F1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable I2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable D3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable M4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable N6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable M7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable F8 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable D9 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L10 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L11 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K12 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E13 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> H 0.15 Q 0.15 K 0.13 W 0.12 E 0.12 R 0.11 C 0.11 M 0.04 L 0.01 I 0.01 C Shift Assignments>> C :: 176.21 CA :: 55.95(D) CB :: 29.44 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) T15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.86 CA :: 60.68(D) CB :: 69.18(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.04(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.21(D) Ave N Shift Values>> N :: 115.7(5.05) E16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.15 Q 0.13 R 0.13 W 0.12 E 0.12 C 0.12 K 0.1 M 0.06 I 0.01 C Shift Assignments>> C :: 176.19 CA :: 55.92 CB :: 29.95 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.42 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 125.29 Ave N Shift Values>> N :: 120.68(3.68) V17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.25 P 0.22 C 0.14 I 0.12 W 0.09 R 0.04 E 0.04 H 0.02 K 0.01 M 0.01 Q 0.01 C Shift Assignments>> C :: 175.5(D) CA :: 61.86 CB :: 31.08 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 124.18 Ave N Shift Values>> N :: 121.02(4.96) K18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.23 C 0.23 Q 0.18 K 0.15 H 0.05 R 0.04 W 0.04 E 0.02 C Shift Assignments>> C :: 176.99(D) CA :: 53.84(D) CB :: 33.59 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.68(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 127.49(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) D19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.32 D 0.29 C 0.13 L 0.08 F 0.07 Y 0.07 K 0.01 HN Overlap>> E276 C Shift Assignments>> C :: 176.89(D) CA :: 53.12(D) CB :: 39.87 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.54(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 125.2(D) Ave N Shift Values>> N :: 120.73(4.2) L20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.32 D 0.3 C 0.12 L 0.09 F 0.06 Y 0.06 K 0.01 C Shift Assignments>> C :: 175.81 CA :: 52.84(D) CB :: 40 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.88(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 128.01(D) Ave N Shift Values>> N :: 121.98(4.07) P21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> S 0.26 P 0.22 V 0.18 T 0.15 I 0.12 C 0.01 F 0.01 C Shift Assignments>> C :: 178.03(D) CA :: 63.71(D) Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) G22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.46 L 0.2 R 0.16 C 0.1 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 174.28(D) CA :: 44.51(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.63(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 113.75(D) Ave N Shift Values>> N :: 109.91(4.29) A23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.73 M 0.23 C 0.02 HN Overlap>> A151 C Shift Assignments>> C :: 177.13(D) CA :: 52.74(D) CB :: 18.59 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.56(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.91(D) Ave N Shift Values>> N :: 123.23(3.7) G24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.31 R 0.22 K 0.14 D 0.08 C 0.07 F 0.06 Y 0.04 G 0.01 I 0.01 C Shift Assignments>> C :: 171.08(D) CA :: 42.6(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.43(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 112.49(D) Ave N Shift Values>> N :: 109.91(4.29) P25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> I 0.21 T 0.17 V 0.16 F 0.07 C 0.06 Y 0.05 S 0.05 W 0.04 P 0.04 E 0.02 R 0.02 K 0.01 H 0.01 C Shift Assignments>> C :: 177.79 CA :: 61.15 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) L26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.21 D 0.21 K 0.17 C 0.1 F 0.08 Y 0.07 R 0.06 N 0.04 C Shift Assignments>> C :: 175.57(D) CA :: 54.96 CB :: 41.58 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.68 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 123.65 Ave N Shift Values>> N :: 121.98(4.07) R27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.33 C 0.16 Q 0.13 H 0.11 K 0.09 W 0.06 E 0.03 R 0.02 I 0.01 M 0.01 C Shift Assignments>> C :: 175.06(D) CA :: 53.99(D) CB :: 27.08 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 9.46(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 132.68(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) F28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.26 F 0.22 C 0.21 I 0.2 E 0.05 D 0.01 L 0.01 C Shift Assignments>> C :: 174.98(D) CA :: 59.09(D) CB :: 38.58 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.32(D) Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 130.07(D) Ave N Shift Values>> N :: 120.69(4.18) Q29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 H 0.15 K 0.15 C 0.11 W 0.11 E 0.1 R 0.1 M 0.03 L 0.03 I 0.01 C Shift Assignments>> C :: 173.69(D) CA :: 55.59(D) CB :: 29.02 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.52(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 131.38(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) K30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.21 M 0.21 Q 0.2 K 0.16 E 0.07 H 0.03 W 0.03 R 0.02 Y 0.01 V 0.01 C Shift Assignments>> C :: 175.59 CA :: 55.16(D) CB :: 34.14 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.87(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.26(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) G31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.76 C 0.17 L 0.04 C Shift Assignments>> C :: 173.36(D) CA :: 46.91(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.47(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 115.41(D) Ave N Shift Values>> N :: 109.91(4.29) R32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 R 0.14 C 0.13 W 0.12 Q 0.11 E 0.11 M 0.1 K 0.07 HN Overlap>> I97 C Shift Assignments>> C :: 176.11(D) CA :: 55.16(D) CB :: 30.59(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.82(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 126.18(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) I33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.28 Y 0.21 I 0.19 C 0.17 K 0.06 L 0.03 R 0.01 D 0.01 C Shift Assignments>> C :: 174.56(D) CA :: 60.11(D) CB :: 40.67 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.87(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 130.6(D) Ave N Shift Values>> N :: 121.6(4.72) E34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.23 C 0.2 Q 0.17 K 0.16 H 0.06 R 0.05 W 0.05 E 0.02 C Shift Assignments>> C :: 173.99(D) CA :: 54.36(D) CB :: 33.29(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 9.22(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 127.49(D) Ave N Shift Values>> N :: 120.68(3.68) F35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.24 Y 0.22 F 0.16 N 0.1 E 0.08 D 0.07 I 0.04 L 0.02 M 0.01 C Shift Assignments>> C :: 175.05(D) CA :: 56.19(D) CB :: 38.24(D) Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.06(D) Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 128.86(D) Ave N Shift Values>> N :: 120.69(4.18) E36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 C 0.15 M 0.14 R 0.14 W 0.1 Q 0.09 E 0.08 K 0.08 C Shift Assignments>> C :: 172.66(D) CA :: 54.38(D) CB :: 30.96 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 9.29(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 129.13(D) Ave N Shift Values>> N :: 120.68(3.68) N37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.3 C 0.27 E 0.12 Y 0.1 F 0.05 M 0.05 D 0.04 K 0.01 I 0.01 C Shift Assignments>> C :: 174.08(D) CA :: 54.13(D) CB :: 37.08 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.95(D) Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 125.34(D) Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) V38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.43 V 0.4 I 0.07 C 0.06 W 0.01 C Shift Assignments>> C :: 177.09(D) CA :: 64.67(D) CB :: 31.58 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.56(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.55(D) Ave N Shift Values>> N :: 121.02(4.96) H39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 C 0.17 H 0.15 R 0.13 K 0.09 W 0.09 Q 0.07 E 0.06 C Shift Assignments>> C :: 173.87(D) CA :: 53.81(D) CB :: 31.34 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.22(D) Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 126.23(D) Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) F40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.33 L 0.19 C 0.15 G 0.09 F 0.07 K 0.06 Y 0.05 D 0.02 C Shift Assignments>> C :: 172.4(D) CA :: 57.87(D) CB :: 43.63(D) Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.39(D) Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 122.76(D) Ave N Shift Values>> N :: 120.69(4.18) S41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 172.09(D) CA :: 56.26(D) CB :: 65.04 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.19(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 124.84(D) Ave N Shift Values>> N :: 116.3(3.95) Y42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.16 T 0.13 V 0.12 F 0.09 C 0.08 S 0.08 Y 0.07 W 0.06 E 0.03 R 0.03 K 0.02 P 0.02 H 0.01 Q 0.01 M 0.01 HN Overlap>> E138 C Shift Assignments>> C :: 176.04 CA :: 60.56(D) Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.47(D) Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 124.49(D) Ave N Shift Values>> N :: 120.79(4.69) A43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.82 M 0.12 C 0.03 L 0.01 HN Overlap>> I92 L255 C Shift Assignments>> C :: 176.2(D) CA :: 51.35(D) CB :: 20.06 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.09(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.52(D) Ave N Shift Values>> N :: 123.23(3.7) D44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.25 N 0.19 C 0.15 Y 0.12 F 0.12 L 0.1 K 0.02 I 0.01 C Shift Assignments>> C :: 176.71(D) CA :: 54.69(D) CB :: 39.78 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.21(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.22(D) Ave N Shift Values>> N :: 120.73(4.2) G45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.48 L 0.19 R 0.15 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.76(D) CA :: 44.56(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.28(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 112.04(D) Ave N Shift Values>> N :: 109.91(4.29) R46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.17 Q 0.14 C 0.12 R 0.12 W 0.11 K 0.11 E 0.1 M 0.06 L 0.01 C Shift Assignments>> C :: 175.42(D) CA :: 54.87(D) CB :: 29.75 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.75(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 123.47(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) E47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.14 H 0.14 K 0.13 E 0.13 W 0.13 R 0.11 C 0.11 M 0.04 I 0.02 L 0.01 C Shift Assignments>> C :: 176.52(D) CA :: 56.67(D) CB :: 29.42 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.7(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 127.61(D) Ave N Shift Values>> N :: 120.68(3.68) T48 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> G 0.39 L 0.24 R 0.12 C 0.12 D 0.06 F 0.01 Y 0.01 C Shift Assignments>> C :: 176.09 CA :: 52.99(D) CB :: 44.27 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) Q50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.17 C 0.16 R 0.14 M 0.13 W 0.11 Q 0.1 E 0.08 K 0.07 C Shift Assignments>> C :: 172.47 CA :: 53.97(D) CB :: 30.73 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.6(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 123.14(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) D51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> D 0.24 N 0.18 C 0.15 Y 0.13 F 0.13 L 0.1 K 0.02 I 0.01 C Shift Assignments>> C :: 173.69(D) CA :: 54.85(D) CB :: 39.78 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) V52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.43 V 0.35 I 0.07 C 0.07 W 0.02 C Shift Assignments>> C :: 175.72(D) CA :: 63.7(D) CB :: 31.6 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.87(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 123.49(D) Ave N Shift Values>> N :: 121.02(4.96) S53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.97 T 0.02 HN Overlap>> A70 C Shift Assignments>> C :: 173.14(D) CA :: 56(D) CB :: 65.79 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.89(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 125.6(D) Ave N Shift Values>> N :: 116.3(3.95) F54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.27 F 0.22 C 0.22 I 0.09 D 0.05 E 0.05 N 0.03 L 0.03 C Shift Assignments>> C :: 172.64(D) CA :: 57.41(D) CB :: 38.79 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.52(D) Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 119.54(D) Ave N Shift Values>> N :: 120.69(4.18) T55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.29(D) CA :: 60.82(D) CB :: 71.59 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.77(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.4(D) Ave N Shift Values>> N :: 115.7(5.05) V56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.27 C 0.18 P 0.11 W 0.1 R 0.06 K 0.05 I 0.05 E 0.04 M 0.04 H 0.03 Q 0.01 C Shift Assignments>> C :: 175.01(D) CA :: 60.94(D) CB :: 32.1 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.65(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 129.49(D) Ave N Shift Values>> N :: 121.02(4.96) M57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.29 N 0.24 D 0.12 C 0.05 L 0.05 M 0.04 H 0.03 P 0.03 R 0.02 Q 0.01 K 0.01 W 0.01 Y 0.01 F 0.01 C Shift Assignments>> C :: 173(D) CA :: 52.17(D) Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.24(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 126.78(D) Ave N Shift Values>> N :: 120.1(3.88) P58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.31 V 0.23 I 0.21 C 0.1 W 0.06 R 0.01 E 0.01 C Shift Assignments>> C :: 178.21(D) CA :: 63.08(D) CB :: 30.39 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) G59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.52 L 0.18 R 0.13 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.8(D) CA :: 44.65(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.49(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 114.2(D) Ave N Shift Values>> N :: 109.91(4.29) Q60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 Q 0.15 K 0.14 C 0.11 W 0.11 R 0.1 E 0.1 M 0.04 L 0.02 I 0.01 C Shift Assignments>> C :: 174.33(D) CA :: 55.41(D) CB :: 29.26 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.98(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.97(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) T61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.67(D) CA :: 61.34(D) CB :: 70.19 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 9.21(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 116.5(D) Ave N Shift Values>> N :: 115.7(5.05) L62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.56 L 0.17 C 0.1 R 0.07 D 0.04 C Shift Assignments>> C :: 173.7(D) CA :: 52.31(D) CB :: 44.46 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.96(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 132.99(D) Ave N Shift Values>> N :: 121.98(4.07) A63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.46 G 0.35 C 0.09 M 0.03 L 0.03 C Shift Assignments>> C :: 174.93(D) CA :: 48.58(D) CB :: 21.6 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.97(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 130.45(D) Ave N Shift Values>> N :: 123.23(3.7) L64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.28 D 0.21 R 0.14 C 0.12 K 0.06 G 0.06 N 0.04 F 0.03 Y 0.02 HN Overlap>> I245 C Shift Assignments>> C :: 175.09(D) CA :: 52.6(D) CB :: 42.87 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.95(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 124.29(D) Ave N Shift Values>> N :: 121.98(4.07) V65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.23 E 0.16 Q 0.15 M 0.14 K 0.14 V 0.03 Y 0.03 W 0.02 H 0.01 R 0.01 I 0.01 C Shift Assignments>> C :: 173.98(D) CA :: 57.51(D) CB :: 34.67 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.64(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 117.03(D) Ave N Shift Values>> N :: 121.02(4.96) G66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.27 G 0.25 L 0.25 C 0.1 D 0.03 F 0.03 Y 0.02 K 0.01 C Shift Assignments>> C :: 171.17 CA :: 44.05(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.58(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.45(D) Ave N Shift Values>> N :: 109.91(4.29) P67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> T 0.23 I 0.21 V 0.21 P 0.1 S 0.06 C 0.04 F 0.04 Y 0.03 W 0.02 C Shift Assignments>> C :: 176.5(D) CA :: 62 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) S68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.96 C 0.03 HN Overlap>> S86 C Shift Assignments>> C :: 175.96(D) CA :: 59.51(D) CB :: 59.49 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.57(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 118.63(D) Ave N Shift Values>> N :: 116.3(3.95) G69 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Duplicate PRTL>> G 0.63 L 0.14 C 0.09 R 0.08 F 0.01 C Shift Assignments>> C :: 174.15 CA :: 44.9(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 11.41(S) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 121.48(D) Ave N Shift Values>> N :: 109.91(4.29) A70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.49 M 0.38 C 0.05 L 0.04 V 0.01 HN Overlap>> S53 C Shift Assignments>> C :: 177.11 CA :: 54.41 CB :: 20.02 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.93 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.5 Ave N Shift Values>> N :: 123.23(3.7) G71 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K72 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable S73 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable T74 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable I75 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> L 0.12 M 0.1 D 0.09 H 0.09 Q 0.07 C 0.07 K 0.07 R 0.07 W 0.05 E 0.04 N 0.04 Y 0.04 F 0.03 A 0.03 S 0.01 C Shift Assignments>> CA :: 55.35 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) R77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.15 R 0.13 W 0.12 M 0.12 K 0.12 E 0.11 H 0.1 Q 0.06 V 0.03 I 0.01 C Shift Assignments>> C :: 175.22 CA :: 57.64 CB :: 31.63 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.55 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 122.03 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) L78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 L 0.2 N 0.13 C 0.12 K 0.08 R 0.05 F 0.04 Y 0.03 C Shift Assignments>> C :: 174.34 CA :: 52.16 CB :: 41.77 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.53 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.34 Ave N Shift Values>> N :: 121.98(4.07) L79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.12 M 0.1 H 0.09 Q 0.08 C 0.07 K 0.07 R 0.07 D 0.07 W 0.05 E 0.05 Y 0.04 F 0.04 N 0.03 A 0.02 S 0.02 C Shift Assignments>> C :: 172.68 CA :: 55.66 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.79 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.25 Ave N Shift Values>> N :: 121.98(4.07) F80 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable R81 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable F82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> A 0.25 N 0.23 D 0.13 L 0.06 C 0.05 M 0.05 H 0.04 R 0.02 Q 0.02 K 0.02 W 0.02 Y 0.01 F 0.01 E 0.01 C Shift Assignments>> C :: 174.44 CA :: 53.13 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) Y83 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.16 D 0.16 A 0.14 L 0.08 M 0.06 H 0.06 C 0.06 Q 0.04 R 0.04 K 0.04 W 0.03 Y 0.02 F 0.02 E 0.02 C Shift Assignments>> C :: 174.11(D) CA :: 53.91 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 6.77 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 110.74 Ave N Shift Values>> N :: 120.79(4.69) D84 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.26 D 0.22 K 0.12 R 0.12 C 0.1 F 0.04 N 0.04 Y 0.03 G 0.01 C Shift Assignments>> C :: 176.45(D) CA :: 53.7(D) CB :: 42.33(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.64(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.85(D) Ave N Shift Values>> N :: 120.73(4.2) I85 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.36 C 0.23 Y 0.16 F 0.11 E 0.07 V 0.02 C Shift Assignments>> C :: 175.85(D) CA :: 61.02(D) CB :: 37.33 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.09(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 114.59(D) Ave N Shift Values>> N :: 121.6(4.72) S86 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 HN Overlap>> S68 C Shift Assignments>> C :: 174.93(D) CA :: 59.4(D) CB :: 62.9 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.53(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 118.67(D) Ave N Shift Values>> N :: 116.3(3.95) S87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 172.28(D) CA :: 57.88(D) CB :: 63.65 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.67(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 115.82(D) Ave N Shift Values>> N :: 116.3(3.95) G88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.3 R 0.25 L 0.25 C 0.1 F 0.02 D 0.02 Y 0.01 K 0.01 C Shift Assignments>> C :: 173.87(D) CA :: 44.15(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.32(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 111.45(D) Ave N Shift Values>> N :: 109.91(4.29) C89 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.16 E 0.14 C 0.13 R 0.12 H 0.1 Q 0.09 K 0.07 I 0.06 M 0.04 V 0.03 C Shift Assignments>> C :: 171.27(D) CA :: 58.78(D) CB :: 30.09 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.35(D) Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 121.51(D) Ave N Shift Values>> N :: 119.95(4.79) I90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.25 Y 0.25 F 0.23 C 0.2 E 0.03 C Shift Assignments>> C :: 174.3 CA :: 59.77(D) CB :: 38.74 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.83(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 131.44(D) Ave N Shift Values>> N :: 121.6(4.72) R91 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.31 M 0.22 Q 0.14 K 0.11 E 0.05 N 0.04 H 0.02 W 0.02 R 0.01 Y 0.01 C Shift Assignments>> C :: 176.53(D) CA :: 52.88(D) CB :: 34.48 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 9.13(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 125.31(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) I92 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.27 F 0.26 C 0.19 I 0.18 E 0.02 L 0.02 D 0.01 HN Overlap>> A43 L255 C Shift Assignments>> C :: 175.37(D) CA :: 59.08(D) CB :: 39.23 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.16(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 122.59(D) Ave N Shift Values>> N :: 121.6(4.72) D93 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.2 C 0.19 F 0.18 D 0.15 N 0.11 L 0.06 I 0.03 E 0.02 C Shift Assignments>> C :: 176.98(D) CA :: 55.92(D) CB :: 39.2(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 9.56(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 130.06(D) Ave N Shift Values>> N :: 120.73(4.2) G94 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.61 L 0.15 R 0.09 C 0.09 F 0.01 D 0.01 C Shift Assignments>> C :: 173.71(D) CA :: 44.83(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.24(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.58(D) Ave N Shift Values>> N :: 109.91(4.29) Q95 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.18 Q 0.14 C 0.13 R 0.12 K 0.11 W 0.11 E 0.09 M 0.06 L 0.01 C Shift Assignments>> C :: 173.97(D) CA :: 54.29(D) CB :: 29.57(D) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.92(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 125.15(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) D96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.35 D 0.28 C 0.13 L 0.07 Y 0.06 F 0.06 K 0.01 C Shift Assignments>> C :: 179.2(D) CA :: 52.88(D) CB :: 39.75 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.32(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 126.65(D) Ave N Shift Values>> N :: 120.73(4.2) I97 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.49 C 0.2 V 0.19 Y 0.04 F 0.02 P 0.01 E 0.01 HN Overlap>> R32 C Shift Assignments>> C :: 176.33(D) CA :: 63.92(D) CB :: 36.27 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.74(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 126.15(D) Ave N Shift Values>> N :: 121.6(4.72) S98 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.11 S 0.11 I 0.1 Y 0.09 C 0.09 W 0.08 T 0.07 V 0.07 E 0.05 R 0.04 K 0.03 H 0.03 Q 0.02 M 0.02 L 0.01 C Shift Assignments>> C :: 175.75 CA :: 59.79(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.11(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 119.64(D) Ave N Shift Values>> N :: 116.3(3.95) Q99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.14 R 0.14 K 0.14 H 0.13 L 0.12 C 0.12 W 0.08 E 0.06 M 0.02 I 0.01 C Shift Assignments>> C :: 174.71(D) CA :: 54.6(D) CB :: 28.12 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.84(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 122.14(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) V100 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.2 Q 0.19 K 0.17 M 0.16 E 0.07 W 0.05 V 0.04 R 0.04 H 0.03 Y 0.01 C Shift Assignments>> C :: 177.54(D) CA :: 57.52(D) CB :: 33.79 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 6.66(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 111.53(D) Ave N Shift Values>> N :: 121.02(4.96) T101 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.92 S 0.07 C Shift Assignments>> C :: 176.34 CA :: 60.29(D) CB :: 67.71(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.31(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.06(D) Ave N Shift Values>> N :: 115.7(5.05) Q102 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Duplicate PRTL>> W 0.15 E 0.13 C 0.13 K 0.12 Q 0.11 H 0.1 I 0.09 R 0.09 M 0.02 V 0.01 L 0.01 C Shift Assignments>> C :: 178.09(D) CA :: 58.91(D) CB :: 29.09 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 10.44(S) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 131.07(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) A103 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.49 A 0.46 C 0.02 I 0.02 C Shift Assignments>> C :: 180.75(D) CA :: 54.21(D) CB :: 17.52 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.23(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.42(D) Ave N Shift Values>> N :: 123.23(3.7) S104 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.14 T 0.11 V 0.11 F 0.09 S 0.09 C 0.08 Y 0.08 W 0.07 E 0.04 R 0.03 K 0.02 H 0.02 Q 0.01 P 0.01 M 0.01 C Shift Assignments>> C :: 176.82 CA :: 60.36(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.34(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 115.86(D) Ave N Shift Values>> N :: 116.3(3.95) L105 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.11 F 0.11 W 0.1 C 0.09 S 0.09 E 0.08 R 0.07 K 0.06 Q 0.05 H 0.05 M 0.04 L 0.03 I 0.02 V 0.01 T 0.01 D 0.01 C Shift Assignments>> C :: 177.4(D) CA :: 58.11(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.6(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 128.43(D) Ave N Shift Values>> N :: 121.98(4.07) R106 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.12 F 0.11 Y 0.1 W 0.09 C 0.09 E 0.07 R 0.06 K 0.05 Q 0.04 H 0.04 M 0.03 I 0.03 L 0.02 V 0.02 T 0.02 C Shift Assignments>> C :: 177.58 CA :: 58.52(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.79(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 114.74(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) S107 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.16 T 0.12 V 0.11 F 0.09 C 0.08 S 0.08 Y 0.08 W 0.06 E 0.03 R 0.03 K 0.02 H 0.02 P 0.01 Q 0.01 M 0.01 HN Overlap>> C244 C Shift Assignments>> C :: 174.22(D) CA :: 60.48 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.5 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.53 Ave N Shift Values>> N :: 116.3(3.95) H108 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.15 R 0.14 E 0.13 W 0.13 C 0.12 Q 0.12 M 0.08 K 0.07 I 0.01 C Shift Assignments>> C :: 172.72 CA :: 56.34 CB :: 30.39 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 6.96(D) Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 119.48(D) Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) I109 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.27 Y 0.25 I 0.22 C 0.18 L 0.02 K 0.01 D 0.01 E 0.01 C Shift Assignments>> C :: 174.77 CA :: 59.66(D) CB :: 39.64 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.13(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 120.23(D) Ave N Shift Values>> N :: 121.6(4.72) G110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.36 L 0.27 G 0.09 C 0.08 D 0.04 K 0.04 F 0.04 Y 0.02 C Shift Assignments>> C :: 170.92 CA :: 43.47(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.05(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 116.62(D) Ave N Shift Values>> N :: 109.91(4.29) V111 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable V112 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable P113 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.36 V 0.28 I 0.13 C 0.1 W 0.05 R 0.01 E 0.01 C Shift Assignments>> C :: 176.56 CA :: 63.04(D) CB :: 30.94 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) Q114 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 H 0.14 K 0.14 W 0.12 E 0.12 C 0.11 R 0.11 M 0.04 I 0.02 L 0.01 C Shift Assignments>> C :: 175.76 CA :: 56.33(D) CB :: 29.27 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.37(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 122.43(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) D115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.24 C 0.23 F 0.18 E 0.08 N 0.07 D 0.06 I 0.05 L 0.02 M 0.01 C Shift Assignments>> C :: 174.85 CA :: 56.61 CB :: 38.35 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.78 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.56 Ave N Shift Values>> N :: 120.73(4.2) T116 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable V117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.29 P 0.17 C 0.16 W 0.09 I 0.06 R 0.04 E 0.04 K 0.03 M 0.02 H 0.02 Q 0.01 C Shift Assignments>> C :: 174.82 CA :: 61.42 CB :: 31.83 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) L118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.33 L 0.19 N 0.14 C 0.12 K 0.08 F 0.04 R 0.04 Y 0.03 C Shift Assignments>> C :: 175.44 CA :: 52.13 CB :: 41.65 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.27 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 129.25 Ave N Shift Values>> N :: 121.98(4.07) F119 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable N120 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> C 0.35 M 0.17 N 0.16 E 0.09 K 0.07 Q 0.06 Y 0.03 H 0.01 F 0.01 C Shift Assignments>> C :: 172.46(D) CA :: 52.82 CB :: 35.42 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) D121 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.49 L 0.19 C 0.11 R 0.09 D 0.06 F 0.01 C Shift Assignments>> C :: 176.23 CA :: 52.01(D) CB :: 44.16 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.04(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 129.21(D) Ave N Shift Values>> N :: 120.73(4.2) T122 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 178.36 CA :: 61.73(D) CB :: 70.89 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 9.87(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 112.45(D) Ave N Shift Values>> N :: 115.7(5.05) I123 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.23 T 0.22 I 0.18 P 0.13 S 0.08 C 0.03 F 0.03 Y 0.02 W 0.01 C Shift Assignments>> C :: 176.47 CA :: 62.34(D) Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.81(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 124.1(D) Ave N Shift Values>> N :: 121.6(4.72) A124 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.58 A 0.31 I 0.04 C 0.03 C Shift Assignments>> C :: 179.24 CA :: 55.45(D) CB :: 18.16 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.99(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.27(D) Ave N Shift Values>> N :: 123.23(3.7) D125 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.09 E 0.09 R 0.09 W 0.09 K 0.08 Y 0.08 Q 0.07 F 0.07 H 0.07 M 0.06 S 0.05 L 0.04 D 0.01 I 0.01 C Shift Assignments>> C :: 178.46(D) CA :: 57.29(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.27(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.56(D) Ave N Shift Values>> N :: 120.73(4.2) N126 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable I127 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable R128 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable Y129 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable G130 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable R131 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable V132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> S 0.26 V 0.22 P 0.18 T 0.16 I 0.12 C 0.01 C Shift Assignments>> C :: 175.76 CA :: 64.71 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) T133 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.97 S 0.02 C Shift Assignments>> C :: 174.84 CA :: 60.6(D) CB :: 68.09 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.04(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 109.13(D) Ave N Shift Values>> N :: 115.7(5.05) A134 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.79 M 0.16 C 0.02 C Shift Assignments>> C :: 178.28(D) CA :: 52.09(D) CB :: 19.42 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.14(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 127.63(D) Ave N Shift Values>> N :: 123.23(3.7) G135 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.38 L 0.27 C 0.07 G 0.06 K 0.05 D 0.05 F 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 174.65 CA :: 43.31(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.9(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 112.31(D) Ave N Shift Values>> N :: 109.91(4.29) N136 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable D137 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> C 0.26 Y 0.2 E 0.15 F 0.12 N 0.1 I 0.04 D 0.04 M 0.03 L 0.01 K 0.01 C Shift Assignments>> C :: 178.73(D) CA :: 56.17 CB :: 37.62 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) E138 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.15 E 0.14 C 0.12 R 0.11 H 0.11 Q 0.11 K 0.1 I 0.06 M 0.03 V 0.02 HN Overlap>> Y42 C Shift Assignments>> C :: 179.16(D) CA :: 58.54(D) CB :: 29.67 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.43(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 124.53(D) Ave N Shift Values>> N :: 120.68(3.68) V139 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.53 P 0.22 I 0.17 C 0.05 C Shift Assignments>> C :: 176.76(D) CA :: 66.6(D) CB :: 30.75 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.83(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 124.11(D) Ave N Shift Values>> N :: 121.02(4.96) E140 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.14 K 0.13 C 0.12 Q 0.12 W 0.11 E 0.09 I 0.09 H 0.09 L 0.05 M 0.01 C Shift Assignments>> C :: 178.69(D) CA :: 58.35(D) CB :: 28.12 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.86(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 121.23(D) Ave N Shift Values>> N :: 120.68(3.68) A141 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.6 A 0.35 I 0.02 C 0.02 C Shift Assignments>> C :: 181.19(D) CA :: 54.4(D) CB :: 16.8(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.74(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.85(D) Ave N Shift Values>> N :: 123.23(3.7) A142 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.52 A 0.41 I 0.02 C 0.02 C Shift Assignments>> C :: 179.05(D) CA :: 54.61(D) CB :: 17.7 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.05(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.6(D) Ave N Shift Values>> N :: 123.23(3.7) A143 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.49 M 0.44 C 0.03 I 0.01 C Shift Assignments>> C :: 181.01(D) CA :: 54.58(D) CB :: 18.84(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.53(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.53(D) Ave N Shift Values>> N :: 123.23(3.7) Q144 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.21 C 0.14 L 0.13 I 0.13 K 0.1 Q 0.08 W 0.07 H 0.05 E 0.04 C Shift Assignments>> C :: 179.71(D) CA :: 58.38(D) CB :: 26.54 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.8(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 122.37(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) A145 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.48 A 0.46 C 0.02 I 0.02 C Shift Assignments>> C :: 179.14(D) CA :: 54.34(D) CB :: 17.71(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.03(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.64(D) Ave N Shift Values>> N :: 123.23(3.7) A146 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.81 M 0.14 C 0.02 C Shift Assignments>> C :: 176.76(D) CA :: 51.7(D) CB :: 19.58 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.05(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.04(D) Ave N Shift Values>> N :: 123.23(3.7) G147 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.8 C 0.08 L 0.07 R 0.01 C Shift Assignments>> C :: 174.75(D) CA :: 45.69(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.68(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.63(D) Ave N Shift Values>> N :: 109.91(4.29) I148 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.31 L 0.22 C 0.12 K 0.1 F 0.08 Y 0.05 D 0.04 G 0.04 C Shift Assignments>> C :: 173.63 CA :: 57.22(D) CB :: 43.22 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.29(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 117.6(D) Ave N Shift Values>> N :: 121.6(4.72) H149 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.17 C 0.15 E 0.13 R 0.12 H 0.08 I 0.07 Q 0.07 V 0.07 K 0.05 M 0.04 P 0.01 C Shift Assignments>> C :: 175.37(D) CA :: 59.5(D) CB :: 30.48 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 7.06(D) Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 126.72(D) Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) D150 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.25 F 0.23 C 0.2 D 0.09 I 0.06 L 0.06 N 0.04 E 0.02 K 0.01 HN Overlap>> N233 R248 C Shift Assignments>> C :: 178.66(D) CA :: 57.05(D) CB :: 39.37(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.32(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.68(D) Ave N Shift Values>> N :: 120.73(4.2) A151 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.57 A 0.39 C 0.01 I 0.01 HN Overlap>> A23 C Shift Assignments>> C :: 179.32(D) CA :: 53.83(D) CB :: 16.51(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.54(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.88(D) Ave N Shift Values>> N :: 123.23(3.7) I152 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.46 C 0.22 V 0.13 Y 0.07 F 0.04 E 0.03 P 0.01 C Shift Assignments>> C :: 178.22(D) CA :: 62.99(D) CB :: 36.41 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.23(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 120.44(D) Ave N Shift Values>> N :: 121.6(4.72) M153 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.17 Q 0.16 K 0.14 C 0.13 W 0.1 R 0.09 E 0.08 L 0.04 M 0.04 HN Overlap>> C244 C Shift Assignments>> C :: 177.49(D) CA :: 54.48(D) CB :: 28.94 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.6(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 116.7(D) Ave N Shift Values>> N :: 120.1(3.88) A154 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.83 M 0.14 C 0.01 C Shift Assignments>> C :: 178.59(D) CA :: 51.17(D) CB :: 18.1 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 6.94(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.32(D) Ave N Shift Values>> N :: 123.23(3.7) F155 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.34 N 0.25 M 0.12 E 0.09 K 0.04 Y 0.04 Q 0.02 F 0.01 D 0.01 C Shift Assignments>> C :: 176.87(D) CA :: 52.83(D) CB :: 35.91(D) Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.68(D) Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 124.4(D) Ave N Shift Values>> N :: 120.69(4.18) P156 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.26 S 0.23 T 0.18 P 0.15 I 0.13 C 0.01 C Shift Assignments>> C :: 177.65(D) CA :: 65.51 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) E157 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 Q 0.15 K 0.14 C 0.13 R 0.1 W 0.1 E 0.07 L 0.06 M 0.03 C Shift Assignments>> C :: 177.57(D) CA :: 54.12(D) CB :: 28.8 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.64(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 114.38(D) Ave N Shift Values>> N :: 120.68(3.68) G158 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.81 C 0.1 L 0.06 C Shift Assignments>> C :: 178.03(D) CA :: 46.04(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.61(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 111.03(D) Ave N Shift Values>> N :: 109.91(4.29) Y159 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.23 V 0.21 I 0.2 P 0.11 S 0.07 C 0.03 F 0.03 Y 0.02 W 0.02 C Shift Assignments>> C :: 175.56(D) CA :: 62.16(D) Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 9.39(D) Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 128.85(D) Ave N Shift Values>> N :: 120.79(4.69) R160 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 K 0.15 H 0.15 C 0.12 W 0.1 E 0.09 R 0.08 L 0.06 M 0.03 I 0.01 C Shift Assignments>> C :: 175.11(D) CA :: 55.15(D) CB :: 28.67 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.9(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 118.2(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) T161 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.11 CA :: 64.47(D) CB :: 69.21 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.43(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 119.7(D) Ave N Shift Values>> N :: 115.7(5.05) Q162 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.23 R 0.2 Q 0.12 C 0.12 K 0.09 H 0.08 W 0.06 E 0.04 I 0.02 C Shift Assignments>> C :: 176.15(D) CA :: 55.85(D) CB :: 26.96(D) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.85(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 129.72(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) V163 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.2 V 0.15 K 0.12 W 0.11 M 0.09 R 0.08 E 0.06 Q 0.05 H 0.05 I 0.02 P 0.01 C Shift Assignments>> C :: 174.42(D) CA :: 59.5(D) CB :: 32.52(D) Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.18(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.25(D) Ave N Shift Values>> N :: 121.02(4.96) G164 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.38 L 0.27 C 0.07 G 0.07 D 0.05 K 0.05 F 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 175.29(D) CA :: 43.33(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.96(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.19(D) Ave N Shift Values>> N :: 109.91(4.29) E165 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.14 K 0.13 E 0.13 C 0.12 Q 0.12 H 0.1 R 0.09 I 0.08 M 0.02 L 0.01 V 0.01 C Shift Assignments>> C :: 178(D) CA :: 58.47(D) CB :: 28.98 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.31(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 123.51(D) Ave N Shift Values>> N :: 120.68(3.68) R166 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 H 0.16 K 0.15 C 0.12 W 0.1 E 0.09 R 0.09 L 0.05 M 0.03 I 0.01 C Shift Assignments>> C :: 175.83(D) CA :: 54.96(D) CB :: 28.85 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.44(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 118.36(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) G167 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.38 L 0.27 C 0.07 G 0.06 K 0.05 D 0.05 F 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 172.4 CA :: 43.26(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.3(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 111.03(D) Ave N Shift Values>> N :: 109.91(4.29) L168 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.23 L 0.19 K 0.14 C 0.11 F 0.1 Y 0.08 N 0.06 R 0.03 C Shift Assignments>> C :: 172.52(D) CA :: 55.03(D) CB :: 41.15 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.16(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 127.87(D) Ave N Shift Values>> N :: 121.98(4.07) K169 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.15 C 0.14 H 0.14 R 0.14 W 0.11 K 0.1 E 0.09 Q 0.08 HN Overlap>> K279 C Shift Assignments>> C :: 175.77(D) CA :: 55.16(D) CB :: 31.26 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.17(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 127.4(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) L170 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.27 L 0.23 K 0.12 C 0.1 N 0.08 R 0.07 F 0.05 Y 0.04 C Shift Assignments>> C :: 176.95(D) CA :: 53.34(D) CB :: 41.86 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.93(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 128.28(D) Ave N Shift Values>> N :: 121.98(4.07) S171 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.84 CA :: 56.82(D) CB :: 64.92 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.18(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 120.65(D) Ave N Shift Values>> N :: 116.3(3.95) G172 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> G 0.6 C 0.25 P 0.05 A 0.03 L 0.02 N 0.01 C Shift Assignments>> C :: 176.44(D) CA :: 47.58 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) G173 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.79 C 0.13 L 0.04 C Shift Assignments>> C :: 175.81 CA :: 46.57(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.73(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.85(D) Ave N Shift Values>> N :: 109.91(4.29) E174 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.16 E 0.14 C 0.13 R 0.11 H 0.09 Q 0.09 K 0.08 I 0.08 V 0.03 M 0.03 C Shift Assignments>> C :: 178.69(D) CA :: 59.13(D) CB :: 29.86 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.57(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 123.65(D) Ave N Shift Values>> N :: 120.68(3.68) K175 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.21 C 0.17 W 0.13 P 0.09 I 0.07 R 0.07 E 0.07 K 0.04 H 0.04 M 0.03 Q 0.02 C Shift Assignments>> C :: 178.56(D) CA :: 60.82(D) CB :: 31.41 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.61(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 120.42(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Q176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.09 C 0.09 E 0.09 K 0.09 W 0.08 Q 0.08 H 0.07 Y 0.07 F 0.07 M 0.06 L 0.05 S 0.05 D 0.02 I 0.01 C Shift Assignments>> C :: 179.11 CA :: 57.14 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.05 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.41 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) R177 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.11 I 0.1 S 0.1 Y 0.09 C 0.09 W 0.08 T 0.08 V 0.07 E 0.05 R 0.04 K 0.03 H 0.02 Q 0.02 M 0.02 L 0.01 HN Overlap>> Q269 C Shift Assignments>> C :: 178.81(D) CA :: 59.88 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.85 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.38 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) V178 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.45 V 0.36 P 0.1 C 0.06 C Shift Assignments>> C :: 177.39(D) CA :: 67.1 CB :: 29.52 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.06(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 123.92(D) Ave N Shift Values>> N :: 121.02(4.96) A179 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.55 A 0.37 I 0.03 C 0.03 C Shift Assignments>> C :: 181.58 CA :: 55.08 CB :: 18.1 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.82(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.32(D) Ave N Shift Values>> N :: 123.23(3.7) I180 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable A181 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable R182 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable T183 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable I184 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> Q 0.1 H 0.09 K 0.09 R 0.09 M 0.08 C 0.08 E 0.07 W 0.07 L 0.06 Y 0.06 F 0.05 S 0.03 D 0.03 N 0.01 C Shift Assignments>> C :: 177.92 CA :: 56.6 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) K186 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.15 C 0.14 R 0.13 Q 0.13 I 0.12 E 0.12 H 0.1 L 0.03 M 0.01 HN Overlap>> L267 C Shift Assignments>> C :: 175.44 CA :: 58.72(D) CB :: 28.39 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.72 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 121.91 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) A187 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.65 M 0.32 C 0.01 C Shift Assignments>> C :: 173.87 CA :: 51.8(D) CB :: 16.53 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.13(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.54(D) Ave N Shift Values>> N :: 123.23(3.7) P188 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable G189 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> G 0.77 L 0.08 C 0.07 R 0.03 C Shift Assignments>> C :: 173.26(D) CA :: 45.31(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) I190 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.27 Y 0.23 C 0.17 I 0.13 K 0.07 L 0.05 D 0.02 R 0.01 C Shift Assignments>> C :: 173.82(D) CA :: 59.08(D) CB :: 40.48 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.84(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 122.57(D) Ave N Shift Values>> N :: 121.6(4.72) I191 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.26 C 0.23 F 0.2 I 0.13 E 0.09 D 0.02 N 0.01 L 0.01 M 0.01 C Shift Assignments>> C :: 172.88(D) CA :: 58.13 CB :: 38.21 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.04(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 129.32(D) Ave N Shift Values>> N :: 121.6(4.72) L192 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.34 N 0.24 L 0.13 C 0.13 K 0.04 F 0.04 Y 0.03 R 0.01 C Shift Assignments>> C :: 174.96(D) CA :: 51.55(D) CB :: 41.03(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.77(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 126.83(D) Ave N Shift Values>> N :: 121.98(4.07) L193 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.34 N 0.19 L 0.16 C 0.11 K 0.06 F 0.04 Y 0.03 R 0.02 C Shift Assignments>> CA :: 52.16 CB :: 41.25(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.98(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.78(D) Ave N Shift Values>> N :: 121.98(4.07) D194 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E195 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable A196 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable T197 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable S198 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable A199 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L200 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> L 0.27 D 0.23 R 0.13 C 0.11 K 0.09 N 0.04 F 0.03 G 0.02 Y 0.02 C Shift Assignments>> C :: 176.57(D) CA :: 53.05(D) CB :: 42.58 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) D201 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.33 N 0.28 C 0.12 L 0.11 F 0.05 Y 0.04 K 0.03 HN Overlap>> D263 C Shift Assignments>> C :: 175.94 CA :: 52.44(D) CB :: 40.5 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.15(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.84(D) Ave N Shift Values>> N :: 120.73(4.2) T202 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.27 S 0.22 T 0.18 P 0.14 I 0.13 C 0.01 C Shift Assignments>> CA :: 65.58 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.3(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 115.84(D) Ave N Shift Values>> N :: 115.7(5.05) S203 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable N204 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E205 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> F 0.11 S 0.11 I 0.1 Y 0.09 C 0.09 W 0.08 T 0.07 V 0.07 E 0.05 R 0.04 K 0.03 H 0.03 Q 0.02 M 0.02 L 0.01 C Shift Assignments>> C :: 177.43(D) CA :: 59.8 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) R206 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.15 C 0.13 K 0.13 E 0.12 Q 0.11 H 0.1 I 0.09 R 0.08 M 0.02 L 0.01 V 0.01 C Shift Assignments>> C :: 179.23 CA :: 58.79(D) CB :: 28.92 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.03(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.2(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) A207 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.51 M 0.43 C 0.02 I 0.01 C Shift Assignments>> C :: 180.42 CA :: 54.26(D) CB :: 18.19 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.68(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.86(D) Ave N Shift Values>> N :: 123.23(3.7) I208 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.35 C 0.24 V 0.23 Y 0.05 E 0.03 P 0.03 F 0.02 C Shift Assignments>> C :: 177.76 CA :: 63.02 CB :: 35.83 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.32 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 122.03 Ave N Shift Values>> N :: 121.6(4.72) Q209 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.19 C 0.13 I 0.13 Q 0.1 K 0.09 W 0.09 L 0.09 H 0.07 E 0.06 C Shift Assignments>> C :: 178.42 CA :: 58.61 CB :: 27.25 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.4 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 122.93 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) A210 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.14 L 0.11 M 0.08 H 0.08 N 0.08 A 0.07 C 0.07 Q 0.06 R 0.05 K 0.05 W 0.04 E 0.03 Y 0.03 F 0.03 S 0.01 C Shift Assignments>> C :: 180.66 CA :: 54.76 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.78 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.33 Ave N Shift Values>> N :: 123.23(3.7) S211 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.94 CA :: 61.82 CB :: 62.44 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.73 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 117.75 Ave N Shift Values>> N :: 116.3(3.95) L212 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.21 Y 0.19 C 0.16 D 0.13 L 0.12 K 0.08 I 0.03 N 0.03 R 0.01 C Shift Assignments>> C :: 178.24 CA :: 56.75 CB :: 40.33 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.52 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 124.15 Ave N Shift Values>> N :: 121.98(4.07) A213 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.35 I 0.02 C 0.02 C Shift Assignments>> C :: 180.35(D) CA :: 54.38 CB :: 16.77 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.04 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.31 Ave N Shift Values>> N :: 123.23(3.7) K214 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.14 W 0.14 R 0.13 E 0.12 H 0.1 K 0.1 M 0.1 Q 0.06 V 0.04 I 0.02 C Shift Assignments>> C :: 178.93 CA :: 58.2(D) CB :: 31.33 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.19(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 117.99(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) V215 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.42 V 0.32 I 0.12 C 0.07 W 0.03 C Shift Assignments>> C :: 176.22 CA :: 63.95 CB :: 31.02 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.59(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 120.37(D) Ave N Shift Values>> N :: 121.02(4.96) C216 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable A217 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> A 0.61 M 0.35 C 0.01 C Shift Assignments>> C :: 177.64 CA :: 53.17(D) CB :: 17.57 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N218 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.32 C 0.25 Y 0.11 E 0.09 F 0.06 D 0.06 M 0.04 K 0.01 I 0.01 HN Overlap>> E252 C Shift Assignments>> C :: 173.88(D) CA :: 54.14(D) CB :: 37.36 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.86(D) Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 117.14(D) Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) R219 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 C 0.16 H 0.14 R 0.13 K 0.11 W 0.09 Q 0.07 E 0.07 C Shift Assignments>> C :: 175.77(D) CA :: 54.35(D) CB :: 31.51(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.87(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.81(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) T220 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 172.93(D) CA :: 63.62(D) CB :: 69 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.09(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 123.16(D) Ave N Shift Values>> N :: 115.7(5.05) T221 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.78 CA :: 61.37(D) CB :: 71.27 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.89(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 127.72(D) Ave N Shift Values>> N :: 115.7(5.05) I222 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.24 I 0.23 Y 0.21 F 0.14 E 0.12 M 0.01 C Shift Assignments>> C :: 173.78(D) CA :: 59.63(D) CB :: 37.55 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.59(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 126.14(D) Ave N Shift Values>> N :: 121.6(4.72) V223 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.23 Q 0.16 K 0.15 M 0.14 E 0.12 V 0.05 W 0.03 R 0.02 H 0.02 Y 0.02 I 0.01 C Shift Assignments>> C :: 173.65(D) CA :: 58.02(D) CB :: 34.32 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.26(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 127.85(D) Ave N Shift Values>> N :: 121.02(4.96) V224 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.16 W 0.15 V 0.14 R 0.1 E 0.1 I 0.08 H 0.06 K 0.05 P 0.04 Q 0.04 M 0.04 C Shift Assignments>> C :: 176(D) CA :: 60.31(D) CB :: 30.96 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.2(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 129.78(D) Ave N Shift Values>> N :: 121.02(4.96) A225 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.56 L 0.17 C 0.13 M 0.1 C Shift Assignments>> C :: 175.24 CA :: 50.47(D) CB :: 22 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.96(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 131.63(D) Ave N Shift Values>> N :: 123.23(3.7) H226 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable R227 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> L 0.12 M 0.1 D 0.09 H 0.09 Q 0.07 C 0.07 K 0.06 R 0.06 W 0.05 E 0.04 N 0.04 Y 0.04 A 0.04 F 0.03 S 0.01 C Shift Assignments>> C :: 176.22 CA :: 55.32 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) L228 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 L 0.17 N 0.13 C 0.11 K 0.09 F 0.08 Y 0.07 R 0.02 C Shift Assignments>> C :: 177.21 CA :: 54.08 CB :: 40.91 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.43 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 126.03 Ave N Shift Values>> N :: 121.98(4.07) S229 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 57.4 CB :: 62.94 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.57 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 119.28 Ave N Shift Values>> N :: 116.3(3.95) T230 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> S 0.24 P 0.22 V 0.19 T 0.15 I 0.12 C 0.01 F 0.01 C Shift Assignments>> C :: 176.24(D) CA :: 63.62 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) V231 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.17 C 0.16 W 0.14 I 0.09 R 0.08 E 0.08 P 0.07 H 0.05 K 0.04 M 0.03 Q 0.03 C Shift Assignments>> C :: 175.65 CA :: 60.68 CB :: 31.01 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.73(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 114.9(D) Ave N Shift Values>> N :: 121.02(4.96) V232 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.43 V 0.36 I 0.09 C 0.06 W 0.02 C Shift Assignments>> C :: 176.96 CA :: 64.25(D) CB :: 31.37 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 6.49(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 116.4(D) Ave N Shift Values>> N :: 121.02(4.96) N233 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.57 C 0.2 D 0.09 Y 0.04 F 0.03 E 0.01 M 0.01 L 0.01 HN Overlap>> D150 C Shift Assignments>> C :: 175.23(D) CA :: 51.9(D) CB :: 37.86 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.34(D) Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.64(D) Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) A234 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.7 M 0.27 C 0.01 C Shift Assignments>> C :: 177.1(D) CA :: 52.86(D) CB :: 18.2 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.85(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.49(D) Ave N Shift Values>> N :: 123.23(3.7) D235 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.19 F 0.18 Y 0.14 L 0.14 C 0.13 D 0.09 R 0.05 I 0.03 N 0.01 C Shift Assignments>> C :: 175.67(D) CA :: 57.33(D) CB :: 41.24 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.25(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 122.81(D) Ave N Shift Values>> N :: 120.73(4.2) Q236 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.2 C 0.16 K 0.15 R 0.11 H 0.11 W 0.09 E 0.07 Q 0.05 V 0.01 C Shift Assignments>> C :: 171.59(D) CA :: 55.26(D) CB :: 32.14 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.43(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 115.76(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) I237 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.29 Y 0.23 F 0.2 C 0.2 E 0.04 C Shift Assignments>> C :: 174.12(D) CA :: 60.16(D) CB :: 38.47(D) Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.54(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 128.84(D) Ave N Shift Values>> N :: 121.6(4.72) L238 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.3 L 0.22 C 0.11 N 0.09 K 0.09 R 0.07 F 0.04 Y 0.03 G 0.01 C Shift Assignments>> C :: 174.38(D) CA :: 52.49(D) CB :: 42 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.01(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 127.08(D) Ave N Shift Values>> N :: 121.98(4.07) V239 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.16 C 0.16 E 0.12 R 0.11 V 0.09 I 0.08 H 0.07 Q 0.05 K 0.04 M 0.04 P 0.02 HN Overlap>> M283 C Shift Assignments>> C :: 174.51 CA :: 59.9(D) CB :: 30.61 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.4(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 124.93(D) Ave N Shift Values>> N :: 121.02(4.96) I240 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.26 Y 0.21 E 0.18 F 0.12 I 0.06 N 0.05 M 0.03 D 0.02 K 0.01 C Shift Assignments>> C :: 173.33(D) CA :: 56.84(D) CB :: 37.48 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.27(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 131.47(D) Ave N Shift Values>> N :: 121.6(4.72) K241 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.26 E 0.19 M 0.17 K 0.11 Q 0.1 Y 0.04 N 0.02 W 0.01 H 0.01 F 0.01 V 0.01 C Shift Assignments>> C :: 176.56(D) CA :: 55.75(D) CB :: 35.23 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.65(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 124.85(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) D242 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.19 N 0.19 Y 0.17 D 0.16 F 0.15 L 0.05 E 0.02 I 0.02 C Shift Assignments>> C :: 175.5(D) CA :: 55.27(D) CB :: 38.97 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 9.55(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 129.22(D) Ave N Shift Values>> N :: 120.73(4.2) G243 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.78 C 0.15 L 0.04 C Shift Assignments>> C :: 172.24(D) CA :: 46.73(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.15(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.51(D) Ave N Shift Values>> N :: 109.91(4.29) C244 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.16 R 0.14 Q 0.12 C 0.12 W 0.12 E 0.12 M 0.08 K 0.08 HN Overlap>> S107 M153 C Shift Assignments>> C :: 173.91(D) CA :: 55.59(D) CB :: 30.32 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.53(D) Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 116.62(D) Ave N Shift Values>> N :: 119.95(4.79) I245 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.3 E 0.17 I 0.15 V 0.11 Y 0.08 K 0.04 M 0.04 F 0.03 Q 0.02 W 0.01 HN Overlap>> L64 C Shift Assignments>> C :: 177.13(D) CA :: 60.39(D) CB :: 35.6 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.02(D) Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 124.34(D) Ave N Shift Values>> N :: 121.6(4.72) V246 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.31 P 0.24 C 0.14 W 0.08 I 0.07 R 0.03 E 0.03 K 0.02 H 0.01 M 0.01 C Shift Assignments>> C :: 176.01(D) CA :: 61.83 CB :: 31.77 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.99(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 126.25(D) Ave N Shift Values>> N :: 121.02(4.96) E247 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.22 C 0.2 Q 0.19 K 0.17 H 0.05 R 0.05 W 0.04 E 0.02 V 0.01 C Shift Assignments>> C :: 173.39(D) CA :: 55(D) CB :: 33.5(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.52(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.59(D) Ave N Shift Values>> N :: 120.68(3.68) R248 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.23 C 0.23 Q 0.17 K 0.15 H 0.05 R 0.04 W 0.04 E 0.02 HN Overlap>> D150 C Shift Assignments>> C :: 174.47(D) CA :: 53.76(D) CB :: 33.51(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.23(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 118.69(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) G249 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.52 L 0.18 R 0.13 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 171.41(D) CA :: 44.64(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.65(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 111.64(D) Ave N Shift Values>> N :: 109.91(4.29) R250 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.15 R 0.14 C 0.13 W 0.12 M 0.11 Q 0.11 E 0.1 K 0.08 C Shift Assignments>> C :: 176.07(D) CA :: 55.27(D) CB :: 30.76 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.84(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.51(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) H251 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.17 W 0.15 V 0.14 R 0.1 E 0.09 I 0.07 H 0.06 K 0.05 M 0.04 Q 0.04 P 0.04 C Shift Assignments>> C :: 175.51(D) CA :: 60.21(D) CB :: 31.12 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.68(D) Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 123.43(D) Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) E252 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.23 R 0.16 C 0.14 W 0.09 K 0.07 Q 0.07 L 0.05 E 0.05 H 0.05 P 0.02 HN Overlap>> N218 C Shift Assignments>> C :: 179.04(D) CA :: 59.64(D) CB :: 27.23(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.94(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 117.19(D) Ave N Shift Values>> N :: 120.68(3.68) A253 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.59 M 0.37 C 0.02 I 0.01 C Shift Assignments>> C :: 180.63(D) CA :: 53.53(D) CB :: 17.81(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 6.91(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.34(D) Ave N Shift Values>> N :: 123.23(3.7) L254 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.19 Y 0.17 C 0.15 D 0.13 L 0.13 K 0.11 I 0.03 N 0.03 R 0.01 HN Overlap>> A262 C Shift Assignments>> C :: 180.67(D) CA :: 56.75(D) CB :: 40.59(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.11(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.03(D) Ave N Shift Values>> N :: 121.98(4.07) L255 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.25 Y 0.23 C 0.18 D 0.09 L 0.08 I 0.06 K 0.04 N 0.02 HN Overlap>> A43 I92 C Shift Assignments>> C :: 179.95(D) CA :: 57.43(D) CB :: 40(D) Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.19(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.56(D) Ave N Shift Values>> N :: 121.98(4.07) S256 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 175.26(D) CA :: 60.22(D) CB :: 62.63(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.46(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.4(D) Ave N Shift Values>> N :: 116.3(3.95) R257 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.14 H 0.14 E 0.13 W 0.13 K 0.12 R 0.11 C 0.11 M 0.04 I 0.02 L 0.01 C Shift Assignments>> C :: 178.38(D) CA :: 56.72(D) CB :: 29.49(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.37(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 121.55(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) G258 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.8 C 0.12 L 0.05 C Shift Assignments>> C :: 173.89(D) CA :: 46.42(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.26(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.13(D) Ave N Shift Values>> N :: 109.91(4.29) G259 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.34 L 0.27 G 0.13 C 0.09 D 0.04 F 0.03 K 0.03 Y 0.02 C Shift Assignments>> C :: 173.9(D) CA :: 43.64(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.36(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 113.32(D) Ave N Shift Values>> N :: 109.91(4.29) V260 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.25 V 0.24 T 0.17 P 0.16 I 0.12 C 0.01 C Shift Assignments>> C :: 179.07(D) CA :: 65.17 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.62(D) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 129.66(D) Ave N Shift Values>> N :: 121.02(4.96) Y261 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.47 C 0.19 Y 0.15 F 0.12 E 0.03 V 0.01 C Shift Assignments>> CA :: 61.78(D) CB :: 37.77 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 9.27(D) Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 124.51(D) Ave N Shift Values>> N :: 120.79(4.69) A262 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.57 A 0.36 I 0.03 C 0.02 HN Overlap>> L254 C Shift Assignments>> C :: 179.84(D) CA :: 54.6(D) CB :: 17.17 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.17 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.05 Ave N Shift Values>> N :: 123.23(3.7) D263 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.22 Y 0.21 C 0.17 D 0.12 L 0.1 K 0.05 I 0.04 N 0.03 HN Overlap>> D201 C Shift Assignments>> C :: 178.85(D) CA :: 56.86(D) CB :: 40.08 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.17(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.8(D) Ave N Shift Values>> N :: 120.73(4.2) M264 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.12 F 0.11 Y 0.1 C 0.09 W 0.09 E 0.07 R 0.05 I 0.05 K 0.05 Q 0.04 H 0.04 V 0.04 T 0.03 M 0.03 L 0.01 C Shift Assignments>> C :: 177.97(D) CA :: 59.06(D) Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.11(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 122.86(D) Ave N Shift Values>> N :: 120.1(3.88) W265 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.27 C 0.14 R 0.13 W 0.1 K 0.07 Q 0.06 E 0.05 H 0.05 P 0.04 L 0.03 C Shift Assignments>> C :: 178.28(D) CA :: 60.08 CB :: 27.56 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.89(D) Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 122.67(D) Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) Q266 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.19 C 0.12 Q 0.11 L 0.11 K 0.1 I 0.09 W 0.09 H 0.07 E 0.06 C Shift Assignments>> C :: 178.96(D) CA :: 58.07(D) CB :: 27.24 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.17(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 119.76(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) L267 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.19 Y 0.17 C 0.14 K 0.14 L 0.13 D 0.11 I 0.03 R 0.02 N 0.02 HN Overlap>> K186 C Shift Assignments>> C :: 179.15(D) CA :: 56.99(D) CB :: 40.78 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.65(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.99(D) Ave N Shift Values>> N :: 121.98(4.07) Q268 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.2 L 0.16 C 0.12 Q 0.12 K 0.09 H 0.08 W 0.07 I 0.05 E 0.05 C Shift Assignments>> C :: 177.54(D) CA :: 57.18(D) CB :: 27.08 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.6(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.71(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) Q269 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.17 L 0.15 Q 0.13 K 0.12 C 0.11 H 0.1 W 0.07 E 0.06 I 0.02 M 0.01 HN Overlap>> R177 C Shift Assignments>> C :: 177.22(D) CA :: 55.91(D) CB :: 27.58 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.8(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 120.38(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) G270 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.68 L 0.12 C 0.08 R 0.06 F 0.01 C Shift Assignments>> C :: 174.25(D) CA :: 45.03(D) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.76(D) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.61(D) Ave N Shift Values>> N :: 109.91(4.29) Q271 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 K 0.15 H 0.14 R 0.12 C 0.11 W 0.09 E 0.08 L 0.08 M 0.02 I 0.01 C Shift Assignments>> C :: 176.01(D) CA :: 55.23(D) CB :: 28.46 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.77(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.34(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) E272 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 H 0.15 K 0.14 W 0.12 E 0.12 C 0.11 R 0.1 M 0.04 L 0.02 I 0.01 C Shift Assignments>> C :: 176.45(D) CA :: 56.13(D) CB :: 29.23(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.17(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 123.74(D) Ave N Shift Values>> N :: 120.68(3.68) E273 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.15 Q 0.15 K 0.13 W 0.12 E 0.12 R 0.11 C 0.11 M 0.04 L 0.01 I 0.01 C Shift Assignments>> C :: 176.51(D) CA :: 56.03(D) CB :: 29.39 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.35(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 124.29(D) Ave N Shift Values>> N :: 120.68(3.68) T274 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.37(D) CA :: 60.96(D) CB :: 69.23(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.17(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.56(D) Ave N Shift Values>> N :: 115.7(5.05) S275 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.52(D) CA :: 57.76(D) CB :: 63.45(D) Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.31(D) Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 120.61(D) Ave N Shift Values>> N :: 116.3(3.95) E276 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 H 0.14 K 0.14 W 0.12 E 0.12 C 0.11 R 0.11 M 0.04 L 0.02 I 0.01 HN Overlap>> D19 C Shift Assignments>> C :: 176.15(D) CA :: 56.16(D) CB :: 29.27(D) Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.46(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 125.18(D) Ave N Shift Values>> N :: 120.68(3.68) D277 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.3 N 0.19 L 0.13 C 0.12 F 0.09 Y 0.08 K 0.05 C Shift Assignments>> C :: 176.24(D) CA :: 53.96(D) CB :: 40.4(D) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.29(D) Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 123.22(D) Ave N Shift Values>> N :: 120.73(4.2) T278 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.26(D) CA :: 61.21(D) CB :: 68.94(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.94(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 116.57(D) Ave N Shift Values>> N :: 115.7(5.05) K279 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 C 0.17 H 0.15 R 0.13 K 0.1 W 0.09 Q 0.07 E 0.06 HN Overlap>> K169 C Shift Assignments>> C :: 174.12 CA :: 53.87(D) CB :: 31.47(D) Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.16(D) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 127.46(D) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) P280 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.32 V 0.29 C 0.11 I 0.11 W 0.06 R 0.02 E 0.02 H 0.01 K 0.01 C Shift Assignments>> C :: 176.87(D) CA :: 62.54(D) CB :: 31.23(D) Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) Q281 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 K 0.15 H 0.14 R 0.11 C 0.11 W 0.09 E 0.08 L 0.07 M 0.02 I 0.01 C Shift Assignments>> C :: 176.11(D) CA :: 55.26(D) CB :: 28.54(D) Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.49(D) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 123.17(D) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) T282 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.94 CA :: 61.16(D) CB :: 69.09(D) Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.11(D) Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.76(D) Ave N Shift Values>> N :: 115.7(5.05) M283 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.19 C 0.17 K 0.15 H 0.12 R 0.11 W 0.09 E 0.06 Q 0.06 HN Overlap>> V239 C Shift Assignments>> C :: 175.75(D) CA :: 54.73(D) CB :: 32.13 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.31(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 124.92(D) Ave N Shift Values>> N :: 120.1(3.88) E284 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 H 0.15 K 0.13 W 0.12 E 0.12 C 0.11 R 0.11 M 0.04 L 0.01 I 0.01 C Shift Assignments>> C :: 175.24(D) CA :: 56.06(D) CB :: 29.33 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.33(D) Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 125.16(D) Ave N Shift Values>> N :: 120.68(3.68) R285 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 0.13 Q 0.12 C 0.12 K 0.08 M 0.06 I 0.01 V 0.01 C Shift Assignments>> C :: 180.68(D) CA :: 56.76(D) CB :: 30.2(D) Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.88(D) Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 129.42(D) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) ########################################################################### Overall Results: #Consistent: 70 #Clerical: 213 #Suspicious: 2 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 237 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 48 Shift Relative Order (SRO) Results: #Consistent: 285 #Suspicious: 0 C Shift Results: #Consistent: 257 #Duplicate: 397 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 23 #Duplicate: 188 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 N Shift Results: #Consistent: 23 #Duplicate: 190 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: E14 CA = 55.95(D), Expected = 57.42, Std = 2.1900, ChiSquare = 5.0207e-01 T15 CA = 60.68(D), Expected = 62.15, Std = 2.7200, ChiSquare = 5.8889e-01 T15 CB = 69.18(D), Expected = 69.64, Std = 1.7000, ChiSquare = 7.8671e-01 T15 H = 8.04(D), Expected = 8.27, Std = 0.6200, ChiSquare = 7.1066e-01 T15 N = 117.21(D), Expected = 115.70, Std = 5.0500, ChiSquare = 7.6493e-01 V17 C = 175.5(D), Expected = 175.69, Std = 2.0300, ChiSquare = 9.2543e-01 K18 C = 176.99(D), Expected = 176.46, Std = 2.0500, ChiSquare = 7.9599e-01 K18 CA = 53.84(D), Expected = 56.84, Std = 2.2500, ChiSquare = 1.8242e-01 K18 H = 8.68(D), Expected = 8.22, Std = 0.6400, ChiSquare = 4.7230e-01 K18 N = 127.49(D), Expected = 121.16, Std = 4.1100, ChiSquare = 1.2352e-01 D19 C = 176.89(D), Expected = 176.41, Std = 1.7700, ChiSquare = 7.8625e-01 D19 CA = 53.12(D), Expected = 54.52, Std = 2.1000, ChiSquare = 5.0499e-01 D19 H = 8.54(D), Expected = 8.33, Std = 0.5700, ChiSquare = 7.1256e-01 D19 N = 125.2(D), Expected = 120.73, Std = 4.2000, ChiSquare = 2.8720e-01 L20 CA = 52.84(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.0355e-01 L20 H = 8.88(D), Expected = 8.22, Std = 0.6500, ChiSquare = 3.0992e-01 L20 N = 128.01(D), Expected = 121.98, Std = 4.0700, ChiSquare = 1.3845e-01 P21 C = 178.03(D), Expected = 176.70, Std = 1.6900, ChiSquare = 4.3129e-01 P21 CA = 63.71(D), Expected = 63.30, Std = 1.6400, ChiSquare = 8.0259e-01 G22 C = 174.28(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.0154e-01 G22 CA = 44.51(D), Expected = 45.33, Std = 1.4200, ChiSquare = 5.6363e-01 G22 H = 8.63(D), Expected = 8.34, Std = 0.7400, ChiSquare = 6.9514e-01 G22 N = 113.75(D), Expected = 109.91, Std = 4.2900, ChiSquare = 3.7073e-01 A23 C = 177.13(D), Expected = 177.80, Std = 2.1800, ChiSquare = 7.5858e-01 A23 CA = 52.74(D), Expected = 53.16, Std = 2.0600, ChiSquare = 8.3844e-01 A23 H = 7.56(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.8612e-01 A23 N = 124.91(D), Expected = 123.23, Std = 3.7000, ChiSquare = 6.4979e-01 G24 C = 171.08(D), Expected = 174.04, Std = 1.9400, ChiSquare = 1.2707e-01 G24 CA = 42.6(D), Expected = 45.33, Std = 1.4200, ChiSquare = 5.4539e-02 G24 H = 8.43(D), Expected = 8.34, Std = 0.7400, ChiSquare = 9.0320e-01 G24 N = 112.49(D), Expected = 109.91, Std = 4.2900, ChiSquare = 5.4757e-01 L26 C = 175.57(D), Expected = 176.97, Std = 2.0900, ChiSquare = 5.0295e-01 R27 C = 175.06(D), Expected = 176.49, Std = 2.1600, ChiSquare = 5.0795e-01 R27 CA = 53.99(D), Expected = 56.95, Std = 2.4100, ChiSquare = 2.1937e-01 R27 H = 9.46(D), Expected = 8.24, Std = 0.6000, ChiSquare = 4.2019e-02 R27 N = 132.68(D), Expected = 120.61, Std = 3.9000, ChiSquare = 1.9690e-03 F28 C = 174.98(D), Expected = 175.49, Std = 2.1300, ChiSquare = 8.1077e-01 F28 CA = 59.09(D), Expected = 58.25, Std = 2.7300, ChiSquare = 7.5832e-01 F28 H = 8.32(D), Expected = 8.42, Std = 0.7400, ChiSquare = 8.9251e-01 F28 N = 130.07(D), Expected = 120.69, Std = 4.1800, ChiSquare = 2.4831e-02 Q29 C = 173.69(D), Expected = 176.39, Std = 1.9600, ChiSquare = 1.6834e-01 Q29 CA = 55.59(D), Expected = 56.62, Std = 2.1900, ChiSquare = 6.3813e-01 Q29 H = 8.52(D), Expected = 8.22, Std = 0.6200, ChiSquare = 6.2848e-01 Q29 N = 131.38(D), Expected = 119.92, Std = 4.0100, ChiSquare = 4.2651e-03 K30 CA = 55.16(D), Expected = 56.84, Std = 2.2500, ChiSquare = 4.5527e-01 K30 H = 7.87(D), Expected = 8.22, Std = 0.6400, ChiSquare = 5.8446e-01 K30 N = 119.26(D), Expected = 121.16, Std = 4.1100, ChiSquare = 6.4388e-01 G31 C = 173.36(D), Expected = 174.04, Std = 1.9400, ChiSquare = 7.2595e-01 G31 CA = 46.91(D), Expected = 45.33, Std = 1.4200, ChiSquare = 2.6585e-01 G31 H = 9.47(D), Expected = 8.34, Std = 0.7400, ChiSquare = 1.2675e-01 G31 N = 115.41(D), Expected = 109.91, Std = 4.2900, ChiSquare = 1.9982e-01 R32 C = 176.11(D), Expected = 176.49, Std = 2.1600, ChiSquare = 8.6035e-01 R32 CA = 55.16(D), Expected = 56.95, Std = 2.4100, ChiSquare = 4.5764e-01 R32 CB = 30.59(D), Expected = 30.66, Std = 1.7700, ChiSquare = 9.6845e-01 R32 H = 8.82(D), Expected = 8.24, Std = 0.6000, ChiSquare = 3.3371e-01 R32 N = 126.18(D), Expected = 120.61, Std = 3.9000, ChiSquare = 1.5323e-01 I33 C = 174.56(D), Expected = 175.82, Std = 1.9500, ChiSquare = 5.1818e-01 I33 CA = 60.11(D), Expected = 61.59, Std = 2.7800, ChiSquare = 5.9447e-01 I33 H = 8.87(D), Expected = 8.26, Std = 0.7100, ChiSquare = 3.9026e-01 I33 N = 130.6(D), Expected = 121.60, Std = 4.7200, ChiSquare = 5.6549e-02 E34 C = 173.99(D), Expected = 176.93, Std = 2.1100, ChiSquare = 1.6351e-01 E34 CA = 54.36(D), Expected = 57.42, Std = 2.1900, ChiSquare = 1.6234e-01 E34 CB = 33.29(D), Expected = 30.07, Std = 1.8400, ChiSquare = 8.0118e-02 E34 H = 9.22(D), Expected = 8.34, Std = 0.6100, ChiSquare = 1.4913e-01 E34 N = 127.49(D), Expected = 120.68, Std = 3.6800, ChiSquare = 6.4235e-02 F35 C = 175.05(D), Expected = 175.49, Std = 2.1300, ChiSquare = 8.3634e-01 F35 CA = 56.19(D), Expected = 58.25, Std = 2.7300, ChiSquare = 4.5050e-01 F35 CB = 38.24(D), Expected = 39.95, Std = 2.0400, ChiSquare = 4.0190e-01 F35 H = 9.06(D), Expected = 8.42, Std = 0.7400, ChiSquare = 3.8711e-01 F35 N = 128.86(D), Expected = 120.69, Std = 4.1800, ChiSquare = 5.0637e-02 E36 C = 172.66(D), Expected = 176.93, Std = 2.1100, ChiSquare = 4.3001e-02 E36 CA = 54.38(D), Expected = 57.42, Std = 2.1900, ChiSquare = 1.6510e-01 E36 H = 9.29(D), Expected = 8.34, Std = 0.6100, ChiSquare = 1.1938e-01 E36 N = 129.13(D), Expected = 120.68, Std = 3.6800, ChiSquare = 2.1665e-02 N37 C = 174.08(D), Expected = 175.16, Std = 1.7600, ChiSquare = 5.3946e-01 N37 CA = 54.13(D), Expected = 53.43, Std = 1.9400, ChiSquare = 7.1823e-01 N37 H = 8.95(D), Expected = 8.37, Std = 0.6500, ChiSquare = 3.7223e-01 N37 N = 125.34(D), Expected = 119.13, Std = 4.4200, ChiSquare = 1.6003e-01 V38 C = 177.09(D), Expected = 175.69, Std = 2.0300, ChiSquare = 4.9041e-01 V38 CA = 64.67(D), Expected = 62.48, Std = 3.0400, ChiSquare = 4.7128e-01 V38 H = 8.56(D), Expected = 8.29, Std = 0.7100, ChiSquare = 7.0374e-01 V38 N = 121.55(D), Expected = 121.02, Std = 4.9600, ChiSquare = 9.1490e-01 H39 C = 173.87(D), Expected = 175.19, Std = 2.1400, ChiSquare = 5.3735e-01 H39 CA = 53.81(D), Expected = 56.37, Std = 2.4000, ChiSquare = 2.8612e-01 H39 H = 8.22(D), Expected = 8.25, Std = 0.7400, ChiSquare = 9.6766e-01 H39 N = 126.23(D), Expected = 119.44, Std = 4.5200, ChiSquare = 1.3304e-01 F40 C = 172.4(D), Expected = 175.49, Std = 2.1300, ChiSquare = 1.4686e-01 F40 CA = 57.87(D), Expected = 58.25, Std = 2.7300, ChiSquare = 8.8930e-01 F40 CB = 43.63(D), Expected = 39.95, Std = 2.0400, ChiSquare = 7.1244e-02 F40 H = 8.39(D), Expected = 8.42, Std = 0.7400, ChiSquare = 9.6766e-01 F40 N = 122.76(D), Expected = 120.69, Std = 4.1800, ChiSquare = 6.2045e-01 S41 C = 172.09(D), Expected = 174.53, Std = 1.7300, ChiSquare = 1.5842e-01 S41 CA = 56.26(D), Expected = 58.57, Std = 2.1200, ChiSquare = 2.7588e-01 S41 H = 7.19(D), Expected = 8.29, Std = 0.6200, ChiSquare = 7.6031e-02 S41 N = 124.84(D), Expected = 116.30, Std = 3.9500, ChiSquare = 3.0616e-02 Y42 CA = 60.56(D), Expected = 58.02, Std = 2.6400, ChiSquare = 3.3599e-01 Y42 H = 7.47(D), Expected = 8.37, Std = 0.7500, ChiSquare = 2.3014e-01 Y42 N = 124.49(D), Expected = 120.79, Std = 4.6900, ChiSquare = 4.3016e-01 A43 C = 176.2(D), Expected = 177.80, Std = 2.1800, ChiSquare = 4.6298e-01 A43 CA = 51.35(D), Expected = 53.16, Std = 2.0600, ChiSquare = 3.7960e-01 A43 H = 8.09(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.5454e-01 A43 N = 122.52(D), Expected = 123.23, Std = 3.7000, ChiSquare = 8.4783e-01 D44 C = 176.71(D), Expected = 176.41, Std = 1.7700, ChiSquare = 8.6541e-01 D44 CA = 54.69(D), Expected = 54.52, Std = 2.1000, ChiSquare = 9.3548e-01 D44 H = 8.21(D), Expected = 8.33, Std = 0.5700, ChiSquare = 8.3326e-01 D44 N = 120.22(D), Expected = 120.73, Std = 4.2000, ChiSquare = 9.0335e-01 G45 C = 173.76(D), Expected = 174.04, Std = 1.9400, ChiSquare = 8.8524e-01 G45 CA = 44.56(D), Expected = 45.33, Std = 1.4200, ChiSquare = 5.8764e-01 G45 H = 8.28(D), Expected = 8.34, Std = 0.7400, ChiSquare = 9.3538e-01 G45 N = 112.04(D), Expected = 109.91, Std = 4.2900, ChiSquare = 6.1954e-01 R46 C = 175.42(D), Expected = 176.49, Std = 2.1600, ChiSquare = 6.2034e-01 R46 CA = 54.87(D), Expected = 56.95, Std = 2.4100, ChiSquare = 3.8810e-01 R46 H = 7.75(D), Expected = 8.24, Std = 0.6000, ChiSquare = 4.1412e-01 R46 N = 123.47(D), Expected = 120.61, Std = 3.9000, ChiSquare = 4.6336e-01 E47 C = 176.52(D), Expected = 176.93, Std = 2.1100, ChiSquare = 8.4593e-01 E47 CA = 56.67(D), Expected = 57.42, Std = 2.1900, ChiSquare = 7.3200e-01 E47 H = 8.7(D), Expected = 8.34, Std = 0.6100, ChiSquare = 5.5508e-01 E47 N = 127.61(D), Expected = 120.68, Std = 3.6800, ChiSquare = 5.9680e-02 L49 CA = 52.99(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.2874e-01 Q50 CA = 53.97(D), Expected = 56.62, Std = 2.1900, ChiSquare = 2.2626e-01 Q50 H = 8.6(D), Expected = 8.22, Std = 0.6200, ChiSquare = 5.3994e-01 Q50 N = 123.14(D), Expected = 119.92, Std = 4.0100, ChiSquare = 4.2198e-01 D51 C = 173.69(D), Expected = 176.41, Std = 1.7700, ChiSquare = 1.2436e-01 D51 CA = 54.85(D), Expected = 54.52, Std = 2.1000, ChiSquare = 8.7513e-01 V52 C = 175.72(D), Expected = 175.69, Std = 2.0300, ChiSquare = 9.8821e-01 V52 CA = 63.7(D), Expected = 62.48, Std = 3.0400, ChiSquare = 6.8819e-01 V52 H = 8.87(D), Expected = 8.29, Std = 0.7100, ChiSquare = 4.1399e-01 V52 N = 123.49(D), Expected = 121.02, Std = 4.9600, ChiSquare = 6.1850e-01 S53 C = 173.14(D), Expected = 174.53, Std = 1.7300, ChiSquare = 4.2170e-01 S53 CA = 56(D), Expected = 58.57, Std = 2.1200, ChiSquare = 2.2541e-01 S53 H = 7.89(D), Expected = 8.29, Std = 0.6200, ChiSquare = 5.1882e-01 S53 N = 125.6(D), Expected = 116.30, Std = 3.9500, ChiSquare = 1.8551e-02 F54 C = 172.64(D), Expected = 175.49, Std = 2.1300, ChiSquare = 1.8089e-01 F54 CA = 57.41(D), Expected = 58.25, Std = 2.7300, ChiSquare = 7.5832e-01 F54 H = 8.52(D), Expected = 8.42, Std = 0.7400, ChiSquare = 8.9251e-01 F54 N = 119.54(D), Expected = 120.69, Std = 4.1800, ChiSquare = 7.8322e-01 T55 C = 173.29(D), Expected = 174.60, Std = 1.8000, ChiSquare = 4.6675e-01 T55 CA = 60.82(D), Expected = 62.15, Std = 2.7200, ChiSquare = 6.2486e-01 T55 H = 8.77(D), Expected = 8.27, Std = 0.6200, ChiSquare = 4.1998e-01 T55 N = 118.4(D), Expected = 115.70, Std = 5.0500, ChiSquare = 5.9289e-01 V56 C = 175.01(D), Expected = 175.69, Std = 2.0300, ChiSquare = 7.3764e-01 V56 CA = 60.94(D), Expected = 62.48, Std = 3.0400, ChiSquare = 6.1245e-01 V56 H = 9.65(D), Expected = 8.29, Std = 0.7100, ChiSquare = 5.5430e-02 V56 N = 129.49(D), Expected = 121.02, Std = 4.9600, ChiSquare = 8.7699e-02 M57 C = 173(D), Expected = 176.30, Std = 2.1300, ChiSquare = 1.2131e-01 M57 CA = 52.17(D), Expected = 56.16, Std = 2.3400, ChiSquare = 8.8171e-02 M57 H = 8.24(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.7341e-01 M57 N = 126.78(D), Expected = 120.10, Std = 3.8800, ChiSquare = 8.5133e-02 P58 C = 178.21(D), Expected = 176.70, Std = 1.6900, ChiSquare = 3.7159e-01 P58 CA = 63.08(D), Expected = 63.30, Std = 1.6400, ChiSquare = 8.9329e-01 G59 C = 173.8(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.0154e-01 G59 CA = 44.65(D), Expected = 45.33, Std = 1.4200, ChiSquare = 6.3203e-01 G59 H = 8.49(D), Expected = 8.34, Std = 0.7400, ChiSquare = 8.3937e-01 G59 N = 114.2(D), Expected = 109.91, Std = 4.2900, ChiSquare = 3.1731e-01 Q60 C = 174.33(D), Expected = 176.39, Std = 1.9600, ChiSquare = 2.9325e-01 Q60 CA = 55.41(D), Expected = 56.62, Std = 2.1900, ChiSquare = 5.8060e-01 Q60 H = 7.98(D), Expected = 8.22, Std = 0.6200, ChiSquare = 6.9868e-01 Q60 N = 121.97(D), Expected = 119.92, Std = 4.0100, ChiSquare = 6.0920e-01 T61 C = 173.67(D), Expected = 174.60, Std = 1.8000, ChiSquare = 6.0539e-01 T61 CA = 61.34(D), Expected = 62.15, Std = 2.7200, ChiSquare = 7.6586e-01 T61 H = 9.21(D), Expected = 8.27, Std = 0.6200, ChiSquare = 1.2949e-01 T61 N = 116.5(D), Expected = 115.70, Std = 5.0500, ChiSquare = 8.7413e-01 L62 C = 173.7(D), Expected = 176.97, Std = 2.0900, ChiSquare = 1.1768e-01 L62 CA = 52.31(D), Expected = 55.65, Std = 2.2100, ChiSquare = 1.3071e-01 L62 H = 8.96(D), Expected = 8.22, Std = 0.6500, ChiSquare = 2.5493e-01 L62 N = 132.99(D), Expected = 121.98, Std = 4.0700, ChiSquare = 6.8272e-03 A63 C = 174.93(D), Expected = 177.80, Std = 2.1800, ChiSquare = 1.8800e-01 A63 CA = 48.58(D), Expected = 53.16, Std = 2.0600, ChiSquare = 2.6196e-02 A63 H = 8.97(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.9938e-01 A63 N = 130.45(D), Expected = 123.23, Std = 3.7000, ChiSquare = 5.1015e-02 L64 C = 175.09(D), Expected = 176.97, Std = 2.0900, ChiSquare = 3.6838e-01 L64 CA = 52.6(D), Expected = 55.65, Std = 2.2100, ChiSquare = 1.6756e-01 L64 H = 8.95(D), Expected = 8.22, Std = 0.6500, ChiSquare = 2.6140e-01 L64 N = 124.29(D), Expected = 121.98, Std = 4.0700, ChiSquare = 5.7033e-01 V65 C = 173.98(D), Expected = 175.69, Std = 2.0300, ChiSquare = 3.9958e-01 V65 CA = 57.51(D), Expected = 62.48, Std = 3.0400, ChiSquare = 1.0208e-01 V65 H = 8.64(D), Expected = 8.29, Std = 0.7100, ChiSquare = 6.2204e-01 V65 N = 117.03(D), Expected = 121.02, Std = 4.9600, ChiSquare = 4.2115e-01 G66 CA = 44.05(D), Expected = 45.33, Std = 1.4200, ChiSquare = 3.6737e-01 G66 H = 8.58(D), Expected = 8.34, Std = 0.7400, ChiSquare = 7.4569e-01 G66 N = 110.45(D), Expected = 109.91, Std = 4.2900, ChiSquare = 8.9983e-01 P67 C = 176.5(D), Expected = 176.70, Std = 1.6900, ChiSquare = 9.0580e-01 S68 C = 175.96(D), Expected = 174.53, Std = 1.7300, ChiSquare = 4.0847e-01 S68 CA = 59.51(D), Expected = 58.57, Std = 2.1200, ChiSquare = 6.5748e-01 S68 H = 8.57(D), Expected = 8.29, Std = 0.6200, ChiSquare = 6.5155e-01 S68 N = 118.63(D), Expected = 116.30, Std = 3.9500, ChiSquare = 5.5528e-01 G69 CA = 44.9(D), Expected = 45.33, Std = 1.4200, ChiSquare = 7.6203e-01 G69 H = 11.41(S), Expected = 8.34, Std = 0.7400, ChiSquare = 3.3444e-05 G69 N = 121.48(D), Expected = 109.91, Std = 4.2900, ChiSquare = 6.9974e-03 Y83 C = 174.11(D), Expected = 175.39, Std = 1.8900, ChiSquare = 4.9825e-01 D84 C = 176.45(D), Expected = 176.41, Std = 1.7700, ChiSquare = 9.8197e-01 D84 CA = 53.7(D), Expected = 54.52, Std = 2.1000, ChiSquare = 6.9618e-01 D84 CB = 42.33(D), Expected = 40.70, Std = 1.6700, ChiSquare = 3.2904e-01 D84 H = 8.64(D), Expected = 8.33, Std = 0.5700, ChiSquare = 5.8654e-01 D84 N = 121.85(D), Expected = 120.73, Std = 4.2000, ChiSquare = 7.8973e-01 I85 C = 175.85(D), Expected = 175.82, Std = 1.9500, ChiSquare = 9.8773e-01 I85 CA = 61.02(D), Expected = 61.59, Std = 2.7800, ChiSquare = 8.3754e-01 I85 H = 8.09(D), Expected = 8.26, Std = 0.7100, ChiSquare = 8.1077e-01 I85 N = 114.59(D), Expected = 121.60, Std = 4.7200, ChiSquare = 1.3750e-01 S86 C = 174.93(D), Expected = 174.53, Std = 1.7300, ChiSquare = 8.1715e-01 S86 CA = 59.4(D), Expected = 58.57, Std = 2.1200, ChiSquare = 6.9542e-01 S86 H = 8.53(D), Expected = 8.29, Std = 0.6200, ChiSquare = 6.9868e-01 S86 N = 118.67(D), Expected = 116.30, Std = 3.9500, ChiSquare = 5.4851e-01 S87 C = 172.28(D), Expected = 174.53, Std = 1.7300, ChiSquare = 1.9340e-01 S87 CA = 57.88(D), Expected = 58.57, Std = 2.1200, ChiSquare = 7.4482e-01 S87 H = 7.67(D), Expected = 8.29, Std = 0.6200, ChiSquare = 3.1731e-01 S87 N = 115.82(D), Expected = 116.30, Std = 3.9500, ChiSquare = 9.0328e-01 G88 C = 173.87(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.3017e-01 G88 CA = 44.15(D), Expected = 45.33, Std = 1.4200, ChiSquare = 4.0598e-01 G88 H = 8.32(D), Expected = 8.34, Std = 0.7400, ChiSquare = 9.7844e-01 G88 N = 111.45(D), Expected = 109.91, Std = 4.2900, ChiSquare = 7.1961e-01 C89 C = 171.27(D), Expected = 174.78, Std = 1.9900, ChiSquare = 7.7763e-02 C89 CA = 58.78(D), Expected = 57.43, Std = 3.4100, ChiSquare = 6.9218e-01 C89 H = 8.35(D), Expected = 8.42, Std = 0.6600, ChiSquare = 9.1553e-01 C89 N = 121.51(D), Expected = 119.95, Std = 4.7900, ChiSquare = 7.4467e-01 I90 CA = 59.77(D), Expected = 61.59, Std = 2.7800, ChiSquare = 5.1268e-01 I90 H = 8.83(D), Expected = 8.26, Std = 0.7100, ChiSquare = 4.2208e-01 I90 N = 131.44(D), Expected = 121.60, Std = 4.7200, ChiSquare = 3.7092e-02 R91 C = 176.53(D), Expected = 176.49, Std = 2.1600, ChiSquare = 9.8523e-01 R91 CA = 52.88(D), Expected = 56.95, Std = 2.4100, ChiSquare = 9.1258e-02 R91 H = 9.13(D), Expected = 8.24, Std = 0.6000, ChiSquare = 1.3799e-01 R91 N = 125.31(D), Expected = 120.61, Std = 3.9000, ChiSquare = 2.2815e-01 I92 C = 175.37(D), Expected = 175.82, Std = 1.9500, ChiSquare = 8.1749e-01 I92 CA = 59.08(D), Expected = 61.59, Std = 2.7800, ChiSquare = 3.6659e-01 I92 H = 8.16(D), Expected = 8.26, Std = 0.7100, ChiSquare = 8.8799e-01 I92 N = 122.59(D), Expected = 121.60, Std = 4.7200, ChiSquare = 8.3387e-01 D93 C = 176.98(D), Expected = 176.41, Std = 1.7700, ChiSquare = 7.4743e-01 D93 CA = 55.92(D), Expected = 54.52, Std = 2.1000, ChiSquare = 5.0499e-01 D93 CB = 39.2(D), Expected = 40.70, Std = 1.6700, ChiSquare = 3.6908e-01 D93 H = 9.56(D), Expected = 8.33, Std = 0.5700, ChiSquare = 3.0936e-02 D93 N = 130.06(D), Expected = 120.73, Std = 4.2000, ChiSquare = 2.6322e-02 G94 C = 173.71(D), Expected = 174.04, Std = 1.9400, ChiSquare = 8.6493e-01 G94 CA = 44.83(D), Expected = 45.33, Std = 1.4200, ChiSquare = 7.2475e-01 G94 H = 9.24(D), Expected = 8.34, Std = 0.7400, ChiSquare = 2.2390e-01 G94 N = 105.58(D), Expected = 109.91, Std = 4.2900, ChiSquare = 3.1282e-01 Q95 C = 173.97(D), Expected = 176.39, Std = 1.9600, ChiSquare = 2.1694e-01 Q95 CA = 54.29(D), Expected = 56.62, Std = 2.1900, ChiSquare = 2.8736e-01 Q95 CB = 29.57(D), Expected = 29.10, Std = 1.9700, ChiSquare = 8.1143e-01 Q95 H = 7.92(D), Expected = 8.22, Std = 0.6200, ChiSquare = 6.2848e-01 Q95 N = 125.15(D), Expected = 119.92, Std = 4.0100, ChiSquare = 1.9215e-01 D96 C = 179.2(D), Expected = 176.41, Std = 1.7700, ChiSquare = 1.1496e-01 D96 CA = 52.88(D), Expected = 54.52, Std = 2.1000, ChiSquare = 4.3483e-01 D96 H = 8.32(D), Expected = 8.33, Std = 0.5700, ChiSquare = 9.8600e-01 D96 N = 126.65(D), Expected = 120.73, Std = 4.2000, ChiSquare = 1.5868e-01 I97 C = 176.33(D), Expected = 175.82, Std = 1.9500, ChiSquare = 7.9368e-01 I97 CA = 63.92(D), Expected = 61.59, Std = 2.7800, ChiSquare = 4.0196e-01 I97 H = 8.74(D), Expected = 8.26, Std = 0.7100, ChiSquare = 4.9901e-01 I97 N = 126.15(D), Expected = 121.60, Std = 4.7200, ChiSquare = 3.3505e-01 S98 CA = 59.79(D), Expected = 58.57, Std = 2.1200, ChiSquare = 5.6497e-01 S98 H = 9.11(D), Expected = 8.29, Std = 0.6200, ChiSquare = 1.8597e-01 S98 N = 119.64(D), Expected = 116.30, Std = 3.9500, ChiSquare = 3.9779e-01 Q99 C = 174.71(D), Expected = 176.39, Std = 1.9600, ChiSquare = 3.9137e-01 Q99 CA = 54.6(D), Expected = 56.62, Std = 2.1900, ChiSquare = 3.5633e-01 Q99 H = 7.84(D), Expected = 8.22, Std = 0.6200, ChiSquare = 5.3994e-01 Q99 N = 122.14(D), Expected = 119.92, Std = 4.0100, ChiSquare = 5.7984e-01 V100 C = 177.54(D), Expected = 175.69, Std = 2.0300, ChiSquare = 3.6212e-01 V100 CA = 57.52(D), Expected = 62.48, Std = 3.0400, ChiSquare = 1.0277e-01 V100 H = 6.66(D), Expected = 8.29, Std = 0.7100, ChiSquare = 2.1689e-02 V100 N = 111.53(D), Expected = 121.02, Std = 4.9600, ChiSquare = 5.5709e-02 T101 CA = 60.29(D), Expected = 62.15, Std = 2.7200, ChiSquare = 4.9409e-01 T101 CB = 67.71(D), Expected = 69.64, Std = 1.7000, ChiSquare = 2.5625e-01 T101 H = 8.31(D), Expected = 8.27, Std = 0.6200, ChiSquare = 9.4856e-01 T101 N = 117.06(D), Expected = 115.70, Std = 5.0500, ChiSquare = 7.8769e-01 Q102 C = 178.09(D), Expected = 176.39, Std = 1.9600, ChiSquare = 3.8575e-01 Q102 CA = 58.91(D), Expected = 56.62, Std = 2.1900, ChiSquare = 2.9572e-01 Q102 H = 10.44(S), Expected = 8.22, Std = 0.6200, ChiSquare = 3.4275e-04 Q102 N = 131.07(D), Expected = 119.92, Std = 4.0100, ChiSquare = 5.4267e-03 A103 C = 180.75(D), Expected = 177.80, Std = 2.1800, ChiSquare = 1.7599e-01 A103 CA = 54.21(D), Expected = 53.16, Std = 2.0600, ChiSquare = 6.1026e-01 A103 H = 9.23(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.6040e-02 A103 N = 122.42(D), Expected = 123.23, Std = 3.7000, ChiSquare = 8.2671e-01 S104 CA = 60.36(D), Expected = 58.57, Std = 2.1200, ChiSquare = 3.9848e-01 S104 H = 7.34(D), Expected = 8.29, Std = 0.6200, ChiSquare = 1.2546e-01 S104 N = 115.86(D), Expected = 116.30, Std = 3.9500, ChiSquare = 9.1131e-01 L105 C = 177.4(D), Expected = 176.97, Std = 2.0900, ChiSquare = 8.3699e-01 L105 CA = 58.11(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.6566e-01 L105 H = 7.6(D), Expected = 8.22, Std = 0.6500, ChiSquare = 3.4016e-01 L105 N = 128.43(D), Expected = 121.98, Std = 4.0700, ChiSquare = 1.1302e-01 R106 CA = 58.52(D), Expected = 56.95, Std = 2.4100, ChiSquare = 5.1475e-01 R106 H = 7.79(D), Expected = 8.24, Std = 0.6000, ChiSquare = 4.5325e-01 R106 N = 114.74(D), Expected = 120.61, Std = 3.9000, ChiSquare = 1.3229e-01 S107 C = 174.22(D), Expected = 174.53, Std = 1.7300, ChiSquare = 8.5779e-01 H108 H = 6.96(D), Expected = 8.25, Std = 0.7400, ChiSquare = 8.1291e-02 H108 N = 119.48(D), Expected = 119.44, Std = 4.5200, ChiSquare = 9.9294e-01 I109 CA = 59.66(D), Expected = 61.59, Std = 2.7800, ChiSquare = 4.8753e-01 I109 H = 7.13(D), Expected = 8.26, Std = 0.7100, ChiSquare = 1.1149e-01 I109 N = 120.23(D), Expected = 121.60, Std = 4.7200, ChiSquare = 7.7162e-01 G110 CA = 43.47(D), Expected = 45.33, Std = 1.4200, ChiSquare = 1.9024e-01 G110 H = 9.05(D), Expected = 8.34, Std = 0.7400, ChiSquare = 3.3733e-01 G110 N = 116.62(D), Expected = 109.91, Std = 4.2900, ChiSquare = 1.1779e-01 P113 CA = 63.04(D), Expected = 63.30, Std = 1.6400, ChiSquare = 8.7403e-01 Q114 CA = 56.33(D), Expected = 56.62, Std = 2.1900, ChiSquare = 8.9465e-01 Q114 H = 8.37(D), Expected = 8.22, Std = 0.6200, ChiSquare = 8.0883e-01 Q114 N = 122.43(D), Expected = 119.92, Std = 4.0100, ChiSquare = 5.3136e-01 N120 C = 172.46(D), Expected = 175.16, Std = 1.7600, ChiSquare = 1.2501e-01 D121 CA = 52.01(D), Expected = 54.52, Std = 2.1000, ChiSquare = 2.3199e-01 D121 H = 8.04(D), Expected = 8.33, Std = 0.5700, ChiSquare = 6.1091e-01 D121 N = 129.21(D), Expected = 120.73, Std = 4.2000, ChiSquare = 4.3482e-02 T122 CA = 61.73(D), Expected = 62.15, Std = 2.7200, ChiSquare = 8.7729e-01 T122 H = 9.87(D), Expected = 8.27, Std = 0.6200, ChiSquare = 9.8616e-03 T122 N = 112.45(D), Expected = 115.70, Std = 5.0500, ChiSquare = 5.1986e-01 I123 CA = 62.34(D), Expected = 61.59, Std = 2.7800, ChiSquare = 7.8733e-01 I123 H = 8.81(D), Expected = 8.26, Std = 0.7100, ChiSquare = 4.3855e-01 I123 N = 124.1(D), Expected = 121.60, Std = 4.7200, ChiSquare = 5.9635e-01 A124 CA = 55.45(D), Expected = 53.16, Std = 2.0600, ChiSquare = 2.6629e-01 A124 H = 7.99(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.2634e-01 A124 N = 125.27(D), Expected = 123.23, Std = 3.7000, ChiSquare = 5.8139e-01 D125 C = 178.46(D), Expected = 176.41, Std = 1.7700, ChiSquare = 2.4679e-01 D125 CA = 57.29(D), Expected = 54.52, Std = 2.1000, ChiSquare = 1.8715e-01 D125 H = 8.27(D), Expected = 8.33, Std = 0.5700, ChiSquare = 9.1617e-01 D125 N = 119.56(D), Expected = 120.73, Std = 4.2000, ChiSquare = 7.8057e-01 T133 CA = 60.6(D), Expected = 62.15, Std = 2.7200, ChiSquare = 5.6878e-01 T133 H = 7.04(D), Expected = 8.27, Std = 0.6200, ChiSquare = 4.7270e-02 T133 N = 109.13(D), Expected = 115.70, Std = 5.0500, ChiSquare = 1.9326e-01 A134 C = 178.28(D), Expected = 177.80, Std = 2.1800, ChiSquare = 8.2573e-01 A134 CA = 52.09(D), Expected = 53.16, Std = 2.0600, ChiSquare = 6.0347e-01 A134 H = 8.14(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.2034e-01 A134 N = 127.63(D), Expected = 123.23, Std = 3.7000, ChiSquare = 2.3437e-01 G135 CA = 43.31(D), Expected = 45.33, Std = 1.4200, ChiSquare = 1.5487e-01 G135 H = 8.9(D), Expected = 8.34, Std = 0.7400, ChiSquare = 4.4920e-01 G135 N = 112.31(D), Expected = 109.91, Std = 4.2900, ChiSquare = 5.7586e-01 D137 C = 178.73(D), Expected = 176.41, Std = 1.7700, ChiSquare = 1.8995e-01 E138 C = 179.16(D), Expected = 176.93, Std = 2.1100, ChiSquare = 2.9057e-01 E138 CA = 58.54(D), Expected = 57.42, Std = 2.1900, ChiSquare = 6.0906e-01 E138 H = 7.43(D), Expected = 8.34, Std = 0.6100, ChiSquare = 1.3575e-01 E138 N = 124.53(D), Expected = 120.68, Std = 3.6800, ChiSquare = 2.9547e-01 V139 C = 176.76(D), Expected = 175.69, Std = 2.0300, ChiSquare = 5.9813e-01 V139 CA = 66.6(D), Expected = 62.48, Std = 3.0400, ChiSquare = 1.7533e-01 V139 H = 7.83(D), Expected = 8.29, Std = 0.7100, ChiSquare = 5.1706e-01 V139 N = 124.11(D), Expected = 121.02, Std = 4.9600, ChiSquare = 5.3330e-01 E140 C = 178.69(D), Expected = 176.93, Std = 2.1100, ChiSquare = 4.0421e-01 E140 CA = 58.35(D), Expected = 57.42, Std = 2.1900, ChiSquare = 6.7109e-01 E140 H = 7.86(D), Expected = 8.34, Std = 0.6100, ChiSquare = 4.3135e-01 E140 N = 121.23(D), Expected = 120.68, Std = 3.6800, ChiSquare = 8.8119e-01 A141 C = 181.19(D), Expected = 177.80, Std = 2.1800, ChiSquare = 1.1993e-01 A141 CA = 54.4(D), Expected = 53.16, Std = 2.0600, ChiSquare = 5.4721e-01 A141 CB = 16.8(D), Expected = 18.90, Std = 1.8500, ChiSquare = 2.5632e-01 A141 H = 7.74(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.4328e-01 A141 N = 122.85(D), Expected = 123.23, Std = 3.7000, ChiSquare = 9.1820e-01 A142 C = 179.05(D), Expected = 177.80, Std = 2.1800, ChiSquare = 5.6638e-01 A142 CA = 54.61(D), Expected = 53.16, Std = 2.0600, ChiSquare = 4.8151e-01 A142 H = 8.05(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.0259e-01 A142 N = 125.6(D), Expected = 123.23, Std = 3.7000, ChiSquare = 5.2182e-01 A143 C = 181.01(D), Expected = 177.80, Std = 2.1800, ChiSquare = 1.4089e-01 A143 CA = 54.58(D), Expected = 53.16, Std = 2.0600, ChiSquare = 4.9062e-01 A143 CB = 18.84(D), Expected = 18.90, Std = 1.8500, ChiSquare = 9.7413e-01 A143 H = 8.53(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.8232e-01 A143 N = 122.53(D), Expected = 123.23, Std = 3.7000, ChiSquare = 8.4994e-01 Q144 C = 179.71(D), Expected = 176.39, Std = 1.9600, ChiSquare = 9.0289e-02 Q144 CA = 58.38(D), Expected = 56.62, Std = 2.1900, ChiSquare = 4.2160e-01 Q144 H = 8.8(D), Expected = 8.22, Std = 0.6200, ChiSquare = 3.4954e-01 Q144 N = 122.37(D), Expected = 119.92, Std = 4.0100, ChiSquare = 5.4122e-01 A145 C = 179.14(D), Expected = 177.80, Std = 2.1800, ChiSquare = 5.3877e-01 A145 CA = 54.34(D), Expected = 53.16, Std = 2.0600, ChiSquare = 5.6677e-01 A145 CB = 17.71(D), Expected = 18.90, Std = 1.8500, ChiSquare = 5.2007e-01 A145 H = 8.03(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.7692e-01 A145 N = 126.64(D), Expected = 123.23, Std = 3.7000, ChiSquare = 3.5673e-01 A146 C = 176.76(D), Expected = 177.80, Std = 2.1800, ChiSquare = 6.3332e-01 A146 CA = 51.7(D), Expected = 53.16, Std = 2.0600, ChiSquare = 4.7849e-01 A146 H = 8.05(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.0259e-01 A146 N = 120.04(D), Expected = 123.23, Std = 3.7000, ChiSquare = 3.8860e-01 G147 C = 174.75(D), Expected = 174.04, Std = 1.9400, ChiSquare = 7.1438e-01 G147 CA = 45.69(D), Expected = 45.33, Std = 1.4200, ChiSquare = 7.9987e-01 G147 H = 7.68(D), Expected = 8.34, Std = 0.7400, ChiSquare = 3.7245e-01 G147 N = 107.63(D), Expected = 109.91, Std = 4.2900, ChiSquare = 5.9509e-01 I148 CA = 57.22(D), Expected = 61.59, Std = 2.7800, ChiSquare = 1.1596e-01 I148 H = 8.29(D), Expected = 8.26, Std = 0.7100, ChiSquare = 9.6630e-01 I148 N = 117.6(D), Expected = 121.60, Std = 4.7200, ChiSquare = 3.9674e-01 H149 C = 175.37(D), Expected = 175.19, Std = 2.1400, ChiSquare = 9.3297e-01 H149 CA = 59.5(D), Expected = 56.37, Std = 2.4000, ChiSquare = 1.9218e-01 H149 H = 7.06(D), Expected = 8.25, Std = 0.7400, ChiSquare = 1.0781e-01 H149 N = 126.72(D), Expected = 119.44, Std = 4.5200, ChiSquare = 1.0726e-01 D150 C = 178.66(D), Expected = 176.41, Std = 1.7700, ChiSquare = 2.0366e-01 D150 CA = 57.05(D), Expected = 54.52, Std = 2.1000, ChiSquare = 2.2830e-01 D150 CB = 39.37(D), Expected = 40.70, Std = 1.6700, ChiSquare = 4.2580e-01 D150 H = 8.32(D), Expected = 8.33, Std = 0.5700, ChiSquare = 9.8600e-01 D150 N = 118.68(D), Expected = 120.73, Std = 4.2000, ChiSquare = 6.2548e-01 A151 C = 179.32(D), Expected = 177.80, Std = 2.1800, ChiSquare = 4.8565e-01 A151 CA = 53.83(D), Expected = 53.16, Std = 2.0600, ChiSquare = 7.4500e-01 A151 CB = 16.51(D), Expected = 18.90, Std = 1.8500, ChiSquare = 1.9639e-01 A151 H = 7.54(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.7133e-01 A151 N = 124.88(D), Expected = 123.23, Std = 3.7000, ChiSquare = 6.5564e-01 I152 C = 178.22(D), Expected = 175.82, Std = 1.9500, ChiSquare = 2.1841e-01 I152 CA = 62.99(D), Expected = 61.59, Std = 2.7800, ChiSquare = 6.1454e-01 I152 H = 7.23(D), Expected = 8.26, Std = 0.7100, ChiSquare = 1.4686e-01 I152 N = 120.44(D), Expected = 121.60, Std = 4.7200, ChiSquare = 8.0587e-01 M153 C = 177.49(D), Expected = 176.30, Std = 2.1300, ChiSquare = 5.7638e-01 M153 CA = 54.48(D), Expected = 56.16, Std = 2.3400, ChiSquare = 4.7279e-01 M153 H = 7.6(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.7133e-01 M153 N = 116.7(D), Expected = 120.10, Std = 3.8800, ChiSquare = 3.8087e-01 A154 C = 178.59(D), Expected = 177.80, Std = 2.1800, ChiSquare = 7.1706e-01 A154 CA = 51.17(D), Expected = 53.16, Std = 2.0600, ChiSquare = 3.3403e-01 A154 H = 6.94(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.5729e-02 A154 N = 122.32(D), Expected = 123.23, Std = 3.7000, ChiSquare = 8.0572e-01 F155 C = 176.87(D), Expected = 175.49, Std = 2.1300, ChiSquare = 5.1706e-01 F155 CA = 52.83(D), Expected = 58.25, Std = 2.7300, ChiSquare = 4.7106e-02 F155 CB = 35.91(D), Expected = 39.95, Std = 2.0400, ChiSquare = 4.7660e-02 F155 H = 7.68(D), Expected = 8.42, Std = 0.7400, ChiSquare = 3.1731e-01 F155 N = 124.4(D), Expected = 120.69, Std = 4.1800, ChiSquare = 3.7478e-01 P156 C = 177.65(D), Expected = 176.70, Std = 1.6900, ChiSquare = 5.7403e-01 E157 C = 177.57(D), Expected = 176.93, Std = 2.1100, ChiSquare = 7.6165e-01 E157 CA = 54.12(D), Expected = 57.42, Std = 2.1900, ChiSquare = 1.3185e-01 E157 H = 7.64(D), Expected = 8.34, Std = 0.6100, ChiSquare = 2.5116e-01 E157 N = 114.38(D), Expected = 120.68, Std = 3.6800, ChiSquare = 8.6905e-02 G158 C = 178.03(D), Expected = 174.04, Std = 1.9400, ChiSquare = 3.9715e-02 G158 CA = 46.04(D), Expected = 45.33, Std = 1.4200, ChiSquare = 6.1707e-01 G158 H = 7.61(D), Expected = 8.34, Std = 0.7400, ChiSquare = 3.2389e-01 G158 N = 111.03(D), Expected = 109.91, Std = 4.2900, ChiSquare = 7.9404e-01 Y159 C = 175.56(D), Expected = 175.39, Std = 1.8900, ChiSquare = 9.2833e-01 Y159 CA = 62.16(D), Expected = 58.02, Std = 2.6400, ChiSquare = 1.1684e-01 Y159 H = 9.39(D), Expected = 8.37, Std = 0.7500, ChiSquare = 1.7383e-01 Y159 N = 128.85(D), Expected = 120.79, Std = 4.6900, ChiSquare = 8.5696e-02 R160 C = 175.11(D), Expected = 176.49, Std = 2.1600, ChiSquare = 5.2290e-01 R160 CA = 55.15(D), Expected = 56.95, Std = 2.4100, ChiSquare = 4.5513e-01 R160 H = 7.9(D), Expected = 8.24, Std = 0.6000, ChiSquare = 5.7094e-01 R160 N = 118.2(D), Expected = 120.61, Std = 3.9000, ChiSquare = 5.3661e-01 T161 CA = 64.47(D), Expected = 62.15, Std = 2.7200, ChiSquare = 3.9369e-01 T161 H = 7.43(D), Expected = 8.27, Std = 0.6200, ChiSquare = 1.7547e-01 T161 N = 119.7(D), Expected = 115.70, Std = 5.0500, ChiSquare = 4.2831e-01 Q162 C = 176.15(D), Expected = 176.39, Std = 1.9600, ChiSquare = 9.0254e-01 Q162 CA = 55.85(D), Expected = 56.62, Std = 2.1900, ChiSquare = 7.2514e-01 Q162 CB = 26.96(D), Expected = 29.10, Std = 1.9700, ChiSquare = 2.7735e-01 Q162 H = 8.85(D), Expected = 8.22, Std = 0.6200, ChiSquare = 3.0957e-01 Q162 N = 129.72(D), Expected = 119.92, Std = 4.0100, ChiSquare = 1.4530e-02 V163 C = 174.42(D), Expected = 175.69, Std = 2.0300, ChiSquare = 5.3157e-01 V163 CA = 59.5(D), Expected = 62.48, Std = 3.0400, ChiSquare = 3.2696e-01 V163 CB = 32.52(D), Expected = 32.66, Std = 1.9100, ChiSquare = 9.4157e-01 V163 H = 8.18(D), Expected = 8.29, Std = 0.7100, ChiSquare = 8.7688e-01 V163 N = 121.25(D), Expected = 121.02, Std = 4.9600, ChiSquare = 9.6301e-01 G164 C = 175.29(D), Expected = 174.04, Std = 1.9400, ChiSquare = 5.1936e-01 G164 CA = 43.33(D), Expected = 45.33, Std = 1.4200, ChiSquare = 1.5900e-01 G164 H = 7.96(D), Expected = 8.34, Std = 0.7400, ChiSquare = 6.0759e-01 G164 N = 108.19(D), Expected = 109.91, Std = 4.2900, ChiSquare = 6.8847e-01 E165 C = 178(D), Expected = 176.93, Std = 2.1100, ChiSquare = 6.1208e-01 E165 CA = 58.47(D), Expected = 57.42, Std = 2.1900, ChiSquare = 6.3162e-01 E165 H = 8.31(D), Expected = 8.34, Std = 0.6100, ChiSquare = 9.6078e-01 E165 N = 123.51(D), Expected = 120.68, Std = 3.6800, ChiSquare = 4.4188e-01 R166 C = 175.83(D), Expected = 176.49, Std = 2.1600, ChiSquare = 7.5994e-01 R166 CA = 54.96(D), Expected = 56.95, Std = 2.4100, ChiSquare = 4.0896e-01 R166 H = 8.44(D), Expected = 8.24, Std = 0.6000, ChiSquare = 7.3888e-01 R166 N = 118.36(D), Expected = 120.61, Std = 3.9000, ChiSquare = 5.6399e-01 G167 CA = 43.26(D), Expected = 45.33, Std = 1.4200, ChiSquare = 1.4491e-01 G167 H = 7.3(D), Expected = 8.34, Std = 0.7400, ChiSquare = 1.5990e-01 G167 N = 111.03(D), Expected = 109.91, Std = 4.2900, ChiSquare = 7.9404e-01 L168 C = 172.52(D), Expected = 176.97, Std = 2.0900, ChiSquare = 3.3239e-02 L168 CA = 55.03(D), Expected = 55.65, Std = 2.2100, ChiSquare = 7.7906e-01 L168 H = 8.16(D), Expected = 8.22, Std = 0.6500, ChiSquare = 9.2645e-01 L168 N = 127.87(D), Expected = 121.98, Std = 4.0700, ChiSquare = 1.4785e-01 K169 C = 175.77(D), Expected = 176.46, Std = 2.0500, ChiSquare = 7.3643e-01 K169 CA = 55.16(D), Expected = 56.84, Std = 2.2500, ChiSquare = 4.5527e-01 K169 H = 8.17(D), Expected = 8.22, Std = 0.6400, ChiSquare = 9.3773e-01 K169 N = 127.4(D), Expected = 121.16, Std = 4.1100, ChiSquare = 1.2895e-01 L170 C = 176.95(D), Expected = 176.97, Std = 2.0900, ChiSquare = 9.9236e-01 L170 CA = 53.34(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.9591e-01 L170 H = 7.93(D), Expected = 8.22, Std = 0.6500, ChiSquare = 6.5549e-01 L170 N = 128.28(D), Expected = 121.98, Std = 4.0700, ChiSquare = 1.2164e-01 S171 CA = 56.82(D), Expected = 58.57, Std = 2.1200, ChiSquare = 4.0910e-01 S171 H = 9.18(D), Expected = 8.29, Std = 0.6200, ChiSquare = 1.5115e-01 S171 N = 120.65(D), Expected = 116.30, Std = 3.9500, ChiSquare = 2.7078e-01 G172 C = 176.44(D), Expected = 174.04, Std = 1.9400, ChiSquare = 2.1604e-01 G173 CA = 46.57(D), Expected = 45.33, Std = 1.4200, ChiSquare = 3.8253e-01 G173 H = 8.73(D), Expected = 8.34, Std = 0.7400, ChiSquare = 5.9817e-01 G173 N = 110.85(D), Expected = 109.91, Std = 4.2900, ChiSquare = 8.2656e-01 E174 C = 178.69(D), Expected = 176.93, Std = 2.1100, ChiSquare = 4.0421e-01 E174 CA = 59.13(D), Expected = 57.42, Std = 2.1900, ChiSquare = 4.3491e-01 E174 H = 7.57(D), Expected = 8.34, Std = 0.6100, ChiSquare = 2.0684e-01 E174 N = 123.65(D), Expected = 120.68, Std = 3.6800, ChiSquare = 4.1963e-01 K175 C = 178.56(D), Expected = 176.46, Std = 2.0500, ChiSquare = 3.0565e-01 K175 CA = 60.82(D), Expected = 56.84, Std = 2.2500, ChiSquare = 7.6913e-02 K175 H = 8.61(D), Expected = 8.22, Std = 0.6400, ChiSquare = 5.4228e-01 K175 N = 120.42(D), Expected = 121.16, Std = 4.1100, ChiSquare = 8.5711e-01 R177 C = 178.81(D), Expected = 176.49, Std = 2.1600, ChiSquare = 2.8279e-01 V178 C = 177.39(D), Expected = 175.69, Std = 2.0300, ChiSquare = 4.0235e-01 V178 H = 8.06(D), Expected = 8.29, Std = 0.7100, ChiSquare = 7.4598e-01 V178 N = 123.92(D), Expected = 121.02, Std = 4.9600, ChiSquare = 5.5876e-01 A179 H = 7.82(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.2652e-01 A179 N = 124.32(D), Expected = 123.23, Std = 3.7000, ChiSquare = 7.6830e-01 K186 CA = 58.72(D), Expected = 56.84, Std = 2.2500, ChiSquare = 4.0341e-01 A187 CA = 51.8(D), Expected = 53.16, Std = 2.0600, ChiSquare = 5.0913e-01 A187 H = 8.13(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.0712e-01 A187 N = 120.54(D), Expected = 123.23, Std = 3.7000, ChiSquare = 4.6721e-01 G189 C = 173.26(D), Expected = 174.04, Std = 1.9400, ChiSquare = 6.8764e-01 G189 CA = 45.31(D), Expected = 45.33, Std = 1.4200, ChiSquare = 9.8876e-01 I190 C = 173.82(D), Expected = 175.82, Std = 1.9500, ChiSquare = 3.0506e-01 I190 CA = 59.08(D), Expected = 61.59, Std = 2.7800, ChiSquare = 3.6659e-01 I190 H = 7.84(D), Expected = 8.26, Std = 0.7100, ChiSquare = 5.5415e-01 I190 N = 122.57(D), Expected = 121.60, Std = 4.7200, ChiSquare = 8.3717e-01 I191 C = 172.88(D), Expected = 175.82, Std = 1.9500, ChiSquare = 1.3163e-01 I191 H = 9.04(D), Expected = 8.26, Std = 0.7100, ChiSquare = 2.7195e-01 I191 N = 129.32(D), Expected = 121.60, Std = 4.7200, ChiSquare = 1.0192e-01 L192 C = 174.96(D), Expected = 176.97, Std = 2.0900, ChiSquare = 3.3619e-01 L192 CA = 51.55(D), Expected = 55.65, Std = 2.2100, ChiSquare = 6.3567e-02 L192 CB = 41.03(D), Expected = 42.37, Std = 1.8600, ChiSquare = 4.7126e-01 L192 H = 8.77(D), Expected = 8.22, Std = 0.6500, ChiSquare = 3.9747e-01 L192 N = 126.83(D), Expected = 121.98, Std = 4.0700, ChiSquare = 2.3340e-01 L193 CB = 41.25(D), Expected = 42.37, Std = 1.8600, ChiSquare = 5.4707e-01 L193 H = 8.98(D), Expected = 8.22, Std = 0.6500, ChiSquare = 2.4231e-01 L193 N = 125.78(D), Expected = 121.98, Std = 4.0700, ChiSquare = 3.5048e-01 L200 C = 176.57(D), Expected = 176.97, Std = 2.0900, ChiSquare = 8.4822e-01 L200 CA = 53.05(D), Expected = 55.65, Std = 2.2100, ChiSquare = 2.3941e-01 D201 CA = 52.44(D), Expected = 54.52, Std = 2.1000, ChiSquare = 3.2194e-01 D201 H = 8.15(D), Expected = 8.33, Std = 0.5700, ChiSquare = 7.5216e-01 D201 N = 121.84(D), Expected = 120.73, Std = 4.2000, ChiSquare = 7.9156e-01 T202 H = 8.3(D), Expected = 8.27, Std = 0.6200, ChiSquare = 9.6141e-01 T202 N = 115.84(D), Expected = 115.70, Std = 5.0500, ChiSquare = 9.7788e-01 E205 C = 177.43(D), Expected = 176.93, Std = 2.1100, ChiSquare = 8.1268e-01 R206 CA = 58.79(D), Expected = 56.95, Std = 2.4100, ChiSquare = 4.4517e-01 R206 H = 8.03(D), Expected = 8.24, Std = 0.6000, ChiSquare = 7.2634e-01 R206 N = 120.2(D), Expected = 120.61, Std = 3.9000, ChiSquare = 9.1627e-01 A207 CA = 54.26(D), Expected = 53.16, Std = 2.0600, ChiSquare = 5.9335e-01 A207 H = 7.68(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.8612e-01 A207 N = 123.86(D), Expected = 123.23, Std = 3.7000, ChiSquare = 8.6480e-01 A213 C = 180.35(D), Expected = 177.80, Std = 2.1800, ChiSquare = 2.4211e-01 K214 CA = 58.2(D), Expected = 56.84, Std = 2.2500, ChiSquare = 5.4555e-01 K214 H = 7.19(D), Expected = 8.22, Std = 0.6400, ChiSquare = 1.0753e-01 K214 N = 117.99(D), Expected = 121.16, Std = 4.1100, ChiSquare = 4.4054e-01 V215 H = 7.59(D), Expected = 8.29, Std = 0.7100, ChiSquare = 3.2417e-01 V215 N = 120.37(D), Expected = 121.02, Std = 4.9600, ChiSquare = 8.9574e-01 A217 CA = 53.17(D), Expected = 53.16, Std = 2.0600, ChiSquare = 9.9613e-01 N218 C = 173.88(D), Expected = 175.16, Std = 1.7600, ChiSquare = 4.6706e-01 N218 CA = 54.14(D), Expected = 53.43, Std = 1.9400, ChiSquare = 7.1438e-01 N218 H = 8.86(D), Expected = 8.37, Std = 0.6500, ChiSquare = 4.5094e-01 N218 N = 117.14(D), Expected = 119.13, Std = 4.4200, ChiSquare = 6.5255e-01 R219 C = 175.77(D), Expected = 176.49, Std = 2.1600, ChiSquare = 7.3888e-01 R219 CA = 54.35(D), Expected = 56.95, Std = 2.4100, ChiSquare = 2.8066e-01 R219 CB = 31.51(D), Expected = 30.66, Std = 1.7700, ChiSquare = 6.3107e-01 R219 H = 7.87(D), Expected = 8.24, Std = 0.6000, ChiSquare = 5.3745e-01 R219 N = 120.81(D), Expected = 120.61, Std = 3.9000, ChiSquare = 9.5910e-01 T220 C = 172.93(D), Expected = 174.60, Std = 1.8000, ChiSquare = 3.5352e-01 T220 CA = 63.62(D), Expected = 62.15, Std = 2.7200, ChiSquare = 5.8889e-01 T220 H = 8.09(D), Expected = 8.27, Std = 0.6200, ChiSquare = 7.7157e-01 T220 N = 123.16(D), Expected = 115.70, Std = 5.0500, ChiSquare = 1.3961e-01 T221 CA = 61.37(D), Expected = 62.15, Std = 2.7200, ChiSquare = 7.7429e-01 T221 H = 8.89(D), Expected = 8.27, Std = 0.6200, ChiSquare = 3.1731e-01 T221 N = 127.72(D), Expected = 115.70, Std = 5.0500, ChiSquare = 1.7303e-02 I222 C = 173.78(D), Expected = 175.82, Std = 1.9500, ChiSquare = 2.9549e-01 I222 CA = 59.63(D), Expected = 61.59, Std = 2.7800, ChiSquare = 4.8079e-01 I222 H = 8.59(D), Expected = 8.26, Std = 0.7100, ChiSquare = 6.4208e-01 I222 N = 126.14(D), Expected = 121.60, Std = 4.7200, ChiSquare = 3.3612e-01 V223 C = 173.65(D), Expected = 175.69, Std = 2.0300, ChiSquare = 3.1493e-01 V223 CA = 58.02(D), Expected = 62.48, Std = 3.0400, ChiSquare = 1.4235e-01 V223 H = 9.26(D), Expected = 8.29, Std = 0.7100, ChiSquare = 1.7188e-01 V223 N = 127.85(D), Expected = 121.02, Std = 4.9600, ChiSquare = 1.6851e-01 V224 C = 176(D), Expected = 175.69, Std = 2.0300, ChiSquare = 8.7863e-01 V224 CA = 60.31(D), Expected = 62.48, Std = 3.0400, ChiSquare = 4.7534e-01 V224 H = 9.2(D), Expected = 8.29, Std = 0.7100, ChiSquare = 1.9995e-01 V224 N = 129.78(D), Expected = 121.02, Std = 4.9600, ChiSquare = 7.7374e-02 A225 CA = 50.47(D), Expected = 53.16, Std = 2.0600, ChiSquare = 1.9161e-01 A225 H = 7.96(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.8916e-01 A225 N = 131.63(D), Expected = 123.23, Std = 3.7000, ChiSquare = 2.3191e-02 T230 C = 176.24(D), Expected = 174.60, Std = 1.8000, ChiSquare = 3.6224e-01 V231 H = 7.73(D), Expected = 8.29, Std = 0.7100, ChiSquare = 4.3027e-01 V231 N = 114.9(D), Expected = 121.02, Std = 4.9600, ChiSquare = 2.1725e-01 V232 CA = 64.25(D), Expected = 62.48, Std = 3.0400, ChiSquare = 5.6041e-01 V232 H = 6.49(D), Expected = 8.29, Std = 0.7100, ChiSquare = 1.1238e-02 V232 N = 116.4(D), Expected = 121.02, Std = 4.9600, ChiSquare = 3.5162e-01 N233 C = 175.23(D), Expected = 175.16, Std = 1.7600, ChiSquare = 9.6827e-01 N233 CA = 51.9(D), Expected = 53.43, Std = 1.9400, ChiSquare = 4.3031e-01 N233 H = 8.34(D), Expected = 8.37, Std = 0.6500, ChiSquare = 9.6319e-01 N233 N = 118.64(D), Expected = 119.13, Std = 4.4200, ChiSquare = 9.1173e-01 A234 C = 177.1(D), Expected = 177.80, Std = 2.1800, ChiSquare = 7.4813e-01 A234 CA = 52.86(D), Expected = 53.16, Std = 2.0600, ChiSquare = 8.8421e-01 A234 H = 7.85(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.5967e-01 A234 N = 126.49(D), Expected = 123.23, Std = 3.7000, ChiSquare = 3.7827e-01 D235 C = 175.67(D), Expected = 176.41, Std = 1.7700, ChiSquare = 6.7589e-01 D235 CA = 57.33(D), Expected = 54.52, Std = 2.1000, ChiSquare = 1.8087e-01 D235 H = 8.25(D), Expected = 8.33, Std = 0.5700, ChiSquare = 8.8838e-01 D235 N = 122.81(D), Expected = 120.73, Std = 4.2000, ChiSquare = 6.2043e-01 Q236 C = 171.59(D), Expected = 176.39, Std = 1.9600, ChiSquare = 1.4326e-02 Q236 CA = 55.26(D), Expected = 56.62, Std = 2.1900, ChiSquare = 5.3460e-01 Q236 H = 7.43(D), Expected = 8.22, Std = 0.6200, ChiSquare = 2.0259e-01 Q236 N = 115.76(D), Expected = 119.92, Std = 4.0100, ChiSquare = 2.9955e-01 I237 C = 174.12(D), Expected = 175.82, Std = 1.9500, ChiSquare = 3.8332e-01 I237 CA = 60.16(D), Expected = 61.59, Std = 2.7800, ChiSquare = 6.0698e-01 I237 CB = 38.47(D), Expected = 38.58, Std = 2.0900, ChiSquare = 9.5803e-01 I237 H = 8.54(D), Expected = 8.26, Std = 0.7100, ChiSquare = 6.9331e-01 I237 N = 128.84(D), Expected = 121.60, Std = 4.7200, ChiSquare = 1.2505e-01 L238 C = 174.38(D), Expected = 176.97, Std = 2.0900, ChiSquare = 2.1526e-01 L238 CA = 52.49(D), Expected = 55.65, Std = 2.2100, ChiSquare = 1.5276e-01 L238 H = 9.01(D), Expected = 8.22, Std = 0.6500, ChiSquare = 2.2422e-01 L238 N = 127.08(D), Expected = 121.98, Std = 4.0700, ChiSquare = 2.1018e-01 V239 CA = 59.9(D), Expected = 62.48, Std = 3.0400, ChiSquare = 3.9606e-01 V239 H = 8.4(D), Expected = 8.29, Std = 0.7100, ChiSquare = 8.7688e-01 V239 N = 124.93(D), Expected = 121.02, Std = 4.9600, ChiSquare = 4.3052e-01 I240 C = 173.33(D), Expected = 175.82, Std = 1.9500, ChiSquare = 2.0163e-01 I240 CA = 56.84(D), Expected = 61.59, Std = 2.7800, ChiSquare = 8.7519e-02 I240 H = 9.27(D), Expected = 8.26, Std = 0.7100, ChiSquare = 1.5487e-01 I240 N = 131.47(D), Expected = 121.60, Std = 4.7200, ChiSquare = 3.6519e-02 K241 C = 176.56(D), Expected = 176.46, Std = 2.0500, ChiSquare = 9.6109e-01 K241 CA = 55.75(D), Expected = 56.84, Std = 2.2500, ChiSquare = 6.2807e-01 K241 H = 8.65(D), Expected = 8.22, Std = 0.6400, ChiSquare = 5.0166e-01 K241 N = 124.85(D), Expected = 121.16, Std = 4.1100, ChiSquare = 3.6929e-01 D242 C = 175.5(D), Expected = 176.41, Std = 1.7700, ChiSquare = 6.0716e-01 D242 CA = 55.27(D), Expected = 54.52, Std = 2.1000, ChiSquare = 7.2098e-01 D242 H = 9.55(D), Expected = 8.33, Std = 0.5700, ChiSquare = 3.2326e-02 D242 N = 129.22(D), Expected = 120.73, Std = 4.2000, ChiSquare = 4.3235e-02 G243 C = 172.24(D), Expected = 174.04, Std = 1.9400, ChiSquare = 3.5349e-01 G243 CA = 46.73(D), Expected = 45.33, Std = 1.4200, ChiSquare = 3.2417e-01 G243 H = 8.15(D), Expected = 8.34, Std = 0.7400, ChiSquare = 7.9737e-01 G243 N = 105.51(D), Expected = 109.91, Std = 4.2900, ChiSquare = 3.0506e-01 C244 C = 173.91(D), Expected = 174.78, Std = 1.9900, ChiSquare = 6.6198e-01 C244 CA = 55.59(D), Expected = 57.43, Std = 3.4100, ChiSquare = 5.8948e-01 C244 H = 7.53(D), Expected = 8.42, Std = 0.6600, ChiSquare = 1.7750e-01 C244 N = 116.62(D), Expected = 119.95, Std = 4.7900, ChiSquare = 4.8693e-01 I245 C = 177.13(D), Expected = 175.82, Std = 1.9500, ChiSquare = 5.0171e-01 I245 CA = 60.39(D), Expected = 61.59, Std = 2.7800, ChiSquare = 6.6599e-01 I245 H = 9.02(D), Expected = 8.26, Std = 0.7100, ChiSquare = 2.8443e-01 I245 N = 124.34(D), Expected = 121.60, Std = 4.7200, ChiSquare = 5.6157e-01 V246 C = 176.01(D), Expected = 175.69, Std = 2.0300, ChiSquare = 8.7474e-01 V246 H = 8.99(D), Expected = 8.29, Std = 0.7100, ChiSquare = 3.2417e-01 V246 N = 126.25(D), Expected = 121.02, Std = 4.9600, ChiSquare = 2.9168e-01 E247 C = 173.39(D), Expected = 176.93, Std = 2.1100, ChiSquare = 9.3401e-02 E247 CA = 55(D), Expected = 57.42, Std = 2.1900, ChiSquare = 2.6915e-01 E247 CB = 33.5(D), Expected = 30.07, Std = 1.8400, ChiSquare = 6.2304e-02 E247 H = 7.52(D), Expected = 8.34, Std = 0.6100, ChiSquare = 1.7886e-01 E247 N = 120.59(D), Expected = 120.68, Std = 3.6800, ChiSquare = 9.8049e-01 R248 C = 174.47(D), Expected = 176.49, Std = 2.1600, ChiSquare = 3.4969e-01 R248 CA = 53.76(D), Expected = 56.95, Std = 2.4100, ChiSquare = 1.8562e-01 R248 CB = 33.51(D), Expected = 30.66, Std = 1.7700, ChiSquare = 1.0736e-01 R248 H = 8.23(D), Expected = 8.24, Std = 0.6000, ChiSquare = 9.8670e-01 R248 N = 118.69(D), Expected = 120.61, Std = 3.9000, ChiSquare = 6.2250e-01 G249 C = 171.41(D), Expected = 174.04, Std = 1.9400, ChiSquare = 1.7520e-01 G249 CA = 44.64(D), Expected = 45.33, Std = 1.4200, ChiSquare = 6.2703e-01 G249 H = 8.65(D), Expected = 8.34, Std = 0.7400, ChiSquare = 6.7528e-01 G249 N = 111.64(D), Expected = 109.91, Std = 4.2900, ChiSquare = 6.8675e-01 R250 C = 176.07(D), Expected = 176.49, Std = 2.1600, ChiSquare = 8.4583e-01 R250 CA = 55.27(D), Expected = 56.95, Std = 2.4100, ChiSquare = 4.8574e-01 R250 H = 7.84(D), Expected = 8.24, Std = 0.6000, ChiSquare = 5.0499e-01 R250 N = 120.51(D), Expected = 120.61, Std = 3.9000, ChiSquare = 9.7954e-01 H251 C = 175.51(D), Expected = 175.19, Std = 2.1400, ChiSquare = 8.8113e-01 H251 CA = 60.21(D), Expected = 56.37, Std = 2.4000, ChiSquare = 1.0960e-01 H251 H = 8.68(D), Expected = 8.25, Std = 0.7400, ChiSquare = 5.6119e-01 H251 N = 123.43(D), Expected = 119.44, Std = 4.5200, ChiSquare = 3.7738e-01 E252 C = 179.04(D), Expected = 176.93, Std = 2.1100, ChiSquare = 3.1731e-01 E252 CA = 59.64(D), Expected = 57.42, Std = 2.1900, ChiSquare = 3.1073e-01 E252 CB = 27.23(D), Expected = 30.07, Std = 1.8400, ChiSquare = 1.2271e-01 E252 H = 8.94(D), Expected = 8.34, Std = 0.6100, ChiSquare = 3.2531e-01 E252 N = 117.19(D), Expected = 120.68, Std = 3.6800, ChiSquare = 3.4294e-01 A253 C = 180.63(D), Expected = 177.80, Std = 2.1800, ChiSquare = 1.9423e-01 A253 CA = 53.53(D), Expected = 53.16, Std = 2.0600, ChiSquare = 8.5746e-01 A253 CB = 17.81(D), Expected = 18.90, Std = 1.8500, ChiSquare = 5.5573e-01 A253 H = 6.91(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.1555e-02 A253 N = 124.34(D), Expected = 123.23, Std = 3.7000, ChiSquare = 7.6418e-01 L254 C = 180.67(D), Expected = 176.97, Std = 2.0900, ChiSquare = 7.6671e-02 L254 CA = 56.75(D), Expected = 55.65, Std = 2.2100, ChiSquare = 6.1867e-01 L254 CB = 40.59(D), Expected = 42.37, Std = 1.8600, ChiSquare = 3.3857e-01 L254 H = 8.11(D), Expected = 8.22, Std = 0.6500, ChiSquare = 8.6562e-01 L254 N = 122.03(D), Expected = 121.98, Std = 4.0700, ChiSquare = 9.9020e-01 L255 C = 179.95(D), Expected = 176.97, Std = 2.0900, ChiSquare = 1.5392e-01 L255 CA = 57.43(D), Expected = 55.65, Std = 2.2100, ChiSquare = 4.2057e-01 L255 CB = 40(D), Expected = 42.37, Std = 1.8600, ChiSquare = 2.0259e-01 L255 H = 8.19(D), Expected = 8.22, Std = 0.6500, ChiSquare = 9.6319e-01 L255 N = 122.56(D), Expected = 121.98, Std = 4.0700, ChiSquare = 8.8668e-01 S256 C = 175.26(D), Expected = 174.53, Std = 1.7300, ChiSquare = 6.7305e-01 S256 CA = 60.22(D), Expected = 58.57, Std = 2.1200, ChiSquare = 4.3639e-01 S256 CB = 62.63(D), Expected = 63.80, Std = 1.5700, ChiSquare = 4.5614e-01 S256 H = 7.46(D), Expected = 8.29, Std = 0.6200, ChiSquare = 1.8066e-01 S256 N = 116.4(D), Expected = 116.30, Std = 3.9500, ChiSquare = 9.7980e-01 R257 C = 178.38(D), Expected = 176.49, Std = 2.1600, ChiSquare = 3.8157e-01 R257 CA = 56.72(D), Expected = 56.95, Std = 2.4100, ChiSquare = 9.2397e-01 R257 CB = 29.49(D), Expected = 30.66, Std = 1.7700, ChiSquare = 5.0860e-01 R257 H = 7.37(D), Expected = 8.24, Std = 0.6000, ChiSquare = 1.4706e-01 R257 N = 121.55(D), Expected = 120.61, Std = 3.9000, ChiSquare = 8.0954e-01 G258 C = 173.89(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.3837e-01 G258 CA = 46.42(D), Expected = 45.33, Std = 1.4200, ChiSquare = 4.4272e-01 G258 H = 7.26(D), Expected = 8.34, Std = 0.7400, ChiSquare = 1.4444e-01 G258 N = 106.13(D), Expected = 109.91, Std = 4.2900, ChiSquare = 3.7825e-01 G259 C = 173.9(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.4247e-01 G259 CA = 43.64(D), Expected = 45.33, Std = 1.4200, ChiSquare = 2.3399e-01 G259 H = 8.36(D), Expected = 8.34, Std = 0.7400, ChiSquare = 9.7844e-01 G259 N = 113.32(D), Expected = 109.91, Std = 4.2900, ChiSquare = 4.2669e-01 V260 C = 179.07(D), Expected = 175.69, Std = 2.0300, ChiSquare = 9.5908e-02 V260 H = 9.62(D), Expected = 8.29, Std = 0.7100, ChiSquare = 6.1036e-02 V260 N = 129.66(D), Expected = 121.02, Std = 4.9600, ChiSquare = 8.1520e-02 Y261 CA = 61.78(D), Expected = 58.02, Std = 2.6400, ChiSquare = 1.5438e-01 Y261 H = 9.27(D), Expected = 8.37, Std = 0.7500, ChiSquare = 2.3014e-01 Y261 N = 124.51(D), Expected = 120.79, Std = 4.6900, ChiSquare = 4.2767e-01 A262 C = 179.84(D), Expected = 177.80, Std = 2.1800, ChiSquare = 3.4939e-01 A262 CA = 54.6(D), Expected = 53.16, Std = 2.0600, ChiSquare = 4.8453e-01 D263 C = 178.85(D), Expected = 176.41, Std = 1.7700, ChiSquare = 1.6804e-01 D263 CA = 56.86(D), Expected = 54.52, Std = 2.1000, ChiSquare = 2.6516e-01 D263 H = 8.17(D), Expected = 8.33, Std = 0.5700, ChiSquare = 7.7894e-01 D263 N = 121.8(D), Expected = 120.73, Std = 4.2000, ChiSquare = 7.9891e-01 M264 C = 177.97(D), Expected = 176.30, Std = 2.1300, ChiSquare = 4.3302e-01 M264 CA = 59.06(D), Expected = 56.16, Std = 2.3400, ChiSquare = 2.1523e-01 M264 H = 8.11(D), Expected = 8.26, Std = 0.6000, ChiSquare = 8.0259e-01 M264 N = 122.86(D), Expected = 120.10, Std = 3.8800, ChiSquare = 4.7687e-01 W265 C = 178.28(D), Expected = 176.10, Std = 1.8900, ChiSquare = 2.4873e-01 W265 H = 8.89(D), Expected = 8.35, Std = 0.8400, ChiSquare = 5.2032e-01 W265 N = 122.67(D), Expected = 121.87, Std = 4.5800, ChiSquare = 8.6134e-01 Q266 C = 178.96(D), Expected = 176.39, Std = 1.9600, ChiSquare = 1.8978e-01 Q266 CA = 58.07(D), Expected = 56.62, Std = 2.1900, ChiSquare = 5.0791e-01 Q266 H = 8.17(D), Expected = 8.22, Std = 0.6200, ChiSquare = 9.3572e-01 Q266 N = 119.76(D), Expected = 119.92, Std = 4.0100, ChiSquare = 9.6817e-01 L267 C = 179.15(D), Expected = 176.97, Std = 2.0900, ChiSquare = 2.9692e-01 L267 CA = 56.99(D), Expected = 55.65, Std = 2.2100, ChiSquare = 5.4429e-01 L267 H = 7.65(D), Expected = 8.22, Std = 0.6500, ChiSquare = 3.8053e-01 L267 N = 121.99(D), Expected = 121.98, Std = 4.0700, ChiSquare = 9.9804e-01 Q268 C = 177.54(D), Expected = 176.39, Std = 1.9600, ChiSquare = 5.5738e-01 Q268 CA = 57.18(D), Expected = 56.62, Std = 2.1900, ChiSquare = 7.9818e-01 Q268 H = 7.6(D), Expected = 8.22, Std = 0.6200, ChiSquare = 3.1731e-01 Q268 N = 118.71(D), Expected = 119.92, Std = 4.0100, ChiSquare = 7.6285e-01 Q269 C = 177.22(D), Expected = 176.39, Std = 1.9600, ChiSquare = 6.7195e-01 Q269 CA = 55.91(D), Expected = 56.62, Std = 2.1900, ChiSquare = 7.4579e-01 Q269 H = 7.8(D), Expected = 8.22, Std = 0.6200, ChiSquare = 4.9814e-01 Q269 N = 120.38(D), Expected = 119.92, Std = 4.0100, ChiSquare = 9.0867e-01 G270 C = 174.25(D), Expected = 174.04, Std = 1.9400, ChiSquare = 9.1380e-01 G270 CA = 45.03(D), Expected = 45.33, Std = 1.4200, ChiSquare = 8.3268e-01 G270 H = 7.76(D), Expected = 8.34, Std = 0.7400, ChiSquare = 4.3317e-01 G270 N = 109.61(D), Expected = 109.91, Std = 4.2900, ChiSquare = 9.4425e-01 Q271 C = 176.01(D), Expected = 176.39, Std = 1.9600, ChiSquare = 8.4627e-01 Q271 CA = 55.23(D), Expected = 56.62, Std = 2.1900, ChiSquare = 5.2562e-01 Q271 H = 7.77(D), Expected = 8.22, Std = 0.6200, ChiSquare = 4.6796e-01 Q271 N = 121.34(D), Expected = 119.92, Std = 4.0100, ChiSquare = 7.2325e-01 E272 C = 176.45(D), Expected = 176.93, Std = 2.1100, ChiSquare = 8.2004e-01 E272 CA = 56.13(D), Expected = 57.42, Std = 2.1900, ChiSquare = 5.5583e-01 E272 CB = 29.23(D), Expected = 30.07, Std = 1.8400, ChiSquare = 6.4801e-01 E272 H = 8.17(D), Expected = 8.34, Std = 0.6100, ChiSquare = 7.8048e-01 E272 N = 123.74(D), Expected = 120.68, Std = 3.6800, ChiSquare = 4.0568e-01 E273 C = 176.51(D), Expected = 176.93, Std = 2.1100, ChiSquare = 8.4222e-01 E273 CA = 56.03(D), Expected = 57.42, Std = 2.1900, ChiSquare = 5.2562e-01 E273 H = 8.35(D), Expected = 8.34, Std = 0.6100, ChiSquare = 9.8692e-01 E273 N = 124.29(D), Expected = 120.68, Std = 3.6800, ChiSquare = 3.2660e-01 T274 C = 174.37(D), Expected = 174.60, Std = 1.8000, ChiSquare = 8.9833e-01 T274 CA = 60.96(D), Expected = 62.15, Std = 2.7200, ChiSquare = 6.6175e-01 T274 CB = 69.23(D), Expected = 69.64, Std = 1.7000, ChiSquare = 8.0942e-01 T274 H = 8.17(D), Expected = 8.27, Std = 0.6200, ChiSquare = 8.7186e-01 T274 N = 117.56(D), Expected = 115.70, Std = 5.0500, ChiSquare = 7.1264e-01 S275 C = 174.52(D), Expected = 174.53, Std = 1.7300, ChiSquare = 9.9539e-01 S275 CA = 57.76(D), Expected = 58.57, Std = 2.1200, ChiSquare = 7.0241e-01 S275 CB = 63.45(D), Expected = 63.80, Std = 1.5700, ChiSquare = 8.2359e-01 S275 H = 8.31(D), Expected = 8.29, Std = 0.6200, ChiSquare = 9.7427e-01 S275 N = 120.61(D), Expected = 116.30, Std = 3.9500, ChiSquare = 2.7521e-01 E276 C = 176.15(D), Expected = 176.93, Std = 2.1100, ChiSquare = 7.1163e-01 E276 CA = 56.16(D), Expected = 57.42, Std = 2.1900, ChiSquare = 5.6506e-01 E276 CB = 29.27(D), Expected = 30.07, Std = 1.8400, ChiSquare = 6.6372e-01 E276 H = 8.46(D), Expected = 8.34, Std = 0.6100, ChiSquare = 8.4405e-01 E276 N = 125.18(D), Expected = 120.68, Std = 3.6800, ChiSquare = 2.2140e-01 D277 C = 176.24(D), Expected = 176.41, Std = 1.7700, ChiSquare = 9.2348e-01 D277 CA = 53.96(D), Expected = 54.52, Std = 2.1000, ChiSquare = 7.8973e-01 D277 CB = 40.4(D), Expected = 40.70, Std = 1.6700, ChiSquare = 8.5743e-01 D277 H = 8.29(D), Expected = 8.33, Std = 0.5700, ChiSquare = 9.4405e-01 D277 N = 123.22(D), Expected = 120.73, Std = 4.2000, ChiSquare = 5.5328e-01 T278 C = 174.26(D), Expected = 174.60, Std = 1.8000, ChiSquare = 8.5018e-01 T278 CA = 61.21(D), Expected = 62.15, Std = 2.7200, ChiSquare = 7.2965e-01 T278 CB = 68.94(D), Expected = 69.64, Std = 1.7000, ChiSquare = 6.8051e-01 T278 H = 7.94(D), Expected = 8.27, Std = 0.6200, ChiSquare = 5.9455e-01 T278 N = 116.57(D), Expected = 115.70, Std = 5.0500, ChiSquare = 8.6322e-01 K279 CA = 53.87(D), Expected = 56.84, Std = 2.2500, ChiSquare = 1.8683e-01 K279 CB = 31.47(D), Expected = 32.83, Std = 1.8800, ChiSquare = 4.6943e-01 K279 H = 8.16(D), Expected = 8.22, Std = 0.6400, ChiSquare = 9.2531e-01 K279 N = 127.46(D), Expected = 121.16, Std = 4.1100, ChiSquare = 1.2531e-01 P280 C = 176.87(D), Expected = 176.70, Std = 1.6900, ChiSquare = 9.1987e-01 P280 CA = 62.54(D), Expected = 63.30, Std = 1.6400, ChiSquare = 6.4307e-01 P280 CB = 31.23(D), Expected = 31.81, Std = 1.5400, ChiSquare = 7.0645e-01 Q281 C = 176.11(D), Expected = 176.39, Std = 1.9600, ChiSquare = 8.8640e-01 Q281 CA = 55.26(D), Expected = 56.62, Std = 2.1900, ChiSquare = 5.3460e-01 Q281 CB = 28.54(D), Expected = 29.10, Std = 1.9700, ChiSquare = 7.7621e-01 Q281 H = 8.49(D), Expected = 8.22, Std = 0.6200, ChiSquare = 6.6321e-01 Q281 N = 123.17(D), Expected = 119.92, Std = 4.0100, ChiSquare = 4.1767e-01 T282 CA = 61.16(D), Expected = 62.15, Std = 2.7200, ChiSquare = 7.1588e-01 T282 CB = 69.09(D), Expected = 69.64, Std = 1.7000, ChiSquare = 7.4629e-01 T282 H = 8.11(D), Expected = 8.27, Std = 0.6200, ChiSquare = 7.9636e-01 T282 N = 117.76(D), Expected = 115.70, Std = 5.0500, ChiSquare = 6.8333e-01 M283 C = 175.75(D), Expected = 176.30, Std = 2.1300, ChiSquare = 7.9624e-01 M283 CA = 54.73(D), Expected = 56.16, Std = 2.3400, ChiSquare = 5.4113e-01 M283 H = 8.31(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.3359e-01 M283 N = 124.92(D), Expected = 120.10, Std = 3.8800, ChiSquare = 2.1414e-01 E284 C = 175.24(D), Expected = 176.93, Std = 2.1100, ChiSquare = 4.2316e-01 E284 CA = 56.06(D), Expected = 57.42, Std = 2.1900, ChiSquare = 5.3460e-01 E284 H = 8.33(D), Expected = 8.34, Std = 0.6100, ChiSquare = 9.8692e-01 E284 N = 125.16(D), Expected = 120.68, Std = 3.6800, ChiSquare = 2.2346e-01 R285 C = 180.68(D), Expected = 176.49, Std = 2.1600, ChiSquare = 5.2402e-02 R285 CA = 56.76(D), Expected = 56.95, Std = 2.4100, ChiSquare = 9.3716e-01 R285 CB = 30.2(D), Expected = 30.66, Std = 1.7700, ChiSquare = 7.9495e-01 R285 H = 7.88(D), Expected = 8.24, Std = 0.6000, ChiSquare = 5.4851e-01 R285 N = 129.42(D), Expected = 120.61, Std = 3.9000, ChiSquare = 2.3885e-02