Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.62 Y 0.19 F 0.16 C Shift Assignments>> C :: 173.164 CA :: 61.859(D) CB :: 38.448 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.349(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.228(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.32 K 0.19 Q 0.12 M 0.11 R 0.08 H 0.06 E 0.04 P 0.02 I 0.01 C Shift Assignments>> C :: 176.619 CA :: 59.915(D) CB :: 33.171 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.378(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 126.351(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.43 Y 0.28 F 0.23 E 0.03 C Shift Assignments>> C :: 175.905 CA :: 60.393(D) CB :: 38.299 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.064(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 128.876(D) Ave N Shift Values>> N :: 121.46(4.28) 1.F11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.2 T 0.15 V 0.14 S 0.11 F 0.1 Y 0.1 E 0.03 K 0.03 R 0.03 H 0.02 Q 0.01 P 0.01 M 0.01 C Shift Assignments>> C :: 174.982 CA :: 60.521 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.274(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 126.808(D) Ave N Shift Values>> N :: 120.45(4.18) 1.V12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> I 0.2 T 0.15 V 0.14 S 0.11 F 0.09 Y 0.09 E 0.03 R 0.02 K 0.02 H 0.02 P 0.02 Q 0.01 M 0.01 C Shift Assignments>> C :: 171.084 CA :: 60.562(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) 1.D13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.26 L 0.25 G 0.23 R 0.11 N 0.06 K 0.03 F 0.02 Y 0.01 C Shift Assignments>> C :: 176.742 CA :: 50.676(D) CB :: 42.828 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.419(D) HA :: 4.789 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.213(D) Ave N Shift Values>> N :: 120.65(3.86) 1.F14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.29 N 0.19 E 0.18 Q 0.11 K 0.09 Y 0.04 F 0.02 H 0.01 R 0.01 C Shift Assignments>> C :: 174.712 CA :: 53.518(D) CB :: 35.542 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.365(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 125.096(D) Ave N Shift Values>> N :: 120.45(4.18) 1.D15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.27 L 0.19 F 0.18 Y 0.15 N 0.09 K 0.06 I 0.01 C Shift Assignments>> C :: 175.695 CA :: 55.549(D) CB :: 40.505 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.437(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 122.801(D) Ave N Shift Values>> N :: 120.65(3.86) 1.Y16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.41 M 0.15 Y 0.13 F 0.07 K 0.06 N 0.05 I 0.03 Q 0.03 C Shift Assignments>> C :: 177.895 CA :: 56.336(D) CB :: 36.313 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.872(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.525(D) Ave N Shift Values>> N :: 120.52(4.2) 1.F17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.54 Y 0.22 F 0.22 HN Overlap>> 1.I160 1.L232 1.I160 1.L232 C Shift Assignments>> C :: 176.861 CA :: 61.571(D) CB :: 39.423 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.019(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.874(D) Ave N Shift Values>> N :: 120.45(4.18) 1.F18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.42 Y 0.14 M 0.14 F 0.08 K 0.06 I 0.04 N 0.04 Q 0.03 C Shift Assignments>> C :: 177.320 CA :: 56.697(D) CB :: 36.331 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.777(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 114.325(D) Ave N Shift Values>> N :: 120.45(4.18) 1.A19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.58 M 0.4 C Shift Assignments>> C :: 178.146 CA :: 53.698(D) CB :: 17.713 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 6.868(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 114.091(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Q20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.29 K 0.16 E 0.14 Q 0.12 H 0.1 R 0.1 L 0.02 V 0.01 M 0.01 P 0.01 C Shift Assignments>> C :: 178.584 CA :: 59.729(D) CB :: 28.449 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.222(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.925(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.54 V 0.36 P 0.09 HN Overlap>> 1.L157 1.L157 C Shift Assignments>> C :: 177.674 CA :: 66.284(D) CB :: 29.507 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.131(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 117.541(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.18 I 0.16 Q 0.16 K 0.15 E 0.12 H 0.11 L 0.06 M 0.01 C Shift Assignments>> C :: 179.500 CA :: 58.610 CB :: 27.973 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.116(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 115.232(D) Ave N Shift Values>> N :: 120.67(3.48) 1.E23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.21 R 0.17 H 0.16 Q 0.14 K 0.13 I 0.07 M 0.05 V 0.03 HN Overlap>> 1.Y54 1.Y54 1.Q137 1.Q137 C Shift Assignments>> C :: 178.288 CA :: 58.898(D) CB :: 29.925 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.910(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.115(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.51 P 0.42 I 0.05 HN Overlap>> 1.K155 1.K155 C Shift Assignments>> C :: 178.982 CA :: 65.394(D) CB :: 31.153 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.120(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.437(D) Ave N Shift Values>> N :: 121.14(4.54) 1.L25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.24 D 0.21 K 0.21 F 0.14 Y 0.1 R 0.04 N 0.03 HN Overlap>> 1.L157 1.L157 C Shift Assignments>> C :: 177.381 CA :: 55.816(D) CB :: 41.497 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.036(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.617(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.74 D 0.15 F 0.03 L 0.03 Y 0.02 C Shift Assignments>> C :: 179.151 CA :: 50.438(D) CB :: 38.918 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.545(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.272(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.P27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> S 0.28 V 0.2 P 0.2 T 0.16 I 0.12 C Shift Assignments>> C :: 178.654 CA :: 64.345(D) Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.Q28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.29 L 0.25 K 0.13 Q 0.11 I 0.07 H 0.06 E 0.04 C Shift Assignments>> C :: 177.387 CA :: 57.305(D) CB :: 26.475 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.957(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.828(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Y29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.42 Y 0.14 E 0.14 F 0.1 M 0.07 D 0.06 L 0.01 I 0.01 K 0.01 HN Overlap>> 1.D163 1.D163 C Shift Assignments>> C :: 175.854 CA :: 54.411(D) CB :: 37.371 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.545(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 120.008(D) Ave N Shift Values>> N :: 120.52(4.2) 1.K30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.19 K 0.16 H 0.16 E 0.16 M 0.15 Q 0.08 V 0.06 HN Overlap>> 1.E130 1.K159 1.E130 1.K159 C Shift Assignments>> C :: 178.212 CA :: 58.079(D) CB :: 31.500 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.352(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.817(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.68 L 0.19 R 0.06 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.665 CA :: 44.786(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.310(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.132(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.29 H 0.2 R 0.18 K 0.12 Q 0.07 E 0.05 P 0.04 C Shift Assignments>> C :: 173.129 CA :: 52.764 CB :: 31.655 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.963(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.827(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> I 0.5 V 0.2 P 0.13 E 0.03 R 0.03 K 0.03 H 0.02 Q 0.01 C Shift Assignments>> C :: 174.246 CA :: 62.598(D) CB :: 29.563 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.L34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.61 L 0.25 R 0.06 D 0.03 F 0.01 C Shift Assignments>> C :: 173.693 CA :: 54.191(D) CB :: 44.900 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.141(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 128.353(D) Ave N Shift Values>> N :: 121.86(3.9) 1.V35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.43 K 0.15 Q 0.12 M 0.08 R 0.04 H 0.03 I 0.03 P 0.03 E 0.02 Y 0.01 HN Overlap>> 1.Q207 1.Q207 C Shift Assignments>> C :: 174.164 CA :: 60.506(D) CB :: 33.769 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.002(D) HA :: 4.125 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 126.469(D) Ave N Shift Values>> N :: 121.14(4.54) 1.V36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.35 P 0.12 R 0.11 E 0.09 K 0.09 H 0.08 M 0.05 I 0.04 Q 0.03 HN Overlap>> 1.I173 1.I173 C Shift Assignments>> C :: 176.397 CA :: 60.750(D) CB :: 31.490 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.696(D) HA :: 4.947 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 127.165(D) Ave N Shift Values>> N :: 121.14(4.54) 1.S37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.95 T 0.04 C Shift Assignments>> C :: 172.182 CA :: 57.531(D) CB :: 65.937 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.433(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 125.492(D) Ave N Shift Values>> N :: 116.28(3.52) 1.V38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.41 K 0.16 Q 0.09 M 0.09 R 0.07 H 0.05 P 0.04 E 0.03 I 0.01 HN Overlap>> 1.D103 1.D103 C Shift Assignments>> C :: 174.505 CA :: 60.345(D) CB :: 33.077 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.927(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.175(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Y39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.7 Y 0.15 F 0.13 HN Overlap>> 1.M296 1.M296 C Shift Assignments>> CA :: 62.499 CB :: 38.596 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.067(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 124.032(D) Ave N Shift Values>> N :: 120.52(4.2) 1.S40 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G41 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R42 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T43 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K44 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T45 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S46 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> G 0.7 L 0.18 R 0.05 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.397 CA :: 44.822(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) 1.A48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.77 L 0.21 C Shift Assignments>> C :: 175.941 CA :: 50.197(D) CB :: 22.152 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.686(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.129(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.51 V 0.44 I 0.01 HN Overlap>> 1.N277 1.N277 C Shift Assignments>> C :: 176.813 CA :: 63.351(D) CB :: 31.919 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.745(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.253(D) Ave N Shift Values>> N :: 121.14(4.54) 1.A50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.74 M 0.24 C Shift Assignments>> C :: 177.378 CA :: 53.585(D) CB :: 18.658 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.945(D) HB1 :: 1.502 HB2 :: 1.502 HB3 :: 1.502 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 133.652(D) Ave N Shift Values>> N :: 123.23(3.54) 1.T51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> CA :: 61.400(D) CB :: 69.769 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.739(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 109.379(D) Ave N Shift Values>> N :: 115.42(4.75) 1.A52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 L 0.07 G 0.04 C Shift Assignments>> C :: 175.822 CA :: 49.369(D) CB :: 21.634 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.672 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 127.805 Ave N Shift Values>> N :: 123.23(3.54) 1.N53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.84 D 0.05 Y 0.02 F 0.02 M 0.02 E 0.01 HN Overlap>> 1.I276 1.L201 1.L325 1.I276 1.L201 1.L325 1.A236 1.A236 C Shift Assignments>> CA :: 50.493(D) CB :: 37.477 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.360(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.049(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Y54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.25 V 0.24 I 0.21 P 0.12 S 0.08 F 0.02 Y 0.02 HN Overlap>> 1.E23 1.E23 C Shift Assignments>> C :: 177.278 CA :: 62.290(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.847(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.189(D) Ave N Shift Values>> N :: 120.52(4.2) 1.E55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.44 R 0.19 Q 0.07 L 0.05 P 0.05 E 0.05 H 0.05 K 0.04 C Shift Assignments>> C :: 178.866 CA :: 60.096(D) CB :: 27.123 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.795(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.858(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.52 M 0.45 I 0.01 HN Overlap>> 1.R200 1.R200 C Shift Assignments>> C :: 179.584 CA :: 54.234(D) CB :: 17.903 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.761(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.626(D) Ave N Shift Values>> N :: 123.23(3.54) 1.R57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.2 Q 0.17 E 0.16 I 0.14 H 0.13 R 0.1 L 0.03 M 0.02 C Shift Assignments>> C :: 181.615 CA :: 58.611 CB :: 28.513 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.622(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 121.104(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.K58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.19 E 0.17 H 0.16 K 0.14 M 0.12 Q 0.09 V 0.07 I 0.01 HN Overlap>> 1.E203 1.E203 C Shift Assignments>> C :: 177.974 CA :: 58.484 CB :: 31.257 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.045(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.945(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.29 L 0.24 K 0.14 F 0.11 Y 0.08 N 0.07 R 0.02 C Shift Assignments>> C :: 176.701 CA :: 54.873(D) CB :: 41.250 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 6.938(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 116.393(D) Ave N Shift Values>> N :: 121.86(3.9) 1.G60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.31 R 0.28 G 0.27 F 0.04 D 0.04 Y 0.02 C Shift Assignments>> C :: 174.056 CA :: 44.016(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.609(D) HA2 :: 4.396 HA3 :: 3.559 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.186(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.44 V 0.36 I 0.15 R 0.01 C Shift Assignments>> C :: 174.403 CA :: 63.652(D) CB :: 30.514 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.315(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.952(D) Ave N Shift Values>> N :: 121.14(4.54) 1.K62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.26 N 0.22 E 0.21 K 0.08 Q 0.08 Y 0.05 F 0.03 H 0.01 C Shift Assignments>> C :: 175.166 CA :: 53.661(D) CB :: 35.750 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.044(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.903(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> A 0.65 M 0.33 C Shift Assignments>> C :: 178.367 CA :: 53.267(D) CB :: 17.751 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) 1.G64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.61 L 0.22 R 0.09 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 173.996 CA :: 44.643(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.005(D) HA2 :: 3.647 HA3 :: 4.420 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.260(D) Ave N Shift Values>> N :: 109.67(3.87) 1.M65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.33 Q 0.26 K 0.17 E 0.07 H 0.04 R 0.03 N 0.02 Y 0.01 HN Overlap>> 1.A229 1.L97 1.A229 1.L97 C Shift Assignments>> C :: 173.649 CA :: 54.185(D) CB :: 34.447 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 7.623(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 122.099(D) Ave N Shift Values>> N :: 120.09(3.57) 1.P66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.45 V 0.44 I 0.02 R 0.01 K 0.01 E 0.01 H 0.01 C Shift Assignments>> C :: 178.679 CA :: 62.628 CB :: 31.821 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.I67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.62 V 0.17 Y 0.09 F 0.05 E 0.04 C Shift Assignments>> C :: 177.146 CA :: 62.756 CB :: 36.332 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.405(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 128.063(D) Ave N Shift Values>> N :: 121.46(4.28) 1.I68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.76 V 0.08 Y 0.08 F 0.05 E 0.01 HN Overlap>> 1.K266 1.K266 C Shift Assignments>> C :: 177.301 CA :: 63.417(D) CB :: 36.904 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.355(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.193(D) Ave N Shift Values>> N :: 121.46(4.28) 1.K69 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.2 H 0.18 M 0.16 E 0.16 K 0.15 Q 0.1 V 0.02 C Shift Assignments>> C :: 178.640 CA :: 57.136(D) CB :: 31.292 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 6.716(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.799(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A70 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.66 A 0.29 I 0.04 C Shift Assignments>> C :: 178.104 CA :: 55.173(D) CB :: 17.369 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.995(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.454(D) Ave N Shift Values>> N :: 123.23(3.54) 1.M71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.19 K 0.18 H 0.16 E 0.15 M 0.14 Q 0.07 V 0.07 C Shift Assignments>> C :: 177.385 CA :: 58.251(D) CB :: 31.692 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.403(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 114.112(D) Ave N Shift Values>> N :: 120.09(3.57) 1.Q72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.19 K 0.18 R 0.17 E 0.13 H 0.13 I 0.07 L 0.07 M 0.01 C Shift Assignments>> C :: 177.965 CA :: 57.585(D) CB :: 28.147 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.233(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.312(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.69 Y 0.15 F 0.13 C Shift Assignments>> C :: 175.593 CA :: 62.358(D) CB :: 38.271 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.365(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 115.284(D) Ave N Shift Values>> N :: 121.46(4.28) 1.A74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.92 M 0.04 G 0.02 HN Overlap>> 1.D264 1.D264 C Shift Assignments>> C :: 175.635 CA :: 49.245(D) CB :: 18.290 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.701(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.475(D) Ave N Shift Values>> N :: 123.23(3.54) 1.P75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> I 0.24 T 0.19 V 0.18 S 0.08 F 0.07 Y 0.07 P 0.03 E 0.02 R 0.02 K 0.02 H 0.01 Q 0.01 C Shift Assignments>> C :: 175.119 CA :: 60.977 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.S76 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Suspicious PRTL>> S 0.99 C Shift Assignments>> C :: 174.507 CA :: 57.307(D) CB :: 63.219 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.716 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 129.293(S) Ave N Shift Values>> N :: 116.28(3.52) 1.A77 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.84 M 0.15 HN Overlap>> 1.L185 1.L185 C Shift Assignments>> C :: 173.714 CA :: 51.207(D) CB :: 17.638 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.043(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.570(D) Ave N Shift Values>> N :: 123.23(3.54) 1.I78 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.33 Y 0.24 E 0.19 F 0.15 M 0.02 V 0.02 K 0.01 HN Overlap>> 1.F181 1.F181 C Shift Assignments>> C :: 174.549 CA :: 59.981(D) CB :: 36.977 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.038(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.604(D) Ave N Shift Values>> N :: 121.46(4.28) 1.Y79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.34 F 0.3 I 0.09 D 0.07 N 0.07 L 0.04 E 0.04 M 0.01 C Shift Assignments>> C :: 176.446 CA :: 57.052(D) CB :: 38.643 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.380(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 126.860(D) Ave N Shift Values>> N :: 120.52(4.2) 1.V80 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.24 M 0.22 R 0.14 Q 0.14 H 0.12 E 0.07 V 0.03 HN Overlap>> 1.A321 1.A321 C Shift Assignments>> C :: 173.328 CA :: 57.012(D) CB :: 32.614 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.903(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.626(D) Ave N Shift Values>> N :: 121.14(4.54) 1.P81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.43 P 0.25 R 0.06 K 0.05 E 0.05 H 0.04 I 0.03 M 0.03 Q 0.01 C Shift Assignments>> C :: 176.634 CA :: 61.411(D) CB :: 31.664 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.M82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.25 Q 0.25 K 0.24 R 0.08 H 0.08 E 0.03 V 0.02 C Shift Assignments>> C :: 176.332 CA :: 56.583(D) CB :: 33.385 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.239(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 119.106(D) Ave N Shift Values>> N :: 120.09(3.57) 1.R83 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.22 Q 0.22 K 0.18 R 0.15 E 0.09 M 0.06 L 0.04 C Shift Assignments>> C :: 174.466 CA :: 53.431(D) CB :: 29.068 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.421(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 127.385(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.K84 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.51 E 0.11 H 0.08 Q 0.07 R 0.07 P 0.06 V 0.05 M 0.01 K 0.01 C Shift Assignments>> C :: 173.797 CA :: 60.968(D) CB :: 28.809 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.190(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.595(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P85 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.49 P 0.29 I 0.2 C Shift Assignments>> C :: 180.201 CA :: 65.726(D) CB :: 30.347 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.I86 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.49 V 0.29 Y 0.07 E 0.05 F 0.04 K 0.01 C Shift Assignments>> C :: 178.189 CA :: 62.575(D) CB :: 35.850 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 6.826(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.157(D) Ave N Shift Values>> N :: 121.46(4.28) 1.Y87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.39 M 0.17 K 0.1 Y 0.09 Q 0.08 F 0.04 I 0.04 V 0.02 H 0.01 N 0.01 C Shift Assignments>> C :: 179.404 CA :: 57.318(D) CB :: 35.691 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 6.876(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 122.193(D) Ave N Shift Values>> N :: 120.52(4.2) 1.E88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.18 K 0.17 I 0.17 Q 0.13 H 0.13 R 0.12 V 0.02 M 0.02 HN Overlap>> 1.T148 1.T148 C Shift Assignments>> C :: 178.433 CA :: 59.496(D) CB :: 29.180 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.959(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.054(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A89 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.68 A 0.27 I 0.03 C Shift Assignments>> C :: 180.829 CA :: 55.132(D) CB :: 17.157 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.693(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.529(D) Ave N Shift Values>> N :: 123.23(3.54) 1.F90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.43 F 0.28 Y 0.25 K 0.01 L 0.01 C Shift Assignments>> C :: 178.264 CA :: 61.222(D) CB :: 40.238 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.236(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.754(D) Ave N Shift Values>> N :: 120.45(4.18) 1.S91 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 176.793 CA :: 61.322(D) CB :: 62.547 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.908(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 111.903(D) Ave N Shift Values>> N :: 116.28(3.52) 1.N92 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.24 N 0.12 E 0.09 D 0.07 I 0.06 L 0.03 M 0.03 C Shift Assignments>> C :: 178.065 CA :: 56.444(D) CB :: 38.150 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.801(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.470(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R93 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.2 E 0.17 R 0.13 H 0.12 K 0.11 Q 0.09 V 0.09 M 0.02 P 0.01 C Shift Assignments>> C :: 180.027 CA :: 60.353(D) CB :: 29.799 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.723(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.667(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.I94 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.66 V 0.29 Y 0.01 F 0.01 HN Overlap>> 1.E203 1.E203 C Shift Assignments>> C :: 178.194 CA :: 65.472(D) CB :: 36.291 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.079(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.090(D) Ave N Shift Values>> N :: 121.46(4.28) 1.M95 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.2 H 0.18 Q 0.17 R 0.17 K 0.15 M 0.05 I 0.03 V 0.01 C Shift Assignments>> C :: 179.436 CA :: 57.799(D) CB :: 29.754 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.427(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 118.622(D) Ave N Shift Values>> N :: 120.09(3.57) 1.N96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.27 F 0.22 N 0.2 D 0.1 E 0.07 I 0.04 L 0.04 M 0.02 HN Overlap>> 1.R133 1.R133 C Shift Assignments>> C :: 177.772 CA :: 55.905(D) CB :: 38.223 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.853(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.412(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L97 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.28 Y 0.24 L 0.14 K 0.14 D 0.09 I 0.06 N 0.01 R 0.01 HN Overlap>> 1.M65 1.M65 C Shift Assignments>> C :: 179.459 CA :: 57.788(D) CB :: 40.896 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.590(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.049(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L98 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.26 Y 0.21 L 0.17 D 0.14 K 0.13 I 0.04 N 0.02 C Shift Assignments>> C :: 178.744 CA :: 57.181(D) CB :: 40.846 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.170(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.182(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.27 F 0.25 N 0.16 D 0.15 L 0.07 I 0.04 E 0.01 M 0.01 C Shift Assignments>> C :: 176.956 CA :: 55.990(D) CB :: 38.959 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.876(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 115.324(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.K100 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.2 H 0.18 E 0.17 M 0.14 K 0.13 Q 0.11 V 0.02 C Shift Assignments>> C :: 177.183 CA :: 57.278(D) CB :: 31.066 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.224(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 114.343(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.H101 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.25 K 0.23 Q 0.15 R 0.13 H 0.12 E 0.06 V 0.02 HN Overlap>> 1.I223 1.I223 C Shift Assignments>> C :: 173.188 CA :: 56.173(D) CB :: 32.665 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.407(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 116.706(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.A102 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.66 L 0.32 K 0.01 C Shift Assignments>> C :: 176.769 CA :: 50.746(D) CB :: 22.346 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.072(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 116.638(D) Ave N Shift Values>> N :: 123.23(3.54) 1.D103 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.22 L 0.19 Y 0.17 D 0.17 K 0.15 N 0.02 I 0.02 R 0.01 HN Overlap>> 1.V38 1.V38 C Shift Assignments>> C :: 177.179(D) CA :: 56.674(D) CB :: 40.987(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.845(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.098(D) Ave N Shift Values>> N :: 120.65(3.86) 1.K104 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.3 M 0.25 K 0.1 Q 0.09 N 0.09 Y 0.06 F 0.03 H 0.01 R 0.01 C Shift Assignments>> C :: 174.066(D) CA :: 54.985(D) CB :: 35.700(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.535(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 114.850(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I105 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.27 Y 0.22 K 0.21 L 0.11 I 0.07 D 0.05 R 0.03 C Shift Assignments>> C :: 172.603 CA :: 58.614(D) CB :: 41.377 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.635(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.064(D) Ave N Shift Values>> N :: 121.46(4.28) 1.E106 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.3 K 0.2 H 0.15 R 0.15 Q 0.12 E 0.05 C Shift Assignments>> C :: 175.448(D) CA :: 54.187(D) CB :: 32.457(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.338(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 128.621(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V107 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.35 V 0.33 I 0.23 R 0.02 E 0.02 H 0.01 C Shift Assignments>> C :: 175.565(D) CA :: 63.054(D) CB :: 30.273(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.863(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 128.948(D) Ave N Shift Values>> N :: 121.14(4.54) 1.A108 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.88 M 0.09 L 0.01 C Shift Assignments>> C :: 177.315(D) CA :: 53.097(D) CB :: 19.755(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.298(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 133.133(D) Ave N Shift Values>> N :: 123.23(3.54) 1.S109 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> CA :: 56.566(D) CB :: 63.968(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.508(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.467(D) Ave N Shift Values>> N :: 116.28(3.52) 1.I110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.25 T 0.22 I 0.18 P 0.17 S 0.11 F 0.01 Y 0.01 C Shift Assignments>> C :: 173.703 CA :: 62.650(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) 1.D111 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.39 D 0.38 L 0.13 F 0.03 Y 0.02 K 0.01 C Shift Assignments>> C :: 173.226 CA :: 50.493(D) CB :: 40.820 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.018(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.302(D) Ave N Shift Values>> N :: 120.65(3.86) 1.E112 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.38 Q 0.18 K 0.15 N 0.12 Y 0.05 F 0.02 H 0.02 R 0.01 C Shift Assignments>> C :: 174.960 CA :: 54.391(D) CB :: 35.407 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 6.436(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 113.689(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A113 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.5 L 0.46 K 0.02 C Shift Assignments>> C :: 174.370 CA :: 50.635(D) CB :: 22.789 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.187(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.877(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Y114 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.21 L 0.2 K 0.18 Y 0.16 D 0.16 I 0.02 N 0.02 R 0.01 C Shift Assignments>> C :: 175.158(D) CA :: 56.742(D) CB :: 41.135(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.054(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 115.993(D) Ave N Shift Values>> N :: 120.52(4.2) 1.L115 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.32 D 0.23 R 0.17 K 0.11 F 0.05 Y 0.03 N 0.03 G 0.01 C Shift Assignments>> C :: 175.409(D) CA :: 53.912(D) CB :: 42.616 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 10.143(D) HA :: 4.558 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.529(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D116 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.37 L 0.24 N 0.13 K 0.1 F 0.07 Y 0.04 R 0.02 C Shift Assignments>> C :: 177.415 CA :: 53.285(D) CB :: 41.377(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.690(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 123.528(D) Ave N Shift Values>> N :: 120.65(3.86) 1.V117 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.2 R 0.17 H 0.15 V 0.12 Q 0.1 I 0.09 K 0.07 M 0.05 P 0.01 C Shift Assignments>> CA :: 59.834 CB :: 30.407 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.294(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.255(D) Ave N Shift Values>> N :: 121.14(4.54) 1.T118 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N119 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> E 0.22 Y 0.21 N 0.2 F 0.15 M 0.07 D 0.04 I 0.03 L 0.01 K 0.01 C Shift Assignments>> C :: 179.285 CA :: 55.667(D) CB :: 37.372 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) 1.K120 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.2 E 0.19 H 0.18 K 0.12 M 0.12 Q 0.11 V 0.04 I 0.01 HN Overlap>> 1.D186 1.D186 C Shift Assignments>> C :: 178.669 CA :: 57.899(D) CB :: 30.992 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.191(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 126.708(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V121 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.21 R 0.16 H 0.15 Q 0.13 K 0.12 I 0.09 V 0.05 M 0.04 C Shift Assignments>> C :: 176.081 CA :: 59.297(D) CB :: 29.900 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.629(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 106.600(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E122 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.3 L 0.27 Q 0.14 H 0.08 E 0.06 K 0.05 I 0.05 C Shift Assignments>> C :: 176.808 CA :: 56.665(D) CB :: 26.960 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.194(D) HA :: 4.562 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.018(D) Ave N Shift Values>> N :: 120.67(3.48) 1.G123 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.9 L 0.07 C Shift Assignments>> C :: 172.899 CA :: 45.853(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.799(D) HA3 :: 3.956 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.175(D) Ave N Shift Values>> N :: 109.67(3.87) 1.N124 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.66 D 0.17 F 0.05 Y 0.05 L 0.03 HN Overlap>> 1.Y231 1.Y231 1.L220 1.L220 C Shift Assignments>> CA :: 52.277(D) CB :: 38.732 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.560(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.757(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.F125 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.24 T 0.22 P 0.18 I 0.17 S 0.12 F 0.01 Y 0.01 C Shift Assignments>> C :: 177.517 CA :: 62.757(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) 1.E126 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.24 R 0.2 Q 0.13 K 0.11 E 0.1 H 0.09 L 0.07 C Shift Assignments>> C :: 180.150 CA :: 59.114(D) CB :: 27.695 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.153(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.282(D) Ave N Shift Values>> N :: 120.67(3.48) 1.N127 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.32 E 0.23 Y 0.13 M 0.11 F 0.08 D 0.03 K 0.02 I 0.01 C Shift Assignments>> C :: 178.978 CA :: 54.575(D) CB :: 36.877 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.031(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.168(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G128 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.91 L 0.05 A 0.01 C Shift Assignments>> C :: 173.519 CA :: 47.212(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.284(D) HA3 :: 3.670 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.571(D) Ave N Shift Values>> N :: 109.67(3.87) 1.I129 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.87 V 0.07 Y 0.02 F 0.02 C Shift Assignments>> C :: 177.629 CA :: 65.542(D) CB :: 37.238 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.788(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.176(D) Ave N Shift Values>> N :: 121.46(4.28) 1.E130 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.18 Q 0.17 R 0.15 E 0.14 I 0.14 H 0.12 L 0.04 M 0.01 HN Overlap>> 1.K159 1.K30 1.K159 1.K30 C Shift Assignments>> C :: 179.138 CA :: 58.515(D) CB :: 28.231 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.404(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.848(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L131 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.29 Y 0.26 D 0.14 L 0.14 I 0.05 K 0.05 N 0.03 C Shift Assignments>> C :: 177.810 CA :: 57.174(D) CB :: 40.329 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.007(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.494(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A132 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.58 A 0.37 I 0.04 HN Overlap>> 1.L272 1.L272 C Shift Assignments>> C :: 178.836 CA :: 55.217(D) CB :: 18.001 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.979(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.821(D) Ave N Shift Values>> N :: 123.23(3.54) 1.R133 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.18 E 0.18 K 0.16 H 0.13 Q 0.13 R 0.12 V 0.03 M 0.02 HN Overlap>> 1.N96 1.N96 C Shift Assignments>> C :: 179.220 CA :: 59.703(D) CB :: 29.300 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.921(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.373(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.K134 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.18 E 0.16 K 0.15 H 0.15 V 0.12 M 0.12 Q 0.07 I 0.01 C Shift Assignments>> C :: 179.330 CA :: 59.105(D) CB :: 31.421 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.037(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.656(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I135 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.86 V 0.08 Y 0.02 F 0.02 C Shift Assignments>> C :: 177.358 CA :: 65.316(D) CB :: 37.171 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.653(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.614(D) Ave N Shift Values>> N :: 121.46(4.28) 1.K136 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.22 R 0.15 E 0.14 K 0.12 H 0.12 M 0.08 Q 0.06 P 0.03 I 0.03 C Shift Assignments>> C :: 179.247 CA :: 59.966(D) CB :: 31.376 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.791(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.193(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Q137 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.27 I 0.15 Q 0.14 L 0.13 H 0.09 K 0.09 E 0.09 HN Overlap>> 1.E23 1.E23 C Shift Assignments>> C :: 177.457 CA :: 58.275(D) CB :: 27.363 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.871(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.063(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E138 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.18 E 0.18 I 0.15 Q 0.14 H 0.13 R 0.12 M 0.02 V 0.02 C Shift Assignments>> C :: 178.858 CA :: 59.235(D) CB :: 29.057 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.590(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.836(D) Ave N Shift Values>> N :: 120.67(3.48) 1.I139 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.89 V 0.05 Y 0.02 F 0.02 HN Overlap>> 1.L232 1.L232 C Shift Assignments>> C :: 178.291 CA :: 65.664(D) CB :: 37.460 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.161(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.927(D) Ave N Shift Values>> N :: 121.46(4.28) 1.L140 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.26 Y 0.21 K 0.19 L 0.15 D 0.09 I 0.05 R 0.02 C Shift Assignments>> C :: 180.109 CA :: 57.800(D) CB :: 41.158 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.476(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.911(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E141 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.2 K 0.16 H 0.15 Q 0.15 R 0.14 I 0.1 M 0.03 V 0.02 C Shift Assignments>> C :: 178.722 CA :: 59.038(D) CB :: 29.479 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.652(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.252(D) Ave N Shift Values>> N :: 120.67(3.48) 1.K142 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.25 M 0.18 Q 0.15 R 0.12 H 0.1 V 0.09 E 0.07 C Shift Assignments>> C :: 178.420 CA :: 58.232(D) CB :: 32.800 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.613(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 115.313(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E143 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.23 R 0.19 Q 0.19 E 0.13 K 0.11 M 0.11 C Shift Assignments>> C :: 176.112 CA :: 54.392(D) CB :: 30.024 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.046(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 114.273(D) Ave N Shift Values>> N :: 120.67(3.48) 1.K144 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.24 Q 0.22 H 0.14 E 0.14 L 0.13 I 0.08 M 0.01 C Shift Assignments>> C :: 174.530 CA :: 57.282 CB :: 27.902 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.590(D) HA :: 4.076 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 111.877(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I145 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.29 Y 0.27 D 0.16 L 0.13 N 0.05 I 0.05 K 0.02 C Shift Assignments>> C :: 175.466 CA :: 56.766(D) CB :: 40.001 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 6.576(D) HA :: 4.614 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 114.661(D) Ave N Shift Values>> N :: 121.46(4.28) 1.T146 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.103 CA :: 61.317(D) CB :: 69.366 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 10.164(D) HA :: 4.302 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.699(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V147 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.25 Q 0.23 M 0.21 R 0.08 H 0.07 V 0.07 E 0.04 C Shift Assignments>> C :: 174.044 CA :: 57.803(D) CB :: 33.402 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.349(D) HA :: 4.862 HG11 :: 1.170 HG12 :: 1.170 HG13 :: 1.170 HG21 :: 0.712 HG22 :: 0.712 HG23 :: 0.712 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 112.949(D) Ave N Shift Values>> N :: 121.14(4.54) 1.T148 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.E88 1.E88 C Shift Assignments>> C :: 173.330 CA :: 62.182(D) CB :: 69.359 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.031(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.056(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V149 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.25 M 0.22 K 0.21 E 0.11 V 0.05 R 0.04 H 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 174.886 CA :: 57.677(D) CB :: 34.380 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.856(D) HA :: 5.630 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.299(D) Ave N Shift Values>> N :: 121.14(4.54) 1.G150 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.41 L 0.3 G 0.09 D 0.06 F 0.05 Y 0.03 K 0.03 C Shift Assignments>> C :: 172.104 CA :: 43.464(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.299(D) HA3 :: 3.927 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.880(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V151 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.36 K 0.17 M 0.09 R 0.09 Q 0.08 H 0.07 E 0.05 P 0.04 C Shift Assignments>> C :: 174.531 CA :: 60.142(D) CB :: 32.764 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.797(D) HG21 :: 0.913 HG22 :: 0.913 HG23 :: 0.913 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.906(D) Ave N Shift Values>> N :: 121.14(4.54) 1.A152 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.89 L 0.09 C Shift Assignments>> CA :: 50.728(D) CB :: 21.417 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.231(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.389(D) Ave N Shift Values>> N :: 123.23(3.54) 1.P153 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N154 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> N 0.48 Y 0.13 F 0.1 E 0.09 D 0.07 M 0.05 L 0.02 I 0.01 C Shift Assignments>> C :: 173.477 CA :: 54.169(D) CB :: 37.569 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) 1.K155 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.27 E 0.27 Y 0.16 F 0.09 V 0.07 M 0.04 K 0.03 Q 0.01 HN Overlap>> 1.V24 1.V24 C Shift Assignments>> C :: 177.101 CA :: 60.147(D) CB :: 36.151 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.187(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.395(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I156 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.54 V 0.23 Y 0.09 E 0.05 F 0.04 C Shift Assignments>> C :: 177.771 CA :: 62.508(D) CB :: 36.053 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.451(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.124(D) Ave N Shift Values>> N :: 121.46(4.28) 1.L157 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.21 L 0.19 K 0.18 Y 0.17 D 0.16 I 0.02 N 0.02 R 0.02 HN Overlap>> 1.V21 1.V21 1.L25 1.L25 C Shift Assignments>> C :: 177.427 CA :: 56.782(D) CB :: 41.146 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.064(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.568(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A158 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.62 A 0.33 I 0.03 C Shift Assignments>> C :: 177.901 CA :: 55.052(D) CB :: 17.551 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.600(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.826(D) Ave N Shift Values>> N :: 123.23(3.54) 1.K159 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.19 E 0.16 K 0.16 H 0.16 M 0.14 Q 0.08 V 0.07 I 0.01 HN Overlap>> 1.E130 1.E130 1.K30 1.K30 C Shift Assignments>> C :: 179.033 CA :: 58.313(D) CB :: 31.456 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.354(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.899(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I160 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.9 Y 0.03 F 0.03 V 0.02 HN Overlap>> 1.F17 1.F17 C Shift Assignments>> C :: 178.692 CA :: 65.154(D) CB :: 37.842 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.989(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.835(D) Ave N Shift Values>> N :: 121.46(4.28) 1.I161 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.3 Y 0.26 E 0.19 F 0.16 M 0.02 V 0.01 K 0.01 HN Overlap>> 1.K234 1.R334 1.K234 1.R334 C Shift Assignments>> C :: 178.144 CA :: 59.669(D) CB :: 37.116 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.367(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.371(D) Ave N Shift Values>> N :: 121.46(4.28) 1.A162 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.56 A 0.38 I 0.04 C Shift Assignments>> C :: 179.627 CA :: 55.390(D) CB :: 18.263 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.790(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.406(D) Ave N Shift Values>> N :: 123.23(3.54) 1.D163 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.34 Y 0.32 I 0.1 L 0.09 D 0.08 K 0.02 N 0.01 HN Overlap>> 1.Y29 1.Y29 C Shift Assignments>> C :: 179.391 CA :: 57.828(D) CB :: 39.984 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.544(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.922(D) Ave N Shift Values>> N :: 120.65(3.86) 1.K164 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.24 M 0.21 R 0.14 H 0.12 Q 0.12 E 0.08 V 0.04 C Shift Assignments>> C :: 177.702 CA :: 57.299(D) CB :: 32.523 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.756(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 115.828(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.S165 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 172.692 CA :: 58.217(D) CB :: 63.784 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.844(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.012(D) Ave N Shift Values>> N :: 116.28(3.52) 1.K166 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.29 K 0.21 R 0.15 H 0.15 Q 0.12 E 0.05 C Shift Assignments>> C :: 174.977 CA :: 54.626 CB :: 32.456 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.082(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.979(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P167 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.63 P 0.16 K 0.05 Q 0.03 I 0.02 M 0.02 R 0.01 H 0.01 C Shift Assignments>> C :: 174.904 CA :: 61.847(D) CB :: 33.506 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.N168 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.7 M 0.07 E 0.06 Y 0.05 F 0.04 D 0.03 K 0.01 C Shift Assignments>> C :: 176.945 CA :: 52.270(D) CB :: 36.954 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.940(D) HA :: 4.540 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.653(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G169 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.59 L 0.23 R 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 174.119 CA :: 44.599(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.227(D) HA2 :: 3.993 HA3 :: 4.267 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.059(D) Ave N Shift Values>> N :: 109.67(3.87) 1.L170 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.28 D 0.19 K 0.19 R 0.14 F 0.08 Y 0.05 N 0.02 C Shift Assignments>> C :: 174.799 CA :: 55.232(D) CB :: 42.279 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.535(D) HA :: 5.076 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.921(D) Ave N Shift Values>> N :: 121.86(3.9) 1.G171 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.87 L 0.09 R 0.01 C Shift Assignments>> C :: 171.663 CA :: 45.327(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.318(D) HA2 :: 3.972 HA3 :: 4.618 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.909 Ave N Shift Values>> N :: 109.67(3.87) 1.V172 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.27 I 0.2 V 0.13 Y 0.12 M 0.07 K 0.07 F 0.06 Q 0.04 C Shift Assignments>> C :: 175.157 CA :: 60.120(D) CB :: 35.649 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.498(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.594(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I173 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.33 F 0.31 I 0.3 L 0.01 D 0.01 HN Overlap>> 1.V36 1.V36 1.I293 1.I293 C Shift Assignments>> C :: 173.993 CA :: 59.772(D) CB :: 39.382 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.639(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.087(D) Ave N Shift Values>> N :: 121.46(4.28) 1.R174 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.22 H 0.18 K 0.17 L 0.16 R 0.1 E 0.09 M 0.03 C Shift Assignments>> C :: 176.646 CA :: 54.083(D) CB :: 28.226 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.457(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.440(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.P175 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T176 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> T 0.99 C Shift Assignments>> C :: 175.390 CA :: 62.564(D) CB :: 68.151 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) 1.E177 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.22 R 0.21 Q 0.16 E 0.16 M 0.13 K 0.08 C Shift Assignments>> C :: 176.994 CA :: 55.514(D) CB :: 30.522 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.843(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.206(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V178 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.77 P 0.19 I 0.03 C Shift Assignments>> C :: 176.547 CA :: 66.926(D) CB :: 31.480 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 6.944(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.472(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Q179 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.25 R 0.23 Q 0.12 K 0.09 E 0.09 H 0.08 L 0.08 HN Overlap>> 1.K306 1.K306 C Shift Assignments>> C :: 178.064 CA :: 59.127(D) CB :: 27.475 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.591(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.913(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D180 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.3 Y 0.28 D 0.15 L 0.12 I 0.05 N 0.04 K 0.02 C Shift Assignments>> C :: 178.150 CA :: 57.004(D) CB :: 40.045 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.283(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.511(D) Ave N Shift Values>> N :: 120.65(3.86) 1.F181 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.49 Y 0.25 F 0.24 HN Overlap>> 1.D211 1.D211 1.I78 1.I78 C Shift Assignments>> C :: 178.556 CA :: 61.211(D) CB :: 39.405 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.980(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.622(D) Ave N Shift Values>> N :: 120.45(4.18) 1.L182 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.24 Y 0.2 K 0.18 L 0.17 D 0.12 I 0.03 R 0.01 N 0.01 C Shift Assignments>> C :: 178.940 CA :: 57.312(D) CB :: 41.086 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.810(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.725(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N183 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.36 Y 0.18 F 0.16 D 0.14 L 0.05 E 0.03 M 0.02 I 0.01 C Shift Assignments>> C :: 175.918 CA :: 54.856(D) CB :: 38.398 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.942(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 114.807(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E184 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.22 R 0.19 Q 0.19 E 0.14 K 0.11 M 0.1 C Shift Assignments>> C :: 176.603 CA :: 54.820(D) CB :: 30.038 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.055(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 114.695(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L185 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.27 D 0.21 K 0.21 F 0.1 R 0.08 Y 0.07 N 0.02 HN Overlap>> 1.A77 1.A77 C Shift Assignments>> C :: 176.955 CA :: 55.302(D) CB :: 41.909 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.064(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.533(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D186 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.31 L 0.26 K 0.14 F 0.08 N 0.08 Y 0.06 R 0.03 HN Overlap>> 1.K120 1.K120 C Shift Assignments>> C :: 178.149 CA :: 54.175(D) CB :: 41.560 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.122(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 126.676(D) Ave N Shift Values>> N :: 120.65(3.86) 1.I187 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.55 Y 0.18 F 0.11 E 0.08 V 0.04 C Shift Assignments>> C :: 175.748 CA :: 61.417(D) CB :: 36.952 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.227(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.802(D) Ave N Shift Values>> N :: 121.46(4.28) 1.D188 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.29 D 0.29 F 0.14 Y 0.13 L 0.12 C Shift Assignments>> C :: 176.942 CA :: 54.465(D) CB :: 39.664 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.288(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 114.248(D) Ave N Shift Values>> N :: 120.65(3.86) 1.E189 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.21 R 0.19 Q 0.18 E 0.16 K 0.11 M 0.09 C Shift Assignments>> C :: 175.924 CA :: 55.645(D) CB :: 30.090 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.564(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.224(D) Ave N Shift Values>> N :: 120.67(3.48) 1.I190 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.39 Y 0.19 F 0.11 I 0.1 M 0.09 K 0.04 Q 0.01 N 0.01 V 0.01 C Shift Assignments>> C :: 174.573 CA :: 57.863(D) CB :: 36.578 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.293(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.380(D) Ave N Shift Values>> N :: 121.46(4.28) 1.P191 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G192 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> G 0.72 L 0.17 R 0.05 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.892 CA :: 44.860(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) 1.I193 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.18 K 0.18 Q 0.17 M 0.14 E 0.13 I 0.05 Y 0.04 R 0.03 H 0.02 F 0.01 C Shift Assignments>> C :: 176.107 CA :: 59.419(D) CB :: 34.538 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.504(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.386(D) Ave N Shift Values>> N :: 121.46(4.28) 1.G194 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.47 L 0.26 R 0.16 F 0.03 D 0.03 Y 0.01 C Shift Assignments>> CA :: 44.395(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.377(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.746(D) Ave N Shift Values>> N :: 109.67(3.87) 1.S195 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V196 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.32 T 0.21 S 0.19 I 0.14 P 0.11 C Shift Assignments>> C :: 178.536 CA :: 66.047(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) 1.L197 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.28 Y 0.26 D 0.16 L 0.14 I 0.05 N 0.04 K 0.03 C Shift Assignments>> C :: 178.667 CA :: 56.887(D) CB :: 40.189 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.210(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.260(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A198 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.71 A 0.23 I 0.05 C Shift Assignments>> C :: 179.219 CA :: 55.429(D) CB :: 17.181 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.513(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.120(D) Ave N Shift Values>> N :: 123.23(3.54) 1.R199 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.2 E 0.18 Q 0.16 H 0.14 I 0.12 R 0.12 M 0.02 L 0.01 V 0.01 C Shift Assignments>> C :: 179.209 CA :: 58.755(D) CB :: 28.875 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.836(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.143(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.R200 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.19 E 0.19 Q 0.17 H 0.15 R 0.13 I 0.08 M 0.03 V 0.01 L 0.01 HN Overlap>> 1.A56 1.A56 C Shift Assignments>> C :: 179.465 CA :: 58.427(D) CB :: 29.161 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.746(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.561(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.L201 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.36 F 0.32 I 0.13 D 0.05 L 0.04 N 0.03 E 0.02 HN Overlap>> 1.I276 1.I276 1.L325 1.N53 1.A236 1.L325 1.N53 1.A236 C Shift Assignments>> C :: 179.536 CA :: 57.716(D) CB :: 38.913 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.434(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.062(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N202 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.29 F 0.25 N 0.15 D 0.12 L 0.06 I 0.05 E 0.03 M 0.01 C Shift Assignments>> C :: 179.508 CA :: 56.163(D) CB :: 38.652 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.736(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 120.502(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E203 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.2 Q 0.17 E 0.17 I 0.14 H 0.14 R 0.1 L 0.02 M 0.02 HN Overlap>> 1.K58 1.K58 1.I94 1.I94 C Shift Assignments>> C :: 177.747 CA :: 58.688(D) CB :: 28.617 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.039(D) HA :: 4.429 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.012(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L204 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.29 L 0.28 K 0.16 F 0.07 R 0.06 N 0.06 Y 0.05 C Shift Assignments>> C :: 176.738 CA :: 54.168(D) CB :: 41.851 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.362(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.910(D) Ave N Shift Values>> N :: 121.86(3.9) 1.G205 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.67 L 0.2 R 0.07 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 174.069 CA :: 44.747(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.896(D) HA2 :: 4.099 HA3 :: 3.746 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.473(D) Ave N Shift Values>> N :: 109.67(3.87) 1.I206 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.3 E 0.25 Y 0.19 F 0.11 V 0.05 M 0.03 K 0.02 C Shift Assignments>> C :: 173.111 CA :: 60.114(D) CB :: 36.463 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.914(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.034(D) Ave N Shift Values>> N :: 121.46(4.28) 1.Q207 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.21 H 0.21 E 0.17 Q 0.15 M 0.12 K 0.1 V 0.01 HN Overlap>> 1.V35 1.V35 C Shift Assignments>> C :: 176.040 CA :: 56.312(D) CB :: 30.663 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.011(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 126.441(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K208 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.36 Q 0.22 K 0.14 E 0.08 N 0.07 H 0.03 R 0.02 Y 0.01 HN Overlap>> 1.D345 1.D345 C Shift Assignments>> C :: 178.050 CA :: 53.182(D) CB :: 34.766 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.577(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.559(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L209 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.35 Y 0.34 I 0.13 L 0.06 D 0.05 K 0.01 N 0.01 C Shift Assignments>> C :: 178.232 CA :: 58.326 CB :: 39.880 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.540(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.236(D) Ave N Shift Values>> N :: 121.86(3.9) 1.R210 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.2 Q 0.18 E 0.16 H 0.14 I 0.11 R 0.1 L 0.04 M 0.02 C Shift Assignments>> C :: 178.220 CA :: 58.207(D) CB :: 28.451 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.471(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 112.882(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.D211 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.21 K 0.2 F 0.18 D 0.18 Y 0.14 R 0.02 N 0.02 I 0.01 HN Overlap>> 1.F181 1.F181 C Shift Assignments>> C :: 178.682 CA :: 56.454(D) CB :: 41.275 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.959(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.711(D) Ave N Shift Values>> N :: 120.65(3.86) 1.I212 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.56 V 0.2 Y 0.09 E 0.05 F 0.05 HN Overlap>> 1.L230 1.L230 C Shift Assignments>> C :: 176.607 CA :: 62.510(D) CB :: 36.149 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.939(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.228(D) Ave N Shift Values>> N :: 121.46(4.28) 1.L213 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.25 F 0.21 Y 0.19 L 0.17 N 0.09 K 0.03 I 0.02 C Shift Assignments>> C :: 177.721 CA :: 55.822(D) CB :: 40.256 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.188(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 115.841(D) Ave N Shift Values>> N :: 121.86(3.9) 1.S214 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K215 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N216 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Y217 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> T 0.25 I 0.25 V 0.23 P 0.09 S 0.05 F 0.03 Y 0.03 C Shift Assignments>> CA :: 61.922(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) 1.N218 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.27 F 0.2 E 0.16 N 0.14 I 0.05 D 0.05 M 0.05 L 0.02 C Shift Assignments>> C :: 177.887 CA :: 56.213(D) CB :: 37.724 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.328(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 115.741(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E219 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.21 E 0.18 Q 0.18 H 0.15 R 0.12 I 0.08 M 0.02 L 0.01 C Shift Assignments>> C :: 178.462 CA :: 58.204(D) CB :: 28.892 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.684(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.804(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L220 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.24 K 0.2 Y 0.19 L 0.16 D 0.11 I 0.04 R 0.02 N 0.01 HN Overlap>> 1.Y231 1.N124 1.Y231 1.N124 C Shift Assignments>> C :: 178.453 CA :: 57.509(D) CB :: 41.200 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.555(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.743(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E221 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.2 E 0.17 Q 0.17 H 0.14 I 0.13 R 0.11 L 0.02 M 0.02 C Shift Assignments>> C :: 178.789 CA :: 58.652(D) CB :: 28.654 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.372(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.665(D) Ave N Shift Values>> N :: 120.67(3.48) 1.K222 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.18 K 0.16 E 0.16 H 0.15 M 0.14 V 0.08 Q 0.08 I 0.01 C Shift Assignments>> C :: 177.499 CA :: 58.488(D) CB :: 31.516 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.309(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.657(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I223 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.68 Y 0.15 F 0.12 E 0.01 V 0.01 HN Overlap>> 1.H101 1.H101 C Shift Assignments>> C :: 177.442 CA :: 62.254(D) CB :: 37.899 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.443(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 116.721(D) Ave N Shift Values>> N :: 121.46(4.28) 1.T224 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.949 CA :: 62.828 CB :: 69.307 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.430(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 106.504(D) Ave N Shift Values>> N :: 115.42(4.75) 1.G225 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.54 L 0.24 R 0.12 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> CA :: 44.506(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.202(D) HA2 :: 4.582 HA3 :: 3.998 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.918(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K226 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A227 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> M 0.68 A 0.26 I 0.05 C Shift Assignments>> C :: 181.702 CA :: 55.404 CB :: 17.456 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) 1.K228 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Duplicate PRTL>> R 0.19 K 0.16 E 0.16 H 0.16 M 0.14 Q 0.08 V 0.07 I 0.01 C Shift Assignments>> C :: 177.800 CA :: 58.361(D) CB :: 31.499 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.656 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.431(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A229 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.75 A 0.17 I 0.06 HN Overlap>> 1.M65 1.M65 C Shift Assignments>> C :: 178.779 CA :: 55.691(D) CB :: 16.942 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.635(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.209(D) Ave N Shift Values>> N :: 123.23(3.54) 1.L230 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.25 Y 0.2 K 0.17 L 0.16 D 0.12 I 0.04 R 0.01 N 0.01 HN Overlap>> 1.I212 1.I212 C Shift Assignments>> C :: 179.055 CA :: 57.404(D) CB :: 41.080 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.885(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.316(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Y231 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.33 I 0.29 F 0.26 E 0.06 M 0.01 HN Overlap>> 1.N124 1.L220 1.N124 1.L220 C Shift Assignments>> C :: 176.339 CA :: 59.313(D) CB :: 38.128 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.589(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.830(D) Ave N Shift Values>> N :: 120.52(4.2) 1.L232 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.24 F 0.21 L 0.18 Y 0.16 D 0.1 R 0.04 I 0.03 HN Overlap>> 1.F17 1.F17 1.I139 1.I139 C Shift Assignments>> C :: 178.410 CA :: 57.434(D) CB :: 41.507 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.094(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.933(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L233 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> F 0.14 Y 0.13 E 0.1 S 0.1 K 0.09 R 0.08 H 0.07 Q 0.07 M 0.05 L 0.03 I 0.02 V 0.01 D 0.01 T 0.01 C Shift Assignments>> C :: 179.117 CA :: 57.992(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) 1.K234 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.19 K 0.16 H 0.16 E 0.15 M 0.15 Q 0.08 V 0.05 HN Overlap>> 1.I161 1.I161 1.R334 1.K266 1.R334 1.K266 C Shift Assignments>> C :: 179.725 CA :: 58.061(D) CB :: 31.514 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.359(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.342(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L235 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.23 F 0.23 Y 0.18 L 0.16 D 0.09 I 0.03 R 0.03 C Shift Assignments>> C :: 179.039 CA :: 57.661(D) CB :: 41.394 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.176(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.626(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A236 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.49 A 0.47 I 0.02 HN Overlap>> 1.I276 1.L201 1.L325 1.N53 1.I276 1.L201 1.L325 1.N53 C Shift Assignments>> C :: 178.523 CA :: 54.471(D) CB :: 17.834 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.398(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.994(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Q237 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.21 H 0.2 K 0.18 R 0.15 E 0.13 M 0.06 L 0.02 C Shift Assignments>> C :: 175.711 CA :: 55.035(D) CB :: 29.194 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.711(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 112.663(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.N238 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.54 E 0.12 Y 0.09 M 0.08 F 0.06 D 0.04 K 0.01 L 0.01 HN Overlap>> 1.I286 1.I286 C Shift Assignments>> CA :: 53.498(D) CB :: 37.013 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.221(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 117.782(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.K239 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Y240 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S241 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E242 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P243 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V244 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E245 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N246 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K247 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S248 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K249 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I250 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P251 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H252 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G253 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R254 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Y255 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> K 0.12 R 0.11 E 0.11 Q 0.1 H 0.1 F 0.08 M 0.08 Y 0.08 L 0.06 S 0.05 D 0.03 I 0.01 C Shift Assignments>> CA :: 57.054(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) 1.L256 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.35 L 0.21 N 0.15 F 0.1 K 0.07 Y 0.07 C Shift Assignments>> CA :: 54.109(D) CB :: 40.911 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.152(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.191(D) Ave N Shift Values>> N :: 121.86(3.9) 1.T257 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.545 CA :: 62.986(D) CB :: 68.604 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.764(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 120.666(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L258 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.6 D 0.2 F 0.06 Y 0.05 L 0.05 C Shift Assignments>> C :: 175.412 CA :: 52.548(D) CB :: 38.984 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.034(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 127.487(D) Ave N Shift Values>> N :: 121.86(3.9) 1.P259 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.41 V 0.36 I 0.19 C Shift Assignments>> C :: 175.423 CA :: 64.014(D) CB :: 30.367 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.Y260 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.43 Y 0.15 D 0.14 F 0.13 L 0.04 E 0.03 M 0.02 I 0.01 C Shift Assignments>> C :: 173.059 CA :: 54.459(D) CB :: 38.364 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 6.758(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 111.635(D) Ave N Shift Values>> N :: 120.52(4.2) 1.N261 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.62 E 0.09 M 0.09 Y 0.06 F 0.04 D 0.03 K 0.01 HN Overlap>> 1.T262 1.T262 C Shift Assignments>> C :: 175.937 CA :: 52.786(D) CB :: 36.808 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.459(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 117.968(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T262 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.N261 1.N261 C Shift Assignments>> C :: 172.076 CA :: 61.022(D) CB :: 68.678 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.381(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.036(D) Ave N Shift Values>> N :: 115.42(4.75) 1.R263 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> L 0.14 D 0.13 M 0.11 H 0.09 Q 0.08 R 0.08 K 0.07 N 0.06 E 0.05 A 0.05 F 0.04 Y 0.04 S 0.01 C Shift Assignments>> C :: 174.160 CA :: 55.192(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) 1.D264 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.38 N 0.21 L 0.19 F 0.08 Y 0.06 K 0.05 HN Overlap>> 1.A74 1.A74 C Shift Assignments>> C :: 177.885 CA :: 53.426(D) CB :: 40.812 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.726(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 122.458(D) Ave N Shift Values>> N :: 120.65(3.86) 1.V265 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.65 P 0.27 I 0.06 C Shift Assignments>> C :: 176.513 CA :: 66.398(D) CB :: 31.086 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.751(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 128.893(D) Ave N Shift Values>> N :: 121.14(4.54) 1.K266 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.18 E 0.17 H 0.15 K 0.15 M 0.12 V 0.1 Q 0.08 I 0.01 HN Overlap>> 1.K234 1.K234 1.I68 1.I68 C Shift Assignments>> C :: 178.853 CA :: 58.876(D) CB :: 31.349 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.325(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.235(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V267 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.53 V 0.41 I 0.03 C Shift Assignments>> C :: 177.217 CA :: 63.777(D) CB :: 31.502 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.262(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.149(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I268 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.87 Y 0.06 F 0.06 C Shift Assignments>> C :: 178.328 CA :: 64.370(D) CB :: 38.649 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.677(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.380(D) Ave N Shift Values>> N :: 121.46(4.28) 1.L269 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.33 I 0.32 F 0.29 E 0.01 L 0.01 C Shift Assignments>> C :: 174.777 CA :: 59.721(D) CB :: 38.756 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.688(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.118(D) Ave N Shift Values>> N :: 121.86(3.9) 1.P270 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> V 0.52 P 0.26 I 0.2 C Shift Assignments>> C :: 179.687 CA :: 65.937(D) CB :: 30.348 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.Y271 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.57 Y 0.2 F 0.14 E 0.04 V 0.01 C Shift Assignments>> C :: 176.915 CA :: 61.411(D) CB :: 37.539 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.382(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 115.974(D) Ave N Shift Values>> N :: 120.52(4.2) 1.L272 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.26 F 0.2 L 0.18 Y 0.15 D 0.1 R 0.05 I 0.02 HN Overlap>> 1.A132 1.A132 C Shift Assignments>> C :: 178.161 CA :: 57.405(D) CB :: 41.618 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.054(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.867(D) Ave N Shift Values>> N :: 121.86(3.9) 1.K273 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.24 E 0.14 R 0.14 H 0.11 K 0.08 I 0.07 P 0.06 Q 0.06 M 0.05 C Shift Assignments>> C :: 178.073 CA :: 60.486(D) CB :: 30.906 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.745(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.078(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K274 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.18 R 0.16 E 0.14 K 0.14 H 0.13 M 0.1 Q 0.06 I 0.02 P 0.01 C Shift Assignments>> C :: 178.554 CA :: 59.580(D) CB :: 31.513 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.412(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.269(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A275 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.74 A 0.22 I 0.03 C Shift Assignments>> C :: 179.983 CA :: 54.949(D) CB :: 16.426 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.254(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.138(D) Ave N Shift Values>> N :: 123.23(3.54) 1.I276 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.89 V 0.04 Y 0.03 F 0.02 HN Overlap>> 1.L201 1.L325 1.N53 1.A236 1.L201 1.L325 1.N53 1.A236 C Shift Assignments>> C :: 177.295 CA :: 65.402(D) CB :: 37.525 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.397(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 119.048(D) Ave N Shift Values>> N :: 121.46(4.28) 1.N277 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.28 F 0.2 E 0.19 N 0.11 I 0.06 M 0.05 D 0.04 L 0.02 K 0.01 HN Overlap>> 1.V49 1.V49 C Shift Assignments>> C :: 178.303 CA :: 56.458(D) CB :: 37.640 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.731(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 120.226(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E278 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.19 E 0.18 Q 0.15 H 0.14 I 0.13 R 0.12 M 0.02 V 0.01 L 0.01 C Shift Assignments>> C :: 178.946 CA :: 58.943(D) CB :: 29.032 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.361(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.693(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A279 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.58 A 0.38 I 0.02 HN Overlap>> 1.T291 1.T291 C Shift Assignments>> C :: 180.868 CA :: 54.803(D) CB :: 17.576 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.386(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.994(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Y280 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.64 Y 0.18 F 0.14 E 0.02 C Shift Assignments>> C :: 178.504 CA :: 61.861(D) CB :: 37.927 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.962(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 118.308(D) Ave N Shift Values>> N :: 120.52(4.2) 1.N281 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.34 Y 0.18 F 0.17 D 0.17 L 0.06 E 0.02 I 0.01 M 0.01 C Shift Assignments>> C :: 176.246 CA :: 54.918 CB :: 38.627 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.745(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.188(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.K282 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.26 K 0.22 Q 0.14 R 0.14 H 0.13 E 0.06 V 0.01 C Shift Assignments>> C :: 176.692 CA :: 55.600(D) CB :: 32.607 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.389(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 116.209(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V283 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.44 K 0.14 P 0.08 R 0.07 M 0.07 Q 0.05 H 0.05 E 0.04 C Shift Assignments>> C :: 174.760 CA :: 60.586(D) CB :: 32.682 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.291(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 114.621(D) Ave N Shift Values>> N :: 121.14(4.54) 1.N284 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> A 0.35 N 0.26 D 0.11 L 0.05 M 0.04 P 0.03 H 0.03 R 0.02 Q 0.02 K 0.01 F 0.01 C Shift Assignments>> C :: 174.072 CA :: 52.131(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) 1.G285 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.52 L 0.25 R 0.13 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 171.572 CA :: 44.478(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.290(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.529(D) Ave N Shift Values>> N :: 109.67(3.87) 1.I286 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.28 D 0.13 N 0.11 L 0.07 I 0.05 E 0.01 M 0.01 HN Overlap>> 1.N238 1.N238 C Shift Assignments>> C :: 173.621 CA :: 56.472(D) CB :: 39.027 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.246(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.746(D) Ave N Shift Values>> N :: 121.46(4.28) 1.P287 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.51 P 0.38 K 0.02 R 0.02 H 0.01 E 0.01 I 0.01 M 0.01 C Shift Assignments>> C :: 176.478 CA :: 62.274(D) CB :: 32.346 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.594 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.M288 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.27 Q 0.27 K 0.2 E 0.1 H 0.04 R 0.03 Y 0.01 V 0.01 C Shift Assignments>> C :: 174.553 CA :: 56.009(D) CB :: 34.454 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.085(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 115.080(D) Ave N Shift Values>> N :: 120.09(3.57) 1.R289 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.31 Q 0.28 K 0.2 H 0.06 R 0.05 E 0.03 C Shift Assignments>> C :: 173.649 CA :: 54.710(D) CB :: 33.950 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.023(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.500(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.I290 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.3 Y 0.24 K 0.17 L 0.1 I 0.09 D 0.05 R 0.01 C Shift Assignments>> C :: 172.580 CA :: 58.697(D) CB :: 41.138 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.187(D) HA :: 5.473 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.214(D) Ave N Shift Values>> N :: 121.46(4.28) 1.T291 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.A279 1.A279 C Shift Assignments>> C :: 173.465 CA :: 61.351(D) CB :: 70.809 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.381(D) HA :: 4.944 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 122.090(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V292 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.56 P 0.25 K 0.05 R 0.03 M 0.02 H 0.02 Q 0.02 E 0.01 C Shift Assignments>> C :: 173.144 CA :: 61.736(D) CB :: 32.731 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.794(D) HA :: 4.528 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 127.059(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I293 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.33 Y 0.31 I 0.29 L 0.02 K 0.02 D 0.01 HN Overlap>> 1.I173 1.I173 C Shift Assignments>> C :: 173.300 CA :: 60.119(D) CB :: 40.235 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.566(D) HA :: 4.563 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.026(D) Ave N Shift Values>> N :: 121.46(4.28) 1.A294 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.96 L 0.01 C Shift Assignments>> C :: 174.781 CA :: 49.858(D) CB :: 20.583 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.393(D) HA :: 5.061 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 129.130(D) Ave N Shift Values>> N :: 123.23(3.54) 1.I295 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.36 Y 0.15 I 0.14 M 0.08 F 0.08 K 0.06 V 0.04 Q 0.03 C Shift Assignments>> C :: 176.657 CA :: 59.109(D) CB :: 36.020 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.623(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.912(D) Ave N Shift Values>> N :: 121.46(4.28) 1.M296 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.25 R 0.22 Q 0.17 M 0.15 E 0.11 K 0.07 HN Overlap>> 1.Y39 1.Y39 C Shift Assignments>> C :: 179.821 CA :: 53.477(D) CB :: 30.400 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.053(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.942(D) Ave N Shift Values>> N :: 120.09(3.57) 1.E297 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.22 R 0.2 H 0.18 Q 0.14 K 0.08 M 0.08 V 0.03 I 0.03 C Shift Assignments>> C :: 174.669 CA :: 58.300(D) CB :: 30.395 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.462(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.991(D) Ave N Shift Values>> N :: 120.67(3.48) 1.D298 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.49 D 0.27 L 0.08 F 0.06 Y 0.06 C Shift Assignments>> C :: 176.698 CA :: 52.712(D) CB :: 39.552 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.907(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.534(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L299 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.34 Y 0.2 F 0.13 M 0.1 N 0.08 I 0.05 K 0.03 D 0.01 HN Overlap>> 1.V342 1.V342 C Shift Assignments>> C :: 175.656 CA :: 56.422(D) CB :: 36.936 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.287(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 113.258(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D300 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.36 L 0.22 N 0.15 K 0.08 F 0.08 Y 0.06 R 0.01 C Shift Assignments>> C :: 175.087 CA :: 53.739(D) CB :: 41.092 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.657(D) HA :: 4.618 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.405(D) Ave N Shift Values>> N :: 120.65(3.86) 1.I301 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.35 Y 0.3 F 0.3 L 0.01 HN Overlap>> 1.D323 1.D323 C Shift Assignments>> C :: 175.547 CA :: 60.305(D) CB :: 39.625 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.019(D) HA :: 4.775 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.114(D) Ave N Shift Values>> N :: 121.46(4.28) 1.L302 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.65 L 0.22 R 0.05 D 0.04 F 0.01 C Shift Assignments>> C :: 175.034 CA :: 53.256(D) CB :: 44.779 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.178(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 129.370(D) Ave N Shift Values>> N :: 121.86(3.9) 1.S303 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.74 T 0.25 C Shift Assignments>> C :: 173.537 CA :: 56.425(D) CB :: 66.961 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.385(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.915(D) Ave N Shift Values>> N :: 116.28(3.52) 1.K304 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.3 M 0.22 Q 0.14 K 0.14 Y 0.06 F 0.02 H 0.01 I 0.01 V 0.01 R 0.01 N 0.01 C Shift Assignments>> CA :: 56.637(D) CB :: 35.319 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.564(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 122.383(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G305 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.77 L 0.14 R 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 172.543 CA :: 44.999(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.620(D) HA2 :: 3.883 HA3 :: 4.513 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.117(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K306 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.33 Y 0.17 N 0.14 M 0.11 F 0.11 K 0.03 I 0.03 D 0.02 Q 0.01 HN Overlap>> 1.Q179 1.Q179 C Shift Assignments>> C :: 172.912 CA :: 55.773(D) CB :: 36.839 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.591(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.973(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K307 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.34 Q 0.24 K 0.16 E 0.09 N 0.04 H 0.04 R 0.03 Y 0.01 C Shift Assignments>> C :: 174.978 CA :: 53.910(D) CB :: 34.642 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.119(D) HA :: 5.185 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.550(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F308 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.21 K 0.21 F 0.18 D 0.17 Y 0.14 R 0.03 N 0.02 I 0.01 HN Overlap>> 1.R338 1.R338 C Shift Assignments>> C :: 175.578 CA :: 56.499(D) CB :: 41.334 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.192(D) HB3 :: 2.895 HD1 :: 7.280 HD2 :: 7.280 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 124.855(D) Ave N Shift Values>> N :: 120.45(4.18) 1.K309 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H310 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> N 0.23 A 0.19 D 0.15 L 0.09 M 0.07 H 0.05 R 0.04 Q 0.04 K 0.03 F 0.02 E 0.02 Y 0.01 C Shift Assignments>> C :: 174.450 CA :: 53.717(D) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) 1.G311 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.7 L 0.18 R 0.06 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.074 CA :: 44.814(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.338(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.027(D) Ave N Shift Values>> N :: 109.67(3.87) 1.I312 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.35 F 0.29 I 0.26 E 0.03 L 0.01 D 0.01 C Shift Assignments>> C :: 175.994 CA :: 59.112(D) CB :: 38.519 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.461(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.935(D) Ave N Shift Values>> N :: 121.46(4.28) 1.S313 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.135 CA :: 57.492(D) CB :: 64.467 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.823(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 126.315(D) Ave N Shift Values>> N :: 116.28(3.52) 1.I314 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.73 V 0.18 Y 0.04 F 0.02 C Shift Assignments>> C :: 174.521 CA :: 64.355(D) CB :: 36.536 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.739(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.208(D) Ave N Shift Values>> N :: 121.46(4.28) 1.D315 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.25 Y 0.24 D 0.2 L 0.14 N 0.08 I 0.03 K 0.02 C Shift Assignments>> C :: 179.145 CA :: 56.294(D) CB :: 39.989 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.521(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.092(D) Ave N Shift Values>> N :: 120.65(3.86) 1.N316 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.4 Y 0.17 D 0.15 F 0.15 L 0.05 E 0.03 M 0.02 I 0.01 C Shift Assignments>> C :: 176.969 CA :: 54.665(D) CB :: 38.404 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.312(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 117.190(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A317 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.67 A 0.28 I 0.04 C Shift Assignments>> C :: 179.530 CA :: 55.239(D) CB :: 17.375 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.621(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.369(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Y318 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.27 Y 0.25 I 0.2 F 0.16 M 0.04 K 0.01 V 0.01 C Shift Assignments>> C :: 178.810 CA :: 58.867(D) CB :: 37.008 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.510(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 113.639(D) Ave N Shift Values>> N :: 120.52(4.2) 1.K319 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.18 K 0.17 H 0.15 E 0.15 M 0.15 V 0.08 Q 0.07 C Shift Assignments>> C :: 178.574 CA :: 58.445(D) CB :: 31.627 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.200(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.454(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V320 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.48 V 0.48 I 0.02 C Shift Assignments>> C :: 178.301 CA :: 64.905(D) CB :: 31.578 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.344(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.665(D) Ave N Shift Values>> N :: 121.14(4.54) 1.A321 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.56 M 0.4 I 0.01 HN Overlap>> 1.V80 1.V80 C Shift Assignments>> C :: 178.677 CA :: 54.511(D) CB :: 18.429 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.896(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.618(D) Ave N Shift Values>> N :: 123.23(3.54) 1.E322 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.3 K 0.14 R 0.13 Q 0.12 E 0.12 H 0.09 L 0.03 P 0.01 M 0.01 C Shift Assignments>> C :: 177.630 CA :: 59.650(D) CB :: 28.151 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.627(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.385(D) Ave N Shift Values>> N :: 120.67(3.48) 1.D323 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.33 Y 0.32 D 0.1 L 0.09 I 0.09 N 0.03 K 0.01 HN Overlap>> 1.I301 1.I301 C Shift Assignments>> C :: 179.484 CA :: 57.501(D) CB :: 39.790 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.946(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.033(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L324 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.27 Y 0.23 L 0.15 K 0.14 D 0.11 I 0.05 N 0.01 R 0.01 C Shift Assignments>> C :: 178.431 CA :: 57.545(D) CB :: 40.881 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.414(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.545(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L325 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.23 K 0.22 Y 0.18 L 0.16 D 0.09 I 0.03 R 0.03 HN Overlap>> 1.I276 1.L201 1.I276 1.L201 1.N53 1.A236 1.N53 1.A236 C Shift Assignments>> C :: 178.265 CA :: 57.632(D) CB :: 41.349 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.425(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.064(D) Ave N Shift Values>> N :: 121.86(3.9) 1.R326 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.26 E 0.16 K 0.15 H 0.11 R 0.11 Q 0.1 V 0.04 M 0.02 C Shift Assignments>> C :: 179.404 CA :: 60.203(D) CB :: 29.219 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.482(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.107(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.E327 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.22 K 0.18 E 0.16 Q 0.14 H 0.12 R 0.1 L 0.01 M 0.01 V 0.01 C Shift Assignments>> C :: 180.350 CA :: 59.384(D) CB :: 28.616 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.021(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.587(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L328 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.32 Y 0.27 L 0.11 K 0.1 I 0.09 D 0.07 C Shift Assignments>> C :: 178.348 CA :: 58.213(D) CB :: 40.714 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.335(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.348(D) Ave N Shift Values>> N :: 121.86(3.9) 1.L329 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.27 F 0.2 Y 0.17 L 0.17 N 0.12 K 0.03 I 0.01 C Shift Assignments>> C :: 178.205 CA :: 55.579(D) CB :: 40.203 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.645(D) HA :: 4.517 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 115.884(D) Ave N Shift Values>> N :: 121.86(3.9) 1.V330 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.51 V 0.42 I 0.04 C Shift Assignments>> C :: 176.800 CA :: 64.313(D) CB :: 31.263 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.556(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.925(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R331 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.19 K 0.19 Q 0.18 H 0.16 R 0.14 I 0.05 M 0.04 C Shift Assignments>> C :: 176.786 CA :: 57.868(D) CB :: 29.327 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.502(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 120.171(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.D332 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.33 L 0.29 K 0.11 R 0.08 N 0.07 F 0.04 Y 0.03 G 0.01 C Shift Assignments>> CA :: 52.787(D) CB :: 42.196 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.910(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.701(D) Ave N Shift Values>> N :: 120.65(3.86) 1.K333 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> Q 0.12 H 0.12 R 0.11 K 0.1 M 0.1 E 0.08 L 0.08 F 0.06 Y 0.06 D 0.04 S 0.03 N 0.01 A 0.01 C Shift Assignments>> C :: 176.807 CA :: 56.570(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) 1.R334 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.25 M 0.23 Q 0.19 R 0.11 H 0.1 E 0.05 V 0.03 HN Overlap>> 1.I161 1.K234 1.I161 1.K234 C Shift Assignments>> C :: 176.536 CA :: 56.853(D) CB :: 32.949 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.358(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.412(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.R335 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.25 M 0.23 Q 0.2 R 0.11 H 0.09 E 0.05 V 0.03 C Shift Assignments>> C :: 175.743 CA :: 56.981(D) CB :: 33.050 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.551(D) HA :: 4.372 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.114(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.N336 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.42 D 0.34 L 0.11 F 0.05 Y 0.04 C Shift Assignments>> C :: 174.580 CA :: 51.994(D) CB :: 40.250 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.019(D) HA :: 4.561 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.526(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V337 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.48 V 0.41 I 0.03 R 0.01 E 0.01 K 0.01 H 0.01 C Shift Assignments>> C :: 173.655 CA :: 62.867(D) CB :: 31.477 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.487(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.770(D) Ave N Shift Values>> N :: 121.14(4.54) 1.R338 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.28 M 0.27 K 0.23 R 0.07 H 0.07 E 0.03 V 0.02 HN Overlap>> 1.F308 1.F308 C Shift Assignments>> C :: 175.714 CA :: 56.190(D) CB :: 33.703 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.229(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 124.800(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.R339 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.34 Q 0.24 K 0.19 H 0.09 R 0.08 E 0.02 C Shift Assignments>> C :: 173.010 CA :: 53.730(D) CB :: 33.397 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.388(D) HA :: 5.162 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.221(D) Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.I340 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.33 L 0.33 D 0.09 G 0.07 F 0.06 K 0.04 Y 0.03 C Shift Assignments>> C :: 172.478 CA :: 55.679(D) CB :: 43.547 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.966(D) HA :: 5.552 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.087(D) Ave N Shift Values>> N :: 121.46(4.28) 1.G341 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.71 L 0.17 R 0.05 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 171.298 CA :: 44.852(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.290(D) HA2 :: 4.771 HA3 :: 3.489 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.156(D) Ave N Shift Values>> N :: 109.67(3.87) 1.V342 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.37 M 0.13 Y 0.1 K 0.1 I 0.07 Q 0.07 F 0.05 V 0.04 H 0.01 HN Overlap>> 1.L299 1.L299 C Shift Assignments>> C :: 173.303 CA :: 58.476(D) CB :: 35.619 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.316(D) HA :: 5.311 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 113.204(D) Ave N Shift Values>> N :: 121.14(4.54) 1.K343 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.28 M 0.25 N 0.14 K 0.09 Q 0.08 Y 0.06 F 0.03 H 0.01 C Shift Assignments>> C :: 175.291 CA :: 54.555(D) CB :: 35.794 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.732(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.029(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L344 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.35 L 0.28 K 0.11 N 0.09 R 0.06 F 0.05 Y 0.03 C Shift Assignments>> C :: 174.817 CA :: 52.698(D) CB :: 42.035 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.002(D) HA :: 5.061 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 128.634(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D345 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.57 L 0.25 R 0.08 D 0.06 F 0.01 HN Overlap>> 1.K208 1.K208 C Shift Assignments>> C :: 174.241 CA :: 52.937(D) CB :: 44.497 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.563(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.640(D) Ave N Shift Values>> N :: 120.65(3.86) 1.N346 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I347 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I348 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I349 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N350 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K351 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T352 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N353 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L354 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S355 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D356 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.F357 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.F358 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D359 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I360 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable ########################################################################### Overall Results: #Consistent: 58 #Clerical: 301 #Suspicious: 1 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 305 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 55 Shift Relative Order (SRO) Results: #Consistent: 360 #Suspicious: 0 C Shift Results: #Consistent: 564 #Duplicate: 304 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 66 #Duplicate: 274 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 2 #Duplicate: 274 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 Error Summary: 1.I8 CA = 61.859(D), Expected = 61.61, Std = 2.6800, ChiSquare = 9.2597e-01 1.I8 H = 8.349(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.1918e-01 1.I8 N = 120.228(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.7346e-01 1.V9 CA = 59.915(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.6793e-01 1.V9 H = 8.378(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.9550e-01 1.V9 N = 126.351(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.5105e-01 1.I10 CA = 60.393(D), Expected = 61.61, Std = 2.6800, ChiSquare = 6.4975e-01 1.I10 H = 9.064(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.4893e-01 1.I10 N = 128.876(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.3147e-02 1.F11 H = 8.274(D), Expected = 8.36, Std = 0.7200, ChiSquare = 9.0492e-01 1.F11 N = 126.808(D), Expected = 120.45, Std = 4.1800, ChiSquare = 1.2825e-01 1.V12 CA = 60.562(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.0023e-01 1.D13 CA = 50.676(D), Expected = 54.69, Std = 2.0300, ChiSquare = 4.8003e-02 1.D13 H = 8.419(D), Expected = 8.31, Std = 0.5800, ChiSquare = 8.5093e-01 1.D13 N = 125.213(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.3716e-01 1.F14 CA = 53.518(D), Expected = 58.08, Std = 2.5700, ChiSquare = 7.5882e-02 1.F14 H = 8.365(D), Expected = 8.36, Std = 0.7200, ChiSquare = 9.9446e-01 1.F14 N = 125.096(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.6636e-01 1.D15 CA = 55.549(D), Expected = 54.69, Std = 2.0300, ChiSquare = 6.7218e-01 1.D15 H = 7.437(D), Expected = 8.31, Std = 0.5800, ChiSquare = 1.3228e-01 1.D15 N = 122.801(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.7735e-01 1.Y16 CA = 56.336(D), Expected = 58.13, Std = 2.5100, ChiSquare = 4.7477e-01 1.Y16 H = 8.872(D), Expected = 8.32, Std = 0.7300, ChiSquare = 4.4955e-01 1.Y16 N = 121.525(D), Expected = 120.52, Std = 4.2000, ChiSquare = 8.1088e-01 1.F17 CA = 61.571(D), Expected = 58.08, Std = 2.5700, ChiSquare = 1.7435e-01 1.F17 H = 8.019(D), Expected = 8.36, Std = 0.7200, ChiSquare = 6.3578e-01 1.F17 N = 117.874(D), Expected = 120.45, Std = 4.1800, ChiSquare = 5.3772e-01 1.F18 CA = 56.697(D), Expected = 58.08, Std = 2.5700, ChiSquare = 5.9049e-01 1.F18 H = 8.777(D), Expected = 8.36, Std = 0.7200, ChiSquare = 5.6248e-01 1.F18 N = 114.325(D), Expected = 120.45, Std = 4.1800, ChiSquare = 1.4284e-01 1.A19 CA = 53.698(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.7808e-01 1.A19 H = 6.868(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.6419e-02 1.A19 N = 114.091(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.8333e-03 1.Q20 CA = 59.729(D), Expected = 56.57, Std = 2.1400, ChiSquare = 1.3990e-01 1.Q20 H = 8.222(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.9730e-01 1.Q20 N = 118.925(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.8866e-01 1.V21 CA = 66.284(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.8465e-01 1.V21 H = 8.131(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.1241e-01 1.V21 N = 117.541(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.2793e-01 1.E22 H = 7.116(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.9626e-02 1.E22 N = 115.232(D), Expected = 120.67, Std = 3.4800, ChiSquare = 1.1814e-01 1.E23 CA = 58.898(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.5023e-01 1.E23 H = 7.910(D), Expected = 8.33, Std = 0.5900, ChiSquare = 4.7655e-01 1.E23 N = 119.115(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.5499e-01 1.V24 CA = 65.394(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.0992e-01 1.V24 H = 8.120(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.9970e-01 1.V24 N = 119.437(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.0758e-01 1.L25 CA = 55.816(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.2668e-01 1.L25 H = 8.036(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.6535e-01 1.L25 N = 117.617(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.7662e-01 1.N26 CA = 50.438(D), Expected = 53.54, Std = 1.8800, ChiSquare = 9.8943e-02 1.N26 H = 7.545(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.0698e-01 1.N26 N = 116.272(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.0954e-01 1.P27 CA = 64.345(D), Expected = 63.33, Std = 1.5200, ChiSquare = 5.0428e-01 1.Q28 CA = 57.305(D), Expected = 56.57, Std = 2.1400, ChiSquare = 7.3125e-01 1.Q28 H = 8.957(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.1161e-01 1.Q28 N = 118.828(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.6799e-01 1.Y29 CA = 54.411(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.3843e-01 1.Y29 H = 8.545(D), Expected = 8.32, Std = 0.7300, ChiSquare = 7.5792e-01 1.Y29 N = 120.008(D), Expected = 120.52, Std = 4.2000, ChiSquare = 9.0297e-01 1.K30 CA = 58.079(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.0782e-01 1.K30 H = 7.352(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.6251e-01 1.K30 N = 117.817(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.9114e-01 1.G31 CA = 44.786(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.7383e-01 1.G31 H = 9.310(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.3163e-01 1.G31 N = 114.132(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.4892e-01 1.K32 H = 7.963(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.0518e-01 1.K32 N = 120.827(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.5283e-01 1.P33 CA = 62.598(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.3010e-01 1.L34 CA = 54.191(D), Expected = 55.62, Std = 2.1300, ChiSquare = 5.0229e-01 1.L34 H = 8.141(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.9109e-01 1.L34 N = 128.353(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.5938e-02 1.V35 CA = 60.506(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.8787e-01 1.V35 H = 9.002(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.8792e-01 1.V35 N = 126.469(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.4048e-01 1.V36 CA = 60.750(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.4293e-01 1.V36 H = 8.696(D), Expected = 8.29, Std = 0.6700, ChiSquare = 5.4453e-01 1.V36 N = 127.165(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.8448e-01 1.S37 CA = 57.531(D), Expected = 58.72, Std = 2.0700, ChiSquare = 5.6570e-01 1.S37 H = 9.433(D), Expected = 8.28, Std = 0.5900, ChiSquare = 5.0673e-02 1.S37 N = 125.492(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.8695e-03 1.V38 CA = 60.345(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.5325e-01 1.V38 H = 8.927(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.4173e-01 1.V38 N = 121.175(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.9385e-01 1.Y39 H = 9.067(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.0617e-01 1.Y39 N = 124.032(D), Expected = 120.52, Std = 4.2000, ChiSquare = 4.0305e-01 1.G47 CA = 44.822(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.9356e-01 1.A48 CA = 50.197(D), Expected = 53.14, Std = 1.9800, ChiSquare = 1.3718e-01 1.A48 H = 8.686(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.1794e-01 1.A48 N = 124.129(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.9953e-01 1.V49 CA = 63.351(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.6338e-01 1.V49 H = 8.745(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.9707e-01 1.V49 N = 120.253(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.4510e-01 1.A50 CA = 53.585(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.2218e-01 1.A50 H = 9.945(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.6336e-03 1.A50 N = 133.652(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.2393e-03 1.T51 CA = 61.400(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.5155e-01 1.T51 H = 7.739(D), Expected = 8.24, Std = 0.6200, ChiSquare = 4.1905e-01 1.T51 N = 109.379(D), Expected = 115.42, Std = 4.7500, ChiSquare = 2.0345e-01 1.A52 CA = 49.369(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.6839e-02 1.N53 CA = 50.493(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.0507e-01 1.N53 H = 8.360(D), Expected = 8.34, Std = 0.6300, ChiSquare = 9.7467e-01 1.N53 N = 119.049(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.7644e-01 1.Y54 CA = 62.290(D), Expected = 58.13, Std = 2.5100, ChiSquare = 9.7445e-02 1.Y54 H = 7.847(D), Expected = 8.32, Std = 0.7300, ChiSquare = 5.1702e-01 1.Y54 N = 119.189(D), Expected = 120.52, Std = 4.2000, ChiSquare = 7.5132e-01 1.E55 CA = 60.096(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.8410e-01 1.E55 H = 8.795(D), Expected = 8.33, Std = 0.5900, ChiSquare = 4.3062e-01 1.E55 N = 118.858(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.0258e-01 1.A56 CA = 54.234(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.8059e-01 1.A56 H = 7.761(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.6437e-01 1.A56 N = 119.626(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.0864e-01 1.R57 H = 8.622(D), Expected = 8.24, Std = 0.6100, ChiSquare = 5.3116e-01 1.R57 N = 121.104(D), Expected = 120.80, Std = 3.6800, ChiSquare = 9.3416e-01 1.K58 H = 8.045(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.0904e-01 1.K58 N = 120.945(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.7778e-01 1.L59 CA = 54.873(D), Expected = 55.62, Std = 2.1300, ChiSquare = 7.2581e-01 1.L59 H = 6.938(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.6846e-02 1.L59 N = 116.393(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.6098e-01 1.G60 CA = 44.016(D), Expected = 45.35, Std = 1.3400, ChiSquare = 3.1948e-01 1.G60 H = 7.609(D), Expected = 8.33, Std = 0.6500, ChiSquare = 2.6733e-01 1.G60 N = 103.186(D), Expected = 109.67, Std = 3.8700, ChiSquare = 9.3846e-02 1.V61 CA = 63.652(D), Expected = 62.49, Std = 2.8600, ChiSquare = 6.8453e-01 1.V61 H = 7.315(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.4561e-01 1.V61 N = 119.952(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.9357e-01 1.K62 CA = 53.661(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.3491e-01 1.K62 H = 7.044(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.6133e-02 1.K62 N = 123.903(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.4919e-01 1.A63 CA = 53.267(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.4886e-01 1.G64 CA = 44.643(D), Expected = 45.35, Std = 1.3400, ChiSquare = 5.9777e-01 1.G64 H = 9.005(D), Expected = 8.33, Std = 0.6500, ChiSquare = 2.9906e-01 1.G64 N = 111.260(D), Expected = 109.67, Std = 3.8700, ChiSquare = 6.8118e-01 1.M65 CA = 54.185(D), Expected = 56.11, Std = 2.2300, ChiSquare = 3.8801e-01 1.M65 H = 7.623(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.8839e-01 1.M65 N = 122.099(D), Expected = 120.09, Std = 3.5700, ChiSquare = 5.7361e-01 1.I67 H = 8.405(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.5415e-01 1.I67 N = 128.063(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.2289e-01 1.I68 CA = 63.417(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.0015e-01 1.I68 H = 8.355(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.1218e-01 1.I68 N = 117.193(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.1878e-01 1.K69 CA = 57.136(D), Expected = 56.95, Std = 2.2000, ChiSquare = 9.3262e-01 1.K69 H = 6.716(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.4023e-02 1.K69 N = 119.799(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.4002e-01 1.A70 CA = 55.173(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.0453e-01 1.A70 H = 7.995(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.3260e-01 1.A70 N = 123.454(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.4955e-01 1.M71 CA = 58.251(D), Expected = 56.11, Std = 2.2300, ChiSquare = 3.3701e-01 1.M71 H = 8.403(D), Expected = 8.26, Std = 0.6000, ChiSquare = 8.1162e-01 1.M71 N = 114.112(D), Expected = 120.09, Std = 3.5700, ChiSquare = 9.4030e-02 1.Q72 CA = 57.585(D), Expected = 56.57, Std = 2.1400, ChiSquare = 6.3529e-01 1.Q72 H = 7.233(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.4351e-02 1.Q72 N = 116.312(D), Expected = 119.89, Std = 3.6000, ChiSquare = 3.2028e-01 1.I73 CA = 62.358(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.8016e-01 1.I73 H = 7.365(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.7844e-01 1.I73 N = 115.284(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.4902e-01 1.A74 CA = 49.245(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.9163e-02 1.A74 H = 8.701(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.0372e-01 1.A74 N = 122.475(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.3111e-01 1.S76 CA = 57.307(D), Expected = 58.72, Std = 2.0700, ChiSquare = 4.9485e-01 1.S76 N = 129.293(S), Expected = 116.28, Std = 3.5200, ChiSquare = 2.1827e-04 1.A77 CA = 51.207(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.2893e-01 1.A77 H = 7.043(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.3814e-02 1.A77 N = 122.570(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.5210e-01 1.I78 CA = 59.981(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.4330e-01 1.I78 H = 8.038(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.2193e-01 1.I78 N = 120.604(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.4148e-01 1.Y79 CA = 57.052(D), Expected = 58.13, Std = 2.5100, ChiSquare = 6.6757e-01 1.Y79 H = 8.380(D), Expected = 8.32, Std = 0.7300, ChiSquare = 9.3449e-01 1.Y79 N = 126.860(D), Expected = 120.52, Std = 4.2000, ChiSquare = 1.3116e-01 1.V80 CA = 57.012(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.5444e-02 1.V80 H = 8.903(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.6023e-01 1.V80 N = 119.626(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.3877e-01 1.P81 CA = 61.411(D), Expected = 63.33, Std = 1.5200, ChiSquare = 2.0677e-01 1.M82 CA = 56.583(D), Expected = 56.11, Std = 2.2300, ChiSquare = 8.3202e-01 1.M82 H = 8.239(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.7208e-01 1.M82 N = 119.106(D), Expected = 120.09, Std = 3.5700, ChiSquare = 7.8283e-01 1.R83 CA = 53.431(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.4833e-01 1.R83 H = 7.421(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.7939e-01 1.R83 N = 127.385(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.3550e-02 1.K84 CA = 60.968(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.7796e-02 1.K84 H = 8.190(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.0000e+00 1.K84 N = 121.595(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.8506e-01 1.P85 CA = 65.726(D), Expected = 63.33, Std = 1.5200, ChiSquare = 1.1495e-01 1.I86 CA = 62.575(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.1879e-01 1.I86 H = 6.826(D), Expected = 8.28, Std = 0.6800, ChiSquare = 3.2498e-02 1.I86 N = 117.157(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.1472e-01 1.Y87 CA = 57.318(D), Expected = 58.13, Std = 2.5100, ChiSquare = 7.4631e-01 1.Y87 H = 6.876(D), Expected = 8.32, Std = 0.7300, ChiSquare = 4.7919e-02 1.Y87 N = 122.193(D), Expected = 120.52, Std = 4.2000, ChiSquare = 6.9038e-01 1.E88 CA = 59.496(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.9781e-01 1.E88 H = 8.959(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.8638e-01 1.E88 N = 119.054(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.4238e-01 1.A89 CA = 55.132(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.1439e-01 1.A89 H = 7.693(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.9811e-01 1.A89 N = 122.529(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.4303e-01 1.F90 CA = 61.222(D), Expected = 58.08, Std = 2.5700, ChiSquare = 2.2149e-01 1.F90 H = 8.236(D), Expected = 8.36, Std = 0.7200, ChiSquare = 8.6326e-01 1.F90 N = 118.754(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.8493e-01 1.S91 CA = 61.322(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.0875e-01 1.S91 H = 8.908(D), Expected = 8.28, Std = 0.5900, ChiSquare = 2.8714e-01 1.S91 N = 111.903(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.1370e-01 1.N92 CA = 56.444(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.2242e-01 1.N92 H = 8.801(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.6432e-01 1.N92 N = 116.470(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.4158e-01 1.R93 CA = 60.353(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.2088e-01 1.R93 H = 7.723(D), Expected = 8.24, Std = 0.6100, ChiSquare = 3.9669e-01 1.R93 N = 117.667(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.9457e-01 1.I94 CA = 65.472(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.4957e-01 1.I94 H = 8.079(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.6754e-01 1.I94 N = 121.090(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.3111e-01 1.M95 CA = 57.799(D), Expected = 56.11, Std = 2.2300, ChiSquare = 4.4881e-01 1.M95 H = 9.427(D), Expected = 8.26, Std = 0.6000, ChiSquare = 5.1775e-02 1.M95 N = 118.622(D), Expected = 120.09, Std = 3.5700, ChiSquare = 6.8092e-01 1.N96 CA = 55.905(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.0840e-01 1.N96 H = 7.853(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.3951e-01 1.N96 N = 116.412(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.3209e-01 1.L97 CA = 57.788(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.0875e-01 1.L97 H = 7.590(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.2481e-01 1.L97 N = 122.049(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.6135e-01 1.L98 CA = 57.181(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.6364e-01 1.L98 H = 8.170(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.2645e-01 1.L98 N = 117.182(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.3034e-01 1.N99 CA = 55.990(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.9251e-01 1.N99 H = 7.876(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.6142e-01 1.N99 N = 115.324(D), Expected = 118.93, Std = 4.0300, ChiSquare = 3.7090e-01 1.K100 CA = 57.278(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.8148e-01 1.K100 H = 7.224(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.0740e-01 1.K100 N = 114.343(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.5232e-02 1.H101 CA = 56.173(D), Expected = 56.52, Std = 2.3100, ChiSquare = 8.8059e-01 1.H101 H = 7.407(D), Expected = 8.24, Std = 0.6800, ChiSquare = 2.2058e-01 1.H101 N = 116.706(D), Expected = 119.69, Std = 4.0000, ChiSquare = 4.5567e-01 1.A102 CA = 50.746(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.2663e-01 1.A102 H = 7.072(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.0108e-02 1.A102 N = 116.638(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.2583e-02 1.D103 C = 177.179(D), Expected = 176.40, Std = 1.7500, ChiSquare = 6.5622e-01 1.D103 CA = 56.674(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.2840e-01 1.D103 CB = 40.987(D), Expected = 40.88, Std = 1.6200, ChiSquare = 9.4734e-01 1.D103 H = 8.845(D), Expected = 8.31, Std = 0.5800, ChiSquare = 3.5631e-01 1.D103 N = 121.098(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.0760e-01 1.K104 C = 174.066(D), Expected = 176.64, Std = 2.0000, ChiSquare = 1.9809e-01 1.K104 CA = 54.985(D), Expected = 56.95, Std = 2.2000, ChiSquare = 3.7176e-01 1.K104 CB = 35.700(D), Expected = 32.79, Std = 1.7800, ChiSquare = 1.0208e-01 1.K104 H = 7.535(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.7498e-01 1.K104 N = 114.850(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.0006e-01 1.I105 CA = 58.614(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.6361e-01 1.I105 H = 8.635(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.0163e-01 1.I105 N = 122.064(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.8777e-01 1.E106 C = 175.448(D), Expected = 176.87, Std = 1.9500, ChiSquare = 4.6586e-01 1.E106 CA = 54.187(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.3386e-01 1.E106 CB = 32.457(D), Expected = 30.01, Std = 1.7200, ChiSquare = 1.5483e-01 1.E106 H = 9.338(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.7548e-02 1.E106 N = 128.621(D), Expected = 120.67, Std = 3.4800, ChiSquare = 2.2326e-02 1.V107 C = 175.565(D), Expected = 175.62, Std = 1.9000, ChiSquare = 9.7691e-01 1.V107 CA = 63.054(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.4367e-01 1.V107 CB = 30.273(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.6987e-01 1.V107 H = 8.863(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.9243e-01 1.V107 N = 128.948(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.5465e-02 1.A108 C = 177.315(D), Expected = 177.74, Std = 2.1300, ChiSquare = 8.4185e-01 1.A108 CA = 53.097(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.8267e-01 1.A108 CB = 19.755(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.8393e-01 1.A108 H = 8.298(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.7026e-01 1.A108 N = 133.133(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.1507e-03 1.S109 CA = 56.566(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.9807e-01 1.S109 CB = 63.968(D), Expected = 63.80, Std = 1.4800, ChiSquare = 9.0962e-01 1.S109 H = 8.508(D), Expected = 8.28, Std = 0.5900, ChiSquare = 6.9917e-01 1.S109 N = 112.467(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.7870e-01 1.I110 CA = 62.650(D), Expected = 61.61, Std = 2.6800, ChiSquare = 6.9797e-01 1.D111 CA = 50.493(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.8688e-02 1.D111 H = 8.018(D), Expected = 8.31, Std = 0.5800, ChiSquare = 6.1465e-01 1.D111 N = 116.302(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.5999e-01 1.E112 CA = 54.391(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.6108e-01 1.E112 H = 6.436(D), Expected = 8.33, Std = 0.5900, ChiSquare = 1.3266e-03 1.E112 N = 113.689(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.4853e-02 1.A113 CA = 50.635(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.0582e-01 1.A113 H = 8.187(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.8271e-01 1.A113 N = 121.877(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.0231e-01 1.Y114 C = 175.158(D), Expected = 175.40, Std = 1.9900, ChiSquare = 9.0321e-01 1.Y114 CA = 56.742(D), Expected = 58.13, Std = 2.5100, ChiSquare = 5.8027e-01 1.Y114 CB = 41.135(D), Expected = 39.32, Std = 2.1600, ChiSquare = 4.0075e-01 1.Y114 H = 9.054(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.1467e-01 1.Y114 N = 115.993(D), Expected = 120.52, Std = 4.2000, ChiSquare = 2.8110e-01 1.L115 C = 175.409(D), Expected = 176.99, Std = 1.9800, ChiSquare = 4.2459e-01 1.L115 CA = 53.912(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.2262e-01 1.L115 H = 10.143(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.2497e-03 1.L115 N = 124.529(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.9375e-01 1.D116 CA = 53.285(D), Expected = 54.69, Std = 2.0300, ChiSquare = 4.8886e-01 1.D116 CB = 41.377(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.5900e-01 1.D116 H = 8.690(D), Expected = 8.31, Std = 0.5800, ChiSquare = 5.1236e-01 1.D116 N = 123.528(D), Expected = 120.65, Std = 3.8600, ChiSquare = 4.5591e-01 1.V117 H = 8.294(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.9524e-01 1.V117 N = 118.255(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.2513e-01 1.N119 CA = 55.667(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.5789e-01 1.K120 CA = 57.899(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.6620e-01 1.K120 H = 9.191(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.5250e-02 1.K120 N = 126.708(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.3341e-01 1.V121 CA = 59.297(D), Expected = 62.49, Std = 2.8600, ChiSquare = 2.6424e-01 1.V121 H = 7.629(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.2386e-01 1.V121 N = 106.600(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.3617e-03 1.E122 CA = 56.665(D), Expected = 57.32, Std = 2.0900, ChiSquare = 7.5398e-01 1.E122 H = 8.194(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.1770e-01 1.E122 N = 122.018(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.9849e-01 1.G123 CA = 45.853(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.0738e-01 1.G123 H = 8.799(D), Expected = 8.33, Std = 0.6500, ChiSquare = 4.7058e-01 1.G123 N = 103.175(D), Expected = 109.67, Std = 3.8700, ChiSquare = 9.3290e-02 1.N124 CA = 52.277(D), Expected = 53.54, Std = 1.8800, ChiSquare = 5.0171e-01 1.N124 H = 7.560(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.1568e-01 1.N124 N = 119.757(D), Expected = 118.93, Std = 4.0300, ChiSquare = 8.3741e-01 1.F125 CA = 62.757(D), Expected = 58.08, Std = 2.5700, ChiSquare = 6.8783e-02 1.E126 CA = 59.114(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.9069e-01 1.E126 H = 8.153(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.6418e-01 1.E126 N = 116.282(D), Expected = 120.67, Std = 3.4800, ChiSquare = 2.0734e-01 1.N127 CA = 54.575(D), Expected = 53.54, Std = 1.8800, ChiSquare = 5.8195e-01 1.N127 H = 8.031(D), Expected = 8.34, Std = 0.6300, ChiSquare = 6.2380e-01 1.N127 N = 119.168(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.5291e-01 1.G128 CA = 47.212(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.6466e-01 1.G128 H = 8.284(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.4358e-01 1.G128 N = 111.571(D), Expected = 109.67, Std = 3.8700, ChiSquare = 6.2327e-01 1.I129 CA = 65.542(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.4233e-01 1.I129 H = 7.788(D), Expected = 8.28, Std = 0.6800, ChiSquare = 4.6935e-01 1.I129 N = 122.176(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.6714e-01 1.E130 CA = 58.515(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.6748e-01 1.E130 H = 7.404(D), Expected = 8.33, Std = 0.5900, ChiSquare = 1.1653e-01 1.E130 N = 117.848(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.1741e-01 1.L131 CA = 57.174(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.6565e-01 1.L131 H = 8.007(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.3154e-01 1.L131 N = 121.494(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.2523e-01 1.A132 CA = 55.217(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.9418e-01 1.A132 H = 7.979(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.1262e-01 1.A132 N = 121.821(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.9061e-01 1.R133 CA = 59.703(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.0419e-01 1.R133 H = 7.921(D), Expected = 8.24, Std = 0.6100, ChiSquare = 6.0101e-01 1.R133 N = 116.373(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.2898e-01 1.K134 CA = 59.105(D), Expected = 56.95, Std = 2.2000, ChiSquare = 3.2731e-01 1.K134 H = 8.037(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.9872e-01 1.K134 N = 121.656(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.7230e-01 1.I135 CA = 65.316(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.6671e-01 1.I135 H = 8.653(D), Expected = 8.28, Std = 0.6800, ChiSquare = 5.8333e-01 1.I135 N = 121.614(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.7130e-01 1.K136 CA = 59.966(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.7040e-01 1.K136 H = 7.791(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.0605e-01 1.K136 N = 118.193(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.4856e-01 1.Q137 CA = 58.275(D), Expected = 56.57, Std = 2.1400, ChiSquare = 4.2561e-01 1.Q137 H = 7.871(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.5417e-01 1.Q137 N = 119.063(D), Expected = 119.89, Std = 3.6000, ChiSquare = 8.1831e-01 1.E138 CA = 59.235(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.5953e-01 1.E138 H = 8.590(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.5945e-01 1.E138 N = 121.836(D), Expected = 120.67, Std = 3.4800, ChiSquare = 7.3758e-01 1.I139 CA = 65.664(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.3036e-01 1.I139 H = 8.161(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.6108e-01 1.I139 N = 117.927(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.0911e-01 1.L140 CA = 57.800(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.0608e-01 1.L140 H = 7.476(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.4605e-01 1.L140 N = 120.911(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.0775e-01 1.E141 CA = 59.038(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.1107e-01 1.E141 H = 8.652(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.8523e-01 1.E141 N = 119.252(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.8366e-01 1.K142 CA = 58.232(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.6008e-01 1.K142 H = 8.613(D), Expected = 8.19, Std = 0.6000, ChiSquare = 4.8081e-01 1.K142 N = 115.313(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.2807e-01 1.E143 CA = 54.392(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.6123e-01 1.E143 H = 8.046(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.3026e-01 1.E143 N = 114.273(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.6030e-02 1.K144 H = 7.590(D), Expected = 8.19, Std = 0.6000, ChiSquare = 3.1731e-01 1.K144 N = 111.877(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.4968e-02 1.I145 CA = 56.766(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.0690e-02 1.I145 H = 6.576(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.2215e-02 1.I145 N = 114.661(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.1216e-01 1.T146 CA = 61.317(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.2735e-01 1.T146 H = 10.164(D), Expected = 8.24, Std = 0.6200, ChiSquare = 1.9142e-03 1.T146 N = 118.699(D), Expected = 115.42, Std = 4.7500, ChiSquare = 4.9000e-01 1.V147 CA = 57.803(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.0125e-01 1.V147 H = 7.349(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.6018e-01 1.V147 N = 112.949(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.1202e-02 1.T148 CA = 62.182(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.8829e-01 1.T148 H = 9.031(D), Expected = 8.24, Std = 0.6200, ChiSquare = 2.0202e-01 1.T148 N = 119.056(D), Expected = 115.42, Std = 4.7500, ChiSquare = 4.4399e-01 1.V149 CA = 57.677(D), Expected = 62.49, Std = 2.8600, ChiSquare = 9.2401e-02 1.V149 H = 7.856(D), Expected = 8.29, Std = 0.6700, ChiSquare = 5.1714e-01 1.V149 N = 121.299(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.7206e-01 1.G150 CA = 43.464(D), Expected = 45.35, Std = 1.3400, ChiSquare = 1.5929e-01 1.G150 H = 9.299(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.3602e-01 1.G150 N = 111.880(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.6796e-01 1.V151 CA = 60.142(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.1166e-01 1.V151 H = 8.797(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.4922e-01 1.V151 N = 124.906(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.0681e-01 1.A152 CA = 50.728(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.2315e-01 1.A152 H = 9.231(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.5736e-02 1.A152 N = 126.389(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.7219e-01 1.N154 CA = 54.169(D), Expected = 53.54, Std = 1.8800, ChiSquare = 7.3795e-01 1.K155 CA = 60.147(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.4617e-01 1.K155 H = 8.187(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.9601e-01 1.K155 N = 119.395(D), Expected = 121.05, Std = 3.7700, ChiSquare = 6.6067e-01 1.I156 CA = 62.508(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.3757e-01 1.I156 H = 7.451(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.2280e-01 1.I156 N = 118.124(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.3572e-01 1.L157 CA = 56.782(D), Expected = 55.62, Std = 2.1300, ChiSquare = 5.8538e-01 1.L157 H = 8.064(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.9843e-01 1.L157 N = 117.568(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.7111e-01 1.A158 CA = 55.052(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.3422e-01 1.A158 H = 7.600(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.1731e-01 1.A158 N = 120.826(D), Expected = 123.23, Std = 3.5400, ChiSquare = 4.9708e-01 1.K159 CA = 58.313(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.3556e-01 1.K159 H = 7.354(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.6352e-01 1.K159 N = 117.899(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.0326e-01 1.I160 CA = 65.154(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.8604e-01 1.I160 H = 7.989(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.6869e-01 1.I160 N = 117.835(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.9702e-01 1.I161 CA = 59.669(D), Expected = 61.61, Std = 2.6800, ChiSquare = 4.6891e-01 1.I161 H = 8.367(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.9820e-01 1.I161 N = 117.371(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.3939e-01 1.A162 CA = 55.390(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.5580e-01 1.A162 H = 7.790(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.9440e-01 1.A162 N = 128.406(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.4370e-01 1.D163 CA = 57.828(D), Expected = 54.69, Std = 2.0300, ChiSquare = 1.2215e-01 1.D163 H = 8.544(D), Expected = 8.31, Std = 0.5800, ChiSquare = 6.8662e-01 1.D163 N = 119.922(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.5041e-01 1.K164 CA = 57.299(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.7396e-01 1.K164 H = 7.756(D), Expected = 8.19, Std = 0.6000, ChiSquare = 4.6948e-01 1.K164 N = 115.828(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.6601e-01 1.S165 CA = 58.217(D), Expected = 58.72, Std = 2.0700, ChiSquare = 8.0801e-01 1.S165 H = 7.844(D), Expected = 8.28, Std = 0.5900, ChiSquare = 4.5992e-01 1.S165 N = 114.012(D), Expected = 116.28, Std = 3.5200, ChiSquare = 5.1937e-01 1.K166 H = 7.082(D), Expected = 8.19, Std = 0.6000, ChiSquare = 6.4796e-02 1.K166 N = 120.979(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.8497e-01 1.P167 CA = 61.847(D), Expected = 63.33, Std = 1.5200, ChiSquare = 3.2923e-01 1.N168 CA = 52.270(D), Expected = 53.54, Std = 1.8800, ChiSquare = 4.9934e-01 1.N168 H = 9.940(D), Expected = 8.34, Std = 0.6300, ChiSquare = 1.1095e-02 1.N168 N = 119.653(D), Expected = 118.93, Std = 4.0300, ChiSquare = 8.5762e-01 1.G169 CA = 44.599(D), Expected = 45.35, Std = 1.3400, ChiSquare = 5.7517e-01 1.G169 H = 8.227(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.7409e-01 1.G169 N = 106.059(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.5078e-01 1.L170 CA = 55.232(D), Expected = 55.62, Std = 2.1300, ChiSquare = 8.5546e-01 1.L170 H = 8.535(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.3890e-01 1.L170 N = 123.921(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.9718e-01 1.G171 CA = 45.327(D), Expected = 45.35, Std = 1.3400, ChiSquare = 9.8631e-01 1.G171 H = 9.318(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.2851e-01 1.V172 CA = 60.120(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.0729e-01 1.V172 H = 8.498(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.5622e-01 1.V172 N = 122.594(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.4877e-01 1.I173 CA = 59.772(D), Expected = 61.61, Std = 2.6800, ChiSquare = 4.9283e-01 1.I173 H = 8.639(D), Expected = 8.28, Std = 0.6800, ChiSquare = 5.9754e-01 1.I173 N = 127.087(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.8860e-01 1.R174 CA = 54.083(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.4475e-01 1.R174 H = 8.457(D), Expected = 8.24, Std = 0.6100, ChiSquare = 7.2204e-01 1.R174 N = 123.440(D), Expected = 120.80, Std = 3.6800, ChiSquare = 4.7313e-01 1.T176 CA = 62.564(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.9434e-01 1.E177 CA = 55.514(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.8753e-01 1.E177 H = 7.843(D), Expected = 8.33, Std = 0.5900, ChiSquare = 4.0913e-01 1.E177 N = 120.206(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.9393e-01 1.V178 CA = 66.926(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.2089e-01 1.V178 H = 6.944(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.4542e-02 1.V178 N = 119.472(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.1332e-01 1.Q179 CA = 59.127(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.3214e-01 1.Q179 H = 8.591(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.2947e-01 1.Q179 N = 118.913(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.8609e-01 1.D180 CA = 57.004(D), Expected = 54.69, Std = 2.0300, ChiSquare = 2.5433e-01 1.D180 H = 8.283(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.6287e-01 1.D180 N = 118.511(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.7948e-01 1.F181 CA = 61.211(D), Expected = 58.08, Std = 2.5700, ChiSquare = 2.2311e-01 1.F181 H = 7.980(D), Expected = 8.36, Std = 0.7200, ChiSquare = 5.9765e-01 1.F181 N = 120.622(D), Expected = 120.45, Std = 4.1800, ChiSquare = 9.6718e-01 1.L182 CA = 57.312(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.2698e-01 1.L182 H = 8.810(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.7223e-01 1.L182 N = 118.725(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.2149e-01 1.N183 CA = 54.856(D), Expected = 53.54, Std = 1.8800, ChiSquare = 4.8393e-01 1.N183 H = 7.942(D), Expected = 8.34, Std = 0.6300, ChiSquare = 5.2755e-01 1.N183 N = 114.807(D), Expected = 118.93, Std = 4.0300, ChiSquare = 3.0627e-01 1.E184 CA = 54.820(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.3163e-01 1.E184 H = 7.055(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.0694e-02 1.E184 N = 114.695(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.5988e-02 1.L185 CA = 55.302(D), Expected = 55.62, Std = 2.1300, ChiSquare = 8.8132e-01 1.L185 H = 7.064(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.2838e-02 1.L185 N = 122.533(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.6299e-01 1.D186 CA = 54.175(D), Expected = 54.69, Std = 2.0300, ChiSquare = 7.9973e-01 1.D186 H = 9.122(D), Expected = 8.31, Std = 0.5800, ChiSquare = 1.6151e-01 1.D186 N = 126.676(D), Expected = 120.65, Std = 3.8600, ChiSquare = 1.1849e-01 1.I187 CA = 61.417(D), Expected = 61.61, Std = 2.6800, ChiSquare = 9.4259e-01 1.I187 H = 8.227(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.3788e-01 1.I187 N = 120.802(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.7782e-01 1.D188 CA = 54.465(D), Expected = 54.69, Std = 2.0300, ChiSquare = 9.1175e-01 1.D188 H = 8.288(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.6974e-01 1.D188 N = 114.248(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.7207e-02 1.E189 CA = 55.645(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.2288e-01 1.E189 H = 7.564(D), Expected = 8.33, Std = 0.5900, ChiSquare = 1.9418e-01 1.E189 N = 117.224(D), Expected = 120.67, Std = 3.4800, ChiSquare = 3.2206e-01 1.I190 CA = 57.863(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.6207e-01 1.I190 H = 7.293(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.4665e-01 1.I190 N = 120.380(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.0078e-01 1.G192 CA = 44.860(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.1461e-01 1.I193 CA = 59.419(D), Expected = 61.61, Std = 2.6800, ChiSquare = 4.1362e-01 1.I193 H = 7.504(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.5380e-01 1.I193 N = 120.386(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.0186e-01 1.G194 CA = 44.395(D), Expected = 45.35, Std = 1.3400, ChiSquare = 4.7604e-01 1.G194 H = 8.377(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.4236e-01 1.G194 N = 110.746(D), Expected = 109.67, Std = 3.8700, ChiSquare = 7.8098e-01 1.V196 CA = 66.047(D), Expected = 62.49, Std = 2.8600, ChiSquare = 2.1361e-01 1.L197 CA = 56.887(D), Expected = 55.62, Std = 2.1300, ChiSquare = 5.5195e-01 1.L197 H = 8.210(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.7545e-01 1.L197 N = 121.260(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.7773e-01 1.A198 CA = 55.429(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.4766e-01 1.A198 H = 8.513(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.0190e-01 1.A198 N = 120.120(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.7966e-01 1.R199 CA = 58.755(D), Expected = 56.77, Std = 2.3100, ChiSquare = 3.9017e-01 1.R199 H = 7.836(D), Expected = 8.24, Std = 0.6100, ChiSquare = 5.0778e-01 1.R199 N = 117.143(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.2034e-01 1.R200 CA = 58.427(D), Expected = 56.77, Std = 2.3100, ChiSquare = 4.7318e-01 1.R200 H = 7.746(D), Expected = 8.24, Std = 0.6100, ChiSquare = 4.1803e-01 1.R200 N = 119.561(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.3635e-01 1.L201 CA = 57.716(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.2510e-01 1.L201 H = 8.434(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.5364e-01 1.L201 N = 119.062(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.7311e-01 1.N202 CA = 56.163(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.6295e-01 1.N202 H = 8.736(D), Expected = 8.34, Std = 0.6300, ChiSquare = 5.2963e-01 1.N202 N = 120.502(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.9648e-01 1.E203 CA = 58.688(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.1276e-01 1.E203 H = 8.039(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.2186e-01 1.E203 N = 121.012(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.2171e-01 1.L204 CA = 54.168(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.9544e-01 1.L204 H = 7.362(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.8175e-01 1.L204 N = 118.910(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.4940e-01 1.G205 CA = 44.747(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.5271e-01 1.G205 H = 7.896(D), Expected = 8.33, Std = 0.6500, ChiSquare = 5.0433e-01 1.G205 N = 106.473(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.0875e-01 1.I206 CA = 60.114(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.7670e-01 1.I206 H = 7.914(D), Expected = 8.28, Std = 0.6800, ChiSquare = 5.9041e-01 1.I206 N = 122.034(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.9331e-01 1.Q207 CA = 56.312(D), Expected = 56.57, Std = 2.1400, ChiSquare = 9.0404e-01 1.Q207 H = 9.011(D), Expected = 8.22, Std = 0.5900, ChiSquare = 1.8002e-01 1.Q207 N = 126.441(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.8801e-02 1.K208 CA = 53.182(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.6763e-02 1.K208 H = 8.577(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.1893e-01 1.K208 N = 120.559(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.9638e-01 1.L209 H = 8.540(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.3342e-01 1.L209 N = 123.236(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.2422e-01 1.R210 CA = 58.207(D), Expected = 56.77, Std = 2.3100, ChiSquare = 5.3389e-01 1.R210 H = 8.471(D), Expected = 8.24, Std = 0.6100, ChiSquare = 7.0492e-01 1.R210 N = 112.882(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.1426e-02 1.D211 CA = 56.454(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.8487e-01 1.D211 H = 7.959(D), Expected = 8.31, Std = 0.5800, ChiSquare = 5.4506e-01 1.D211 N = 120.711(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.8739e-01 1.I212 CA = 62.510(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.3701e-01 1.I212 H = 7.939(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.1604e-01 1.I212 N = 117.228(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.2277e-01 1.L213 CA = 55.822(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.2445e-01 1.L213 H = 7.188(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.0892e-01 1.L213 N = 115.841(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.2275e-01 1.Y217 CA = 61.922(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.3085e-01 1.N218 CA = 56.213(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.5508e-01 1.N218 H = 8.328(D), Expected = 8.34, Std = 0.6300, ChiSquare = 9.8480e-01 1.N218 N = 115.741(D), Expected = 118.93, Std = 4.0300, ChiSquare = 4.2876e-01 1.E219 CA = 58.204(D), Expected = 57.32, Std = 2.0900, ChiSquare = 6.7232e-01 1.E219 H = 7.684(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.7355e-01 1.E219 N = 118.804(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.9182e-01 1.L220 CA = 57.509(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.7516e-01 1.L220 H = 7.555(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.9906e-01 1.L220 N = 119.743(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.8725e-01 1.E221 CA = 58.652(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.2392e-01 1.E221 H = 8.372(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.4325e-01 1.E221 N = 117.665(D), Expected = 120.67, Std = 3.4800, ChiSquare = 3.8786e-01 1.K222 CA = 58.488(D), Expected = 56.95, Std = 2.2000, ChiSquare = 4.8450e-01 1.K222 H = 7.309(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.4201e-01 1.K222 N = 117.657(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.6812e-01 1.I223 CA = 62.254(D), Expected = 61.61, Std = 2.6800, ChiSquare = 8.1010e-01 1.I223 H = 7.443(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.1837e-01 1.I223 N = 116.721(D), Expected = 121.46, Std = 4.2800, ChiSquare = 2.6819e-01 1.T224 H = 8.430(D), Expected = 8.24, Std = 0.6200, ChiSquare = 7.5926e-01 1.T224 N = 106.504(D), Expected = 115.42, Std = 4.7500, ChiSquare = 6.0511e-02 1.G225 CA = 44.506(D), Expected = 45.35, Std = 1.3400, ChiSquare = 5.2879e-01 1.G225 H = 8.202(D), Expected = 8.33, Std = 0.6500, ChiSquare = 8.4389e-01 1.G225 N = 112.918(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.0131e-01 1.K228 CA = 58.361(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.2129e-01 1.K228 N = 117.431(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.3708e-01 1.A229 CA = 55.691(D), Expected = 53.14, Std = 1.9800, ChiSquare = 1.9761e-01 1.A229 H = 7.635(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.4636e-01 1.A229 N = 122.209(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.7303e-01 1.L230 CA = 57.404(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.0228e-01 1.L230 H = 7.885(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.9558e-01 1.L230 N = 117.316(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.4397e-01 1.Y231 CA = 59.313(D), Expected = 58.13, Std = 2.5100, ChiSquare = 6.3742e-01 1.Y231 H = 7.589(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.1665e-01 1.Y231 N = 119.830(D), Expected = 120.52, Std = 4.2000, ChiSquare = 8.6951e-01 1.L232 CA = 57.434(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.9441e-01 1.L232 H = 8.094(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.3427e-01 1.L232 N = 117.933(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.1397e-01 1.L233 CA = 57.992(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.6544e-01 1.K234 CA = 58.061(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.1356e-01 1.K234 H = 8.359(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.7820e-01 1.K234 N = 117.342(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.2533e-01 1.L235 CA = 57.661(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.3795e-01 1.L235 H = 8.176(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.3379e-01 1.L235 N = 120.626(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.5169e-01 1.A236 CA = 54.471(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.0144e-01 1.A236 H = 8.398(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.4140e-01 1.A236 N = 118.994(D), Expected = 123.23, Std = 3.5400, ChiSquare = 2.3146e-01 1.Q237 CA = 55.035(D), Expected = 56.57, Std = 2.1400, ChiSquare = 4.7320e-01 1.Q237 H = 7.711(D), Expected = 8.22, Std = 0.5900, ChiSquare = 3.8830e-01 1.Q237 N = 112.663(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.4696e-02 1.N238 CA = 53.498(D), Expected = 53.54, Std = 1.8800, ChiSquare = 9.8218e-01 1.N238 H = 8.221(D), Expected = 8.34, Std = 0.6300, ChiSquare = 8.5018e-01 1.N238 N = 117.782(D), Expected = 118.93, Std = 4.0300, ChiSquare = 7.7575e-01 1.Y255 CA = 57.054(D), Expected = 58.13, Std = 2.5100, ChiSquare = 6.6815e-01 1.L256 CA = 54.109(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.7808e-01 1.L256 H = 8.152(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.0448e-01 1.L256 N = 122.191(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.3236e-01 1.T257 CA = 62.986(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.6742e-01 1.T257 H = 8.764(D), Expected = 8.24, Std = 0.6200, ChiSquare = 3.9802e-01 1.T257 N = 120.666(D), Expected = 115.42, Std = 4.7500, ChiSquare = 2.6941e-01 1.L258 CA = 52.548(D), Expected = 55.62, Std = 2.1300, ChiSquare = 1.4923e-01 1.L258 H = 8.034(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.6300e-01 1.L258 N = 127.487(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.4907e-01 1.P259 CA = 64.014(D), Expected = 63.33, Std = 1.5200, ChiSquare = 6.5271e-01 1.Y260 CA = 54.459(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.4359e-01 1.Y260 H = 6.758(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.2377e-02 1.Y260 N = 111.635(D), Expected = 120.52, Std = 4.2000, ChiSquare = 3.4389e-02 1.N261 CA = 52.786(D), Expected = 53.54, Std = 1.8800, ChiSquare = 6.8837e-01 1.N261 H = 8.459(D), Expected = 8.34, Std = 0.6300, ChiSquare = 8.5018e-01 1.N261 N = 117.968(D), Expected = 118.93, Std = 4.0300, ChiSquare = 8.1133e-01 1.T262 CA = 61.022(D), Expected = 62.22, Std = 2.5900, ChiSquare = 6.4369e-01 1.T262 H = 8.381(D), Expected = 8.24, Std = 0.6200, ChiSquare = 8.2010e-01 1.T262 N = 118.036(D), Expected = 115.42, Std = 4.7500, ChiSquare = 5.8181e-01 1.R263 CA = 55.192(D), Expected = 56.77, Std = 2.3100, ChiSquare = 4.9453e-01 1.D264 CA = 53.426(D), Expected = 54.69, Std = 2.0300, ChiSquare = 5.3351e-01 1.D264 H = 8.726(D), Expected = 8.31, Std = 0.5800, ChiSquare = 4.7323e-01 1.D264 N = 122.458(D), Expected = 120.65, Std = 3.8600, ChiSquare = 6.3950e-01 1.V265 CA = 66.398(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.7180e-01 1.V265 H = 8.751(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.9142e-01 1.V265 N = 128.893(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.7690e-02 1.K266 CA = 58.876(D), Expected = 56.95, Std = 2.2000, ChiSquare = 3.8133e-01 1.K266 H = 8.325(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.2198e-01 1.K266 N = 117.235(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.1157e-01 1.V267 CA = 63.777(D), Expected = 62.49, Std = 2.8600, ChiSquare = 6.5271e-01 1.V267 H = 7.262(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.2495e-01 1.V267 N = 118.149(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.1002e-01 1.I268 CA = 64.370(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.0308e-01 1.I268 H = 7.677(D), Expected = 8.28, Std = 0.6800, ChiSquare = 3.7521e-01 1.I268 N = 117.380(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.4045e-01 1.L269 CA = 59.721(D), Expected = 55.62, Std = 2.1300, ChiSquare = 5.4185e-02 1.L269 H = 8.688(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.8105e-01 1.L269 N = 120.118(D), Expected = 121.86, Std = 3.9000, ChiSquare = 6.5512e-01 1.P270 CA = 65.937(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.6321e-02 1.Y271 CA = 61.411(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.9115e-01 1.Y271 H = 7.382(D), Expected = 8.32, Std = 0.7300, ChiSquare = 1.9882e-01 1.Y271 N = 115.974(D), Expected = 120.52, Std = 4.2000, ChiSquare = 2.7908e-01 1.L272 CA = 57.405(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.0202e-01 1.L272 H = 8.054(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.8657e-01 1.L272 N = 121.867(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.9857e-01 1.K273 CA = 60.486(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.0799e-01 1.K273 H = 8.745(D), Expected = 8.19, Std = 0.6000, ChiSquare = 3.5497e-01 1.K273 N = 117.078(D), Expected = 121.05, Std = 3.7700, ChiSquare = 2.9207e-01 1.K274 CA = 59.580(D), Expected = 56.95, Std = 2.2000, ChiSquare = 2.3191e-01 1.K274 H = 7.412(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.9475e-01 1.K274 N = 119.269(D), Expected = 121.05, Std = 3.7700, ChiSquare = 6.3663e-01 1.A275 CA = 54.949(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.6091e-01 1.A275 H = 8.254(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.2829e-01 1.A275 N = 122.138(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.5772e-01 1.I276 CA = 65.402(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.5709e-01 1.I276 H = 8.397(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.6339e-01 1.I276 N = 119.048(D), Expected = 121.46, Std = 4.2800, ChiSquare = 5.7306e-01 1.N277 CA = 56.458(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.2063e-01 1.N277 H = 8.731(D), Expected = 8.34, Std = 0.6300, ChiSquare = 5.3484e-01 1.N277 N = 120.226(D), Expected = 118.93, Std = 4.0300, ChiSquare = 7.4776e-01 1.E278 CA = 58.943(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.3742e-01 1.E278 H = 8.361(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.5810e-01 1.E278 N = 118.693(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.6996e-01 1.A279 CA = 54.803(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.0097e-01 1.A279 H = 8.386(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.5656e-01 1.A279 N = 121.994(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.2697e-01 1.Y280 CA = 61.861(D), Expected = 58.13, Std = 2.5100, ChiSquare = 1.3716e-01 1.Y280 H = 8.962(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.7916e-01 1.Y280 N = 118.308(D), Expected = 120.52, Std = 4.2000, ChiSquare = 5.9842e-01 1.N281 H = 7.745(D), Expected = 8.34, Std = 0.6300, ChiSquare = 3.4494e-01 1.N281 N = 116.188(D), Expected = 118.93, Std = 4.0300, ChiSquare = 4.9625e-01 1.K282 CA = 55.600(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.3946e-01 1.K282 H = 7.389(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.8188e-01 1.K282 N = 116.209(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.9911e-01 1.V283 CA = 60.586(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.0558e-01 1.V283 H = 7.291(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.3595e-01 1.V283 N = 114.621(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.5103e-01 1.N284 CA = 52.131(D), Expected = 53.54, Std = 1.8800, ChiSquare = 4.5358e-01 1.G285 CA = 44.478(D), Expected = 45.35, Std = 1.3400, ChiSquare = 5.1521e-01 1.G285 H = 7.290(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.0960e-01 1.G285 N = 106.529(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.1701e-01 1.I286 CA = 56.472(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.5217e-02 1.I286 H = 8.246(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.6012e-01 1.I286 N = 117.746(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.8553e-01 1.P287 CA = 62.274(D), Expected = 63.33, Std = 1.5200, ChiSquare = 4.8722e-01 1.M288 CA = 56.009(D), Expected = 56.11, Std = 2.2300, ChiSquare = 9.6388e-01 1.M288 H = 8.085(D), Expected = 8.26, Std = 0.6000, ChiSquare = 7.7054e-01 1.M288 N = 115.080(D), Expected = 120.09, Std = 3.5700, ChiSquare = 1.6051e-01 1.R289 CA = 54.710(D), Expected = 56.77, Std = 2.3100, ChiSquare = 3.7251e-01 1.R289 H = 8.023(D), Expected = 8.24, Std = 0.6100, ChiSquare = 7.2204e-01 1.R289 N = 119.500(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.2389e-01 1.I290 CA = 58.697(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.7706e-01 1.I290 H = 8.187(D), Expected = 8.28, Std = 0.6800, ChiSquare = 8.9122e-01 1.I290 N = 123.214(D), Expected = 121.46, Std = 4.2800, ChiSquare = 6.8194e-01 1.T291 CA = 61.351(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.3723e-01 1.T291 H = 8.381(D), Expected = 8.24, Std = 0.6200, ChiSquare = 8.2010e-01 1.T291 N = 122.090(D), Expected = 115.42, Std = 4.7500, ChiSquare = 1.6026e-01 1.V292 CA = 61.736(D), Expected = 62.49, Std = 2.8600, ChiSquare = 7.9206e-01 1.V292 H = 8.794(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.5191e-01 1.V292 N = 127.059(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.9232e-01 1.I293 CA = 60.119(D), Expected = 61.61, Std = 2.6800, ChiSquare = 5.7798e-01 1.I293 H = 8.566(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.7406e-01 1.I293 N = 127.026(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.9344e-01 1.A294 CA = 49.858(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.7403e-02 1.A294 H = 9.393(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.6775e-02 1.A294 N = 129.130(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.5581e-02 1.I295 CA = 59.109(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.5071e-01 1.I295 H = 8.623(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.1397e-01 1.I295 N = 122.912(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.3442e-01 1.M296 CA = 53.477(D), Expected = 56.11, Std = 2.2300, ChiSquare = 2.3771e-01 1.M296 H = 9.053(D), Expected = 8.26, Std = 0.6000, ChiSquare = 1.8628e-01 1.M296 N = 123.942(D), Expected = 120.09, Std = 3.5700, ChiSquare = 2.8059e-01 1.E297 CA = 58.300(D), Expected = 57.32, Std = 2.0900, ChiSquare = 6.3914e-01 1.E297 H = 8.462(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.2297e-01 1.E297 N = 116.991(D), Expected = 120.67, Std = 3.4800, ChiSquare = 2.9043e-01 1.D298 CA = 52.712(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.2987e-01 1.D298 H = 7.907(D), Expected = 8.31, Std = 0.5800, ChiSquare = 4.8716e-01 1.D298 N = 118.534(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.8356e-01 1.L299 CA = 56.422(D), Expected = 55.62, Std = 2.1300, ChiSquare = 7.0653e-01 1.L299 H = 8.287(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.3012e-01 1.L299 N = 113.258(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.7409e-02 1.D300 CA = 53.739(D), Expected = 54.69, Std = 2.0300, ChiSquare = 6.3945e-01 1.D300 H = 7.657(D), Expected = 8.31, Std = 0.5800, ChiSquare = 2.6022e-01 1.D300 N = 119.405(D), Expected = 120.65, Std = 3.8600, ChiSquare = 7.4704e-01 1.I301 CA = 60.305(D), Expected = 61.61, Std = 2.6800, ChiSquare = 6.2630e-01 1.I301 H = 8.019(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.0111e-01 1.I301 N = 120.114(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.5315e-01 1.L302 CA = 53.256(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.6706e-01 1.L302 H = 9.178(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.4471e-01 1.L302 N = 129.370(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.4149e-02 1.S303 CA = 56.425(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.6756e-01 1.S303 H = 8.385(D), Expected = 8.28, Std = 0.5900, ChiSquare = 8.5875e-01 1.S303 N = 113.915(D), Expected = 116.28, Std = 3.5200, ChiSquare = 5.0166e-01 1.K304 CA = 56.637(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.8686e-01 1.K304 H = 8.564(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.3307e-01 1.K304 N = 122.383(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.2365e-01 1.G305 CA = 44.999(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.9337e-01 1.G305 H = 8.620(D), Expected = 8.33, Std = 0.6500, ChiSquare = 6.5549e-01 1.G305 N = 114.117(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.5052e-01 1.K306 CA = 55.773(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.9265e-01 1.K306 H = 8.591(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.0392e-01 1.K306 N = 118.973(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.8168e-01 1.K307 CA = 53.910(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.6703e-01 1.K307 H = 8.119(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.0580e-01 1.K307 N = 124.550(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.5321e-01 1.F308 CA = 56.499(D), Expected = 58.08, Std = 2.5700, ChiSquare = 5.3844e-01 1.F308 H = 9.192(D), Expected = 8.36, Std = 0.7200, ChiSquare = 2.4786e-01 1.F308 N = 124.855(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.9196e-01 1.H310 CA = 53.717(D), Expected = 56.52, Std = 2.3100, ChiSquare = 2.2497e-01 1.G311 CA = 44.814(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.8916e-01 1.G311 H = 8.338(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.9018e-01 1.G311 N = 105.027(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.3024e-01 1.I312 CA = 59.112(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.5129e-01 1.I312 H = 8.461(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.9010e-01 1.I312 N = 122.935(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.3038e-01 1.S313 CA = 57.492(D), Expected = 58.72, Std = 2.0700, ChiSquare = 5.5302e-01 1.S313 H = 8.823(D), Expected = 8.28, Std = 0.5900, ChiSquare = 3.5740e-01 1.S313 N = 126.315(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.3602e-03 1.I314 CA = 64.355(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.0572e-01 1.I314 H = 8.739(D), Expected = 8.28, Std = 0.6800, ChiSquare = 4.9968e-01 1.I314 N = 123.208(D), Expected = 121.46, Std = 4.2800, ChiSquare = 6.8297e-01 1.D315 CA = 56.294(D), Expected = 54.69, Std = 2.0300, ChiSquare = 4.2944e-01 1.D315 H = 7.521(D), Expected = 8.31, Std = 0.5800, ChiSquare = 1.7372e-01 1.D315 N = 116.092(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.3767e-01 1.N316 CA = 54.665(D), Expected = 53.54, Std = 1.8800, ChiSquare = 5.4957e-01 1.N316 H = 7.312(D), Expected = 8.34, Std = 0.6300, ChiSquare = 1.0273e-01 1.N316 N = 117.190(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.6591e-01 1.A317 CA = 55.239(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.8910e-01 1.A317 H = 8.621(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.8289e-01 1.A317 N = 125.369(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.4569e-01 1.Y318 CA = 58.867(D), Expected = 58.13, Std = 2.5100, ChiSquare = 7.6904e-01 1.Y318 H = 7.510(D), Expected = 8.32, Std = 0.7300, ChiSquare = 2.6718e-01 1.Y318 N = 113.639(D), Expected = 120.52, Std = 4.2000, ChiSquare = 1.0135e-01 1.K319 CA = 58.445(D), Expected = 56.95, Std = 2.2000, ChiSquare = 4.9679e-01 1.K319 H = 7.200(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.8943e-02 1.K319 N = 119.454(D), Expected = 121.05, Std = 3.7700, ChiSquare = 6.7205e-01 1.V320 CA = 64.905(D), Expected = 62.49, Std = 2.8600, ChiSquare = 3.9844e-01 1.V320 H = 8.344(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.3576e-01 1.V320 N = 119.665(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.4526e-01 1.A321 CA = 54.511(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.8867e-01 1.A321 H = 8.896(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.4605e-01 1.A321 N = 119.618(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.0757e-01 1.E322 CA = 59.650(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.6492e-01 1.E322 H = 7.627(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.3345e-01 1.E322 N = 118.385(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.1143e-01 1.D323 CA = 57.501(D), Expected = 54.69, Std = 2.0300, ChiSquare = 1.6614e-01 1.D323 H = 7.946(D), Expected = 8.31, Std = 0.5800, ChiSquare = 5.3028e-01 1.D323 N = 120.033(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.7300e-01 1.L324 CA = 57.545(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.6613e-01 1.L324 H = 8.414(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.7712e-01 1.L324 N = 120.545(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.3598e-01 1.L325 CA = 57.632(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.4486e-01 1.L325 H = 8.425(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.6418e-01 1.L325 N = 119.064(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.7342e-01 1.R326 CA = 60.203(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.3724e-01 1.R326 H = 8.482(D), Expected = 8.24, Std = 0.6100, ChiSquare = 6.9157e-01 1.R326 N = 117.107(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.1560e-01 1.E327 CA = 59.384(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.2337e-01 1.E327 H = 8.021(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.0047e-01 1.E327 N = 118.587(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.4946e-01 1.L328 CA = 58.213(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.2346e-01 1.L328 H = 8.335(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.7167e-01 1.L328 N = 122.348(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.0042e-01 1.L329 CA = 55.579(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.8464e-01 1.L329 H = 7.645(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.6812e-01 1.L329 N = 115.884(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.2545e-01 1.V330 CA = 64.313(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.2386e-01 1.V330 H = 7.556(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.7329e-01 1.V330 N = 118.925(D), Expected = 121.14, Std = 4.5400, ChiSquare = 6.2563e-01 1.R331 CA = 57.868(D), Expected = 56.77, Std = 2.3100, ChiSquare = 6.3456e-01 1.R331 H = 7.502(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.2634e-01 1.R331 N = 120.171(D), Expected = 120.80, Std = 3.6800, ChiSquare = 8.6428e-01 1.D332 CA = 52.787(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.4853e-01 1.D332 H = 7.910(D), Expected = 8.31, Std = 0.5800, ChiSquare = 4.9041e-01 1.D332 N = 118.701(D), Expected = 120.65, Std = 3.8600, ChiSquare = 6.1361e-01 1.K333 CA = 56.570(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.6287e-01 1.R334 CA = 56.853(D), Expected = 56.77, Std = 2.3100, ChiSquare = 9.7134e-01 1.R334 H = 8.358(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.4661e-01 1.R334 N = 117.412(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.5723e-01 1.R335 CA = 56.981(D), Expected = 56.77, Std = 2.3100, ChiSquare = 9.2722e-01 1.R335 H = 8.551(D), Expected = 8.24, Std = 0.6100, ChiSquare = 6.1017e-01 1.R335 N = 119.114(D), Expected = 120.80, Std = 3.6800, ChiSquare = 6.4684e-01 1.N336 CA = 51.994(D), Expected = 53.54, Std = 1.8800, ChiSquare = 4.1088e-01 1.N336 H = 9.019(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.8113e-01 1.N336 N = 116.526(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.5082e-01 1.V337 CA = 62.867(D), Expected = 62.49, Std = 2.8600, ChiSquare = 8.9513e-01 1.V337 H = 8.487(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.6873e-01 1.V337 N = 122.770(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.1957e-01 1.R338 CA = 56.190(D), Expected = 56.77, Std = 2.3100, ChiSquare = 8.0175e-01 1.R338 H = 9.229(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.0495e-01 1.R338 N = 124.800(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.7706e-01 1.R339 CA = 53.730(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.8817e-01 1.R339 H = 8.388(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.0830e-01 1.R339 N = 116.221(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.1339e-01 1.I340 CA = 55.679(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.6894e-02 1.I340 H = 8.966(D), Expected = 8.28, Std = 0.6800, ChiSquare = 3.1306e-01 1.I340 N = 120.087(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.4837e-01 1.G341 CA = 44.852(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.1016e-01 1.G341 H = 9.290(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.3970e-01 1.G341 N = 113.156(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.6771e-01 1.V342 CA = 58.476(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.6047e-01 1.V342 H = 8.316(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.6905e-01 1.V342 N = 113.204(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.0461e-02 1.K343 CA = 54.555(D), Expected = 56.95, Std = 2.2000, ChiSquare = 2.7631e-01 1.K343 H = 8.732(D), Expected = 8.19, Std = 0.6000, ChiSquare = 3.6635e-01 1.K343 N = 123.029(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.9963e-01 1.L344 CA = 52.698(D), Expected = 55.62, Std = 2.1300, ChiSquare = 1.7012e-01 1.L344 H = 9.002(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.3495e-01 1.L344 N = 128.634(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.2401e-02 1.D345 CA = 52.937(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.8784e-01 1.D345 H = 8.563(D), Expected = 8.31, Std = 0.5800, ChiSquare = 6.6269e-01 1.D345 N = 120.640(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.9793e-01