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.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.26 L 0.25 K 0.16 F 0.09 Y 0.07 C 0.05 N 0.05 R 0.04 C Shift Assignments>> C :: 177.036 CA :: 54.833 CB :: 41.589 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 :: 8.247 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 :: 124.122 Ave N Shift Values>> N :: 121.86(3.9) 1.S5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.T41 1.T41 C Shift Assignments>> CA :: 57.298 CB :: 63.729 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.585 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 :: 117.927 Ave N Shift Values>> N :: 116.28(3.52) 1.T6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.311 CA :: 57.976 CB :: 63.080 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.364 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 :: 118.262 Ave N Shift Values>> N :: 116.28(3.52) 1.D8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.26 L 0.24 K 0.16 F 0.1 Y 0.07 N 0.05 C 0.05 R 0.03 C Shift Assignments>> C :: 177.069(D) CA :: 54.852(D) CB :: 41.477(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 :: 8.107(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 :: 123.848(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.21 K 0.18 Y 0.17 L 0.15 D 0.1 C 0.08 I 0.03 R 0.02 N 0.01 C Shift Assignments>> C :: 177.306 CA :: 57.412(D) CB :: 41.218 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 :: 8.498(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 :: 117.621(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.77 M 0.21 C 0.01 C Shift Assignments>> C :: 177.801 CA :: 52.597(D) CB :: 18.094(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.878(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.944(D) Ave N Shift Values>> N :: 123.23(3.54) 1.S11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.694 CA :: 57.991(D) CB :: 63.064(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.922(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 :: 114.232(D) Ave N Shift Values>> N :: 116.28(3.52) 1.L12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.25 L 0.24 K 0.17 F 0.1 Y 0.07 C 0.05 N 0.04 R 0.04 C Shift Assignments>> C :: 176.902 CA :: 55.033 CB :: 41.560 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 :: 7.718(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 :: 123.400(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.33 L 0.23 N 0.11 K 0.1 F 0.08 Y 0.06 C 0.05 R 0.01 C Shift Assignments>> C :: 175.988(D) CA :: 53.931(D) CB :: 41.270(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 :: 8.053(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 :: 120.812(D) Ave N Shift Values>> N :: 120.65(3.86) 1.D14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.3 L 0.17 N 0.15 F 0.13 Y 0.1 C 0.07 K 0.03 HN Overlap>> 1.E19 2.E104 1.E19 2.E104 C Shift Assignments>> C :: 177.366 CA :: 54.695(D) CB :: 40.437(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 :: 8.117(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 :: 121.286(D) Ave N Shift Values>> N :: 120.65(3.86) 1.T15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.692 CA :: 63.080(D) CB :: 68.609(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.093 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.664 Ave N Shift Values>> N :: 115.42(4.75) 1.S16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.870(D) CA :: 59.261(D) CB :: 62.770(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.103(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 :: 117.457(D) Ave N Shift Values>> N :: 116.28(3.52) 1.K17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.12 L 0.12 M 0.1 H 0.08 Q 0.07 R 0.07 N 0.06 K 0.06 C 0.05 W 0.04 A 0.04 E 0.04 F 0.03 Y 0.03 S 0.01 HN Overlap>> 2.L33 2.F7 2.A91 2.L33 2.F7 2.A91 C Shift Assignments>> C :: 177.010 CA :: 55.107 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 :: 7.957(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 :: 122.483(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.13 M 0.1 D 0.09 H 0.09 Q 0.08 R 0.08 K 0.07 W 0.05 C 0.05 E 0.05 F 0.04 Y 0.04 N 0.03 A 0.03 S 0.01 HN Overlap>> 1.Q39 2.N35 1.Q39 2.N35 C Shift Assignments>> C :: 177.560 CA :: 55.539 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 :: 7.804 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 :: 120.976 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.14 K 0.14 E 0.13 C 0.13 Q 0.13 H 0.11 R 0.1 I 0.03 M 0.02 HN Overlap>> 1.D14 1.D14 2.E104 2.E104 C Shift Assignments>> C :: 177.162 CA :: 57.844(D) CB :: 29.237 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 :: 8.095(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 :: 121.243(D) Ave N Shift Values>> N :: 120.67(3.48) 1.I20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.46 C 0.22 Y 0.15 F 0.1 E 0.03 V 0.01 HN Overlap>> 1.E25 2.F58 1.E25 2.F58 C Shift Assignments>> C :: 175.999 CA :: 61.578 CB :: 37.602 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 :: 7.837 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 :: 120.263 Ave N Shift Values>> N :: 121.46(4.28) 1.A21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 M 0.2 C 0.01 C Shift Assignments>> C :: 178.147 CA :: 52.664 CB :: 18.194 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.973 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.438 Ave N Shift Values>> N :: 123.23(3.54) 1.T22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 2.T20 2.T20 C Shift Assignments>> C :: 174.988 CA :: 62.745 CB :: 69.147 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 :: 7.982(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 :: 113.354(D) Ave N Shift Values>> N :: 115.42(4.75) 1.F23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.12 Y 0.11 F 0.11 S 0.1 W 0.09 E 0.07 K 0.06 R 0.06 H 0.05 Q 0.05 M 0.03 I 0.02 L 0.02 V 0.01 T 0.01 C Shift Assignments>> C :: 175.808 CA :: 58.295 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 :: 7.909(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.564(D) Ave N Shift Values>> N :: 120.45(4.18) 1.L24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.24 L 0.23 K 0.16 F 0.11 Y 0.08 C 0.05 N 0.04 R 0.02 C Shift Assignments>> C :: 177.378 CA :: 55.245 CB :: 41.397 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 :: 7.956(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 :: 121.676(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.14 H 0.14 E 0.13 W 0.13 R 0.12 K 0.12 C 0.11 M 0.04 I 0.01 HN Overlap>> 1.I20 1.I20 2.F58 2.F58 C Shift Assignments>> C :: 177.085 CA :: 56.702 CB :: 29.608 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 :: 7.808(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 :: 120.290(D) Ave N Shift Values>> N :: 120.67(3.48) 1.G26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.73 L 0.15 R 0.03 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 174.498(D) CA :: 44.962(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.930(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.227(D) Ave N Shift Values>> N :: 109.67(3.87) 1.E27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 H 0.14 E 0.13 W 0.13 K 0.12 R 0.12 C 0.11 M 0.04 I 0.01 C Shift Assignments>> C :: 175.494(D) CA :: 56.136(D) CB :: 29.524(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.053(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 :: 120.600(D) Ave N Shift Values>> N :: 120.67(3.48) 1.N28 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S29 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K30 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Q31 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.34 I 0.03 C 0.02 HN Overlap>> 1.N70 1.N70 C Shift Assignments>> C :: 180.869 CA :: 55.054 CB :: 17.642(A) 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 :: 7.529 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 :: 120.772 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.28 V 0.26 K 0.09 W 0.08 R 0.05 M 0.05 P 0.04 Q 0.04 H 0.04 E 0.03 C Shift Assignments>> C :: 180.317 CA :: 60.453(D) CB :: 32.668(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.819(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 :: 119.956(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.51 C 0.23 Y 0.11 F 0.08 E 0.02 V 0.02 C Shift Assignments>> C :: 178.302 CA :: 62.135(D) CB :: 37.423 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 :: 9.718(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 :: 126.804(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Q34 Overall: Clerical Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate C Shift Assignments>> C :: 180.084 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 :: 8.609(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 :: 118.082(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.M35 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S36 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I37 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.19 W 0.17 E 0.13 R 0.1 H 0.1 Q 0.07 K 0.06 I 0.05 V 0.04 M 0.03 C Shift Assignments>> C :: 178.269 CA :: 59.450 CB :: 30.153 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.013(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 :: 121.944(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.Q39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.21 C 0.18 I 0.12 L 0.11 Q 0.09 W 0.08 H 0.06 E 0.05 K 0.04 HN Overlap>> 1.K18 1.K18 2.N35 2.N35 C Shift Assignments>> C :: 178.670 CA :: 58.365 CB :: 27.034 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 :: 7.699(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 :: 120.998(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.F40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.25 N 0.21 Y 0.17 C 0.14 F 0.1 E 0.06 D 0.02 M 0.01 HN Overlap>> 2.N45 2.N45 C Shift Assignments>> C :: 178.180 CB :: 37.761 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 :: 8.050 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 :: 117.234 Ave N Shift Values>> N :: 120.45(4.18) 1.T41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.S5 1.S5 C Shift Assignments>> C :: 175.108 CA :: 67.491 CB :: 66.953 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 :: 8.553(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.890(D) Ave N Shift Values>> N :: 115.42(4.75) 1.N42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.28 F 0.24 C 0.18 I 0.07 D 0.06 N 0.05 L 0.03 E 0.03 M 0.01 C Shift Assignments>> C :: 176.753 CA :: 57.055 CB :: 38.599 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 :: 7.419(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 :: 119.394(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.72 C 0.16 Y 0.05 F 0.04 V 0.01 C Shift Assignments>> C :: 178.116 CA :: 64.149(D) CB :: 38.074 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 :: 7.460(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 :: 116.517(D) Ave N Shift Values>> N :: 121.46(4.28) 1.C44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.24 Y 0.22 D 0.14 L 0.14 C 0.1 K 0.05 I 0.04 N 0.03 HN Overlap>> 1.C48 1.C48 C Shift Assignments>> C :: 176.916 CA :: 56.928 CB :: 40.414 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.201 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.085 Ave N Shift Values>> N :: 120.17(4.64) 1.F45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.6 C 0.15 Y 0.12 F 0.11 C Shift Assignments>> C :: 176.760 CA :: 62.733(D) CB :: 38.864(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.397(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 :: 124.373(D) Ave N Shift Values>> N :: 120.45(4.18) 1.K46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.21 W 0.13 R 0.11 K 0.11 V 0.09 E 0.09 H 0.09 M 0.08 Q 0.04 C Shift Assignments>> C :: 178.663(D) CA :: 59.194(D) CB :: 31.693(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 :: 7.494(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 :: 115.272(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.2 K 0.18 C 0.16 Q 0.15 R 0.09 H 0.08 W 0.05 E 0.03 V 0.01 C Shift Assignments>> C :: 176.063(D) CA :: 55.872(D) CB :: 32.926(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 :: 7.188(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 :: 113.870(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.C48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.61 C 0.14 F 0.12 Y 0.11 HN Overlap>> 1.C44 1.C44 C Shift Assignments>> C :: 174.348 CA :: 63.181(D) CB :: 39.996 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.275(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.164(D) Ave N Shift Values>> N :: 120.17(4.64) 1.V49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.32 C 0.25 W 0.12 V 0.08 P 0.04 E 0.04 K 0.03 R 0.03 H 0.03 Q 0.02 C Shift Assignments>> C :: 174.514 CA :: 61.964 CB :: 29.374 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 :: 7.676 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 :: 121.361 Ave N Shift Values>> N :: 121.14(4.54) 1.E50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.14 H 0.14 W 0.14 Q 0.13 R 0.13 C 0.12 K 0.1 M 0.05 I 0.01 HN Overlap>> 1.F72 1.F72 C Shift Assignments>> C :: 176.748(D) CA :: 56.896(D) CB :: 29.848(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.964(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 127.544(D) Ave N Shift Values>> N :: 120.67(3.48) 1.S51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 173.325(D) CA :: 56.177(D) CB :: 64.359(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.717(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 :: 112.332(D) Ave N Shift Values>> N :: 116.28(3.52) 1.V52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.25 W 0.16 V 0.13 E 0.08 R 0.07 I 0.07 H 0.06 P 0.04 Q 0.03 K 0.03 M 0.02 C Shift Assignments>> C :: 173.619(D) CA :: 60.717(D) CB :: 30.576(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 :: 8.752(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 :: 120.236(D) Ave N Shift Values>> N :: 121.14(4.54) 1.N53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.69 D 0.12 C 0.09 F 0.02 Y 0.02 L 0.02 C Shift Assignments>> C :: 173.511(D) CA :: 50.652(D) CB :: 38.726(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.937(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 :: 118.566(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.35 L 0.25 N 0.11 K 0.1 F 0.05 C 0.04 R 0.04 Y 0.03 HN Overlap>> 2.N56 2.N56 C Shift Assignments>> C :: 174.449(D) CA :: 52.633(D) CB :: 41.831(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 :: 7.721(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 :: 117.954(D) Ave N Shift Values>> N :: 120.65(3.86) 1.S55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 173.794(D) CA :: 58.530(D) CB :: 63.432(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.136(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 :: 113.826(D) Ave N Shift Values>> N :: 116.28(3.52) 1.N56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.5 D 0.25 L 0.07 C 0.06 F 0.05 Y 0.04 C Shift Assignments>> C :: 174.829(D) CA :: 52.087(D) CB :: 39.614(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.895(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 :: 118.998(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.3 D 0.27 R 0.12 K 0.11 F 0.04 N 0.04 C 0.04 Y 0.03 G 0.01 C Shift Assignments>> C :: 177.867(D) CA :: 53.334(D) CB :: 42.413(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.325(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 :: 120.521(D) Ave N Shift Values>> N :: 121.86(3.9) 1.S58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 175.282(D) CA :: 56.403(D) CB :: 64.887(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.735(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 :: 122.634(D) Ave N Shift Values>> N :: 116.28(3.52) 1.S59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.24 T 0.19 V 0.18 C 0.08 P 0.05 F 0.04 S 0.04 Y 0.04 W 0.03 E 0.01 R 0.01 K 0.01 HN Overlap>> 2.V50 2.V50 C Shift Assignments>> CA :: 61.428 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.019 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 :: 117.538 Ave N Shift Values>> N :: 116.28(3.52) 1.Q60 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.19 I 0.18 R 0.17 W 0.1 Q 0.08 L 0.06 E 0.06 K 0.06 H 0.05 C Shift Assignments>> C :: 179.196(D) CA :: 59.076(D) CB :: 27.363(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.237(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 :: 120.966(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 W 0.17 E 0.13 R 0.1 H 0.09 K 0.09 Q 0.08 I 0.07 V 0.02 M 0.02 C Shift Assignments>> C :: 178.708(D) CA :: 59.368(D) CB :: 29.745(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.981(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.068(D) Ave N Shift Values>> N :: 120.67(3.48) 1.E62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.25 C 0.21 W 0.14 K 0.08 E 0.07 Q 0.05 H 0.05 R 0.04 P 0.02 V 0.02 C Shift Assignments>> C :: 178.404(D) CA :: 60.494(D) CB :: 28.718(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.507(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 :: 118.826(D) Ave N Shift Values>> N :: 120.67(3.48) 1.Q63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.15 R 0.12 W 0.12 Q 0.12 K 0.12 E 0.09 I 0.09 H 0.08 L 0.04 M 0.01 C Shift Assignments>> C :: 177.453(D) CA :: 58.269(D) CB :: 28.093(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.104(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 :: 118.438(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.C64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.33 V 0.19 K 0.11 Q 0.1 M 0.07 E 0.04 W 0.03 I 0.02 R 0.02 H 0.02 Y 0.01 HN Overlap>> 2.Q39 2.Q39 C Shift Assignments>> C :: 176.340(D) CA :: 59.982(D) CB :: 34.133(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.154(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 118.874(D) Ave N Shift Values>> N :: 120.17(4.64) 1.L65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.24 F 0.2 Y 0.15 L 0.12 C 0.09 R 0.08 D 0.04 I 0.04 C Shift Assignments>> C :: 178.015(D) CA :: 58.419(D) CB :: 41.901(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.513(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 :: 121.310(D) Ave N Shift Values>> N :: 121.86(3.9) 1.S66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 177.151 CA :: 61.095(D) CB :: 62.136(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.868(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 :: 112.955(D) Ave N Shift Values>> N :: 116.28(3.52) 1.N67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.22 E 0.21 N 0.16 Y 0.14 F 0.09 M 0.07 D 0.02 I 0.02 K 0.01 C Shift Assignments>> C :: 176.799 CA :: 55.452(D) CB :: 37.064 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 :: 8.687(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 :: 121.382(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.C68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.22 Y 0.15 R 0.15 K 0.14 C 0.14 I 0.1 L 0.05 G 0.02 C Shift Assignments>> C :: 175.257 CA :: 60.491(D) CB :: 42.532(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.336(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 121.811(D) Ave N Shift Values>> N :: 120.17(4.64) 1.V69 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.29 P 0.24 I 0.24 C 0.17 W 0.02 C Shift Assignments>> C :: 176.380(D) CA :: 64.721(D) CB :: 30.027(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.763(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 :: 118.443(D) Ave N Shift Values>> N :: 121.14(4.54) 1.N70 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.29 F 0.24 C 0.19 I 0.1 E 0.04 D 0.03 N 0.03 L 0.02 M 0.01 HN Overlap>> 1.Q31 1.Q31 C Shift Assignments>> C :: 177.595 CA :: 57.635(D) CB :: 38.494 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 :: 7.566(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 :: 120.722(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.14 C 0.14 W 0.14 E 0.14 H 0.13 Q 0.09 K 0.08 M 0.07 V 0.01 C Shift Assignments>> C :: 176.266(D) CA :: 57.545(D) CB :: 30.795(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.223(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 :: 117.744(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.F72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.53 C 0.23 Y 0.1 F 0.07 V 0.02 E 0.02 HN Overlap>> 1.E50 1.E50 C Shift Assignments>> C :: 178.427 CA :: 62.367(D) CB :: 37.345(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.926(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 :: 127.476(D) Ave N Shift Values>> N :: 120.45(4.18) 1.L73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.3 Y 0.28 C 0.13 I 0.1 L 0.06 D 0.05 K 0.01 C Shift Assignments>> C :: 179.103 CA :: 58.240 CB :: 40.022 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 :: 8.383(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 :: 122.145(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.27 Y 0.24 D 0.11 L 0.11 C 0.11 I 0.05 K 0.04 N 0.02 HN Overlap>> 2.S54 2.S54 C Shift Assignments>> C :: 179.247 CA :: 57.283(D) CB :: 40.282(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 :: 8.395(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 :: 119.004(D) Ave N Shift Values>> N :: 120.65(3.86) 1.T75 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.47 T 0.23 I 0.16 S 0.06 C 0.03 P 0.02 HN Overlap>> 2.E59 2.E59 C Shift Assignments>> CA :: 67.657 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 :: 8.000(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 :: 119.649(D) Ave N Shift Values>> N :: 115.42(4.75) 1.N76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 F 0.25 C 0.15 D 0.1 L 0.06 N 0.06 I 0.05 E 0.01 HN Overlap>> 2.Q36 2.Q36 C Shift Assignments>> C :: 176.848 CA :: 56.774 CB :: 39.199 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 :: 8.020 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 :: 120.449 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.7 C 0.18 Y 0.03 V 0.03 F 0.03 C Shift Assignments>> C :: 177.698 CA :: 64.598 CB :: 37.461 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 :: 8.020 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 :: 118.030 Ave N Shift Values>> N :: 121.46(4.28) 1.R78 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.15 C 0.15 E 0.13 K 0.12 Q 0.11 H 0.1 R 0.1 I 0.05 M 0.02 V 0.01 C Shift Assignments>> C :: 179.803 CA :: 58.542(D) CB :: 29.350(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.588(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 :: 120.023(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.I79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.36 C 0.31 I 0.23 Y 0.02 E 0.01 P 0.01 F 0.01 C Shift Assignments>> C :: 176.703(D) CA :: 63.275 CB :: 35.316 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 :: 8.268(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 :: 121.492(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.57 I 0.14 C 0.13 P 0.13 HN Overlap>> 2.Q76 2.Q76 C Shift Assignments>> C :: 178.661 CA :: 66.917 CB :: 30.504 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 :: 8.271 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 :: 119.928 Ave N Shift Values>> N :: 121.14(4.54) 1.N81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.2 Y 0.18 N 0.18 F 0.14 E 0.12 D 0.05 M 0.04 I 0.03 L 0.01 C Shift Assignments>> C :: 177.981(D) CA :: 55.645(D) CB :: 37.653(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.076(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 :: 117.038(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.88 L 0.06 C 0.03 HN Overlap>> 2.G10 2.G10 C Shift Assignments>> C :: 175.893 CA :: 46.290 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.104(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.979(D) Ave N Shift Values>> N :: 109.67(3.87) 1.L83 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.21 K 0.2 D 0.17 F 0.14 Y 0.11 C 0.06 R 0.03 N 0.02 I 0.01 C Shift Assignments>> C :: 178.143 CA :: 56.222(D) CB :: 41.459(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.059(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 :: 122.336(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Q84 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 K 0.14 R 0.12 C 0.12 W 0.11 H 0.11 E 0.1 L 0.06 I 0.03 M 0.01 C Shift Assignments>> C :: 176.338(D) CA :: 56.644(D) CB :: 28.211(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.670(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.072(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.N85 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.55 D 0.14 C 0.1 Y 0.07 F 0.06 L 0.03 M 0.01 C Shift Assignments>> C :: 175.025(D) CA :: 53.099(D) CB :: 38.501(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.737(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 :: 117.482(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T86 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.464(D) CA :: 61.920(D) CB :: 69.187(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.729(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 :: 114.885(D) Ave N Shift Values>> N :: 115.42(4.75) 1.R87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.15 H 0.14 E 0.14 W 0.14 C 0.13 Q 0.11 M 0.07 K 0.06 V 0.01 C Shift Assignments>> C :: 180.811(D) CA :: 56.995 CB :: 30.507 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 :: 7.781(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 128.943(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) 2.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.G2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.25 L 0.23 K 0.15 F 0.11 Y 0.08 C 0.05 N 0.05 R 0.02 HN Overlap>> 2.R69 2.R69 C Shift Assignments>> C :: 177.681 CA :: 55.142 CB :: 41.321 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 :: 8.310 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 :: 122.661 Ave N Shift Values>> N :: 121.86(3.9) 2.S4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.806 CA :: 58.363 CB :: 62.951 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.250 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.429 Ave N Shift Values>> N :: 116.28(3.52) 2.S5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.11 C 0.11 F 0.11 W 0.09 S 0.09 E 0.08 K 0.06 R 0.06 H 0.05 Q 0.05 M 0.04 L 0.02 I 0.02 V 0.01 T 0.01 D 0.01 C Shift Assignments>> C :: 174.655 CA :: 58.199 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.103 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 :: 117.899 Ave N Shift Values>> N :: 116.28(3.52) 2.I6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.43 C 0.23 Y 0.15 F 0.11 E 0.04 V 0.01 C Shift Assignments>> C :: 175.991(D) CA :: 61.327(D) CB :: 37.489(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.788(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 :: 121.622(D) Ave N Shift Values>> N :: 121.46(4.28) 2.F7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.1 W 0.09 K 0.09 R 0.08 F 0.08 C 0.08 Y 0.08 H 0.07 Q 0.07 M 0.06 S 0.05 L 0.04 D 0.02 I 0.01 HN Overlap>> 1.K17 1.K17 C Shift Assignments>> C :: 176.237(D) CA :: 57.368(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.006(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 :: 122.507(D) Ave N Shift Values>> N :: 120.45(4.18) 2.G8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 L 0.15 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 174.540 CA :: 44.933 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.079 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.923 Ave N Shift Values>> N :: 109.67(3.87) 2.G9 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent C Shift Assignments>> C :: 174.488 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.927 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.891 Ave N Shift Values>> N :: 109.67(3.87) 2.G10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.47 L 0.25 R 0.14 C 0.04 F 0.03 D 0.02 Y 0.01 HN Overlap>> 1.G82 1.G82 C Shift Assignments>> C :: 173.353 CA :: 44.430 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.121 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.059 Ave N Shift Values>> N :: 109.67(3.87) 2.A11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.11 C Shift Assignments>> C :: 175.794 CA :: 50.155 CB :: 17.360 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.040 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.120 Ave N Shift Values>> N :: 123.23(3.54) 2.P12 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.S13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.048 CB :: 63.337 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.218 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 :: 121.853 Ave N Shift Values>> N :: 116.28(3.52) 2.Q14 Overall: Mistyped Typing: Mistyped SRO: Suspicious C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 2.E17 2.E17 C Shift Assignments>> CA :: 55.516 CB :: 62.988(A) 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 :: 8.247 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 :: 122.324 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) SRO Rule Breaks>> (CA > CB : 1.0000) 2.Q15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> W 0.1 E 0.1 F 0.08 K 0.08 C 0.08 Y 0.08 R 0.08 H 0.07 Q 0.07 S 0.05 M 0.05 L 0.04 D 0.01 I 0.01 C Shift Assignments>> C :: 175.858(D) CA :: 57.477 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 :: 8.292(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 :: 119.518(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.K16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.18 K 0.15 C 0.14 R 0.13 H 0.12 W 0.09 E 0.08 Q 0.05 V 0.01 C Shift Assignments>> C :: 176.580(D) CA :: 56.125(D) CB :: 31.986(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.221(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 :: 123.260(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.E17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 K 0.14 H 0.14 W 0.12 E 0.12 R 0.11 C 0.11 M 0.04 I 0.01 L 0.01 HN Overlap>> 2.Q14 2.Q14 C Shift Assignments>> C :: 176.207(D) CA :: 56.117(D) CB :: 29.280(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.317(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.401(D) Ave N Shift Values>> N :: 120.67(3.48) 2.A18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.83 M 0.14 C 0.01 C Shift Assignments>> C :: 177.507(D) CA :: 52.057(D) CB :: 18.325(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.190(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.583(D) Ave N Shift Values>> N :: 123.23(3.54) 2.A19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.84 M 0.13 C 0.01 C Shift Assignments>> C :: 178.065(D) CA :: 52.164(D) CB :: 18.511 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.155(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.437(D) Ave N Shift Values>> N :: 123.23(3.54) 2.T20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.T22 1.T22 C Shift Assignments>> C :: 174.771(D) CA :: 61.426 CB :: 69.130(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.986(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 :: 113.351(D) Ave N Shift Values>> N :: 115.42(4.75) 2.T21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.13 C 0.12 Y 0.1 F 0.1 W 0.09 I 0.06 E 0.06 K 0.04 R 0.04 V 0.04 T 0.04 H 0.04 Q 0.03 M 0.02 L 0.01 C Shift Assignments>> C :: 174.275(D) CA :: 59.227 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 :: 7.943(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.414(D) Ave N Shift Values>> N :: 115.42(4.75) 2.A22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.83 M 0.14 C 0.01 HN Overlap>> 2.A30 2.A30 C Shift Assignments>> C :: 177.488 CA :: 52.118 CB :: 18.339 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.136 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.833 Ave N Shift Values>> N :: 123.23(3.54) 2.K23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.19 K 0.15 C 0.14 R 0.13 H 0.13 W 0.09 E 0.07 Q 0.05 V 0.01 HN Overlap>> 2.E32 2.E32 C Shift Assignments>> C :: 176.704 CA :: 55.809 CB :: 31.966 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 :: 8.173 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 :: 121.110 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.T24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.275 CA :: 61.062 CB :: 69.321 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 :: 7.991 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.434 Ave N Shift Values>> N :: 115.42(4.75) 2.T25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.13 C 0.13 Y 0.1 F 0.1 W 0.08 I 0.06 E 0.05 K 0.04 R 0.04 V 0.04 T 0.04 H 0.03 Q 0.03 M 0.02 L 0.01 C Shift Assignments>> C :: 172.702 CA :: 59.277 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 :: 8.126 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 :: 119.500 Ave N Shift Values>> N :: 115.42(4.75) 2.P26 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.N27 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.P28 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.I29 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.31 N 0.24 D 0.12 L 0.06 M 0.04 H 0.03 C 0.03 R 0.02 Q 0.02 W 0.01 K 0.01 F 0.01 Y 0.01 HN Overlap>> 2.A22 2.A22 C Shift Assignments>> C :: 177.460 CA :: 52.591 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.125(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.878(D) Ave N Shift Values>> N :: 123.23(3.54) 2.K31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.35 P 0.28 C 0.2 W 0.05 K 0.02 R 0.02 I 0.01 H 0.01 E 0.01 C Shift Assignments>> CA :: 62.156 CB :: 32.007 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 :: 7.896 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 :: 119.787 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.E32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.15 K 0.14 H 0.13 W 0.13 E 0.13 C 0.11 R 0.11 M 0.03 I 0.01 L 0.01 HN Overlap>> 2.K23 2.K23 C Shift Assignments>> C :: 176.855 CA :: 56.728 CB :: 29.214 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 :: 8.108 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 :: 121.093 Ave N Shift Values>> N :: 120.67(3.48) 2.L33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.22 L 0.22 K 0.16 F 0.14 Y 0.1 C 0.06 N 0.04 R 0.02 HN Overlap>> 1.K17 1.K17 2.A91 2.A91 C Shift Assignments>> C :: 177.595 CA :: 55.672 CB :: 41.241 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 :: 7.890 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 :: 122.403 Ave N Shift Values>> N :: 121.86(3.9) 2.K34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.15 M 0.14 K 0.13 R 0.13 H 0.12 W 0.11 E 0.09 Q 0.05 V 0.02 HN Overlap>> 2.I37 2.I37 C Shift Assignments>> C :: 176.733 CA :: 57.166 CB :: 31.757 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 :: 7.948 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 :: 120.110 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.N35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.25 L 0.19 F 0.16 Y 0.13 K 0.08 C 0.07 N 0.07 I 0.01 HN Overlap>> 1.K18 1.Q39 1.K18 1.Q39 C Shift Assignments>> C :: 177.692(D) CA :: 55.539 CB :: 40.742(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.809(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 :: 121.011(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.Q36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.1 R 0.09 Q 0.09 H 0.09 E 0.09 W 0.08 M 0.07 C 0.07 F 0.06 Y 0.06 L 0.05 S 0.04 D 0.02 HN Overlap>> 1.N76 1.N76 C Shift Assignments>> CA :: 56.937 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 :: 8.047 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 :: 120.463 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.I37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.55 C 0.18 Y 0.13 F 0.11 HN Overlap>> 2.A67 2.K34 2.A67 2.K34 C Shift Assignments>> CA :: 62.185 CB :: 38.305 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 :: 7.903 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 :: 120.030 Ave N Shift Values>> N :: 121.46(4.28) 2.A38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.67 M 0.3 C 0.01 C Shift Assignments>> C :: 178.690 CA :: 53.333 CB :: 18.026 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.027(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.835(D) Ave N Shift Values>> N :: 123.23(3.54) 2.Q39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.14 K 0.14 Q 0.13 W 0.13 E 0.11 R 0.1 H 0.1 I 0.06 L 0.03 M 0.01 HN Overlap>> 1.C64 1.C64 C Shift Assignments>> C :: 176.988 CA :: 57.856(D) CB :: 28.325 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 :: 8.058(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 :: 118.849(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.E40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.15 Q 0.14 C 0.13 W 0.13 E 0.12 H 0.11 R 0.08 I 0.04 L 0.03 M 0.02 C Shift Assignments>> C :: 177.491 CA :: 57.516 CB :: 28.560(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.234(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 :: 120.629(D) Ave N Shift Values>> N :: 120.67(3.48) 2.L41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.22 L 0.22 K 0.16 F 0.13 Y 0.1 C 0.06 N 0.04 R 0.02 C Shift Assignments>> C :: 177.297 CA :: 55.644 CB :: 41.257 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 :: 7.956(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 :: 121.386(D) Ave N Shift Values>> N :: 121.86(3.9) 2.A42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.73 M 0.24 C 0.01 C Shift Assignments>> C :: 178.146(D) CA :: 52.880(D) CB :: 18.056(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.922(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.364(D) Ave N Shift Values>> N :: 123.23(3.54) 2.V43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.37 V 0.33 C 0.16 W 0.04 I 0.02 R 0.01 C Shift Assignments>> C :: 176.505 CA :: 62.770 CB :: 31.523 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 :: 7.597 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 :: 116.745 Ave N Shift Values>> N :: 121.14(4.54) 2.A44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.7 M 0.27 C 0.01 C Shift Assignments>> C :: 177.889 CA :: 53.157 CB :: 18.057 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.984(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.275(D) Ave N Shift Values>> N :: 123.23(3.54) 2.N45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.53 C 0.11 D 0.11 Y 0.08 F 0.07 L 0.03 E 0.02 M 0.01 HN Overlap>> 1.F40 1.F40 C Shift Assignments>> C :: 175.624 CA :: 53.416 CB :: 38.216 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 :: 8.108(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 :: 117.242(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.A46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.82 M 0.16 C 0.01 HN Overlap>> 2.A79 2.A79 C Shift Assignments>> C :: 177.919(D) CA :: 52.198(D) CB :: 18.261(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.993 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.736 Ave N Shift Values>> N :: 123.23(3.54) 2.T47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.810 CA :: 61.459(D) CB :: 69.158(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.987(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 :: 114.019(D) Ave N Shift Values>> N :: 115.42(4.75) 2.E48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.14 C 0.12 T 0.1 S 0.1 V 0.1 F 0.08 Y 0.08 W 0.07 E 0.03 K 0.02 R 0.02 H 0.02 Q 0.01 M 0.01 P 0.01 HN Overlap>> 2.S64 2.S64 C Shift Assignments>> C :: 178.636 CA :: 60.299 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 :: 8.152 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 :: 120.299 Ave N Shift Values>> N :: 120.67(3.48) 2.L49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.26 F 0.25 C 0.14 D 0.11 L 0.07 N 0.06 I 0.05 C Shift Assignments>> C :: 178.223 CA :: 56.754 CB :: 39.248 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 :: 7.873(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 :: 116.250(D) Ave N Shift Values>> N :: 121.86(3.9) 2.V50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.11 H 0.09 L 0.09 Q 0.09 R 0.08 K 0.08 E 0.06 W 0.06 C 0.05 D 0.05 F 0.05 Y 0.04 S 0.02 N 0.02 A 0.01 HN Overlap>> 1.S59 1.S59 C Shift Assignments>> C :: 176.292 CA :: 56.064 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 :: 8.934(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 :: 117.484(D) Ave N Shift Values>> N :: 121.14(4.54) 2.N51 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.24 T 0.19 V 0.18 C 0.08 P 0.05 F 0.04 S 0.04 Y 0.04 W 0.03 E 0.01 R 0.01 K 0.01 C Shift Assignments>> C :: 177.097 CA :: 61.471(S) 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 :: 8.832(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 124.627(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.K52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.12 Y 0.11 F 0.11 S 0.1 W 0.09 E 0.07 K 0.06 R 0.06 H 0.05 Q 0.05 M 0.03 I 0.02 L 0.02 V 0.01 T 0.01 C Shift Assignments>> C :: 178.646 CA :: 58.354 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 :: 7.448(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 :: 115.887(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.I53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.1 K 0.09 Q 0.09 H 0.09 E 0.08 M 0.08 W 0.07 C 0.06 F 0.06 Y 0.06 L 0.06 S 0.03 D 0.03 C Shift Assignments>> C :: 178.615 CA :: 56.793(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.588(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 :: 114.116(D) Ave N Shift Values>> N :: 121.46(4.28) 2.S54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 HN Overlap>> 1.D74 1.D74 C Shift Assignments>> C :: 174.704 CA :: 62.696 CB :: 61.543 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.412(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 :: 118.989(D) Ave N Shift Values>> N :: 116.28(3.52) 2.E55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.19 I 0.18 W 0.14 K 0.11 E 0.09 Q 0.08 R 0.07 H 0.07 L 0.01 C Shift Assignments>> C :: 178.677 CA :: 59.633 CB :: 28.430 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 :: 8.726(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 124.973(D) Ave N Shift Values>> N :: 120.67(3.48) 2.N56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 F 0.23 C 0.18 N 0.07 D 0.07 I 0.06 L 0.04 E 0.03 M 0.01 HN Overlap>> 1.D54 1.D54 C Shift Assignments>> C :: 177.540 CA :: 56.836 CB :: 38.599 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 :: 7.712 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 :: 117.845 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.C57 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.F58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.26 V 0.22 P 0.17 T 0.16 I 0.12 C 0.02 HN Overlap>> 1.I20 1.E25 1.I20 1.E25 C Shift Assignments>> C :: 176.961 CA :: 64.778 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 :: 7.828 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 :: 120.275 Ave N Shift Values>> N :: 120.45(4.18) 2.E59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.15 W 0.12 K 0.12 Q 0.12 R 0.12 E 0.1 H 0.09 I 0.08 L 0.04 M 0.01 HN Overlap>> 1.T75 1.T75 C Shift Assignments>> C :: 177.479 CA :: 58.226 CB :: 28.127 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 :: 8.053 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 :: 119.744 Ave N Shift Values>> N :: 120.67(3.48) 2.K60 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.7 C 0.18 Y 0.04 V 0.03 F 0.03 C Shift Assignments>> C :: 178.057 CA :: 64.540(S) CB :: 37.498 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 :: 7.973(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 :: 118.416(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.C61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.24 L 0.22 K 0.14 F 0.13 Y 0.1 C 0.06 N 0.05 R 0.01 C Shift Assignments>> C :: 174.281 CA :: 55.392 CB :: 41.173 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.674(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 112.733(D) Ave N Shift Values>> N :: 120.17(4.64) 2.L62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.3 D 0.25 R 0.14 K 0.1 F 0.04 C 0.04 N 0.03 Y 0.03 G 0.01 C Shift Assignments>> C :: 175.292 CA :: 53.443(D) CB :: 42.519(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.749(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 :: 121.840(D) Ave N Shift Values>> N :: 121.86(3.9) 2.T63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 172.993(D) CA :: 59.032(D) CB :: 70.819(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.862(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 :: 113.573(D) Ave N Shift Values>> N :: 115.42(4.75) 2.S64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 2.E48 2.E48 C Shift Assignments>> CA :: 56.016 CB :: 62.084 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.128 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.334 Ave N Shift Values>> N :: 116.28(3.52) 2.P65 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Y66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.27 V 0.2 K 0.12 W 0.08 M 0.06 R 0.06 Q 0.05 H 0.05 E 0.04 P 0.01 C Shift Assignments>> C :: 174.499(D) CA :: 59.939(D) CB :: 32.690(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.949(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 :: 118.953(D) Ave N Shift Values>> N :: 120.52(4.2) 2.A67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.8 M 0.16 C 0.01 HN Overlap>> 2.I37 2.I37 C Shift Assignments>> C :: 177.774(D) CA :: 53.130(D) CB :: 18.895(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.908(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.999(D) Ave N Shift Values>> N :: 123.23(3.54) 2.T68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.557(D) CA :: 59.784(D) CB :: 70.312(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.632(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 :: 110.593(D) Ave N Shift Values>> N :: 115.42(4.75) 2.R69 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.15 H 0.15 C 0.12 W 0.12 M 0.12 E 0.11 Q 0.09 K 0.09 HN Overlap>> 2.L3 2.L3 C Shift Assignments>> C :: 175.738(D) CA :: 56.106(D) CB :: 31.022 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 :: 8.331(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 :: 122.711(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) 2.N70 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.66 C 0.17 M 0.03 D 0.03 Y 0.02 F 0.02 E 0.02 HN Overlap>> 2.Y92 2.Y92 C Shift Assignments>> C :: 174.771(D) CA :: 51.113(D) CB :: 37.039 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 :: 8.781(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 :: 120.393(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.D71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.29 C 0.15 I 0.1 D 0.06 L 0.05 N 0.02 C Shift Assignments>> C :: 177.281(D) CA :: 57.821(D) CB :: 39.421(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 :: 8.251(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 :: 122.997(D) Ave N Shift Values>> N :: 120.65(3.86) 2.A72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.65 A 0.3 I 0.02 C 0.01 C Shift Assignments>> C :: 179.782(D) CA :: 54.668(D) CB :: 16.897(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.394(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.049(D) Ave N Shift Values>> N :: 123.23(3.54) 2.C73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.26 E 0.2 Y 0.18 I 0.14 F 0.12 M 0.03 K 0.01 C Shift Assignments>> C :: 176.347 CA :: 58.844(D) CB :: 36.986 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 6.847(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.196(D) Ave N Shift Values>> N :: 120.17(4.64) 2.I74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.53 C 0.25 I 0.09 P 0.07 C Shift Assignments>> C :: 177.446 CA :: 63.586 CB :: 34.535 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 :: 7.602(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 :: 121.082(D) Ave N Shift Values>> N :: 121.46(4.28) 2.D75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.29 F 0.28 C 0.15 I 0.08 D 0.07 L 0.06 N 0.03 HN Overlap>> 2.Q97 2.Q97 C Shift Assignments>> C :: 180.148 CA :: 57.424 CB :: 39.331 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 :: 8.048 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 :: 120.239 Ave N Shift Values>> N :: 120.65(3.86) 2.Q76 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.17 W 0.15 K 0.12 E 0.12 Q 0.1 I 0.1 H 0.09 R 0.08 M 0.01 V 0.01 HN Overlap>> 1.V80 1.V80 C Shift Assignments>> CA :: 59.121 CB :: 29.013 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 :: 8.233(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 :: 119.942(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.C77 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L78 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.23 L 0.22 K 0.16 F 0.12 Y 0.09 C 0.06 N 0.04 R 0.02 C Shift Assignments>> C :: 177.602(D) CA :: 55.441(D) CB :: 41.308 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 :: 7.835(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 :: 121.319(D) Ave N Shift Values>> N :: 121.86(3.9) 2.A79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.77 M 0.2 C 0.01 HN Overlap>> 2.A46 2.A46 C Shift Assignments>> C :: 178.035(D) CA :: 52.574(D) CB :: 18.132(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.026(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.668(D) Ave N Shift Values>> N :: 123.23(3.54) 2.K80 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.18 R 0.17 I 0.13 W 0.12 Q 0.12 E 0.08 H 0.08 L 0.06 C Shift Assignments>> C :: 177.478 CA :: 58.539 CB :: 27.715 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 :: 8.024(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 :: 120.958(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.Y81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.21 F 0.2 C 0.15 Y 0.13 K 0.09 I 0.08 G 0.06 L 0.05 C Shift Assignments>> C :: 175.429 CA :: 60.633 CB :: 42.929 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 :: 9.231(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 :: 120.878(D) Ave N Shift Values>> N :: 120.52(4.2) 2.M82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.3 Y 0.28 C 0.13 I 0.1 L 0.07 D 0.06 K 0.01 N 0.01 C Shift Assignments>> C :: 178.146 CA :: 58.107 CB :: 39.977 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 :: 8.890(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 :: 122.685(D) Ave N Shift Values>> N :: 120.09(3.57) 2.R83 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.S84 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.W85 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.N86 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.5 P 0.21 C 0.13 I 0.13 C Shift Assignments>> C :: 178.740 CA :: 66.275 CB :: 30.553 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 :: 7.958(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 :: 117.916(D) Ave N Shift Values>> N :: 121.14(4.54) 2.I88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.53 C 0.26 I 0.09 P 0.07 C Shift Assignments>> C :: 177.575 CA :: 63.514 CB :: 34.518 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 :: 8.439 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 :: 121.608 Ave N Shift Values>> N :: 121.46(4.28) 2.S89 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 177.536 CA :: 61.385(D) CB :: 62.281 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.577(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.388(D) Ave N Shift Values>> N :: 116.28(3.52) 2.K90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.2 W 0.14 R 0.12 E 0.11 H 0.1 K 0.09 M 0.07 V 0.07 Q 0.05 I 0.01 C Shift Assignments>> C :: 179.431 CA :: 59.057(D) CB :: 31.334 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 :: 7.599(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 :: 119.402(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.A91 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.52 A 0.44 I 0.01 C 0.01 HN Overlap>> 1.K17 2.L33 1.K17 2.L33 C Shift Assignments>> C :: 180.003(D) CA :: 54.332(D) CB :: 17.513(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.918(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.406(D) Ave N Shift Values>> N :: 123.23(3.54) 2.Y92 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.4 Y 0.2 C 0.19 F 0.16 E 0.01 HN Overlap>> 2.N70 2.N70 C Shift Assignments>> C :: 176.828 CA :: 60.951(D) CB :: 38.308(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.864(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 :: 120.441(D) Ave N Shift Values>> N :: 120.52(4.2) 2.I93 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.47 C 0.27 V 0.17 Y 0.03 F 0.02 C Shift Assignments>> C :: 178.311(D) CA :: 63.878(D) CB :: 36.233 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 :: 8.493(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 :: 118.548(D) Ave N Shift Values>> N :: 121.46(4.28) 2.S94 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 176.187(D) CA :: 61.254(D) CB :: 62.294(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.736(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 :: 113.947(D) Ave N Shift Values>> N :: 116.28(3.52) 2.R95 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.16 K 0.15 C 0.13 W 0.12 H 0.11 E 0.11 R 0.08 L 0.05 I 0.03 M 0.02 C Shift Assignments>> C :: 178.629(D) CA :: 56.902(D) CB :: 28.406 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 :: 7.373(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 :: 120.937(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) 2.I96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.46 C 0.28 V 0.09 Y 0.06 F 0.04 E 0.02 C Shift Assignments>> C :: 177.823 CA :: 62.761(D) CB :: 36.513(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.796(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 :: 117.707(D) Ave N Shift Values>> N :: 121.46(4.28) 2.Q97 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.17 Q 0.14 C 0.13 K 0.11 W 0.1 L 0.1 H 0.09 E 0.08 I 0.04 M 0.01 HN Overlap>> 2.D75 2.D75 C Shift Assignments>> C :: 176.800(D) CA :: 56.982(D) CB :: 27.816(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.008(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 :: 120.247(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.N98 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.51 D 0.12 C 0.11 Y 0.08 F 0.07 L 0.03 E 0.01 M 0.01 C Shift Assignments>> C :: 175.385(D) CA :: 53.484(D) CB :: 38.276(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.851(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 :: 118.138(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.A99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.75 M 0.22 C 0.01 C Shift Assignments>> C :: 178.074(D) CA :: 52.877(D) CB :: 18.215(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.931(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.971(D) Ave N Shift Values>> N :: 123.23(3.54) 2.S100 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.771(D) CA :: 58.293(D) CB :: 62.999(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.052(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 :: 114.494(D) Ave N Shift Values>> N :: 116.28(3.52) 2.A101 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.79 M 0.19 C 0.01 C Shift Assignments>> C :: 177.895(D) CA :: 52.478(D) CB :: 18.184(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.076(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.888(D) Ave N Shift Values>> N :: 123.23(3.54) 2.S102 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 175.006 CA :: 58.124 CB :: 63.165 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.066(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 :: 114.369(D) Ave N Shift Values>> N :: 116.28(3.52) 2.G103 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.71 L 0.16 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.841(D) CA :: 44.903(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.128(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.033(D) Ave N Shift Values>> N :: 109.67(3.87) 2.E104 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.15 H 0.14 E 0.13 W 0.13 K 0.12 R 0.12 C 0.11 M 0.04 I 0.01 HN Overlap>> 1.D14 1.E19 1.D14 1.E19 C Shift Assignments>> C :: 175.454(D) CA :: 56.172(D) CB :: 29.538(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.067(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 :: 121.327(D) Ave N Shift Values>> N :: 120.67(3.48) 2.I105 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.56 C 0.16 Y 0.14 F 0.12 C Shift Assignments>> C :: 180.833(D) CA :: 62.308(D) CB :: 38.719(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.562(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.699(D) Ave N Shift Values>> N :: 121.46(4.28) ########################################################################### Overall Results: #Consistent: 63 #Clerical: 125 #Suspicious: 0 #Anomalous: 0 #Mistyped: 4 #Indeterminable: 0 Typing Results: #Consistent: 162 #Suspicious: 0 #Mistyped: 4 #Indeterminable: 26 Shift Relative Order (SRO) Results: #Consistent: 191 #Suspicious: 1 C Shift Results: #Consistent: 244 #Duplicate: 218 #Unknown: 0 #Suspicious: 2 #Anomalous: 2 H Shift Results: #Consistent: 43 #Duplicate: 125 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 43 #Duplicate: 125 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.D8 C = 177.069(D), Expected = 176.40, Std = 1.7500, ChiSquare = 7.0225e-01 1.D8 CA = 54.852(D), Expected = 54.69, Std = 2.0300, ChiSquare = 9.3639e-01 1.D8 CB = 41.477(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.1249e-01 1.D8 H = 8.107(D), Expected = 8.31, Std = 0.5800, ChiSquare = 7.2634e-01 1.D8 N = 123.848(D), Expected = 120.65, Std = 3.8600, ChiSquare = 4.0739e-01 1.L9 CA = 57.412(D), Expected = 55.62, Std = 2.1300, ChiSquare = 4.0017e-01 1.L9 H = 8.498(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.8011e-01 1.L9 N = 117.621(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.7707e-01 1.A10 CA = 52.597(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.8390e-01 1.A10 CB = 18.094(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.1669e-01 1.A10 H = 7.878(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.9150e-01 1.A10 N = 122.944(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.3561e-01 1.S11 CA = 57.991(D), Expected = 58.72, Std = 2.0700, ChiSquare = 7.2471e-01 1.S11 CB = 63.064(D), Expected = 63.80, Std = 1.4800, ChiSquare = 6.1898e-01 1.S11 H = 7.922(D), Expected = 8.28, Std = 0.5900, ChiSquare = 5.4400e-01 1.S11 N = 114.232(D), Expected = 116.28, Std = 3.5200, ChiSquare = 5.6069e-01 1.L12 H = 7.718(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.3088e-01 1.L12 N = 123.400(D), Expected = 121.86, Std = 3.9000, ChiSquare = 6.9294e-01 1.D13 C = 175.988(D), Expected = 176.40, Std = 1.7500, ChiSquare = 8.1388e-01 1.D13 CA = 53.931(D), Expected = 54.69, Std = 2.0300, ChiSquare = 7.0848e-01 1.D13 CB = 41.270(D), Expected = 40.88, Std = 1.6200, ChiSquare = 8.0976e-01 1.D13 H = 8.053(D), Expected = 8.31, Std = 0.5800, ChiSquare = 6.5769e-01 1.D13 N = 120.812(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.6652e-01 1.D14 CA = 54.695(D), Expected = 54.69, Std = 2.0300, ChiSquare = 9.9803e-01 1.D14 CB = 40.437(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.8450e-01 1.D14 H = 8.117(D), Expected = 8.31, Std = 0.5800, ChiSquare = 7.3932e-01 1.D14 N = 121.286(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.6913e-01 1.T15 CA = 63.080(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.3985e-01 1.T15 CB = 68.609(D), Expected = 69.73, Std = 1.6300, ChiSquare = 4.9162e-01 1.S16 C = 174.870(D), Expected = 174.62, Std = 1.7200, ChiSquare = 8.8444e-01 1.S16 CA = 59.261(D), Expected = 58.72, Std = 2.0700, ChiSquare = 7.9382e-01 1.S16 CB = 62.770(D), Expected = 63.80, Std = 1.4800, ChiSquare = 4.8646e-01 1.S16 H = 8.103(D), Expected = 8.28, Std = 0.5900, ChiSquare = 7.6418e-01 1.S16 N = 117.457(D), Expected = 116.28, Std = 3.5200, ChiSquare = 7.3810e-01 1.K17 H = 7.957(D), Expected = 8.19, Std = 0.6000, ChiSquare = 6.9777e-01 1.K17 N = 122.483(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.0387e-01 1.E19 CA = 57.844(D), Expected = 57.32, Std = 2.0900, ChiSquare = 8.0203e-01 1.E19 H = 8.095(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.9041e-01 1.E19 N = 121.243(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.6922e-01 1.T22 H = 7.982(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.7732e-01 1.T22 N = 113.354(D), Expected = 115.42, Std = 4.7500, ChiSquare = 6.6360e-01 1.F23 H = 7.909(D), Expected = 8.36, Std = 0.7200, ChiSquare = 5.3106e-01 1.F23 N = 121.564(D), Expected = 120.45, Std = 4.1800, ChiSquare = 7.8985e-01 1.L24 H = 7.956(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.7336e-01 1.L24 N = 121.676(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.6237e-01 1.E25 H = 7.808(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.7629e-01 1.E25 N = 120.290(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.1305e-01 1.G26 C = 174.498(D), Expected = 173.87, Std = 1.8800, ChiSquare = 7.3835e-01 1.G26 CA = 44.962(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.7216e-01 1.G26 H = 7.930(D), Expected = 8.33, Std = 0.6500, ChiSquare = 5.3830e-01 1.G26 N = 108.227(D), Expected = 109.67, Std = 3.8700, ChiSquare = 7.0925e-01 1.E27 C = 175.494(D), Expected = 176.87, Std = 1.9500, ChiSquare = 4.8041e-01 1.E27 CA = 56.136(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.7105e-01 1.E27 CB = 29.524(D), Expected = 30.01, Std = 1.7200, ChiSquare = 7.7752e-01 1.E27 H = 8.053(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.3872e-01 1.E27 N = 120.600(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.8395e-01 1.Q31 Typing: Mistyped 1.Q31 CB = 17.642(A), Expected = 29.19, Std = 1.8200, ChiSquare = 2.2235e-10 1.K32 CA = 60.453(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.1132e-01 1.K32 CB = 32.668(D), Expected = 32.79, Std = 1.7800, ChiSquare = 9.4536e-01 1.K32 H = 8.819(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.9449e-01 1.K32 N = 119.956(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.7167e-01 1.V33 CA = 62.135(D), Expected = 62.49, Std = 2.8600, ChiSquare = 9.0122e-01 1.V33 H = 9.718(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.3061e-02 1.V33 N = 126.804(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.1219e-01 1.Q34 H = 8.609(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.0969e-01 1.Q34 N = 118.082(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.1551e-01 1.H38 H = 8.013(D), Expected = 8.24, Std = 0.6800, ChiSquare = 7.3851e-01 1.H38 N = 121.944(D), Expected = 119.69, Std = 4.0000, ChiSquare = 5.7309e-01 1.Q39 H = 7.699(D), Expected = 8.22, Std = 0.5900, ChiSquare = 3.7721e-01 1.Q39 N = 120.998(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.5825e-01 1.T41 H = 8.553(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.1367e-01 1.T41 N = 117.890(D), Expected = 115.42, Std = 4.7500, ChiSquare = 6.0306e-01 1.N42 H = 7.419(D), Expected = 8.34, Std = 0.6300, ChiSquare = 1.4377e-01 1.N42 N = 119.394(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.0834e-01 1.I43 CA = 64.149(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.4344e-01 1.I43 H = 7.460(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.2786e-01 1.I43 N = 116.517(D), Expected = 121.46, Std = 4.2800, ChiSquare = 2.4813e-01 1.F45 CA = 62.733(D), Expected = 58.08, Std = 2.5700, ChiSquare = 7.0218e-02 1.F45 CB = 38.864(D), Expected = 39.99, Std = 2.0900, ChiSquare = 5.9006e-01 1.F45 H = 9.397(D), Expected = 8.36, Std = 0.7200, ChiSquare = 1.4979e-01 1.F45 N = 124.373(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.4798e-01 1.K46 C = 178.663(D), Expected = 176.64, Std = 2.0000, ChiSquare = 3.1178e-01 1.K46 CA = 59.194(D), Expected = 56.95, Std = 2.2000, ChiSquare = 3.0773e-01 1.K46 CB = 31.693(D), Expected = 32.79, Std = 1.7800, ChiSquare = 5.3770e-01 1.K46 H = 7.494(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.4605e-01 1.K46 N = 115.272(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.2537e-01 1.K47 C = 176.063(D), Expected = 176.64, Std = 2.0000, ChiSquare = 7.7296e-01 1.K47 CA = 55.872(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.2413e-01 1.K47 CB = 32.926(D), Expected = 32.79, Std = 1.7800, ChiSquare = 9.3910e-01 1.K47 H = 7.188(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.4919e-02 1.K47 N = 113.870(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.6844e-02 1.C48 CA = 63.181(D), Expected = 58.30, Std = 3.3300, ChiSquare = 1.4271e-01 1.C48 H = 8.275(D), Expected = 8.39, Std = 0.6700, ChiSquare = 8.6372e-01 1.C48 N = 116.164(D), Expected = 120.17, Std = 4.6400, ChiSquare = 3.8794e-01 1.E50 C = 176.748(D), Expected = 176.87, Std = 1.9500, ChiSquare = 9.5011e-01 1.E50 CA = 56.896(D), Expected = 57.32, Std = 2.0900, ChiSquare = 8.3924e-01 1.E50 CB = 29.848(D), Expected = 30.01, Std = 1.7200, ChiSquare = 9.2496e-01 1.E50 H = 8.964(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.8256e-01 1.E50 N = 127.544(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.8236e-02 1.S51 C = 173.325(D), Expected = 174.62, Std = 1.7200, ChiSquare = 4.5151e-01 1.S51 CA = 56.177(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.1926e-01 1.S51 CB = 64.359(D), Expected = 63.80, Std = 1.4800, ChiSquare = 7.0565e-01 1.S51 H = 7.717(D), Expected = 8.28, Std = 0.5900, ChiSquare = 3.3996e-01 1.S51 N = 112.332(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.6204e-01 1.V52 C = 173.619(D), Expected = 175.62, Std = 1.9000, ChiSquare = 2.9227e-01 1.V52 CA = 60.717(D), Expected = 62.49, Std = 2.8600, ChiSquare = 5.3530e-01 1.V52 CB = 30.576(D), Expected = 32.73, Std = 1.7900, ChiSquare = 2.2884e-01 1.V52 H = 8.752(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.9048e-01 1.V52 N = 120.236(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.4217e-01 1.N53 C = 173.511(D), Expected = 175.27, Std = 1.7900, ChiSquare = 3.2576e-01 1.N53 CA = 50.652(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.2450e-01 1.N53 CB = 38.726(D), Expected = 38.69, Std = 1.6900, ChiSquare = 9.8301e-01 1.N53 H = 7.937(D), Expected = 8.34, Std = 0.6300, ChiSquare = 5.2238e-01 1.N53 N = 118.566(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.2803e-01 1.D54 C = 174.449(D), Expected = 176.40, Std = 1.7500, ChiSquare = 2.6491e-01 1.D54 CA = 52.633(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.1092e-01 1.D54 CB = 41.831(D), Expected = 40.88, Std = 1.6200, ChiSquare = 5.5718e-01 1.D54 H = 7.721(D), Expected = 8.31, Std = 0.5800, ChiSquare = 3.0986e-01 1.D54 N = 117.954(D), Expected = 120.65, Std = 3.8600, ChiSquare = 4.8490e-01 1.S55 C = 173.794(D), Expected = 174.62, Std = 1.7200, ChiSquare = 6.3106e-01 1.S55 CA = 58.530(D), Expected = 58.72, Std = 2.0700, ChiSquare = 9.2687e-01 1.S55 CB = 63.432(D), Expected = 63.80, Std = 1.4800, ChiSquare = 8.0363e-01 1.S55 H = 8.136(D), Expected = 8.28, Std = 0.5900, ChiSquare = 8.0718e-01 1.S55 N = 113.826(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.8570e-01 1.N56 C = 174.829(D), Expected = 175.27, Std = 1.7900, ChiSquare = 8.0540e-01 1.N56 CA = 52.087(D), Expected = 53.54, Std = 1.8800, ChiSquare = 4.3960e-01 1.N56 CB = 39.614(D), Expected = 38.69, Std = 1.6900, ChiSquare = 5.8455e-01 1.N56 H = 7.895(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.7997e-01 1.N56 N = 118.998(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.8654e-01 1.L57 C = 177.867(D), Expected = 176.99, Std = 1.9800, ChiSquare = 6.5782e-01 1.L57 CA = 53.334(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.8316e-01 1.L57 CB = 42.413(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.5631e-01 1.L57 H = 8.325(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.8380e-01 1.L57 N = 120.521(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.3135e-01 1.S58 C = 175.282(D), Expected = 174.62, Std = 1.7200, ChiSquare = 7.0032e-01 1.S58 CA = 56.403(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.6300e-01 1.S58 CB = 64.887(D), Expected = 63.80, Std = 1.4800, ChiSquare = 4.6267e-01 1.S58 H = 9.735(D), Expected = 8.28, Std = 0.5900, ChiSquare = 1.3659e-02 1.S58 N = 122.634(D), Expected = 116.28, Std = 3.5200, ChiSquare = 7.1057e-02 1.Q60 C = 179.196(D), Expected = 176.31, Std = 1.9500, ChiSquare = 1.3887e-01 1.Q60 CA = 59.076(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.4159e-01 1.Q60 CB = 27.363(D), Expected = 29.19, Std = 1.8200, ChiSquare = 3.1545e-01 1.Q60 H = 8.237(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.7701e-01 1.Q60 N = 120.966(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.6502e-01 1.E61 C = 178.708(D), Expected = 176.87, Std = 1.9500, ChiSquare = 3.4590e-01 1.E61 CA = 59.368(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.2713e-01 1.E61 CB = 29.745(D), Expected = 30.01, Std = 1.7200, ChiSquare = 8.7755e-01 1.E61 H = 7.981(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.5417e-01 1.E61 N = 122.068(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.8789e-01 1.E62 C = 178.404(D), Expected = 176.87, Std = 1.9500, ChiSquare = 4.3148e-01 1.E62 CA = 60.494(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.2885e-01 1.E62 CB = 28.718(D), Expected = 30.01, Std = 1.7200, ChiSquare = 4.5255e-01 1.E62 H = 8.507(D), Expected = 8.33, Std = 0.5900, ChiSquare = 7.6418e-01 1.E62 N = 118.826(D), Expected = 120.67, Std = 3.4800, ChiSquare = 5.9619e-01 1.Q63 C = 177.453(D), Expected = 176.31, Std = 1.9500, ChiSquare = 5.5777e-01 1.Q63 CA = 58.269(D), Expected = 56.57, Std = 2.1400, ChiSquare = 4.2724e-01 1.Q63 CB = 28.093(D), Expected = 29.19, Std = 1.8200, ChiSquare = 5.4668e-01 1.Q63 H = 8.104(D), Expected = 8.22, Std = 0.5900, ChiSquare = 8.4413e-01 1.Q63 N = 118.438(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.8670e-01 1.C64 C = 176.340(D), Expected = 174.95, Std = 2.0700, ChiSquare = 5.0190e-01 1.C64 CA = 59.982(D), Expected = 58.30, Std = 3.3300, ChiSquare = 6.1348e-01 1.C64 CB = 34.133(D), Expected = 32.49, Std = 6.0100, ChiSquare = 7.8456e-01 1.C64 H = 8.154(D), Expected = 8.39, Std = 0.6700, ChiSquare = 7.2466e-01 1.C64 N = 118.874(D), Expected = 120.17, Std = 4.6400, ChiSquare = 7.8001e-01 1.L65 C = 178.015(D), Expected = 176.99, Std = 1.9800, ChiSquare = 6.0468e-01 1.L65 CA = 58.419(D), Expected = 55.62, Std = 2.1300, ChiSquare = 1.8882e-01 1.L65 CB = 41.901(D), Expected = 42.31, Std = 1.8800, ChiSquare = 8.2778e-01 1.L65 H = 8.513(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.6328e-01 1.L65 N = 121.310(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.8785e-01 1.S66 CA = 61.095(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.5124e-01 1.S66 CB = 62.136(D), Expected = 63.80, Std = 1.4800, ChiSquare = 2.6088e-01 1.S66 H = 7.868(D), Expected = 8.28, Std = 0.5900, ChiSquare = 4.8499e-01 1.S66 N = 112.955(D), Expected = 116.28, Std = 3.5200, ChiSquare = 3.4486e-01 1.N67 CA = 55.452(D), Expected = 53.54, Std = 1.8800, ChiSquare = 3.0914e-01 1.N67 H = 8.687(D), Expected = 8.34, Std = 0.6300, ChiSquare = 5.8178e-01 1.N67 N = 121.382(D), Expected = 118.93, Std = 4.0300, ChiSquare = 5.4290e-01 1.C68 CA = 60.491(D), Expected = 58.30, Std = 3.3300, ChiSquare = 5.1057e-01 1.C68 CB = 42.532(D), Expected = 32.49, Std = 6.0100, ChiSquare = 9.4745e-02 1.C68 H = 9.336(D), Expected = 8.39, Std = 0.6700, ChiSquare = 1.5797e-01 1.C68 N = 121.811(D), Expected = 120.17, Std = 4.6400, ChiSquare = 7.2359e-01 1.V69 C = 176.380(D), Expected = 175.62, Std = 1.9000, ChiSquare = 6.8916e-01 1.V69 CA = 64.721(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.3535e-01 1.V69 CB = 30.027(D), Expected = 32.73, Std = 1.7900, ChiSquare = 1.3103e-01 1.V69 H = 7.763(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.3154e-01 1.V69 N = 118.443(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.5248e-01 1.N70 CA = 57.635(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.9392e-02 1.N70 H = 7.566(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.1923e-01 1.N70 N = 120.722(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.5656e-01 1.R71 C = 176.266(D), Expected = 176.41, Std = 2.0300, ChiSquare = 9.4345e-01 1.R71 CA = 57.545(D), Expected = 56.77, Std = 2.3100, ChiSquare = 7.3725e-01 1.R71 CB = 30.795(D), Expected = 30.70, Std = 1.8300, ChiSquare = 9.5860e-01 1.R71 H = 9.223(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.0708e-01 1.R71 N = 117.744(D), Expected = 120.80, Std = 3.6800, ChiSquare = 4.0629e-01 1.F72 CA = 62.367(D), Expected = 58.08, Std = 2.5700, ChiSquare = 9.5297e-02 1.F72 CB = 37.345(D), Expected = 39.99, Std = 2.0900, ChiSquare = 2.0567e-01 1.F72 H = 8.926(D), Expected = 8.36, Std = 0.7200, ChiSquare = 4.3180e-01 1.F72 N = 127.476(D), Expected = 120.45, Std = 4.1800, ChiSquare = 9.2790e-02 1.L73 H = 8.383(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.1391e-01 1.L73 N = 122.145(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.4175e-01 1.D74 CA = 57.283(D), Expected = 54.69, Std = 2.0300, ChiSquare = 2.0148e-01 1.D74 CB = 40.282(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.1203e-01 1.D74 H = 8.395(D), Expected = 8.31, Std = 0.5800, ChiSquare = 8.8349e-01 1.D74 N = 119.004(D), Expected = 120.65, Std = 3.8600, ChiSquare = 6.6980e-01 1.T75 H = 8.000(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.9868e-01 1.T75 N = 119.649(D), Expected = 115.42, Std = 4.7500, ChiSquare = 3.7330e-01 1.R78 CA = 58.542(D), Expected = 56.77, Std = 2.3100, ChiSquare = 4.4302e-01 1.R78 CB = 29.350(D), Expected = 30.70, Std = 1.8300, ChiSquare = 4.6069e-01 1.R78 H = 7.588(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.8514e-01 1.R78 N = 120.023(D), Expected = 120.80, Std = 3.6800, ChiSquare = 8.3278e-01 1.I79 C = 176.703(D), Expected = 175.85, Std = 1.9200, ChiSquare = 6.5685e-01 1.I79 H = 8.268(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.8592e-01 1.I79 N = 121.492(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.9403e-01 1.N81 C = 177.981(D), Expected = 175.27, Std = 1.7900, ChiSquare = 1.2989e-01 1.N81 CA = 55.645(D), Expected = 53.54, Std = 1.8800, ChiSquare = 2.6285e-01 1.N81 CB = 37.653(D), Expected = 38.69, Std = 1.6900, ChiSquare = 5.3947e-01 1.N81 H = 8.076(D), Expected = 8.34, Std = 0.6300, ChiSquare = 6.7518e-01 1.N81 N = 117.038(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.3873e-01 1.G82 H = 8.104(D), Expected = 8.33, Std = 0.6500, ChiSquare = 7.2807e-01 1.G82 N = 108.979(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.5829e-01 1.L83 CA = 56.222(D), Expected = 55.62, Std = 2.1300, ChiSquare = 7.7746e-01 1.L83 CB = 41.459(D), Expected = 42.31, Std = 1.8800, ChiSquare = 6.5079e-01 1.L83 H = 8.059(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.9249e-01 1.L83 N = 122.336(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.0286e-01 1.Q84 C = 176.338(D), Expected = 176.31, Std = 1.9500, ChiSquare = 9.8854e-01 1.Q84 CA = 56.644(D), Expected = 56.57, Std = 2.1400, ChiSquare = 9.7242e-01 1.Q84 CB = 28.211(D), Expected = 29.19, Std = 1.8200, ChiSquare = 5.9064e-01 1.Q84 H = 7.670(D), Expected = 8.22, Std = 0.5900, ChiSquare = 3.5123e-01 1.Q84 N = 117.072(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.3376e-01 1.N85 C = 175.025(D), Expected = 175.27, Std = 1.7900, ChiSquare = 8.9113e-01 1.N85 CA = 53.099(D), Expected = 53.54, Std = 1.8800, ChiSquare = 8.1454e-01 1.N85 CB = 38.501(D), Expected = 38.69, Std = 1.6900, ChiSquare = 9.1096e-01 1.N85 H = 7.737(D), Expected = 8.34, Std = 0.6300, ChiSquare = 3.3850e-01 1.N85 N = 117.482(D), Expected = 118.93, Std = 4.0300, ChiSquare = 7.1937e-01 1.T86 C = 173.464(D), Expected = 174.54, Std = 1.7600, ChiSquare = 5.4096e-01 1.T86 CA = 61.920(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.0779e-01 1.T86 CB = 69.187(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.3904e-01 1.T86 H = 7.729(D), Expected = 8.24, Std = 0.6200, ChiSquare = 4.0983e-01 1.T86 N = 114.885(D), Expected = 115.42, Std = 4.7500, ChiSquare = 9.1032e-01 1.R87 C = 180.811(D), Expected = 176.41, Std = 2.0300, ChiSquare = 3.0160e-02 1.R87 H = 7.781(D), Expected = 8.24, Std = 0.6100, ChiSquare = 4.5178e-01 1.R87 N = 128.943(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.6913e-02 2.I6 C = 175.991(D), Expected = 175.85, Std = 1.9200, ChiSquare = 9.4146e-01 2.I6 CA = 61.327(D), Expected = 61.61, Std = 2.6800, ChiSquare = 9.1590e-01 2.I6 CB = 37.489(D), Expected = 38.63, Std = 2.0200, ChiSquare = 5.7217e-01 2.I6 H = 7.788(D), Expected = 8.28, Std = 0.6800, ChiSquare = 4.6935e-01 2.I6 N = 121.622(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.6981e-01 2.F7 C = 176.237(D), Expected = 175.42, Std = 1.9900, ChiSquare = 6.8140e-01 2.F7 CA = 57.368(D), Expected = 58.08, Std = 2.5700, ChiSquare = 7.8175e-01 2.F7 H = 8.006(D), Expected = 8.36, Std = 0.7200, ChiSquare = 6.2295e-01 2.F7 N = 122.507(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.2264e-01 2.Q14 Typing: Mistyped 2.Q14 CB = 62.988(A), Expected = 29.19, Std = 1.8200, ChiSquare = 5.5859e-77 2.Q14 SRO Rule Break>> CA > CB : 1 2.Q15 C = 175.858(D), Expected = 176.31, Std = 1.9500, ChiSquare = 8.1670e-01 2.Q15 H = 8.292(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.0287e-01 2.Q15 N = 119.518(D), Expected = 119.89, Std = 3.6000, ChiSquare = 9.1770e-01 2.K16 C = 176.580(D), Expected = 176.64, Std = 2.0000, ChiSquare = 9.7607e-01 2.K16 CA = 56.125(D), Expected = 56.95, Std = 2.2000, ChiSquare = 7.0766e-01 2.K16 CB = 31.986(D), Expected = 32.79, Std = 1.7800, ChiSquare = 6.5150e-01 2.K16 H = 8.221(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.5879e-01 2.K16 N = 123.260(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.5774e-01 2.E17 C = 176.207(D), Expected = 176.87, Std = 1.9500, ChiSquare = 7.3386e-01 2.E17 CA = 56.117(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.6489e-01 2.E17 CB = 29.280(D), Expected = 30.01, Std = 1.7200, ChiSquare = 6.7126e-01 2.E17 H = 8.317(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.8242e-01 2.E17 N = 122.401(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.1890e-01 2.A18 C = 177.507(D), Expected = 177.74, Std = 2.1300, ChiSquare = 9.1289e-01 2.A18 CA = 52.057(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.8440e-01 2.A18 CB = 18.325(D), Expected = 19.01, Std = 1.8300, ChiSquare = 7.0817e-01 2.A18 H = 8.190(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.8670e-01 2.A18 N = 125.583(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.0625e-01 2.A19 C = 178.065(D), Expected = 177.74, Std = 2.1300, ChiSquare = 8.7873e-01 2.A19 CA = 52.164(D), Expected = 53.14, Std = 1.9800, ChiSquare = 6.2206e-01 2.A19 H = 8.155(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.4021e-01 2.A19 N = 123.437(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.5337e-01 2.T20 C = 174.771(D), Expected = 174.54, Std = 1.7600, ChiSquare = 8.9558e-01 2.T20 CB = 69.130(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.1280e-01 2.T20 H = 7.986(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.8204e-01 2.T20 N = 113.351(D), Expected = 115.42, Std = 4.7500, ChiSquare = 6.6314e-01 2.T21 C = 174.275(D), Expected = 174.54, Std = 1.7600, ChiSquare = 8.8032e-01 2.T21 H = 7.943(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.3192e-01 2.T21 N = 116.414(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.3424e-01 2.A30 H = 8.125(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.0052e-01 2.A30 N = 126.878(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.0277e-01 2.N35 C = 177.692(D), Expected = 175.27, Std = 1.7900, ChiSquare = 1.7603e-01 2.N35 CB = 40.742(D), Expected = 38.69, Std = 1.6900, ChiSquare = 2.2467e-01 2.N35 H = 7.809(D), Expected = 8.34, Std = 0.6300, ChiSquare = 3.9931e-01 2.N35 N = 121.011(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.0559e-01 2.A38 H = 8.027(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.7309e-01 2.A38 N = 124.835(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.5027e-01 2.Q39 CA = 57.856(D), Expected = 56.57, Std = 2.1400, ChiSquare = 5.4788e-01 2.Q39 H = 8.058(D), Expected = 8.22, Std = 0.5900, ChiSquare = 7.8364e-01 2.Q39 N = 118.849(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.7245e-01 2.E40 CB = 28.560(D), Expected = 30.01, Std = 1.7200, ChiSquare = 3.9922e-01 2.E40 H = 8.234(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.7075e-01 2.E40 N = 120.629(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.9060e-01 2.L41 H = 7.956(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.7336e-01 2.L41 N = 121.386(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.0326e-01 2.A42 C = 178.146(D), Expected = 177.74, Std = 2.1300, ChiSquare = 8.4883e-01 2.A42 CA = 52.880(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.9553e-01 2.A42 CB = 18.056(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.0215e-01 2.A42 H = 7.922(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.4313e-01 2.A42 N = 123.364(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.6980e-01 2.A44 H = 7.984(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.1885e-01 2.A44 N = 125.275(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.6348e-01 2.N45 H = 8.108(D), Expected = 8.34, Std = 0.6300, ChiSquare = 7.1268e-01 2.N45 N = 117.242(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.7532e-01 2.A46 C = 177.919(D), Expected = 177.74, Std = 2.1300, ChiSquare = 9.3303e-01 2.A46 CA = 52.198(D), Expected = 53.14, Std = 1.9800, ChiSquare = 6.3425e-01 2.A46 CB = 18.261(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.8233e-01 2.T47 CA = 61.459(D), Expected = 62.22, Std = 2.5900, ChiSquare = 7.6889e-01 2.T47 CB = 69.158(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.2565e-01 2.T47 H = 7.987(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.8323e-01 2.T47 N = 114.019(D), Expected = 115.42, Std = 4.7500, ChiSquare = 7.6803e-01 2.L49 H = 7.873(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.8285e-01 2.L49 N = 116.250(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.5030e-01 2.V50 H = 8.934(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.3645e-01 2.V50 N = 117.484(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.2065e-01 2.N51 Typing: Mistyped 2.N51 CA = 61.471(S), Expected = 53.54, Std = 1.8800, ChiSquare = 2.4581e-05 2.N51 H = 8.832(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.3483e-01 2.N51 N = 124.627(D), Expected = 118.93, Std = 4.0300, ChiSquare = 1.5747e-01 2.K52 H = 7.448(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.1621e-01 2.K52 N = 115.887(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.7084e-01 2.I53 CA = 56.793(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.2274e-02 2.I53 H = 7.588(D), Expected = 8.28, Std = 0.6800, ChiSquare = 3.0885e-01 2.I53 N = 114.116(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.6183e-02 2.S54 H = 8.412(D), Expected = 8.28, Std = 0.5900, ChiSquare = 8.2297e-01 2.S54 N = 118.989(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.4154e-01 2.E55 H = 8.726(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.0210e-01 2.E55 N = 124.973(D), Expected = 120.67, Std = 3.4800, ChiSquare = 2.1627e-01 2.K60 Typing: Mistyped 2.K60 CA = 64.540(S), Expected = 56.95, Std = 2.2000, ChiSquare = 5.6059e-04 2.K60 H = 7.973(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.1760e-01 2.K60 N = 118.416(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.8476e-01 2.C61 H = 7.674(D), Expected = 8.39, Std = 0.6700, ChiSquare = 2.8522e-01 2.C61 N = 112.733(D), Expected = 120.17, Std = 4.6400, ChiSquare = 1.0898e-01 2.L62 CA = 53.443(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.0675e-01 2.L62 CB = 42.519(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.1148e-01 2.L62 H = 7.749(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.5930e-01 2.L62 N = 121.840(D), Expected = 121.86, Std = 3.9000, ChiSquare = 9.9591e-01 2.T63 C = 172.993(D), Expected = 174.54, Std = 1.7600, ChiSquare = 3.7941e-01 2.T63 CA = 59.032(D), Expected = 62.22, Std = 2.5900, ChiSquare = 2.1836e-01 2.T63 CB = 70.819(D), Expected = 69.73, Std = 1.6300, ChiSquare = 5.0407e-01 2.T63 H = 7.862(D), Expected = 8.24, Std = 0.6200, ChiSquare = 5.4208e-01 2.T63 N = 113.573(D), Expected = 115.42, Std = 4.7500, ChiSquare = 6.9739e-01 2.Y66 C = 174.499(D), Expected = 175.40, Std = 1.9900, ChiSquare = 6.5072e-01 2.Y66 CA = 59.939(D), Expected = 58.13, Std = 2.5100, ChiSquare = 4.7108e-01 2.Y66 CB = 32.690(D), Expected = 39.32, Std = 2.1600, ChiSquare = 2.1446e-03 2.Y66 H = 8.949(D), Expected = 8.32, Std = 0.7300, ChiSquare = 3.8888e-01 2.Y66 N = 118.953(D), Expected = 120.52, Std = 4.2000, ChiSquare = 7.0908e-01 2.A67 C = 177.774(D), Expected = 177.74, Std = 2.1300, ChiSquare = 9.8726e-01 2.A67 CA = 53.130(D), Expected = 53.14, Std = 1.9800, ChiSquare = 9.9597e-01 2.A67 CB = 18.895(D), Expected = 19.01, Std = 1.8300, ChiSquare = 9.4989e-01 2.A67 H = 7.908(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.2649e-01 2.A67 N = 119.999(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.6139e-01 2.T68 C = 173.557(D), Expected = 174.54, Std = 1.7600, ChiSquare = 5.7649e-01 2.T68 CA = 59.784(D), Expected = 62.22, Std = 2.5900, ChiSquare = 3.4694e-01 2.T68 CB = 70.312(D), Expected = 69.73, Std = 1.6300, ChiSquare = 7.2105e-01 2.T68 H = 7.632(D), Expected = 8.24, Std = 0.6200, ChiSquare = 3.2677e-01 2.T68 N = 110.593(D), Expected = 115.42, Std = 4.7500, ChiSquare = 3.0953e-01 2.R69 C = 175.738(D), Expected = 176.41, Std = 2.0300, ChiSquare = 7.4062e-01 2.R69 CA = 56.106(D), Expected = 56.77, Std = 2.3100, ChiSquare = 7.7377e-01 2.R69 H = 8.331(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.8141e-01 2.R69 N = 122.711(D), Expected = 120.80, Std = 3.6800, ChiSquare = 6.0356e-01 2.N70 C = 174.771(D), Expected = 175.27, Std = 1.7900, ChiSquare = 7.8042e-01 2.N70 CA = 51.113(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.9672e-01 2.N70 H = 8.781(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.8393e-01 2.N70 N = 120.393(D), Expected = 118.93, Std = 4.0300, ChiSquare = 7.1658e-01 2.D71 C = 177.281(D), Expected = 176.40, Std = 1.7500, ChiSquare = 6.1466e-01 2.D71 CA = 57.821(D), Expected = 54.69, Std = 2.0300, ChiSquare = 1.2298e-01 2.D71 CB = 39.421(D), Expected = 40.88, Std = 1.6200, ChiSquare = 3.6779e-01 2.D71 H = 8.251(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.1898e-01 2.D71 N = 122.997(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.4317e-01 2.A72 C = 179.782(D), Expected = 177.74, Std = 2.1300, ChiSquare = 3.3772e-01 2.A72 CA = 54.668(D), Expected = 53.14, Std = 1.9800, ChiSquare = 4.4028e-01 2.A72 CB = 16.897(D), Expected = 19.01, Std = 1.8300, ChiSquare = 2.4824e-01 2.A72 H = 8.394(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.4644e-01 2.A72 N = 120.049(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.6887e-01 2.C73 CA = 58.844(D), Expected = 58.30, Std = 3.3300, ChiSquare = 8.7023e-01 2.C73 H = 6.847(D), Expected = 8.39, Std = 0.6700, ChiSquare = 2.1280e-02 2.C73 N = 116.196(D), Expected = 120.17, Std = 4.6400, ChiSquare = 3.9174e-01 2.I74 H = 7.602(D), Expected = 8.28, Std = 0.6800, ChiSquare = 3.1874e-01 2.I74 N = 121.082(D), Expected = 121.46, Std = 4.2800, ChiSquare = 9.2962e-01 2.Q76 H = 8.233(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.8242e-01 2.Q76 N = 119.942(D), Expected = 119.89, Std = 3.6000, ChiSquare = 9.8848e-01 2.L78 C = 177.602(D), Expected = 176.99, Std = 1.9800, ChiSquare = 7.5725e-01 2.L78 CA = 55.441(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.3303e-01 2.L78 H = 7.835(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.4339e-01 2.L78 N = 121.319(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.8967e-01 2.A79 C = 178.035(D), Expected = 177.74, Std = 2.1300, ChiSquare = 8.8985e-01 2.A79 CA = 52.574(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.7499e-01 2.A79 CB = 18.132(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.3138e-01 2.A79 H = 8.026(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.7182e-01 2.A79 N = 123.668(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.0153e-01 2.K80 H = 8.024(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.8204e-01 2.K80 N = 120.958(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.8053e-01 2.Y81 H = 9.231(D), Expected = 8.32, Std = 0.7300, ChiSquare = 2.1205e-01 2.Y81 N = 120.878(D), Expected = 120.52, Std = 4.2000, ChiSquare = 9.3207e-01 2.M82 H = 8.890(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.9372e-01 2.M82 N = 122.685(D), Expected = 120.09, Std = 3.5700, ChiSquare = 4.6729e-01 2.V87 H = 7.958(D), Expected = 8.29, Std = 0.6700, ChiSquare = 6.2023e-01 2.V87 N = 117.916(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.7762e-01 2.S89 CA = 61.385(D), Expected = 58.72, Std = 2.0700, ChiSquare = 1.9794e-01 2.S89 H = 8.577(D), Expected = 8.28, Std = 0.5900, ChiSquare = 6.1469e-01 2.S89 N = 115.388(D), Expected = 116.28, Std = 3.5200, ChiSquare = 7.9995e-01 2.K90 CA = 59.057(D), Expected = 56.95, Std = 2.2000, ChiSquare = 3.3820e-01 2.K90 H = 7.599(D), Expected = 8.19, Std = 0.6000, ChiSquare = 3.2462e-01 2.K90 N = 119.402(D), Expected = 121.05, Std = 3.7700, ChiSquare = 6.6201e-01 2.A91 C = 180.003(D), Expected = 177.74, Std = 2.1300, ChiSquare = 2.8804e-01 2.A91 CA = 54.332(D), Expected = 53.14, Std = 1.9800, ChiSquare = 5.4716e-01 2.A91 CB = 17.513(D), Expected = 19.01, Std = 1.8300, ChiSquare = 4.1334e-01 2.A91 H = 7.918(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.3835e-01 2.A91 N = 122.406(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.1594e-01 2.Y92 CA = 60.951(D), Expected = 58.13, Std = 2.5100, ChiSquare = 2.6105e-01 2.Y92 CB = 38.308(D), Expected = 39.32, Std = 2.1600, ChiSquare = 6.3941e-01 2.Y92 H = 8.864(D), Expected = 8.32, Std = 0.7300, ChiSquare = 4.5615e-01 2.Y92 N = 120.441(D), Expected = 120.52, Std = 4.2000, ChiSquare = 9.8499e-01 2.I93 C = 178.311(D), Expected = 175.85, Std = 1.9200, ChiSquare = 1.9992e-01 2.I93 CA = 63.878(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.9740e-01 2.I93 H = 8.493(D), Expected = 8.28, Std = 0.6800, ChiSquare = 7.5410e-01 2.I93 N = 118.548(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.9627e-01 2.S94 C = 176.187(D), Expected = 174.62, Std = 1.7200, ChiSquare = 3.6227e-01 2.S94 CA = 61.254(D), Expected = 58.72, Std = 2.0700, ChiSquare = 2.2089e-01 2.S94 CB = 62.294(D), Expected = 63.80, Std = 1.4800, ChiSquare = 3.0888e-01 2.S94 H = 7.736(D), Expected = 8.28, Std = 0.5900, ChiSquare = 3.5651e-01 2.S94 N = 113.947(D), Expected = 116.28, Std = 3.5200, ChiSquare = 5.0747e-01 2.R95 C = 178.629(D), Expected = 176.41, Std = 2.0300, ChiSquare = 2.7435e-01 2.R95 CA = 56.902(D), Expected = 56.77, Std = 2.3100, ChiSquare = 9.5443e-01 2.R95 H = 7.373(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.5523e-01 2.R95 N = 120.937(D), Expected = 120.80, Std = 3.6800, ChiSquare = 9.7030e-01 2.I96 CA = 62.761(D), Expected = 61.61, Std = 2.6800, ChiSquare = 6.6758e-01 2.I96 CB = 36.513(D), Expected = 38.63, Std = 2.0200, ChiSquare = 2.9463e-01 2.I96 H = 7.796(D), Expected = 8.28, Std = 0.6800, ChiSquare = 4.7661e-01 2.I96 N = 117.707(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.8056e-01 2.Q97 C = 176.800(D), Expected = 176.31, Std = 1.9500, ChiSquare = 8.0160e-01 2.Q97 CA = 56.982(D), Expected = 56.57, Std = 2.1400, ChiSquare = 8.4733e-01 2.Q97 CB = 27.816(D), Expected = 29.19, Std = 1.8200, ChiSquare = 4.5028e-01 2.Q97 H = 8.008(D), Expected = 8.22, Std = 0.5900, ChiSquare = 7.1935e-01 2.Q97 N = 120.247(D), Expected = 119.89, Std = 3.6000, ChiSquare = 9.2101e-01 2.N98 C = 175.385(D), Expected = 175.27, Std = 1.7900, ChiSquare = 9.4877e-01 2.N98 CA = 53.484(D), Expected = 53.54, Std = 1.8800, ChiSquare = 9.7624e-01 2.N98 CB = 38.276(D), Expected = 38.69, Std = 1.6900, ChiSquare = 8.0648e-01 2.N98 H = 7.851(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.3764e-01 2.N98 N = 118.138(D), Expected = 118.93, Std = 4.0300, ChiSquare = 8.4420e-01 2.A99 C = 178.074(D), Expected = 177.74, Std = 2.1300, ChiSquare = 8.7540e-01 2.A99 CA = 52.877(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.9433e-01 2.A99 CB = 18.215(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.6398e-01 2.A99 H = 7.931(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.5391e-01 2.A99 N = 123.971(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.3420e-01 2.S100 C = 174.771(D), Expected = 174.62, Std = 1.7200, ChiSquare = 9.3004e-01 2.S100 CA = 58.293(D), Expected = 58.72, Std = 2.0700, ChiSquare = 8.3657e-01 2.S100 CB = 62.999(D), Expected = 63.80, Std = 1.4800, ChiSquare = 5.8836e-01 2.S100 H = 8.052(D), Expected = 8.28, Std = 0.5900, ChiSquare = 6.9917e-01 2.S100 N = 114.494(D), Expected = 116.28, Std = 3.5200, ChiSquare = 6.1188e-01 2.A101 C = 177.895(D), Expected = 177.74, Std = 2.1300, ChiSquare = 9.4199e-01 2.A101 CA = 52.478(D), Expected = 53.14, Std = 1.9800, ChiSquare = 7.3812e-01 2.A101 CB = 18.184(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.5173e-01 2.A101 H = 8.076(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.3627e-01 2.A101 N = 125.888(D), Expected = 123.23, Std = 3.5400, ChiSquare = 4.5274e-01 2.S102 H = 8.066(D), Expected = 8.28, Std = 0.5900, ChiSquare = 7.1682e-01 2.S102 N = 114.369(D), Expected = 116.28, Std = 3.5200, ChiSquare = 5.8720e-01 2.G103 C = 173.841(D), Expected = 173.87, Std = 1.8800, ChiSquare = 9.8769e-01 2.G103 CA = 44.903(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.3869e-01 2.G103 H = 8.128(D), Expected = 8.33, Std = 0.6500, ChiSquare = 7.5598e-01 2.G103 N = 111.033(D), Expected = 109.67, Std = 3.8700, ChiSquare = 7.2469e-01 2.E104 C = 175.454(D), Expected = 176.87, Std = 1.9500, ChiSquare = 4.6774e-01 2.E104 CA = 56.172(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.8281e-01 2.E104 CB = 29.538(D), Expected = 30.01, Std = 1.7200, ChiSquare = 7.8376e-01 2.E104 H = 8.067(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.5577e-01 2.E104 N = 121.327(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.5026e-01 2.I105 C = 180.833(D), Expected = 175.85, Std = 1.9200, ChiSquare = 9.4505e-03 2.I105 CA = 62.308(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.9452e-01 2.I105 CB = 38.719(D), Expected = 38.63, Std = 2.0200, ChiSquare = 9.6486e-01 2.I105 H = 7.562(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.9102e-01 2.I105 N = 125.699(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.2197e-01