Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.37 L 0.29 G 0.11 D 0.05 F 0.05 C 0.03 Y 0.02 K 0.02 C Shift Assignments>> C :: 170.306 CA :: 43.598 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.313 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 119.953 Ave N Shift Values>> N :: 109.67(3.87) 1.T2 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.095(D) CA :: 62.742(D) CB :: 69.948(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 :: 8.455 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 :: 114.922 Ave N Shift Values>> N :: 115.42(4.75) 1.F3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.3 C 0.14 I 0.11 L 0.05 D 0.05 N 0.01 HN Overlap>> 1.M25 1.M25 C Shift Assignments>> C :: 175.611(D) CA :: 58.171(D) CB :: 39.648(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 :: 8.439(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 :: 121.964(D) Ave N Shift Values>> N :: 120.45(4.18) 1.T4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 173.729(D) CA :: 61.922(D) CB :: 69.675(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 :: 7.879(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 :: 114.388(D) Ave N Shift Values>> N :: 115.42(4.75) 1.W5 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.35 N 0.23 L 0.16 F 0.07 C 0.05 Y 0.05 K 0.03 HN Overlap>> 1.A29 1.A29 C Shift Assignments>> C :: 175.255(D) CA :: 53.251(D) CB :: 40.645(S) Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 7.996(D) Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 121.397(D) Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.T6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.262(D) CA :: 62.199(D) CB :: 69.828(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 :: 7.813(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 :: 114.277(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.26 K 0.2 D 0.18 R 0.11 F 0.09 Y 0.06 C 0.05 N 0.02 C Shift Assignments>> C :: 177.177(D) CA :: 55.451(D) CB :: 42.119(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 :: 8.134(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 :: 123.790(D) Ave N Shift Values>> N :: 121.86(3.9) 1.S8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 HN Overlap>> 1.S10 1.S10 C Shift Assignments>> C :: 174.370(D) CA :: 58.608(D) CB :: 64.145(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.101(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 :: 115.713(D) Ave N Shift Values>> N :: 116.28(3.52) 1.D9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 N 0.18 L 0.17 F 0.11 Y 0.09 C 0.06 K 0.03 C Shift Assignments>> C :: 176.190 CA :: 54.274 CB :: 40.445 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 :: 8.280 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 :: 121.848 Ave N Shift Values>> N :: 120.65(3.86) 1.S10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.S8 1.S8 C Shift Assignments>> C :: 174.792 CA :: 59.030 CB :: 64.048 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.172 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 :: 115.746 Ave N Shift Values>> N :: 116.28(3.52) 1.E11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.2 E 0.18 W 0.18 C 0.16 R 0.15 M 0.05 I 0.02 L 0.01 C Shift Assignments>> C :: 176.730 CA :: 56.677 CB :: 29.284 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 :: 8.220 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 :: 121.619 Ave N Shift Values>> N :: 120.67(3.48) 1.G12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 174.214(D) CA :: 45.761(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.272 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.307 Ave N Shift Values>> N :: 109.67(3.87) 1.K13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.26 K 0.25 C 0.22 R 0.12 W 0.07 E 0.05 C Shift Assignments>> C :: 176.267(D) CA :: 56.452(D) CB :: 32.972(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 :: 8.004(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 :: 120.291(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 N 0.2 L 0.16 F 0.1 Y 0.08 C 0.06 K 0.02 C Shift Assignments>> C :: 175.493(D) CA :: 54.112(D) CB :: 40.377(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.331 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 :: 120.246 Ave N Shift Values>> N :: 120.65(3.86) 1.T15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.83 C 0.16 C Shift Assignments>> C :: 172.964(D) CA :: 59.780(D) CB :: 69.934(D) CG2 :: 21.194 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 :: 7.925(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.742(D) Ave N Shift Values>> N :: 115.42(4.75) 1.P16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.72 C 0.19 W 0.03 I 0.02 C Shift Assignments>> C :: 177.388 CA :: 63.715 CB :: 31.886 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) 1.G17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 174.411 CA :: 45.487 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.293 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.805 Ave N Shift Values>> N :: 109.67(3.87) 1.G18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 173.912 CA :: 45.559 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.077 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.249 Ave N Shift Values>> N :: 109.67(3.87) 1.Y19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.3 F 0.27 C 0.17 I 0.14 D 0.03 L 0.02 E 0.01 N 0.01 C Shift Assignments>> C :: 175.682(D) CA :: 58.248(D) CB :: 38.948(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 :: 8.020 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.533 Ave N Shift Values>> N :: 120.52(4.2) 1.C20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.23 K 0.23 D 0.14 F 0.11 R 0.1 Y 0.08 C 0.05 N 0.01 C Shift Assignments>> C :: 174.058(D) CA :: 56.270(D) CB :: 42.032(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.367(D) Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 119.183(D) Ave N Shift Values>> N :: 120.17(4.64) 1.L21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.27 K 0.18 R 0.16 D 0.15 F 0.08 Y 0.05 C 0.05 N 0.01 HN Overlap>> 1.A29 1.A29 C Shift Assignments>> C :: 175.872 CA :: 55.599 CB :: 42.415 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 :: 8.062 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 :: 121.517 Ave N Shift Values>> N :: 121.86(3.9) 1.T22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.837 CA :: 62.041 CB :: 69.917 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 :: 8.116 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 :: 115.010 Ave N Shift Values>> N :: 115.42(4.75) 1.R23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.2 W 0.2 C 0.17 R 0.17 K 0.15 M 0.06 I 0.02 C Shift Assignments>> C :: 175.322 CA :: 57.386 CB :: 29.738 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 :: 7.905 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 :: 122.721 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.W24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 K 0.23 M 0.15 R 0.1 W 0.1 E 0.06 C Shift Assignments>> C :: 176.166 CA :: 58.831 CB :: 32.933 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 8.049 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 119.670 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.M25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.2 E 0.18 W 0.18 C 0.16 R 0.15 M 0.05 I 0.02 L 0.01 HN Overlap>> 1.F3 1.F3 C Shift Assignments>> C :: 176.302 CA :: 56.761 CB :: 29.282 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 :: 8.417 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 :: 122.009 Ave N Shift Values>> N :: 120.09(3.57) 1.L26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.24 K 0.21 D 0.14 R 0.13 F 0.1 Y 0.07 C 0.05 N 0.01 C Shift Assignments>> C :: 177.135 CA :: 56.073 CB :: 42.209 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 :: 7.974 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 :: 120.751 Ave N Shift Values>> N :: 121.86(3.9) 1.I27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> I 0.55 C 0.15 F 0.14 Y 0.14 C Shift Assignments>> C :: 174.354 CA :: 62.433 CB :: 39.438 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) 1.E28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.23 W 0.17 C 0.17 E 0.16 R 0.13 L 0.05 M 0.03 I 0.03 C Shift Assignments>> C :: 176.438 CA :: 56.278 CB :: 28.633 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 :: 8.104 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 :: 121.079 Ave N Shift Values>> N :: 120.67(3.48) 1.A29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 M 0.18 C 0.02 HN Overlap>> 1.W5 1.W5 1.L21 1.L21 C Shift Assignments>> C :: 177.863(D) CA :: 53.536(D) CB :: 19.029(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.011 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.481 Ave N Shift Values>> N :: 123.23(3.54) 1.E30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.21 W 0.18 E 0.18 C 0.16 R 0.14 M 0.04 I 0.03 L 0.01 C Shift Assignments>> C :: 176.271(D) CA :: 56.890(D) CB :: 29.115(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 :: 8.070(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.453(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.25 K 0.21 D 0.18 F 0.1 R 0.08 Y 0.07 C 0.05 N 0.02 C Shift Assignments>> C :: 176.979 CA :: 55.611 CB :: 41.940 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 :: 7.987 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 :: 121.908 Ave N Shift Values>> N :: 121.86(3.9) 1.K32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.21 M 0.21 C 0.2 R 0.15 W 0.11 E 0.09 C Shift Assignments>> C :: 176.481(D) CA :: 56.693(D) CB :: 32.265(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 :: 7.941 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 :: 119.279 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.C33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.24 K 0.21 D 0.13 R 0.13 F 0.1 Y 0.07 C 0.05 N 0.01 C Shift Assignments>> C :: 174.199(D) CA :: 56.158(D) CB :: 42.200(D) Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.076(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 :: 118.285(D) Ave N Shift Values>> N :: 120.17(4.64) 1.F34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.3 Y 0.29 C 0.14 I 0.1 L 0.06 D 0.06 K 0.01 N 0.01 C Shift Assignments>> C :: 175.634(D) CA :: 58.031(D) CB :: 39.889(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 :: 8.115(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 :: 119.793(D) Ave N Shift Values>> N :: 120.45(4.18) 1.G35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 172.911 CA :: 45.538 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.179 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.528 Ave N Shift Values>> N :: 109.67(3.87) 1.N36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 L 0.18 N 0.13 F 0.12 Y 0.1 C 0.07 K 0.05 C Shift Assignments>> C :: 179.042 CA :: 54.693 CB :: 40.578 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 :: 7.839 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 :: 123.221 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) ########################################################################### Overall Results: #Consistent: 18 #Clerical: 17 #Suspicious: 0 #Anomalous: 0 #Mistyped: 1 #Indeterminable: 0 Typing Results: #Consistent: 35 #Suspicious: 0 #Mistyped: 1 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 36 #Suspicious: 0 C Shift Results: #Consistent: 51 #Duplicate: 52 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 H Shift Results: #Consistent: 22 #Duplicate: 12 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 22 #Duplicate: 12 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.T2 C = 174.095(D), Expected = 174.54, Std = 1.7600, ChiSquare = 8.0039e-01 1.T2 CA = 62.742(D), Expected = 62.22, Std = 2.5900, ChiSquare = 8.4027e-01 1.T2 CB = 69.948(D), Expected = 69.73, Std = 1.6300, ChiSquare = 8.9361e-01 1.F3 C = 175.611(D), Expected = 175.42, Std = 1.9900, ChiSquare = 9.2354e-01 1.F3 CA = 58.171(D), Expected = 58.08, Std = 2.5700, ChiSquare = 9.7175e-01 1.F3 CB = 39.648(D), Expected = 39.99, Std = 2.0900, ChiSquare = 8.7002e-01 1.F3 H = 8.439(D), Expected = 8.36, Std = 0.7200, ChiSquare = 9.1263e-01 1.F3 N = 121.964(D), Expected = 120.45, Std = 4.1800, ChiSquare = 7.1720e-01 1.T4 C = 173.729(D), Expected = 174.54, Std = 1.7600, ChiSquare = 6.4495e-01 1.T4 CA = 61.922(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.0840e-01 1.T4 CB = 69.675(D), Expected = 69.73, Std = 1.6300, ChiSquare = 9.7308e-01 1.T4 H = 7.879(D), Expected = 8.24, Std = 0.6200, ChiSquare = 5.6039e-01 1.T4 N = 114.388(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.2800e-01 1.W5 Typing: Mistyped 1.W5 C = 175.255(D), Expected = 176.12, Std = 2.0100, ChiSquare = 6.6694e-01 1.W5 CA = 53.251(D), Expected = 57.66, Std = 2.5800, ChiSquare = 8.7467e-02 1.W5 CB = 40.645(S), Expected = 30.01, Std = 2.0100, ChiSquare = 1.2162e-07 1.W5 H = 7.996(D), Expected = 8.29, Std = 0.7900, ChiSquare = 7.0978e-01 1.W5 N = 121.397(D), Expected = 121.68, Std = 4.1800, ChiSquare = 9.4602e-01 1.T6 C = 174.262(D), Expected = 174.54, Std = 1.7600, ChiSquare = 8.7449e-01 1.T6 CA = 62.199(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.9353e-01 1.T6 CB = 69.828(D), Expected = 69.73, Std = 1.6300, ChiSquare = 9.5206e-01 1.T6 H = 7.813(D), Expected = 8.24, Std = 0.6200, ChiSquare = 4.9101e-01 1.T6 N = 114.277(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.0984e-01 1.L7 C = 177.177(D), Expected = 176.99, Std = 1.9800, ChiSquare = 9.2476e-01 1.L7 CA = 55.451(D), Expected = 55.62, Std = 2.1300, ChiSquare = 9.3676e-01 1.L7 CB = 42.119(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.1908e-01 1.L7 H = 8.134(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.8259e-01 1.L7 N = 123.790(D), Expected = 121.86, Std = 3.9000, ChiSquare = 6.2069e-01 1.S8 C = 174.370(D), Expected = 174.62, Std = 1.7200, ChiSquare = 8.8444e-01 1.S8 CA = 58.608(D), Expected = 58.72, Std = 2.0700, ChiSquare = 9.5685e-01 1.S8 CB = 64.145(D), Expected = 63.80, Std = 1.4800, ChiSquare = 8.1568e-01 1.S8 H = 8.101(D), Expected = 8.28, Std = 0.5900, ChiSquare = 7.6159e-01 1.S8 N = 115.713(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.7203e-01 1.G12 C = 174.214(D), Expected = 173.87, Std = 1.8800, ChiSquare = 8.5481e-01 1.G12 CA = 45.761(D), Expected = 45.35, Std = 1.3400, ChiSquare = 7.5906e-01 1.K13 C = 176.267(D), Expected = 176.64, Std = 2.0000, ChiSquare = 8.5205e-01 1.K13 CA = 56.452(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.2092e-01 1.K13 CB = 32.972(D), Expected = 32.79, Std = 1.7800, ChiSquare = 9.1856e-01 1.K13 H = 8.004(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.5656e-01 1.K13 N = 120.291(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.4044e-01 1.D14 C = 175.493(D), Expected = 176.40, Std = 1.7500, ChiSquare = 6.0426e-01 1.D14 CA = 54.112(D), Expected = 54.69, Std = 2.0300, ChiSquare = 7.7585e-01 1.D14 CB = 40.377(D), Expected = 40.88, Std = 1.6200, ChiSquare = 7.5619e-01 1.T15 C = 172.964(D), Expected = 174.54, Std = 1.7600, ChiSquare = 3.7054e-01 1.T15 CA = 59.780(D), Expected = 62.22, Std = 2.5900, ChiSquare = 3.4615e-01 1.T15 CB = 69.934(D), Expected = 69.73, Std = 1.6300, ChiSquare = 9.0040e-01 1.T15 H = 7.925(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.1141e-01 1.T15 N = 115.742(D), Expected = 115.42, Std = 4.7500, ChiSquare = 9.4595e-01 1.Y19 C = 175.682(D), Expected = 175.40, Std = 1.9900, ChiSquare = 8.8731e-01 1.Y19 CA = 58.248(D), Expected = 58.13, Std = 2.5100, ChiSquare = 9.6250e-01 1.Y19 CB = 38.948(D), Expected = 39.32, Std = 2.1600, ChiSquare = 8.6326e-01 1.C20 C = 174.058(D), Expected = 174.95, Std = 2.0700, ChiSquare = 6.6653e-01 1.C20 CA = 56.270(D), Expected = 58.30, Std = 3.3300, ChiSquare = 5.4212e-01 1.C20 CB = 42.032(D), Expected = 32.49, Std = 6.0100, ChiSquare = 1.1236e-01 1.C20 H = 8.367(D), Expected = 8.39, Std = 0.6700, ChiSquare = 9.7262e-01 1.C20 N = 119.183(D), Expected = 120.17, Std = 4.6400, ChiSquare = 8.3155e-01 1.A29 C = 177.863(D), Expected = 177.74, Std = 2.1300, ChiSquare = 9.5395e-01 1.A29 CA = 53.536(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.4148e-01 1.A29 CB = 19.029(D), Expected = 19.01, Std = 1.8300, ChiSquare = 9.9172e-01 1.E30 C = 176.271(D), Expected = 176.87, Std = 1.9500, ChiSquare = 7.5871e-01 1.E30 CA = 56.890(D), Expected = 57.32, Std = 2.0900, ChiSquare = 8.3699e-01 1.E30 CB = 29.115(D), Expected = 30.01, Std = 1.7200, ChiSquare = 6.0282e-01 1.E30 H = 8.070(D), Expected = 8.33, Std = 0.5900, ChiSquare = 6.5945e-01 1.E30 N = 117.453(D), Expected = 120.67, Std = 3.4800, ChiSquare = 3.5527e-01 1.K32 C = 176.481(D), Expected = 176.64, Std = 2.0000, ChiSquare = 9.3664e-01 1.K32 CA = 56.693(D), Expected = 56.95, Std = 2.2000, ChiSquare = 9.0700e-01 1.K32 CB = 32.265(D), Expected = 32.79, Std = 1.7800, ChiSquare = 7.6804e-01 1.C33 C = 174.199(D), Expected = 174.95, Std = 2.0700, ChiSquare = 7.1675e-01 1.C33 CA = 56.158(D), Expected = 58.30, Std = 3.3300, ChiSquare = 5.2007e-01 1.C33 CB = 42.200(D), Expected = 32.49, Std = 6.0100, ChiSquare = 1.0617e-01 1.C33 H = 8.076(D), Expected = 8.39, Std = 0.6700, ChiSquare = 6.3931e-01 1.C33 N = 118.285(D), Expected = 120.17, Std = 4.6400, ChiSquare = 6.8456e-01 1.F34 C = 175.634(D), Expected = 175.42, Std = 1.9900, ChiSquare = 9.1436e-01 1.F34 CA = 58.031(D), Expected = 58.08, Std = 2.5700, ChiSquare = 9.8479e-01 1.F34 CB = 39.889(D), Expected = 39.99, Std = 2.0900, ChiSquare = 9.6146e-01 1.F34 H = 8.115(D), Expected = 8.36, Std = 0.7200, ChiSquare = 7.3365e-01 1.F34 N = 119.793(D), Expected = 120.45, Std = 4.1800, ChiSquare = 8.7511e-01