Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.A1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.97 T 0.02 C Shift Assignments>> C :: 174.7 CA :: 57.4 CB :: 65.7 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.6 HB2 :: 4.28 HB3 :: 3.99 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) 1.L3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.83 R 0.11 G 0.05 HN Overlap>> 1.N31 1.N31 C Shift Assignments>> C :: 177.3 CA :: 58.6 CB :: 42.7 CG :: 26.5 CD1 :: 25.7 CD2 :: 24.6 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 :: 8.78(D) HA :: 3.68 HB2 :: 1.55 HB3 :: 1.46 HG :: 1.3 HD11 :: 0.68 HD12 :: 0.68 HD13 :: 0.68 HD21 :: 0.54 HD22 :: 0.54 HD23 :: 0.54 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 :: 123.0(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Y4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.99 C Shift Assignments>> C :: 178.4 CA :: 60.8 CB :: 38.3 CD1 :: 132.6 CD2 :: 132.6 CE1 :: 118.2 CE2 :: 118.2 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.43(D) HA :: 3.75 HB2 :: 2.96 HB3 :: 2.86 HD1 :: 6.97 HD2 :: 6.97 HE1 :: 6.89 HE2 :: 6.89 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 :: 114.8(D) Ave N Shift Values>> N :: 120.52(4.2) 1.E5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.61 I 0.28 M 0.04 K 0.04 Q 0.01 C Shift Assignments>> C :: 179.2 CA :: 59.1 CB :: 30.1 CG :: 37.1 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 :: 7.64(D) HA :: 4.01 HB2 :: 2.17 HB3 :: 2.07 HG2 :: 2.3 HG3 :: 2.3 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 :: 119.3(D) Ave N Shift Values>> N :: 120.67(3.48) 1.K6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.55 R 0.43 G 0.01 C Shift Assignments>> C :: 178.0 CA :: 58.9 CB :: 33.1 CG :: 26.2 CD :: 30.0 CE :: 42.1 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 :: 8.05(D) HA :: 4.02 HB2 :: 1.59 HB3 :: 1.59 HE2 :: 2.96 HE3 :: 2.96 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.7(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.76 R 0.17 A 0.04 G 0.01 C Shift Assignments>> C :: 176.8 CA :: 54.9 CB :: 42.1 CG :: 27.5 CD1 :: 26.2 CD2 :: 23.2 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 :: 7.68(D) HA :: 4.31 HB2 :: 1.51 HB3 :: 1.35 HG :: 1.34 HD11 :: 0.58 HD12 :: 0.58 HD13 :: 0.58 HD21 :: 0.7 HD22 :: 0.7 HD23 :: 0.7 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 113.8(D) Ave N Shift Values>> N :: 121.86(3.9) 1.G8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.91 L 0.07 C Shift Assignments>> C :: 175.3 CA :: 46.0 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.3(D) HA2 :: 3.8 HA3 :: 4.27 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.8(D) Ave N Shift Values>> N :: 109.67(3.87) 1.G9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.31 L 0.3 R 0.25 F 0.04 D 0.04 Y 0.02 C Shift Assignments>> C :: 173.4 CA :: 44.1 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.31(D) HA2 :: 3.59 HA3 :: 4.56 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.9(D) Ave N Shift Values>> N :: 109.67(3.87) 1.A10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.59 A 0.3 I 0.08 V 0.01 HN Overlap>> 1.V73 1.V73 C Shift Assignments>> C :: 179.1 CA :: 56.1 CB :: 18.6 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.54(D) HA :: 4 HB1 :: 1.51 HB2 :: 1.51 HB3 :: 1.51 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.3(D) Ave N Shift Values>> N :: 123.23(3.54) 1.A11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.64 A 0.29 I 0.05 HN Overlap>> 1.V108 1.V108 C Shift Assignments>> C :: 180.5 CA :: 55.4 CB :: 17.7 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.47(D) HA :: 4.21 HB1 :: 1.45 HB2 :: 1.45 HB3 :: 1.45 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.6(D) Ave N Shift Values>> N :: 123.23(3.54) 1.A12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.59 M 0.36 I 0.02 L 0.01 C Shift Assignments>> C :: 180.5 CA :: 54.9 CB :: 19.0 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.65(D) HA :: 4.14 HB1 :: 1.37 HB2 :: 1.37 HB3 :: 1.37 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.6(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.3 CA :: 67.0 CB :: 31.6 CG1 :: 21.5 CG2 :: 24.4 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 :: 7.86(D) HA :: 3.42 HB :: 2.07 HG11 :: 0.81 HG12 :: 0.81 HG13 :: 0.81 HG21 :: 0.57 HG22 :: 0.57 HG23 :: 0.57 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 :: 118.9(D) Ave N Shift Values>> N :: 121.14(4.54) 1.D14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.34 Y 0.32 I 0.1 L 0.09 D 0.07 K 0.03 N 0.01 HN Overlap>> 1.E88 1.E88 C Shift Assignments>> C :: 179.4 CA :: 58.1 CB :: 40.2 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 :: 8.42(D) HA :: 4.45 HB2 :: 2.8 HB3 :: 2.76 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 :: 119.2(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.87 R 0.09 G 0.02 C Shift Assignments>> C :: 179.0 CA :: 58.1 CB :: 42.4 CG :: 27.4 CD1 :: 24.4 CD2 :: 24.9 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 :: 7.86(D) HA :: 4.3 HB2 :: 1.81 HB3 :: 1.81 HG :: 1.71 HD11 :: 1.03 HD12 :: 1.03 HD13 :: 1.03 HD21 :: 0.99 HD22 :: 0.99 HD23 :: 0.99 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 :: 120.5(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.63 A 0.28 I 0.06 C Shift Assignments>> C :: 179.6 CA :: 55.8 CB :: 18.1 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.18(D) HA :: 4.03 HB1 :: 1.46 HB2 :: 1.46 HB3 :: 1.46 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.1(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 178.0 CA :: 68.2 CB :: 31.9 CG1 :: 22.4 CG2 :: 24.7 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 :: 9.17(D) HA :: 3.91 HB :: 2.51 HG11 :: 1.38 HG12 :: 1.38 HG13 :: 1.38 HG21 :: 1.38 HG22 :: 1.38 HG23 :: 1.38 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 :: 118.5(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.5 I 0.31 K 0.08 Q 0.05 M 0.03 C Shift Assignments>> C :: 180.1 CA :: 60.5 CB :: 29.9 CG :: 36.0 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 :: 8.41(D) HA :: 4.25 HB2 :: 2.43 HB3 :: 2.38 HG2 :: 2.56 HG3 :: 2.56 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 :: 119.9(D) Ave N Shift Values>> N :: 120.67(3.48) 1.K19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.94 R 0.04 C Shift Assignments>> C :: 179.2 CA :: 59.3 CB :: 32.6 CG :: 24.3 CD :: 29.3 CE :: 41.3 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 :: 8.54(D) HA :: 4.31 HB2 :: 2.21 HB3 :: 1.97 HG2 :: 1.74 HG3 :: 1.74 HD2 :: 1.74 HD3 :: 1.74 HE2 :: 3.06 HE3 :: 3.06 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 :: 120.2(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.99 C Shift Assignments>> C :: 177.5 CA :: 58.2 CB :: 40.2 CD1 :: 130.9 CD2 :: 130.9 CE1 :: 132.3 CE2 :: 132.3 CZ :: 130.1 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 :: 9.06(D) HA :: 4.87 HB2 :: 3.62 HB3 :: 3.73 HD1 :: 7.39 HD2 :: 7.39 HE1 :: 7.83 HE2 :: 7.83 HZ :: 6.72 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 :: 122.4(D) Ave N Shift Values>> N :: 120.45(4.18) 1.Y21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.99 C Shift Assignments>> C :: 177.6 CA :: 61.1 CB :: 38.0 CD1 :: 134.6 CD2 :: 134.6 CE1 :: 118.4 CE2 :: 118.4 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 :: 9.64(D) HA :: 4.44 HB2 :: 3.55 HB3 :: 3.81 HD1 :: 7.57 HD2 :: 7.57 HE1 :: 7.05 HE2 :: 7.05 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 :: 119.9(D) Ave N Shift Values>> N :: 120.52(4.2) 1.G22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.92 L 0.05 C Shift Assignments>> C :: 176.7 CA :: 47.0 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.16(D) HA2 :: 3.48 HA3 :: 3.99 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.3(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.48 K 0.47 G 0.04 C Shift Assignments>> C :: 179.6 CA :: 60.5 CB :: 32.8 CG :: 26.4 CD :: 29.5 CE :: 42.5 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 :: 8.14(D) HA :: 4.07 HB2 :: 2.04 HB3 :: 2.04 HG2 :: 1.54 HG3 :: 1.76 HD2 :: 1.84 HD3 :: 1.84 HE2 :: 2.77 HE3 :: 2.77 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 :: 122.3(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.3 CA :: 67.2 CB :: 31.4 CG1 :: 22.2 CG2 :: 25.5 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 :: 8.03(D) HA :: 3.29 HB :: 2.05 HG11 :: 0.56 HG12 :: 0.56 HG13 :: 0.56 HG21 :: 0.66 HG22 :: 0.66 HG23 :: 0.66 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 :: 119.2(D) Ave N Shift Values>> N :: 121.14(4.54) 1.L25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.94 R 0.03 G 0.01 C Shift Assignments>> C :: 178.3 CA :: 57.1 CB :: 42.2 CG :: 27.0 CD1 :: 24.5 CD2 :: 24.5 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 :: 7.58(D) HA :: 4.05 HB2 :: 1.56 HB3 :: 1.5 HG :: 1.62 HD11 :: 0.99 HD12 :: 0.99 HD13 :: 0.99 HD21 :: 0.95 HD22 :: 0.95 HD23 :: 0.95 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 :: 117.2(D) Ave N Shift Values>> N :: 121.86(3.9) 1.A26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.93 M 0.05 C Shift Assignments>> C :: 176.5 CA :: 51.8 CB :: 19.6 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.12(D) HA :: 4.36 HB1 :: 1.44 HB2 :: 1.44 HB3 :: 1.44 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.6(D) Ave N Shift Values>> N :: 123.23(3.54) 1.D27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.37 L 0.2 N 0.18 F 0.08 K 0.06 Y 0.06 C Shift Assignments>> C :: 176.5 CA :: 53.6 CB :: 40.9 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 :: 7.35(D) HA :: 4.56 HB2 :: 2.68 HB3 :: 3.12 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 :: 119.7(D) Ave N Shift Values>> N :: 120.65(3.86) 1.E28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.6 I 0.15 K 0.12 Q 0.06 M 0.04 C Shift Assignments>> C :: 177.5 CA :: 58.1 CB :: 29.5 CG :: 36.4 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.01(D) HA :: 4.1 HB2 :: 2.12 HB3 :: 2.01 HG2 :: 2.3 HG3 :: 2.3 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 128.3(D) Ave N Shift Values>> N :: 120.67(3.48) 1.R29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.58 K 0.27 G 0.14 HN Overlap>> 1.E74 1.E74 C Shift Assignments>> C :: 178.3 CA :: 58.7 CB :: 31.4 CG :: 25.6 CD :: 43.4 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 :: 8.68(D) HA :: 4.04 HB2 :: 1.69 HB3 :: 1.46 HG2 :: 1.69 HG3 :: 1.69 HD2 :: 3.26 HD3 :: 2.77 HE :: 8.26 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 :: 117.5(D) NE :: 82.6 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.V30 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Suspicious PRTL>> V 0.8 I 0.17 A 0.01 C Shift Assignments>> C :: 175.5 CA :: 60.0 CB :: 35.7 CG1 :: 23.6 CG2 :: 19.6 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 :: 7.11(D) HA :: 4.49 HB :: 1.74 HG11 :: 0.51 HG12 :: 0.51 HG13 :: 0.51 HG21 :: 0.57 HG22 :: 0.57 HG23 :: 0.57 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 :: 104.0(S) Ave N Shift Values>> N :: 121.14(4.54) 1.N31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.42 Y 0.15 M 0.13 F 0.09 K 0.05 I 0.04 N 0.03 Q 0.02 HN Overlap>> 1.L3 1.L3 C Shift Assignments>> C :: 178.9 CA :: 56.8 CB :: 36.4 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 :: 8.77(D) HA :: 4.1 HB2 :: 3.28 HB3 :: 2.99 HD21 :: 7.17 HD22 :: 6.68 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 :: 122.9(D) ND2 :: 107.2 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R32 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> K 0.39 L 0.3 R 0.25 G 0.03 C Shift Assignments>> C :: 177.4 CA :: 58.0 CB :: 28.2 CG :: 25.7 CD :: 42.8 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 :: 8.12(D) HA :: 3.96 HB2 :: 1.44 HB3 :: 1.38 HG2 :: 0.68(S) HG3 :: 0.15(S) HD2 :: 2.67 HD3 :: 2.55 HE :: 6.93 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 :: 120.4(D) NE :: 84.8 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.F33 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> F 0.99 C Shift Assignments>> C :: 174.9 CA :: 60.1 CB :: 37.8 CD1 :: 130.0 CD2 :: 130.0 CE1 :: 130.6 CE2 :: 130.6 CZ :: 129.2 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 :: 7.13(D) HA :: 3.5 HB2 :: 1.42(S) HB3 :: 1.3(S) HD1 :: 6.35 HD2 :: 6.35 HE1 :: 6.11 HE2 :: 6.11 HZ :: 5.74 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 116.2(D) Ave N Shift Values>> N :: 120.45(4.18) 1.F34 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> F 0.96 G 0.03 C Shift Assignments>> C :: 176.4 CA :: 58.7 CB :: 41.9 CD1 :: 133.5 CD2 :: 133.5 CE1 :: 132.0 CE2 :: 132.0 CZ :: 130.0 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 :: 7.42(D) HA :: 4.89 HB2 :: 2.72 HB3 :: 3.92 HD1 :: 7.84 HD2 :: 7.84 HE1 :: 8.76(S) HE2 :: 8.76(S) HZ :: 6.97 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 :: 113.4(D) Ave N Shift Values>> N :: 120.45(4.18) 1.V35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 175.7 CA :: 65.1 CB :: 31.9 CG1 :: 20.4 CG2 :: 20.4 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 :: 7.28(D) HA :: 4 HB :: 2.09 HG11 :: 0.95 HG12 :: 0.95 HG13 :: 0.95 HG21 :: 0.9 HG22 :: 0.9 HG23 :: 0.9 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 :: 117.5(D) Ave N Shift Values>> N :: 121.14(4.54) 1.N36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.54 D 0.2 F 0.08 Y 0.08 L 0.05 C Shift Assignments>> C :: 174.6 CA :: 53.3 CB :: 38.9 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 :: 8.43(D) HA :: 5.02 HB2 :: 2.64 HB3 :: 3.02 HD21 :: 7.56 HD22 :: 6.83 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 :: 117.8(D) ND2 :: 114.1 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T37 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.4 CA :: 62.4 CB :: 70.8 CG2 :: 23.1 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(D) HA :: 4.65 HB :: 4.71 HG21 :: 2(S) HG22 :: 2(S) HG23 :: 2(S) 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 :: 117.5(D) Ave N Shift Values>> N :: 115.42(4.75) 1.D38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.29 D 0.22 K 0.18 R 0.12 F 0.08 Y 0.05 N 0.02 C Shift Assignments>> C :: 176.8 CA :: 54.9 CB :: 42.2 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.06(D) HA :: 4.7 HB2 :: 2.87 HB3 :: 3.09 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 :: 127.1(D) Ave N Shift Values>> N :: 120.65(3.86) 1.M39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.55 Q 0.3 K 0.07 E 0.05 I 0.01 C Shift Assignments>> C :: 178.0 CA :: 60.5 CB :: 33.2 CG :: 31.6 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.02(D) HA :: 4.4 HB2 :: 2.47 HB3 :: 2.32 HG2 :: 2.63 HG3 :: 2.82 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 :: 122.7(D) Ave N Shift Values>> N :: 120.09(3.57) 1.A40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.67 A 0.22 I 0.09 C Shift Assignments>> C :: 181.7 CA :: 56.1 CB :: 18.0 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.73(D) HA :: 4.32 HB1 :: 1.66 HB2 :: 1.66 HB3 :: 1.66 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.1(D) Ave N Shift Values>> N :: 123.23(3.54) 1.K41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.61 R 0.37 G 0.01 C Shift Assignments>> C :: 181.0 CA :: 59.8 CB :: 33.1 CG :: 26.2 CD :: 29.4 CE :: 42.2 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 :: 8.35(D) HA :: 4.71 HB2 :: 2.35 HB3 :: 2.4 HG2 :: 1.81 HG3 :: 1.92 HE2 :: 2.88 HE3 :: 2.88 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 :: 120.8(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Q42 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> I 0.7 E 0.26 M 0.02 C Shift Assignments>> C :: 179.8 CA :: 62.2 CB :: 30.7 CG :: 37.0 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.31(D) HA :: 5.87(S) HB2 :: 3.17(S) HB3 :: 3.31(S) HG2 :: 3.02 HG3 :: 3.39(S) HE21 :: 7.7 HE22 :: 6.72 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 :: 122.9(D) NE2 :: 111.3 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.71 K 0.19 G 0.09 HN Overlap>> 1.R63 1.R63 C Shift Assignments>> C :: 179.3 CA :: 62.3 CB :: 32.6 CG :: 27.5 CD :: 30.0 CE :: 42.1 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.02(D) HA :: 4.5 HB2 :: 2.05 HB3 :: 2.11 HG2 :: 1.43 HG3 :: 1.1 HD2 :: 1.65 HD3 :: 1.6 HE2 :: 2.56 HE3 :: 2.46 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 :: 119.9(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Q44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.39 Q 0.36 E 0.09 R 0.06 I 0.04 M 0.03 C Shift Assignments>> C :: 179.0 CA :: 59.3 CB :: 28.8 CG :: 33.8 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 :: 8.84(D) HA :: 4.55 HB2 :: 2.72 HB3 :: 2.72 HG2 :: 2.64 HG3 :: 2.64 HE21 :: 7.99 HE22 :: 6.93 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 :: 119.3(D) NE2 :: 116.8 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.H45 Overall: Mistyped Typing: Mistyped SRO: Suspicious C Shifts: Anomalous H Shifts: Anomalous N Shifts: Anomalous PRTL>> V 0.96 I 0.03 C Shift Assignments>> C :: 180.8 CA :: 82.1(A) CB :: 25.3 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 :: 10.67(S) HA :: 7.99(S) HB2 :: 10.81(A) HB3 :: 9.23(A) HD1 :: 12.93 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 :: 122.1(D) ND1 :: 142.6(A) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) SRO Rule Breaks>> (H > HB2 : 0.9986) (HA > HB2 : 0.9926) (HA > HB3 : 0.9952) 1.Q46 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Duplicate PRTL>> Q 0.33 K 0.29 E 0.24 M 0.05 I 0.04 R 0.01 C Shift Assignments>> C :: 180.0 CA :: 58.7 CB :: 29.5 CG :: 34.5 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 :: 10.55(S) HA :: 6.99(A) HB2 :: 3.35(S) HB3 :: 2.85 HG2 :: 2.68 HG3 :: 1.81 HE21 :: 8.8(S) HE22 :: 6.25 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 :: 124.6(D) NE2 :: 112.2 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) SRO Rule Breaks>> (HE22 > HA : 0.9976) 1.K47 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> K 0.48 R 0.43 G 0.07 C Shift Assignments>> C :: 179.9 CA :: 61.3 CB :: 33.1 CG :: 25.8 CD :: 30.2 CE :: 42.6 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.72(D) HA :: 4.49 HB2 :: 2.34 HB3 :: 2.65(S) HG2 :: 1.7 HG3 :: 1.37 HD2 :: 1.94 HD3 :: 1.89 HE2 :: 3.11 HE3 :: 2.96 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.2(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D48 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> Y 0.35 F 0.35 I 0.18 L 0.04 D 0.03 C Shift Assignments>> C :: 177.7 CA :: 58.7 CB :: 39.6 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 :: 10.07(D) HA :: 4.36 HB2 :: 3.04 HB3 :: 1.13(S) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.8(D) Ave N Shift Values>> N :: 120.65(3.86) 1.F49 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> F 0.99 C Shift Assignments>> C :: 177.1 CA :: 62.5 CB :: 40.1 CD1 :: 131.4 CD2 :: 131.4 CE1 :: 129.9 CE2 :: 129.9 CZ :: 128.2 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 :: 10.23(D) HA :: 3.2 HB2 :: 3.73 HB3 :: 4.26(S) HD1 :: 5.29(S) HD2 :: 5.29(S) HE1 :: 5.54(S) HE2 :: 5.54(S) HZ :: 5.91 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 :: 121.9(D) Ave N Shift Values>> N :: 120.45(4.18) SRO Rule Breaks>> (HA > HB2 : 0.9952) (HA > HB3 : 0.9955) 1.M50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.94 I 0.05 C Shift Assignments>> C :: 176.8 CA :: 60.6 CB :: 34.4 CG :: 32.1 CE :: 16.7 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 :: 8.95(D) HA :: 3.87 HB2 :: 2.67 HB3 :: 2.5 HG2 :: 2.85 HG3 :: 2.5 HE1 :: 2.07 HE2 :: 2.07 HE3 :: 2.07 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 118.4(D) Ave N Shift Values>> N :: 120.09(3.57) 1.T51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 177.0 CA :: 67.7 CB :: 68.7 CG2 :: 21.2 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 :: 8.92(D) HA :: 3.78 HB :: 4.63 HG21 :: 1.34 HG22 :: 1.34 HG23 :: 1.34 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 :: 116.7(D) Ave N Shift Values>> N :: 115.42(4.75) 1.Y52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.99 C Shift Assignments>> C :: 176.8 CA :: 61.9 CB :: 38.9 CD1 :: 133.2 CD2 :: 133.2 CE1 :: 118.1 CE2 :: 118.1 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 :: 8.13(D) HA :: 3.37 HB2 :: 2.07 HB3 :: 2.64 HD1 :: 6.33 HD2 :: 6.33 HE1 :: 6.57 HE2 :: 6.57 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 124.3(D) Ave N Shift Values>> N :: 120.52(4.2) 1.A53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.66 M 0.3 I 0.01 L 0.01 C Shift Assignments>> C :: 175.6 CA :: 54.6 CB :: 19.1 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.29(D) HA :: 3.48 HB1 :: 1 HB2 :: 1 HB3 :: 1 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.1(D) Ave N Shift Values>> N :: 123.23(3.54) 1.F54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.99 HN Overlap>> 1.T57 1.T57 C Shift Assignments>> C :: 176.3 CA :: 58.4 CB :: 38.5 CD1 :: 131.9 CD2 :: 131.9 CE1 :: 130.0 CE2 :: 130.0 CZ :: 128.5 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 :: 7.53(D) HA :: 4.35 HB2 :: 2.88 HB3 :: 3.27 HD1 :: 7.32 HD2 :: 7.32 HE1 :: 7 HE2 :: 7 HZ :: 6.95 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 :: 110.9(D) Ave N Shift Values>> N :: 120.45(4.18) 1.G55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.88 L 0.09 C Shift Assignments>> C :: 175.5 CA :: 45.4 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.99(D) HA2 :: 3.47 HA3 :: 4.35 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.9(D) Ave N Shift Values>> N :: 109.67(3.87) 1.G56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.92 L 0.05 A 0.01 C Shift Assignments>> C :: 175.7 CA :: 47.1 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.38(D) HA2 :: 4.47 HA3 :: 3.28 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.2(D) Ave N Shift Values>> N :: 109.67(3.87) 1.T57 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.F54 1.F54 C Shift Assignments>> C :: 176.3 CA :: 63.2 CB :: 68.4 CG2 :: 21.1 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 :: 7.58(D) HA :: 3.68 HB :: 4.04 HG21 :: 0.3(S) HG22 :: 0.3(S) HG23 :: 0.3(S) 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 :: 111.0(D) Ave N Shift Values>> N :: 115.42(4.75) 1.D58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.26 F 0.2 Y 0.17 L 0.17 N 0.11 K 0.03 I 0.01 C Shift Assignments>> C :: 176.8 CA :: 55.6 CB :: 40.2 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 :: 8.57(D) HA :: 4.24 HB2 :: 2.55 HB3 :: 2.55 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 :: 121.5(D) Ave N Shift Values>> N :: 120.65(3.86) 1.R59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.71 K 0.18 G 0.05 L 0.04 C Shift Assignments>> C :: 174.4 CA :: 55.9 CB :: 29.7 CG :: 26.9 CD :: 42.9 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 :: 7.16(D) HA :: 3.75 HB2 :: 1.03 HB3 :: 1.03 HG2 :: 1.08 HG3 :: 1.08 HD2 :: 2.84 HD3 :: 2.78 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.6(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.F60 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.99 C Shift Assignments>> C :: 182.1(S) CA :: 54.1 CB :: 39.3 CD1 :: 132.2 CD2 :: 132.2 CE1 :: 130.0 CE2 :: 130.0 CZ :: 129.1 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 :: 7.36(D) HA :: 4.45 HB2 :: 2.65 HB3 :: 2.69 HD1 :: 6.45 HD2 :: 6.45 HE1 :: 6.35 HE2 :: 6.35 HZ :: 6.69 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.0(D) Ave N Shift Values>> N :: 120.45(4.18) 1.P61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 178.6 CA :: 63.1 CB :: 32.1 CG :: 27.5 CD :: 50.1 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.53 HB2 :: 2.4 HB3 :: 1.98 HG2 :: 1.99 HG3 :: 1.89 HD2 :: 3.26 HD3 :: 3.25 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.G62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> P 0.65 A 0.15 G 0.07 N 0.06 D 0.02 C Shift Assignments>> C :: 176.4 CA :: 48.7 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.07(D) HA2 :: 4.29 HA3 :: 4.09 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.8(D) Ave N Shift Values>> N :: 109.67(3.87) 1.R63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.8 G 0.14 K 0.04 HN Overlap>> 1.K43 1.K43 C Shift Assignments>> C :: 179.3 CA :: 59.3 CB :: 30.0 CG :: 27.2 CD :: 43.4 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 :: 9.03(D) HA :: 4.44 HB2 :: 2.01 HB3 :: 1.95 HG2 :: 1.83 HG3 :: 1.75 HD2 :: 3.25 HD3 :: 3.25 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.8(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.S64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 HN Overlap>> 1.N89 1.N89 C Shift Assignments>> C :: 177.3 CA :: 60.5 CB :: 62.5 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.55(D) HA :: 4.51 HB2 :: 3.84 HB3 :: 3.74 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 :: 115.4(D) Ave N Shift Values>> N :: 116.28(3.52) 1.M65 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Duplicate PRTL>> M 0.77 A 0.2 I 0.02 C Shift Assignments>> C :: 181.6 CA :: 59.4 CB :: 36.9 CG :: 34.5 CE :: 19.2 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 :: 8.84(D) HA :: 6.02(S) HB2 :: 3.45(S) HB3 :: 4.12(A) HG2 :: 2.72 HG3 :: 3.25 HE1 :: 0.9 HE2 :: 0.9 HE3 :: 0.9 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.3(D) Ave N Shift Values>> N :: 120.09(3.57) 1.R66 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> G 0.83 R 0.1 K 0.05 C Shift Assignments>> C :: 180.6 CA :: 60.6 CB :: 32.0 CG :: 30.0 CD :: 44.1 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 :: 9.73(D) HA :: 6.32(S) HB2 :: 2.72(S) HB3 :: 2.72(S) HG2 :: 2.75(S) HG3 :: 2.62(S) HD2 :: 3.82 HD3 :: 3.63 HE :: 8.05 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 124.8(D) NE :: 85.4 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.A67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.59 A 0.3 I 0.08 V 0.01 C Shift Assignments>> C :: 181.2 CA :: 56.1 CB :: 18.6 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.42(D) HA :: 4.83 HB1 :: 1.79 HB2 :: 1.79 HB3 :: 1.79 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.8(D) Ave N Shift Values>> N :: 123.23(3.54) 1.A68 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> M 0.55 A 0.42 I 0.01 C Shift Assignments>> C :: 180.0 CA :: 54.3 CB :: 17.3 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.21(D) HA :: 3.94 HB1 :: 0.31(S) HB2 :: 0.31(S) HB3 :: 0.31(S) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 117.5(D) Ave N Shift Values>> N :: 123.23(3.54) 1.H69 Overall: Mistyped Typing: Mistyped SRO: Suspicious C Shifts: Anomalous H Shifts: Anomalous N Shifts: Anomalous PRTL>> T 0.63 I 0.23 V 0.12 C Shift Assignments>> C :: 175.4 CA :: 70.8(A) CB :: 25.3 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 :: 10.46(D) HA :: 7.5(S) HB2 :: 10.44(A) HB3 :: 9.26(A) HD1 :: 15.75 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 :: 114.4(D) ND1 :: 135.3(A) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) SRO Rule Breaks>> (HA > HB2 : 0.9926) (HA > HB3 : 0.9952) 1.Q70 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> K 0.31 P 0.27 Q 0.19 I 0.11 R 0.05 E 0.03 M 0.02 C Shift Assignments>> C :: 178.2 CA :: 61.8 CB :: 28.9 CG :: 33.4 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.11(D) HA :: 5.02 HB2 :: 3.2(S) HB3 :: 2.7 HG2 :: 2.88 HG3 :: 2.79 HE21 :: 8.03 HE22 :: 6.98 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 :: 125.3(D) NE2 :: 111.8 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.24 F 0.24 Y 0.19 L 0.14 D 0.07 I 0.04 R 0.04 C Shift Assignments>> C :: 178.8 CA :: 58.1 CB :: 41.5 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.24(D) HA :: 4.65 HB2 :: 2.65 HB3 :: 2.78 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 :: 119.5(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.68 R 0.23 G 0.05 A 0.01 C Shift Assignments>> C :: 180.5 CA :: 56.9 CB :: 42.8 CG :: 26.1 CD1 :: 26.8 CD2 :: 22.8 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 :: 7.89(D) HA :: 4.08 HB2 :: 2.47 HB3 :: 0.86 HG :: 1.84 HD11 :: 0.68 HD12 :: 0.68 HD13 :: 0.68 HD21 :: 0.25 HD22 :: 0.25 HD23 :: 0.25 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.3(D) Ave N Shift Values>> N :: 121.86(3.9) 1.V73 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> 1.A10 1.A10 C Shift Assignments>> C :: 178.6 CA :: 66.8 CB :: 33.2 CG1 :: 21.7 CG2 :: 24.0 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 :: 8.52(D) HA :: 3.99 HB :: 2.83 HG11 :: 1.41 HG12 :: 1.41 HG13 :: 1.41 HG21 :: 1.91(S) HG22 :: 1.91(S) HG23 :: 1.91(S) 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 :: 121.2(D) Ave N Shift Values>> N :: 121.14(4.54) 1.E74 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.63 I 0.23 M 0.09 K 0.02 Q 0.01 HN Overlap>> 1.R29 1.R29 C Shift Assignments>> C :: 178.6 CA :: 59.9 CB :: 30.8 CG :: 36.8 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 :: 8.76(D) HA :: 4.23 HB2 :: 2.23 HB3 :: 2.13 HG2 :: 2.68 HG3 :: 2.48 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 :: 117.5(D) Ave N Shift Values>> N :: 120.67(3.48) 1.N75 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.35 L 0.22 N 0.14 F 0.1 Y 0.08 K 0.08 HN Overlap>> 1.V111 1.L121 1.V111 1.L121 C Shift Assignments>> C :: 175.9 CA :: 54.2 CB :: 40.9 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 :: 8.62(D) HA :: 5.12 HB2 :: 2.81 HB3 :: 2.75 HD21 :: 7.94 HD22 :: 7.14 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 :: 112.0(D) ND2 :: 116.4 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A76 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.95 L 0.03 M 0.01 HN Overlap>> 1.V107 1.V107 C Shift Assignments>> C :: 177.5 CA :: 51.1 CB :: 20.6 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.48(D) HA :: 4.73 HB1 :: 1.34 HB2 :: 1.34 HB3 :: 1.34 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.4(D) Ave N Shift Values>> N :: 123.23(3.54) 1.G77 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.92 L 0.05 C Shift Assignments>> C :: 174.5 CA :: 47.0 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.75(D) HA2 :: 3.89 HA3 :: 3.78 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.1(D) Ave N Shift Values>> N :: 109.67(3.87) 1.L78 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> L 0.97 R 0.02 C Shift Assignments>> C :: 176.8 CA :: 56.2 CB :: 41.4 CG :: 26.4 CD1 :: 25.0 CD2 :: 25.5 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 :: 7.35(D) HA :: 3.95 HB2 :: 0.28(S) HB3 :: 1.36 HG :: 0.8 HD11 :: 1.28 HD12 :: 1.28 HD13 :: 1.28 HD21 :: 0.29 HD22 :: 0.29 HD23 :: 0.29 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 :: 120.5(D) Ave N Shift Values>> N :: 121.86(3.9) 1.T79 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 174.8 CA :: 60.6 CB :: 70.3 CG2 :: 20.4 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 10.86(S) HA :: 4.73 HB :: 4.27 HG21 :: 1.29 HG22 :: 1.29 HG23 :: 1.29 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 :: 126.5(D) Ave N Shift Values>> N :: 115.42(4.75) 1.D80 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.27 Y 0.22 K 0.22 L 0.11 I 0.07 D 0.04 R 0.03 C Shift Assignments>> C :: 177.3 CA :: 58.7 CB :: 41.4 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 :: 8.82(D) HA :: 3.83 HB2 :: 2.46 HB3 :: 2.32 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 :: 120.9(D) Ave N Shift Values>> N :: 120.65(3.86) 1.V81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 176.8 CA :: 64.4 CB :: 30.7 CG1 :: 19.2 CG2 :: 20.4 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 :: 7.7(D) HA :: 3.72 HB :: 1.63 HG11 :: 0.3 HG12 :: 0.3 HG13 :: 0.3 HG21 :: 0.53 HG22 :: 0.53 HG23 :: 0.53 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 114.5(D) Ave N Shift Values>> N :: 121.14(4.54) 1.H82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.99 C Shift Assignments>> C :: 176.5 CA :: 59.8 CB :: 32.0 CD2 :: 115.9 CE1 :: 139 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 :: 6.6(D) HA :: 3.43 HB2 :: 2.36 HB3 :: 1.84 HD2 :: 6.95 HE1 :: 7.67 HE2 :: 11.25 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 :: 121.0(D) NE2 :: 167.1 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.F83 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> F 0.99 C Shift Assignments>> C :: 177.0 CA :: 60.1 CB :: 39.6 CD1 :: 131.0 CD2 :: 131.0 CE1 :: 130.8 CE2 :: 130.8 CZ :: 129.4 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 :: 6.69(D) HA :: 2.39(S) HB2 :: 1.84 HB3 :: 3.1 HD1 :: 6.52 HD2 :: 6.52 HE1 :: 7.06 HE2 :: 7.06 HZ :: 6.94 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 :: 120.2(D) Ave N Shift Values>> N :: 120.45(4.18) SRO Rule Breaks>> (HA > HB3 : 0.9955) 1.D84 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.33 F 0.33 D 0.1 I 0.09 L 0.08 N 0.03 C Shift Assignments>> C :: 178.2 CA :: 57.4 CB :: 39.6 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 :: 8.5(D) HA :: 4.07 HB2 :: 2.47 HB3 :: 2.47 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 :: 117.3(D) Ave N Shift Values>> N :: 120.65(3.86) 1.A85 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.62 A 0.32 I 0.04 C Shift Assignments>> C :: 179.6 CA :: 55.4 CB :: 17.9 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.4(D) HA :: 3.79 HB1 :: 1.06 HB2 :: 1.06 HB3 :: 1.06 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.3(D) Ave N Shift Values>> N :: 123.23(3.54) 1.I86 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 176.6 CA :: 65.7 CB :: 35.7 CG1 :: 28.3 CG2 :: 15.7 CD1 :: 10.9 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 6.97(D) HA :: 3.16 HB :: 0.22(S) HG12 :: 0.03 HG13 :: 0.01 HG21 :: 0.97 HG22 :: 0.97 HG23 :: 0.97 HD11 :: 0.97 HD12 :: 0.97 HD13 :: 0.97 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 :: 117.1(D) Ave N Shift Values>> N :: 121.46(4.28) 1.A87 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.65 A 0.25 I 0.08 C Shift Assignments>> C :: 178.6 CA :: 56.0 CB :: 18.1 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.43(D) HA :: 3.6 HB1 :: 1.26 HB2 :: 1.26 HB3 :: 1.26 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.1(D) Ave N Shift Values>> N :: 123.23(3.54) 1.E88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.6 I 0.19 K 0.08 M 0.05 Q 0.05 HN Overlap>> 1.D14 1.D14 C Shift Assignments>> C :: 178.8 CA :: 59.3 CB :: 30.0 CG :: 36.3 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 :: 8.46(D) HA :: 3.75 HB2 :: 1.98 HG2 :: 2.24 HG3 :: 1.98 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 :: 119.1(D) Ave N Shift Values>> N :: 120.67(3.48) 1.N89 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> Y 0.3 F 0.3 D 0.14 L 0.09 N 0.06 I 0.06 HN Overlap>> 1.S64 1.S64 C Shift Assignments>> C :: 178.0 CA :: 56.8 CB :: 39.5 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 :: 7.65(D) HA :: 4.5 HB2 :: 2.81 HB3 :: 2.49 HD21 :: 5.65(S) HD22 :: 9.06(S) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 115.4(D) ND2 :: 114.6 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.93 A 0.05 C Shift Assignments>> C :: 177.1 CA :: 58.0 CB :: 39.1 CG :: 27.2 CD1 :: 22.9 CD2 :: 27.5 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 :: 7.92(D) HA :: 3.4 HB2 :: 0.78 HB3 :: 1.93 HG :: 1.17 HD11 :: 0.44 HD12 :: 0.44 HD13 :: 0.44 HD21 :: 0.69 HD22 :: 0.69 HD23 :: 0.69 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 :: 125.1(D) Ave N Shift Values>> N :: 121.86(3.9) 1.V91 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.9 CA :: 68.9 CB :: 31.4 CG1 :: 21.1 CG2 :: 23.1 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 :: 8.15(D) HA :: 3.17 HB :: 2.04 HG11 :: 0.76 HG12 :: 0.76 HG13 :: 0.76 HG21 :: 0.79 HG22 :: 0.79 HG23 :: 0.79 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 :: 121.8(D) Ave N Shift Values>> N :: 121.14(4.54) 1.L92 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.89 R 0.07 G 0.02 C Shift Assignments>> C :: 179.8 CA :: 58.0 CB :: 42.3 CG :: 26.9 CD1 :: 23.1 CD2 :: 25.0 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 :: 8.53(D) HA :: 4.14 HB2 :: 1.75 HB3 :: 1.49 HG :: 1.75 HD11 :: 0.89 HD12 :: 0.89 HD13 :: 0.89 HD21 :: 0.89 HD22 :: 0.89 HD23 :: 0.89 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 :: 117.7(D) Ave N Shift Values>> N :: 121.86(3.9) 1.T93 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 175.3 CA :: 68.7 CB :: 68.4 CG2 :: 21.5 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 :: 7.5(D) HA :: 3.6 HB :: 4.63 HG21 :: 1.31 HG22 :: 1.31 HG23 :: 1.31 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 :: 116.3(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L94 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.87 A 0.08 R 0.03 C Shift Assignments>> C :: 179.1 CA :: 58.0 CB :: 40.6 CG :: 26.3 CD1 :: 27.0 CD2 :: 21.3 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 :: 8.03(D) HA :: 3.92 HB2 :: 1.96 HB3 :: 1.23 HG :: 2.15 HD11 :: 0.77 HD12 :: 0.77 HD13 :: 0.77 HD21 :: 0.93 HD22 :: 0.93 HD23 :: 0.93 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.5(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Q95 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.32 K 0.31 E 0.19 I 0.1 R 0.05 M 0.01 C Shift Assignments>> C :: 181.1 CA :: 59.3 CB :: 28.4 CG :: 34.5 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 :: 8.57(D) HA :: 4.13 HB2 :: 2.32 HB3 :: 2.01 HG2 :: 2.61 HG3 :: 2.34 HE21 :: 7.29 HE22 :: 6.62 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 :: 118.5(D) NE2 :: 110.0 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.54 I 0.35 K 0.06 M 0.02 Q 0.01 C Shift Assignments>> C :: 178.4 CA :: 59.3 CB :: 29.5 CG :: 36.9 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 :: 8.34(D) HA :: 4.08 HB2 :: 2.27 HB3 :: 2.07 HG2 :: 2.29 HG3 :: 2.67 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 :: 121.5(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L97 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.83 R 0.08 A 0.06 G 0.01 C Shift Assignments>> C :: 176.1 CA :: 54.9 CB :: 42.3 CG :: 26.8 CD1 :: 25.6 CD2 :: 22.8 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 :: 7.54(D) HA :: 4.37 HB2 :: 1.84 HB3 :: 1.8 HG :: 1.85 HD11 :: 0.9 HD12 :: 0.9 HD13 :: 0.9 HD21 :: 0.93 HD22 :: 0.93 HD23 :: 0.93 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.0(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N98 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.39 E 0.18 Y 0.13 M 0.09 F 0.09 D 0.04 K 0.01 I 0.01 L 0.01 C Shift Assignments>> C :: 174.9 CA :: 54.4 CB :: 37.1 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 :: 8.09(D) HA :: 4.4 HB2 :: 3.09 HB3 :: 2.8 HD21 :: 7.51 HD22 :: 6.78 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 115.6(D) ND2 :: 112.4 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> 1.R117 1.R117 C Shift Assignments>> C :: 175.0 CA :: 63.1 CB :: 31.9 CG1 :: 22.7 CG2 :: 22.7 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 :: 7.61(D) HA :: 3.88 HB :: 1.88 HG11 :: 1.12 HG12 :: 1.12 HG13 :: 1.12 HG21 :: 1.01 HG22 :: 1.01 HG23 :: 1.01 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 :: 117.8(D) Ave N Shift Values>> N :: 121.14(4.54) 1.S100 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 176.1 CA :: 59.3 CB :: 64.3 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.38(D) HA :: 4.18 HB2 :: 4.13 HB3 :: 3.91 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 :: 118.9(D) Ave N Shift Values>> N :: 116.28(3.52) 1.Q101 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.38 Q 0.36 R 0.13 E 0.04 M 0.04 I 0.01 C Shift Assignments>> C :: 176.7 CA :: 58.2 CB :: 28.4 CG :: 33.4 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 :: 8.89(D) HA :: 3.7 HB2 :: 2.25 HB3 :: 1.97 HG2 :: 2.44 HG3 :: 2.37 HE21 :: 7.94 HE22 :: 6.62 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 :: 125.6(D) NE2 :: 115.2 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D102 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.3 Y 0.3 D 0.14 L 0.1 I 0.06 N 0.06 C Shift Assignments>> C :: 178.8 CA :: 56.9 CB :: 39.6 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 :: 8.33(D) HA :: 4.29 HB2 :: 2.69 HB3 :: 2.51 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 :: 115.9(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L103 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.85 R 0.12 HN Overlap>> 1.E106 1.E106 C Shift Assignments>> C :: 178.8 CA :: 57.4 CB :: 41.9 CG :: 27.5 CD1 :: 25.6 CD2 :: 24.3 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 :: 7.3(D) HA :: 4.2 HB2 :: 1.94 HB3 :: 1.45 HG :: 1.61 HD11 :: 0.91 HD12 :: 0.91 HD13 :: 0.91 HD21 :: 0.86 HD22 :: 0.86 HD23 :: 0.86 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 :: 120.7(D) Ave N Shift Values>> N :: 121.86(3.9) 1.I104 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 177.4 CA :: 66.4 CB :: 37.5 CG1 :: 29.9 CG2 :: 18.1 CD1 :: 13.5 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 :: 7.5(D) HA :: 3.21 HB :: 1.85 HG12 :: 0.67 HG13 :: 1.63 HG21 :: 0.82 HG22 :: 0.82 HG23 :: 0.82 HD11 :: 0.67 HD12 :: 0.67 HD13 :: 0.67 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 :: 120.0(D) Ave N Shift Values>> N :: 121.46(4.28) 1.D105 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.32 Y 0.3 D 0.12 L 0.11 I 0.07 K 0.03 N 0.02 C Shift Assignments>> C :: 179.3 CA :: 57.4 CB :: 40.1 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 :: 8.77(D) HA :: 4.22 HB2 :: 2.71 HB3 :: 2.6 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.4(D) Ave N Shift Values>> N :: 120.65(3.86) 1.E106 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.49 I 0.35 K 0.09 Q 0.04 M 0.01 HN Overlap>> 1.L103 1.L103 C Shift Assignments>> C :: 178.8 CA :: 60.0 CB :: 29.4 CG :: 36.3 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 :: 7.35(D) HA :: 3.96 HB2 :: 2.12 HB3 :: 2.1 HG2 :: 2.47 HG3 :: 2.16 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 :: 120.8(D) Ave N Shift Values>> N :: 120.67(3.48) 1.V107 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> 1.A76 1.A76 C Shift Assignments>> C :: 178.3 CA :: 65.3 CB :: 31.4 CG1 :: 20.9 CG2 :: 21.7 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 :: 7.53(D) HA :: 3.7 HB :: 2.07 HG11 :: 0.45 HG12 :: 0.45 HG13 :: 0.45 HG21 :: 0.14 HG22 :: 0.14 HG23 :: 0.14 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 :: 121.5(D) Ave N Shift Values>> N :: 121.14(4.54) 1.V108 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> 1.A11 1.A11 C Shift Assignments>> C :: 179.3 CA :: 66.9 CB :: 31.9 CG1 :: 21.1 CG2 :: 23.6 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 :: 8.45(D) HA :: 3.32 HB :: 2.07 HG11 :: 0.79 HG12 :: 0.79 HG13 :: 0.79 HG21 :: 0.91 HG22 :: 0.91 HG23 :: 0.91 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 :: 119.7(D) Ave N Shift Values>> N :: 121.14(4.54) 1.T109 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.3 CA :: 66.3 CB :: 68.9 CG2 :: 21.8 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 :: 7.77(D) HA :: 3.85 HB :: 4.29 HG21 :: 1.21 HG22 :: 1.21 HG23 :: 1.21 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 :: 116.1(D) Ave N Shift Values>> N :: 115.42(4.75) 1.I110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 179.0 CA :: 64.6 CB :: 36.7 CG1 :: 28.8 CG2 :: 16.9 CD1 :: 11.1 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 :: 7.58(D) HA :: 3.8 HB :: 2.12 HG12 :: 1.06 HG13 :: 1.45 HG21 :: 0.43 HG22 :: 0.43 HG23 :: 0.43 HD11 :: 0.53 HD12 :: 0.53 HD13 :: 0.53 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.3(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V111 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> 1.N75 1.N75 C Shift Assignments>> C :: 176.6 CA :: 64.6 CB :: 31.4 CG1 :: 22.4 CG2 :: 20.0 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 :: 8.52(D) HA :: 3.95 HB :: 2.21 HG11 :: 0.75 HG12 :: 0.75 HG13 :: 0.75 HG21 :: 0.87 HG22 :: 0.87 HG23 :: 0.87 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 112.0(D) Ave N Shift Values>> N :: 121.14(4.54) 1.G112 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.73 L 0.16 R 0.04 F 0.01 D 0.01 C Shift Assignments>> C :: 174.2 CA :: 44.9 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.76(D) HA2 :: 3.68 HA3 :: 4.1 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.8(D) Ave N Shift Values>> N :: 109.67(3.87) 1.S113 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 176.2 CA :: 58.1 CB :: 64.0 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.21(D) HA :: 4.53 HB2 :: 4.18 HB3 :: 4.1 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 :: 115.5(D) Ave N Shift Values>> N :: 116.28(3.52) 1.V114 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.5 CA :: 66.3 CB :: 32.0 CG1 :: 21.2 CG2 :: 21.7 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 :: 8.75(D) HA :: 3.57 HB :: 2.07 HG11 :: 0.97 HG12 :: 0.97 HG13 :: 0.97 HG21 :: 1.04 HG22 :: 1.04 HG23 :: 1.04 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 128.4(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Q115 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.37 K 0.36 R 0.12 E 0.06 I 0.03 M 0.02 HN Overlap>> 1.D119 1.D119 C Shift Assignments>> C :: 178.1 CA :: 58.9 CB :: 28.2 CG :: 33.7 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 :: 8.36(D) HA :: 4.08 HB2 :: 2 HB3 :: 1.83 HG2 :: 2.27 HG3 :: 2.27 HE21 :: 7.6 HE22 :: 6.95 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 :: 118.7(D) NE2 :: 112.8 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.H116 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.21 R 0.18 H 0.18 Q 0.16 K 0.12 M 0.06 I 0.04 V 0.02 C Shift Assignments>> C :: 176.3 CA :: 58.2 CB :: 30.0 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.49(D) HA :: 4.92 HB2 :: 3.53 HB3 :: 3.36 HD2 :: 7.46 HE1 :: 8.17 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 :: 115.7(D) Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.R117 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> R 0.71 G 0.23 K 0.04 HN Overlap>> 1.V99 1.V99 C Shift Assignments>> C :: 177.5 CA :: 58.1 CB :: 31.3 CG :: 26.6 CD :: 43.9 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 :: 7.64(D) HA :: 3.99 HB2 :: 1.27 HB3 :: 1.36 HG2 :: 0.98 HG3 :: 0.24(S) HD2 :: 2.79 HD3 :: 2.47 HE :: 6.63 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 :: 117.8(D) NE :: 84.15 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.N118 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.3 F 0.25 N 0.14 D 0.09 E 0.07 I 0.06 L 0.04 M 0.02 C Shift Assignments>> C :: 177.3 CA :: 56.3 CB :: 38.3 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 :: 8.05(D) HA :: 4.51 HB2 :: 3.07 HB3 :: 2.99 HD21 :: 7.66 HD22 :: 6.76 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 :: 117.0(D) ND2 :: 110.1 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D119 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Duplicate PRTL>> K 0.26 F 0.24 Y 0.18 L 0.12 R 0.07 I 0.05 D 0.04 HN Overlap>> 1.Q115 1.Q115 C Shift Assignments>> C :: 179.1 CA :: 58.7 CB :: 41.8 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 :: 8.36(D) HA :: 5.34 HB2 :: 3.48 HB3 :: 3.6(S) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.6(D) Ave N Shift Values>> N :: 120.65(3.86) 1.V120 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.8 CA :: 69.6 CB :: 34.0 CG1 :: 23.4 CG2 :: 26.1 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 :: 8.9(D) HA :: 6.93(A) HB :: 3.14(S) HG11 :: 2.76(A) HG12 :: 2.76(A) HG13 :: 2.76(A) HG21 :: 3.31(A) HG22 :: 3.31(A) HG23 :: 3.31(A) 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 :: 120.7(D) Ave N Shift Values>> N :: 121.14(4.54) 1.L121 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.84 A 0.14 HN Overlap>> 1.N75 1.N75 C Shift Assignments>> C :: 176.0 CA :: 55.4 CB :: 40.5 CG :: 26.7 CD1 :: 22.4 CD2 :: 25.7 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 :: 8.59(D) HA :: 5.07 HB2 :: 1.97 HB3 :: 1.95 HG :: 2.02 HD11 :: 0.79 HD12 :: 0.79 HD13 :: 0.79 HD21 :: 0.72 HD22 :: 0.72 HD23 :: 0.72 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 :: 111.9(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N122 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.34 Y 0.19 F 0.17 D 0.14 L 0.05 E 0.04 M 0.02 I 0.02 C Shift Assignments>> C :: 174.3 CA :: 55.0 CB :: 38.4 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.02(D) HA :: 4.85 HB2 :: 3.74 HB3 :: 3.74 HD21 :: 8.1 HD22 :: 8.29 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 :: 118.2(D) ND2 :: 110.8 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R123 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.22 M 0.2 R 0.17 H 0.14 E 0.1 Q 0.08 V 0.04 C Shift Assignments>> C :: 181.5 CA :: 57.3 CB :: 32.2 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(D) HA :: 4.57 HB2 :: 1.73 HB3 :: 2.03 HG2 :: 1.81 HD2 :: 3.29 HD3 :: 3.18 HE :: 7.26 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.8(D) NE :: 85.3 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.HEM1 Overall Status: Residue type HEM not supported. ########################################################################### Overall Results: #Consistent: 3 #Clerical: 93 #Suspicious: 22 #Anomalous: 3 #Mistyped: 2 #Indeterminable: 0 Typing Results: #Consistent: 120 #Suspicious: 0 #Mistyped: 2 #Indeterminable: 1 Shift Relative Order (SRO) Results: #Consistent: 118 #Suspicious: 5 C Shift Results: #Consistent: 534 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 2 H Shift Results: #Consistent: 682 #Duplicate: 117 #Unknown: 0 #Suspicious: 52 #Anomalous: 13 N Shift Results: #Consistent: 20 #Duplicate: 119 #Unknown: 0 #Suspicious: 1 #Anomalous: 2 Error Summary: 1.L3 H = 8.78(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.9747e-01 1.L3 N = 123.0(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.7005e-01 1.Y4 H = 7.43(D), Expected = 8.32, Std = 0.7300, ChiSquare = 2.2278e-01 1.Y4 N = 114.8(D), Expected = 120.52, Std = 4.2000, ChiSquare = 1.7323e-01 1.E5 H = 7.64(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.4221e-01 1.E5 N = 119.3(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.9382e-01 1.K6 H = 8.05(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.1550e-01 1.K6 N = 117.7(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.7422e-01 1.L7 H = 7.68(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.9747e-01 1.L7 N = 113.8(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.8766e-02 1.G8 H = 7.3(D), Expected = 8.33, Std = 0.6500, ChiSquare = 1.1305e-01 1.G8 N = 104.8(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.0825e-01 1.G9 H = 8.31(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.7545e-01 1.G9 N = 108.9(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.4229e-01 1.A10 H = 8.54(D), Expected = 8.20, Std = 0.6000, ChiSquare = 5.7094e-01 1.A10 N = 121.3(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.8562e-01 1.A11 H = 8.47(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.5271e-01 1.A11 N = 119.6(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.0516e-01 1.A12 H = 7.65(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.5932e-01 1.A12 N = 121.6(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.4519e-01 1.V13 H = 7.86(D), Expected = 8.29, Std = 0.6700, ChiSquare = 5.2101e-01 1.V13 N = 118.9(D), Expected = 121.14, Std = 4.5400, ChiSquare = 6.2174e-01 1.D14 H = 8.42(D), Expected = 8.31, Std = 0.5800, ChiSquare = 8.4958e-01 1.D14 N = 119.2(D), Expected = 120.65, Std = 3.8600, ChiSquare = 7.0718e-01 1.L15 H = 7.86(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.6920e-01 1.L15 N = 120.5(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.2730e-01 1.A16 H = 8.18(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.7341e-01 1.A16 N = 122.1(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.4957e-01 1.V17 H = 9.17(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.8904e-01 1.V17 N = 118.5(D), Expected = 121.14, Std = 4.5400, ChiSquare = 5.6090e-01 1.E18 H = 8.41(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.9214e-01 1.E18 N = 119.9(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.2489e-01 1.K19 H = 8.54(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.5967e-01 1.K19 N = 120.2(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.2162e-01 1.F20 H = 9.06(D), Expected = 8.36, Std = 0.7200, ChiSquare = 3.3094e-01 1.F20 N = 122.4(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.4085e-01 1.Y21 H = 9.64(D), Expected = 8.32, Std = 0.7300, ChiSquare = 7.0573e-02 1.Y21 N = 119.9(D), Expected = 120.52, Std = 4.2000, ChiSquare = 8.8264e-01 1.G22 H = 8.16(D), Expected = 8.33, Std = 0.6500, ChiSquare = 7.9368e-01 1.G22 N = 107.3(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.4027e-01 1.K23 H = 8.14(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.3359e-01 1.K23 N = 122.3(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.4022e-01 1.V24 H = 8.03(D), Expected = 8.29, Std = 0.6700, ChiSquare = 6.9797e-01 1.V24 N = 119.2(D), Expected = 121.14, Std = 4.5400, ChiSquare = 6.6915e-01 1.L25 H = 7.58(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.1731e-01 1.L25 N = 117.2(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.3214e-01 1.A26 H = 7.12(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.1861e-02 1.A26 N = 118.6(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.9090e-01 1.D27 H = 7.35(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.7890e-02 1.D27 N = 119.7(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.0559e-01 1.E28 H = 9.01(D), Expected = 8.33, Std = 0.5900, ChiSquare = 2.4910e-01 1.E28 N = 128.3(D), Expected = 120.67, Std = 3.4800, ChiSquare = 2.8341e-02 1.R29 H = 8.68(D), Expected = 8.24, Std = 0.6100, ChiSquare = 4.7072e-01 1.R29 N = 117.5(D), Expected = 120.80, Std = 3.6800, ChiSquare = 3.6986e-01 1.V30 H = 7.11(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.8206e-02 1.V30 N = 104.0(S), Expected = 121.14, Std = 4.5400, ChiSquare = 1.5980e-04 1.N31 H = 8.77(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.9490e-01 1.N31 N = 122.9(D), Expected = 118.93, Std = 4.0300, ChiSquare = 3.2457e-01 1.R32 H = 8.12(D), Expected = 8.24, Std = 0.6100, ChiSquare = 8.4405e-01 1.R32 HG2 = 0.68(S), Expected = 1.57, Std = 0.2700, ChiSquare = 9.7969e-04 1.R32 HG3 = 0.15(S), Expected = 1.54, Std = 0.2900, ChiSquare = 1.6422e-06 1.R32 N = 120.4(D), Expected = 120.80, Std = 3.6800, ChiSquare = 9.1344e-01 1.F33 H = 7.13(D), Expected = 8.36, Std = 0.7200, ChiSquare = 8.7575e-02 1.F33 HB2 = 1.42(S), Expected = 3.00, Std = 0.3700, ChiSquare = 1.9524e-05 1.F33 HB3 = 1.3(S), Expected = 2.93, Std = 0.4000, ChiSquare = 4.6014e-05 1.F33 N = 116.2(D), Expected = 120.45, Std = 4.1800, ChiSquare = 3.0927e-01 1.F34 H = 7.42(D), Expected = 8.36, Std = 0.7200, ChiSquare = 1.9170e-01 1.F34 HE1 = 8.76(S), Expected = 7.08, Std = 0.3100, ChiSquare = 5.9814e-08 1.F34 HE2 = 8.76(S), Expected = 7.08, Std = 0.3200, ChiSquare = 1.5210e-07 1.F34 N = 113.4(D), Expected = 120.45, Std = 4.1800, ChiSquare = 9.1680e-02 1.V35 H = 7.28(D), Expected = 8.29, Std = 0.6700, ChiSquare = 1.3169e-01 1.V35 N = 117.5(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.2269e-01 1.N36 H = 8.43(D), Expected = 8.34, Std = 0.6300, ChiSquare = 8.8640e-01 1.N36 N = 117.8(D), Expected = 118.93, Std = 4.0300, ChiSquare = 7.7917e-01 1.T37 H = 8(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.9868e-01 1.T37 HG21 = 2(S), Expected = 1.14, Std = 0.2300, ChiSquare = 1.8466e-04 1.T37 HG22 = 2(S), Expected = 1.14, Std = 0.2300, ChiSquare = 1.8466e-04 1.T37 HG23 = 2(S), Expected = 1.14, Std = 0.2300, ChiSquare = 1.8466e-04 1.T37 N = 117.5(D), Expected = 115.42, Std = 4.7500, ChiSquare = 6.6146e-01 1.D38 H = 9.06(D), Expected = 8.31, Std = 0.5800, ChiSquare = 1.9598e-01 1.D38 N = 127.1(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.4725e-02 1.M39 H = 9.02(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.0527e-01 1.M39 N = 122.7(D), Expected = 120.09, Std = 3.5700, ChiSquare = 4.6472e-01 1.A40 H = 8.73(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.7706e-01 1.A40 N = 121.1(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.4738e-01 1.K41 H = 8.35(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.8973e-01 1.K41 N = 120.8(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.4713e-01 1.Q42 H = 9.31(D), Expected = 8.22, Std = 0.5900, ChiSquare = 6.4681e-02 1.Q42 HA = 5.87(S), Expected = 4.27, Std = 0.4400, ChiSquare = 2.7651e-04 1.Q42 HB2 = 3.17(S), Expected = 2.05, Std = 0.2500, ChiSquare = 7.4643e-06 1.Q42 HB3 = 3.31(S), Expected = 2.02, Std = 0.2800, ChiSquare = 4.0824e-06 1.Q42 HG3 = 3.39(S), Expected = 2.29, Std = 0.2900, ChiSquare = 1.4878e-04 1.Q42 N = 122.9(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.0309e-01 1.K43 H = 9.02(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.6656e-01 1.K43 N = 119.9(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.6034e-01 1.Q44 H = 8.84(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.9333e-01 1.Q44 N = 119.3(D), Expected = 119.89, Std = 3.6000, ChiSquare = 8.6982e-01 1.H45 Typing: Mistyped 1.H45 CA = 82.1(A), Expected = 56.52, Std = 2.3100, ChiSquare = 1.6851e-28 1.H45 H = 10.67(S), Expected = 8.24, Std = 0.6800, ChiSquare = 3.5220e-04 1.H45 HA = 7.99(S), Expected = 4.61, Std = 0.4300, ChiSquare = 3.8271e-15 1.H45 HB2 = 10.81(A), Expected = 3.10, Std = 0.3600, ChiSquare = 0.0000e+00 1.H45 HB3 = 9.23(A), Expected = 3.04, Std = 0.3800, ChiSquare = 1.1723e-59 1.H45 N = 122.1(D), Expected = 119.69, Std = 4.0000, ChiSquare = 5.4684e-01 1.H45 ND1 = 142.6(A), Expected = 195.02, Std = 18.5100, ChiSquare = 4.6260e-03 1.H45 SRO Rule Break>> H > HB2 : 0.998586572438163 1.H45 SRO Rule Break>> HA > HB2 : 0.992622401073105 1.H45 SRO Rule Break>> HA > HB3 : 0.995208761122519 1.Q46 H = 10.55(S), Expected = 8.22, Std = 0.5900, ChiSquare = 7.8428e-05 1.Q46 HA = 6.99(A), Expected = 4.27, Std = 0.4400, ChiSquare = 6.3367e-10 1.Q46 HB2 = 3.35(S), Expected = 2.05, Std = 0.2500, ChiSquare = 1.9929e-07 1.Q46 HE21 = 8.8(S), Expected = 7.24, Std = 0.4500, ChiSquare = 5.2695e-04 1.Q46 N = 124.6(D), Expected = 119.89, Std = 3.6000, ChiSquare = 1.9076e-01 1.Q46 SRO Rule Break>> HE22 > HA : 0.997619047619048 1.K47 H = 9.72(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.0772e-02 1.K47 HB3 = 2.65(S), Expected = 1.74, Std = 0.2700, ChiSquare = 7.5067e-04 1.K47 N = 124.2(D), Expected = 121.05, Std = 3.7700, ChiSquare = 4.0341e-01 1.D48 H = 10.07(D), Expected = 8.31, Std = 0.5800, ChiSquare = 2.4095e-03 1.D48 HB3 = 1.13(S), Expected = 2.66, Std = 0.2800, ChiSquare = 4.6477e-08 1.D48 N = 125.8(D), Expected = 120.65, Std = 3.8600, ChiSquare = 1.8214e-01 1.F49 H = 10.23(D), Expected = 8.36, Std = 0.7200, ChiSquare = 9.3981e-03 1.F49 HB3 = 4.26(S), Expected = 2.93, Std = 0.4000, ChiSquare = 8.8419e-04 1.F49 HD1 = 5.29(S), Expected = 7.06, Std = 0.3100, ChiSquare = 1.1319e-08 1.F49 HD2 = 5.29(S), Expected = 7.06, Std = 0.3100, ChiSquare = 1.1319e-08 1.F49 HE1 = 5.54(S), Expected = 7.08, Std = 0.3100, ChiSquare = 6.7737e-07 1.F49 HE2 = 5.54(S), Expected = 7.08, Std = 0.3200, ChiSquare = 1.4905e-06 1.F49 N = 121.9(D), Expected = 120.45, Std = 4.1800, ChiSquare = 7.2867e-01 1.F49 SRO Rule Break>> HA > HB2 : 0.995201919232307 1.F49 SRO Rule Break>> HA > HB3 : 0.99548625359048 1.M50 H = 8.95(D), Expected = 8.26, Std = 0.6000, ChiSquare = 2.5014e-01 1.M50 N = 118.4(D), Expected = 120.09, Std = 3.5700, ChiSquare = 6.3594e-01 1.T51 H = 8.92(D), Expected = 8.24, Std = 0.6200, ChiSquare = 2.7274e-01 1.T51 N = 116.7(D), Expected = 115.42, Std = 4.7500, ChiSquare = 7.8757e-01 1.Y52 H = 8.13(D), Expected = 8.32, Std = 0.7300, ChiSquare = 7.9465e-01 1.Y52 N = 124.3(D), Expected = 120.52, Std = 4.2000, ChiSquare = 3.6812e-01 1.A53 H = 8.29(D), Expected = 8.20, Std = 0.6000, ChiSquare = 8.8076e-01 1.A53 N = 120.1(D), Expected = 123.23, Std = 3.5400, ChiSquare = 3.7660e-01 1.F54 H = 7.53(D), Expected = 8.36, Std = 0.7200, ChiSquare = 2.4900e-01 1.F54 N = 110.9(D), Expected = 120.45, Std = 4.1800, ChiSquare = 2.2331e-02 1.G55 H = 7.99(D), Expected = 8.33, Std = 0.6500, ChiSquare = 6.0092e-01 1.G55 N = 106.9(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.7414e-01 1.G56 H = 8.38(D), Expected = 8.33, Std = 0.6500, ChiSquare = 9.3868e-01 1.G56 N = 113.2(D), Expected = 109.67, Std = 3.8700, ChiSquare = 3.6169e-01 1.T57 H = 7.58(D), Expected = 8.24, Std = 0.6200, ChiSquare = 2.8709e-01 1.T57 HG21 = 0.3(S), Expected = 1.14, Std = 0.2300, ChiSquare = 2.6003e-04 1.T57 HG22 = 0.3(S), Expected = 1.14, Std = 0.2300, ChiSquare = 2.6003e-04 1.T57 HG23 = 0.3(S), Expected = 1.14, Std = 0.2300, ChiSquare = 2.6003e-04 1.T57 N = 111.0(D), Expected = 115.42, Std = 4.7500, ChiSquare = 3.5210e-01 1.D58 H = 8.57(D), Expected = 8.31, Std = 0.5800, ChiSquare = 6.5395e-01 1.D58 N = 121.5(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.2571e-01 1.R59 H = 7.16(D), Expected = 8.24, Std = 0.6100, ChiSquare = 7.6645e-02 1.R59 N = 116.6(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.5374e-01 1.F60 C = 182.1(S), Expected = 175.42, Std = 1.9900, ChiSquare = 7.8855e-04 1.F60 H = 7.36(D), Expected = 8.36, Std = 0.7200, ChiSquare = 1.6487e-01 1.F60 N = 118.0(D), Expected = 120.45, Std = 4.1800, ChiSquare = 5.5779e-01 1.G62 H = 9.07(D), Expected = 8.33, Std = 0.6500, ChiSquare = 2.5493e-01 1.G62 N = 112.8(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.1864e-01 1.R63 H = 9.03(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.9529e-01 1.R63 N = 119.8(D), Expected = 120.80, Std = 3.6800, ChiSquare = 7.8582e-01 1.S64 H = 7.55(D), Expected = 8.28, Std = 0.5900, ChiSquare = 2.1598e-01 1.S64 N = 115.4(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.0259e-01 1.M65 H = 8.84(D), Expected = 8.26, Std = 0.6000, ChiSquare = 3.3371e-01 1.M65 HA = 6.02(S), Expected = 4.41, Std = 0.4800, ChiSquare = 7.9604e-04 1.M65 HB2 = 3.45(S), Expected = 2.03, Std = 0.3400, ChiSquare = 2.9607e-05 1.M65 HB3 = 4.12(A), Expected = 1.99, Std = 0.3400, ChiSquare = 3.7353e-10 1.M65 N = 123.3(D), Expected = 120.09, Std = 3.5700, ChiSquare = 3.6857e-01 1.R66 H = 9.73(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.4581e-02 1.R66 HA = 6.32(S), Expected = 4.30, Std = 0.4600, ChiSquare = 1.1267e-05 1.R66 HB2 = 2.72(S), Expected = 1.79, Std = 0.2700, ChiSquare = 5.7223e-04 1.R66 HB3 = 2.72(S), Expected = 1.76, Std = 0.2800, ChiSquare = 6.0677e-04 1.R66 HG2 = 2.75(S), Expected = 1.57, Std = 0.2700, ChiSquare = 1.2404e-05 1.R66 HG3 = 2.62(S), Expected = 1.54, Std = 0.2900, ChiSquare = 1.9598e-04 1.R66 N = 124.8(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.7706e-01 1.A67 H = 8.42(D), Expected = 8.20, Std = 0.6000, ChiSquare = 7.1387e-01 1.A67 N = 121.8(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.8625e-01 1.A68 H = 9.21(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.2311e-02 1.A68 HB1 = 0.31(S), Expected = 1.35, Std = 0.2600, ChiSquare = 6.3342e-05 1.A68 HB2 = 0.31(S), Expected = 1.35, Std = 0.2600, ChiSquare = 6.3342e-05 1.A68 HB3 = 0.31(S), Expected = 1.35, Std = 0.2600, ChiSquare = 6.3342e-05 1.A68 N = 117.5(D), Expected = 123.23, Std = 3.5400, ChiSquare = 1.0552e-01 1.H69 Typing: Mistyped 1.H69 CA = 70.8(A), Expected = 56.52, Std = 2.3100, ChiSquare = 6.3367e-10 1.H69 H = 10.46(D), Expected = 8.24, Std = 0.6800, ChiSquare = 1.0958e-03 1.H69 HA = 7.5(S), Expected = 4.61, Std = 0.4300, ChiSquare = 1.8057e-11 1.H69 HB2 = 10.44(A), Expected = 3.10, Std = 0.3600, ChiSquare = 0.0000e+00 1.H69 HB3 = 9.26(A), Expected = 3.04, Std = 0.3800, ChiSquare = 3.2145e-60 1.H69 N = 114.4(D), Expected = 119.69, Std = 4.0000, ChiSquare = 1.8600e-01 1.H69 ND1 = 135.3(A), Expected = 195.02, Std = 18.5100, ChiSquare = 1.2537e-03 1.H69 SRO Rule Break>> HA > HB2 : 0.992622401073105 1.H69 SRO Rule Break>> HA > HB3 : 0.995208761122519 1.Q70 H = 9.11(D), Expected = 8.22, Std = 0.5900, ChiSquare = 1.3143e-01 1.Q70 HB2 = 3.2(S), Expected = 2.05, Std = 0.2500, ChiSquare = 4.2249e-06 1.Q70 N = 125.3(D), Expected = 119.89, Std = 3.6000, ChiSquare = 1.3290e-01 1.D71 H = 9.24(D), Expected = 8.31, Std = 0.5800, ChiSquare = 1.0884e-01 1.D71 N = 119.5(D), Expected = 120.65, Std = 3.8600, ChiSquare = 7.6576e-01 1.L72 H = 7.89(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.0092e-01 1.L72 N = 118.3(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.6134e-01 1.V73 H = 8.52(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.3138e-01 1.V73 HG21 = 1.91(S), Expected = 0.80, Std = 0.2800, ChiSquare = 7.3616e-05 1.V73 HG22 = 1.91(S), Expected = 0.80, Std = 0.2800, ChiSquare = 7.3616e-05 1.V73 HG23 = 1.91(S), Expected = 0.80, Std = 0.2800, ChiSquare = 7.3616e-05 1.V73 N = 121.2(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.8946e-01 1.E74 H = 8.76(D), Expected = 8.33, Std = 0.5900, ChiSquare = 4.6612e-01 1.E74 N = 117.5(D), Expected = 120.67, Std = 3.4800, ChiSquare = 3.6234e-01 1.N75 H = 8.62(D), Expected = 8.34, Std = 0.6300, ChiSquare = 6.5672e-01 1.N75 N = 112.0(D), Expected = 118.93, Std = 4.0300, ChiSquare = 8.5505e-02 1.A76 H = 7.48(D), Expected = 8.20, Std = 0.6000, ChiSquare = 2.3014e-01 1.A76 N = 121.4(D), Expected = 123.23, Std = 3.5400, ChiSquare = 6.0519e-01 1.G77 H = 7.75(D), Expected = 8.33, Std = 0.6500, ChiSquare = 3.7223e-01 1.G77 N = 107.1(D), Expected = 109.67, Std = 3.8700, ChiSquare = 5.0664e-01 1.L78 H = 7.35(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.7579e-01 1.L78 HB2 = 0.28(S), Expected = 1.61, Std = 0.3400, ChiSquare = 9.1624e-05 1.L78 N = 120.5(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.2730e-01 1.T79 H = 10.86(S), Expected = 8.24, Std = 0.6200, ChiSquare = 2.3809e-05 1.T79 N = 126.5(D), Expected = 115.42, Std = 4.7500, ChiSquare = 1.9667e-02 1.D80 H = 8.82(D), Expected = 8.31, Std = 0.5800, ChiSquare = 3.7923e-01 1.D80 N = 120.9(D), Expected = 120.65, Std = 3.8600, ChiSquare = 9.4836e-01 1.V81 H = 7.7(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.7854e-01 1.V81 N = 114.5(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.4359e-01 1.H82 H = 6.6(D), Expected = 8.24, Std = 0.6800, ChiSquare = 1.5876e-02 1.H82 N = 121.0(D), Expected = 119.69, Std = 4.0000, ChiSquare = 7.4329e-01 1.F83 H = 6.69(D), Expected = 8.36, Std = 0.7200, ChiSquare = 2.0371e-02 1.F83 HA = 2.39(S), Expected = 4.63, Std = 0.5700, ChiSquare = 8.5008e-05 1.F83 N = 120.2(D), Expected = 120.45, Std = 4.1800, ChiSquare = 9.5231e-01 1.F83 SRO Rule Break>> HA > HB3 : 0.99548625359048 1.D84 H = 8.5(D), Expected = 8.31, Std = 0.5800, ChiSquare = 7.4322e-01 1.D84 N = 117.3(D), Expected = 120.65, Std = 3.8600, ChiSquare = 3.8546e-01 1.A85 H = 7.4(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.8242e-01 1.A85 N = 121.3(D), Expected = 123.23, Std = 3.5400, ChiSquare = 5.8562e-01 1.I86 H = 6.97(D), Expected = 8.28, Std = 0.6800, ChiSquare = 5.4046e-02 1.I86 HB = 0.22(S), Expected = 1.78, Std = 0.2900, ChiSquare = 7.4772e-08 1.I86 N = 117.1(D), Expected = 121.46, Std = 4.2800, ChiSquare = 3.0835e-01 1.A87 H = 7.43(D), Expected = 8.20, Std = 0.6000, ChiSquare = 1.9938e-01 1.A87 N = 122.1(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.4957e-01 1.E88 H = 8.46(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.2561e-01 1.E88 N = 119.1(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.5188e-01 1.N89 H = 7.65(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.7341e-01 1.N89 HD21 = 5.65(S), Expected = 7.35, Std = 0.4800, ChiSquare = 3.9761e-04 1.N89 HD22 = 9.06(S), Expected = 7.14, Std = 0.4900, ChiSquare = 8.9151e-05 1.N89 N = 115.4(D), Expected = 118.93, Std = 4.0300, ChiSquare = 3.8107e-01 1.L90 H = 7.92(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.3342e-01 1.L90 N = 125.1(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.0610e-01 1.V91 H = 8.15(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.3448e-01 1.V91 N = 121.8(D), Expected = 121.14, Std = 4.5400, ChiSquare = 8.8442e-01 1.L92 H = 8.53(D), Expected = 8.23, Std = 0.6500, ChiSquare = 6.4441e-01 1.L92 N = 117.7(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.8612e-01 1.T93 H = 7.5(D), Expected = 8.24, Std = 0.6200, ChiSquare = 2.3265e-01 1.T93 N = 116.3(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.5302e-01 1.L94 H = 8.03(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.5832e-01 1.L94 N = 118.5(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.8894e-01 1.Q95 H = 8.57(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.5303e-01 1.Q95 N = 118.5(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.9941e-01 1.E96 H = 8.34(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.8648e-01 1.E96 N = 121.5(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.1149e-01 1.L97 H = 7.54(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.8845e-01 1.L97 N = 118.0(D), Expected = 121.86, Std = 3.9000, ChiSquare = 3.2230e-01 1.N98 H = 8.09(D), Expected = 8.34, Std = 0.6300, ChiSquare = 6.9150e-01 1.N98 N = 115.6(D), Expected = 118.93, Std = 4.0300, ChiSquare = 4.0863e-01 1.V99 H = 7.61(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.1014e-01 1.V99 N = 117.8(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.6192e-01 1.S100 H = 8.38(D), Expected = 8.28, Std = 0.5900, ChiSquare = 8.6541e-01 1.S100 N = 118.9(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.5668e-01 1.Q101 H = 8.89(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.5613e-01 1.Q101 N = 125.6(D), Expected = 119.89, Std = 3.6000, ChiSquare = 1.1271e-01 1.D102 H = 8.33(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.7249e-01 1.D102 N = 115.9(D), Expected = 120.65, Std = 3.8600, ChiSquare = 2.1848e-01 1.L103 H = 7.3(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.5250e-01 1.L103 N = 120.7(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.6613e-01 1.I104 H = 7.5(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.5136e-01 1.I104 N = 120.0(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.3301e-01 1.D105 H = 8.77(D), Expected = 8.31, Std = 0.5800, ChiSquare = 4.2772e-01 1.D105 N = 118.4(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.5996e-01 1.E106 H = 7.35(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.6710e-02 1.E106 N = 120.8(D), Expected = 120.67, Std = 3.4800, ChiSquare = 9.7020e-01 1.V107 H = 7.53(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.5666e-01 1.V107 N = 121.5(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.3680e-01 1.V108 H = 8.45(D), Expected = 8.29, Std = 0.6700, ChiSquare = 8.1126e-01 1.V108 N = 119.7(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.5111e-01 1.T109 H = 7.77(D), Expected = 8.24, Std = 0.6200, ChiSquare = 4.4841e-01 1.T109 N = 116.1(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.8617e-01 1.I110 H = 7.58(D), Expected = 8.28, Std = 0.6800, ChiSquare = 3.0329e-01 1.I110 N = 122.3(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.4441e-01 1.V111 H = 8.52(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.3138e-01 1.V111 N = 112.0(D), Expected = 121.14, Std = 4.5400, ChiSquare = 4.4092e-02 1.G112 H = 7.76(D), Expected = 8.33, Std = 0.6500, ChiSquare = 3.8053e-01 1.G112 N = 106.8(D), Expected = 109.67, Std = 3.8700, ChiSquare = 4.5833e-01 1.S113 H = 7.21(D), Expected = 8.28, Std = 0.5900, ChiSquare = 6.9746e-02 1.S113 N = 115.5(D), Expected = 116.28, Std = 3.5200, ChiSquare = 8.2463e-01 1.V114 H = 8.75(D), Expected = 8.29, Std = 0.6700, ChiSquare = 4.9236e-01 1.V114 N = 128.4(D), Expected = 121.14, Std = 4.5400, ChiSquare = 1.0979e-01 1.Q115 H = 8.36(D), Expected = 8.22, Std = 0.5900, ChiSquare = 8.1243e-01 1.Q115 N = 118.7(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.4098e-01 1.H116 H = 7.49(D), Expected = 8.24, Std = 0.6800, ChiSquare = 2.7005e-01 1.H116 N = 115.7(D), Expected = 119.69, Std = 4.0000, ChiSquare = 3.1852e-01 1.R117 H = 7.64(D), Expected = 8.24, Std = 0.6100, ChiSquare = 3.2531e-01 1.R117 HG3 = 0.24(S), Expected = 1.54, Std = 0.2900, ChiSquare = 7.3684e-06 1.R117 N = 117.8(D), Expected = 120.80, Std = 3.6800, ChiSquare = 4.1495e-01 1.N118 H = 8.05(D), Expected = 8.34, Std = 0.6300, ChiSquare = 6.4529e-01 1.N118 N = 117.0(D), Expected = 118.93, Std = 4.0300, ChiSquare = 6.3200e-01 1.D119 H = 8.36(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.3130e-01 1.D119 HB3 = 3.6(S), Expected = 2.66, Std = 0.2800, ChiSquare = 7.8752e-04 1.D119 N = 118.6(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.9536e-01 1.V120 H = 8.9(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.6259e-01 1.V120 HA = 6.93(A), Expected = 4.19, Std = 0.5800, ChiSquare = 2.3109e-06 1.V120 HB = 3.14(S), Expected = 1.98, Std = 0.3200, ChiSquare = 2.8896e-04 1.V120 HG11 = 2.76(A), Expected = 0.83, Std = 0.2600, ChiSquare = 1.1443e-13 1.V120 HG12 = 2.76(A), Expected = 0.83, Std = 0.2600, ChiSquare = 1.1443e-13 1.V120 HG13 = 2.76(A), Expected = 0.83, Std = 0.2600, ChiSquare = 1.1443e-13 1.V120 HG21 = 3.31(A), Expected = 0.80, Std = 0.2800, ChiSquare = 3.1230e-19 1.V120 HG22 = 3.31(A), Expected = 0.80, Std = 0.2800, ChiSquare = 3.1230e-19 1.V120 HG23 = 3.31(A), Expected = 0.80, Std = 0.2800, ChiSquare = 3.1230e-19 1.V120 N = 120.7(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.2279e-01 1.L121 H = 8.59(D), Expected = 8.23, Std = 0.6500, ChiSquare = 5.7968e-01 1.L121 N = 111.9(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.0654e-02 1.N122 H = 9.02(D), Expected = 8.34, Std = 0.6300, ChiSquare = 2.8043e-01 1.N122 N = 118.2(D), Expected = 118.93, Std = 4.0300, ChiSquare = 8.5626e-01 1.R123 H = 9(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.1280e-01 1.R123 N = 123.8(D), Expected = 120.80, Std = 3.6800, ChiSquare = 4.1495e-01