Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Q2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.99 C Shift Assignments>> CD1 :: 12.423 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>> HD11 :: 0.838 HD12 :: 0.838 HD13 :: 0.838 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) 1.P5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Q7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.5 V 0.21 T 0.15 K 0.09 A 0.02 C Shift Assignments>> CG2 :: 23.070 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>> HG21 :: 1.031 HG22 :: 1.031 HG23 :: 1.031 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) 1.Q9 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A10 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.M11 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> L 0.55 V 0.17 K 0.12 T 0.1 A 0.01 C Shift Assignments>> CD2 :: 23.256(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> HD21 :: 0.958(D) HD22 :: 0.958(D) HD23 :: 0.958(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 1.G13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.91 L 0.07 C Shift Assignments>> C :: 178.760 CA :: 45.986 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.597 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.560 Ave N Shift Values>> N :: 109.67(3.87) 1.Q14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.2 Q 0.19 R 0.19 E 0.16 I 0.14 L 0.06 M 0.01 HN Overlap>> 2.S82 2.S82 C Shift Assignments>> C :: 177.923 CA :: 58.313 CB :: 28.151 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.621 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 :: 122.475 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.38 L 0.3 I 0.28 R 0.02 C Shift Assignments>> C :: 178.292 CA :: 58.438 CB :: 40.803 CD2 :: 25.871(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.293 HD21 :: 1.010(D) HD22 :: 1.010(D) HD23 :: 1.010(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.567 Ave N Shift Values>> N :: 121.86(3.9) 1.D16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.28 Y 0.23 L 0.15 K 0.14 D 0.1 I 0.05 N 0.01 R 0.01 HN Overlap>> 1.E80 1.E80 2.Q27 2.Q27 C Shift Assignments>> C :: 178.868 CA :: 57.646 CB :: 40.889 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 :: 7.823 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 :: 119.080 Ave N Shift Values>> N :: 120.65(3.86) 1.T17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 177.311 CA :: 66.548 CB :: 68.112 CG2 :: 21.423 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 :: 7.652 HG21 :: 1.135 HG22 :: 1.135 HG23 :: 1.135 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.953 Ave N Shift Values>> N :: 115.42(4.75) 1.Y18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.42 E 0.16 Y 0.16 V 0.09 F 0.09 M 0.02 K 0.02 HN Overlap>> 1.V25 1.V25 C Shift Assignments>> C :: 178.282 CA :: 61.060 CB :: 36.332 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 :: 8.159 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.289 Ave N Shift Values>> N :: 120.52(4.2) 1.Q19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.36 R 0.27 L 0.11 Q 0.09 K 0.08 E 0.05 P 0.02 C Shift Assignments>> C :: 179.269 CA :: 59.489 CB :: 26.727 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 :: 8.653 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 :: 119.149 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Q20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.18 Y 0.15 F 0.14 E 0.08 K 0.07 R 0.07 I 0.06 Q 0.05 V 0.04 M 0.04 T 0.04 L 0.02 HN Overlap>> 1.E45 1.E45 1.Q27 2.L46 1.Q27 2.L46 C Shift Assignments>> C :: 178.863 CA :: 58.936 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 :: 8.005 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 :: 119.762 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Q21 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.46 I 0.4 K 0.12 C Shift Assignments>> C :: 178.148 CA :: 57.735 CB :: 39.879 CD2 :: 25.685(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.569 HD21 :: 1.059(D) HD22 :: 1.059(D) HD23 :: 1.059(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.040 Ave N Shift Values>> N :: 121.86(3.9) 1.Q23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.28 I 0.23 Q 0.14 L 0.11 E 0.09 K 0.09 C Shift Assignments>> C :: 178.687(D) CA :: 58.799(D) CB :: 27.360(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.695(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.596(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.61 K 0.35 I 0.02 C Shift Assignments>> C :: 179.790 CA :: 57.820 CB :: 40.786 CD2 :: 23.633(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.434 HD21 :: 0.961(D) HD22 :: 0.961(D) HD23 :: 0.961(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.621 Ave N Shift Values>> N :: 121.86(3.9) 1.V25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 HN Overlap>> 1.Y18 1.Y18 C Shift Assignments>> C :: 178.005(D) CA :: 66.549(D) CB :: 30.806(D) CG2 :: 23.541(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.066(D) HG21 :: 1.120(D) HG22 :: 1.120(D) HG23 :: 1.120(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.231(D) Ave N Shift Values>> N :: 121.14(4.54) 1.I26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 2.Q40 2.Q40 C Shift Assignments>> C :: 178.836 CA :: 65.323 CB :: 36.031 CD1 :: 12.893(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.431 HD11 :: 0.876(D) HD12 :: 0.876(D) HD13 :: 0.876(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.588 Ave N Shift Values>> N :: 121.46(4.28) 1.Q27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.24 R 0.2 Q 0.16 K 0.15 E 0.13 L 0.06 M 0.01 HN Overlap>> 1.E45 1.Q20 1.E45 1.Q20 2.E38 2.E38 C Shift Assignments>> C :: 179.643 CA :: 58.992 CB :: 27.912 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.926 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 :: 119.702 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Q28 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.66 P 0.26 V 0.07 C Shift Assignments>> C :: 178.292(D) CA :: 66.324(S) CB :: 28.387(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.232(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.808(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.3 R 0.16 K 0.14 E 0.14 M 0.09 Q 0.05 P 0.05 I 0.03 C Shift Assignments>> C :: 178.111(D) CA :: 60.136(D) CB :: 31.553(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.932(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.777(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Q30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.26 I 0.22 Q 0.15 K 0.11 E 0.1 L 0.1 HN Overlap>> 1.N87 2.Q19 1.N87 2.Q19 C Shift Assignments>> C :: 178.739 CA :: 58.785 CB :: 27.511 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 :: 8.052 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.714 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.22 E 0.19 K 0.19 M 0.15 V 0.11 Q 0.09 I 0.01 C Shift Assignments>> C :: 178.276 CA :: 58.776 CB :: 31.466 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.369 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.101 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.I46 1.I46 2.K113 2.K113 C Shift Assignments>> C :: 178.052 CA :: 66.245 CB :: 30.514 CG2 :: 23.159 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 :: 8.186 HG21 :: 1.004 HG22 :: 1.004 HG23 :: 1.004 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 :: 120.039 Ave N Shift Values>> N :: 121.14(4.54) 1.Q33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.25 K 0.19 Q 0.16 E 0.16 R 0.14 L 0.03 M 0.01 C Shift Assignments>> C :: 178.220(D) CA :: 59.214(D) CB :: 28.317(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.572(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.289(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.8 A 0.16 I 0.03 C Shift Assignments>> C :: 180.470(D) CA :: 55.202(D) CB :: 15.990(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.686(D) HB1 :: 1.553 HB2 :: 1.553 HB3 :: 1.553 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.637(D) Ave N Shift Values>> N :: 123.23(3.54) 1.D35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.32 Y 0.31 D 0.12 L 0.1 I 0.07 N 0.03 K 0.01 HN Overlap>> 2.R43 2.R43 C Shift Assignments>> C :: 179.562(D) CA :: 57.273(D) CB :: 39.784(D) Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.351(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.464(D) Ave N Shift Values>> N :: 120.65(3.86) 1.L36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.46 L 0.28 I 0.15 R 0.08 C Shift Assignments>> C :: 177.954(D) CA :: 58.160(D) CB :: 41.308(D) CD2 :: 25.974(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.864(D) HD21 :: 0.978(D) HD22 :: 0.978(D) HD23 :: 0.978(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.315(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Y 0.28 F 0.21 E 0.14 N 0.14 I 0.06 D 0.05 M 0.04 L 0.02 C Shift Assignments>> C :: 177.963(D) CA :: 56.298(D) CB :: 37.840(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.333(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 118.648(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.22 K 0.2 E 0.2 Q 0.15 R 0.13 V 0.03 M 0.02 C Shift Assignments>> C :: 178.599 CA :: 59.559 CB :: 29.080 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 :: 8.118 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 :: 120.140 Ave N Shift Values>> N :: 120.67(3.48) 1.A39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> M 0.65 A 0.3 I 0.03 C Shift Assignments>> C :: 179.309 CA :: 54.988 CB :: 17.253(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.060 HB1 :: 1.526(D) HB2 :: 1.526(D) HB3 :: 1.526(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.355 Ave N Shift Values>> N :: 123.23(3.54) 1.K40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.31 R 0.16 K 0.14 E 0.13 M 0.09 P 0.05 Q 0.05 I 0.03 C Shift Assignments>> C :: 179.457 CA :: 60.144 CB :: 31.603 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 :: 8.408 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 :: 117.380 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.23 E 0.2 K 0.18 M 0.16 Q 0.11 V 0.08 I 0.01 C Shift Assignments>> C :: 178.989 CA :: 58.401 CB :: 31.341 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.378 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.724 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.62 A 0.34 I 0.03 C Shift Assignments>> C :: 179.036 CA :: 54.846 CB :: 17.342(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.875 HB1 :: 1.525 HB2 :: 1.525 HB3 :: 1.525 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.182 Ave N Shift Values>> N :: 123.23(3.54) 1.L43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.51 L 0.28 K 0.18 R 0.02 C Shift Assignments>> C :: 179.069 CA :: 58.058 CB :: 40.445 CD2 :: 26.559(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.162 HD21 :: 0.943(D) HD22 :: 0.943(D) HD23 :: 0.943(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.527 Ave N Shift Values>> N :: 121.86(3.9) 1.E44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.22 E 0.21 Q 0.18 I 0.15 R 0.14 M 0.03 V 0.01 L 0.01 C Shift Assignments>> C :: 179.711(D) CA :: 58.955(D) CB :: 29.062(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.361(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.256(D) Ave N Shift Values>> N :: 120.67(3.48) 1.E45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.24 R 0.24 Q 0.15 K 0.13 E 0.11 L 0.08 M 0.01 HN Overlap>> 1.Q20 1.Q27 1.Q20 1.Q27 C Shift Assignments>> C :: 178.817(D) CA :: 58.924(D) CB :: 27.656(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.983(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.738(D) Ave N Shift Values>> N :: 120.67(3.48) 1.I46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 HN Overlap>> 1.I96 1.V32 2.N28 2.K113 1.I96 1.V32 2.N28 2.K113 C Shift Assignments>> C :: 178.220(D) CA :: 63.927(D) CB :: 36.193(D) CD1 :: 12.762(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.272(D) HD11 :: 0.416(D) HD12 :: 0.416(D) HD13 :: 0.416(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 119.999(D) Ave N Shift Values>> N :: 121.46(4.28) 1.E47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.24 E 0.19 K 0.18 Q 0.14 R 0.13 V 0.04 M 0.02 C Shift Assignments>> C :: 178.102(D) CA :: 59.845(D) CB :: 29.212(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.670(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.765(D) Ave N Shift Values>> N :: 120.67(3.48) 1.T48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.099 CA :: 61.990 CB :: 69.357 CG2 :: 21.596(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.132 HG21 :: 1.418(D) HG22 :: 1.418(D) HG23 :: 1.418(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 107.396 Ave N Shift Values>> N :: 115.42(4.75) 1.L49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.53 L 0.45 C Shift Assignments>> C :: 174.820 CA :: 53.200(D) CB :: 40.229(D) CD2 :: 21.886(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.316(D) HD21 :: 0.926(D) HD22 :: 0.926(D) HD23 :: 0.926(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.663(D) Ave N Shift Values>> N :: 121.86(3.9) 1.P50 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D51 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D52 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.85 M 0.13 C Shift Assignments>> C :: 177.319 CA :: 52.597 CB :: 18.880(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.377 HB1 :: 1.517(D) HB2 :: 1.517(D) HB3 :: 1.517(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.078 Ave N Shift Values>> N :: 123.23(3.54) 1.Q54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.27 K 0.24 R 0.16 E 0.14 L 0.11 M 0.04 I 0.01 C Shift Assignments>> C :: 173.509 CA :: 54.961 CB :: 28.500 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 :: 8.963 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 :: 121.856 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 173.216(D) CA :: 58.716(D) CB :: 38.656(D) CD1 :: 13.381(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.453(D) HD11 :: 0.725(D) HD12 :: 0.725(D) HD13 :: 0.725(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.734(D) Ave N Shift Values>> N :: 121.46(4.28) 1.Y56 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.25 Y 0.22 D 0.21 L 0.16 N 0.07 K 0.03 I 0.03 C Shift Assignments>> C :: 174.479(D) CA :: 56.331(D) CB :: 40.203(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.260(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 125.155(D) Ave N Shift Values>> N :: 120.52(4.2) 1.K57 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.26 N 0.23 E 0.22 K 0.08 Q 0.08 Y 0.05 F 0.03 C Shift Assignments>> C :: 175.169(D) CA :: 53.719(D) CB :: 35.781(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.341(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 122.903(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.T58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 HN Overlap>> 1.L89 1.L89 2.A26 2.A26 C Shift Assignments>> C :: 174.327(D) CA :: 61.992(D) CB :: 68.901(D) CG2 :: 21.281 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 :: 8.224(D) HG21 :: 1.162 HG22 :: 1.162 HG23 :: 1.162 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 :: 121.041(D) Ave N Shift Values>> N :: 115.42(4.75) 1.V59 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.94 M 0.04 C Shift Assignments>> C :: 175.465(D) CA :: 60.225(D) CB :: 32.000(D) CG2 :: 20.613(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.930(D) HG21 :: 0.844(D) HG22 :: 0.844(D) HG23 :: 0.844(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 129.557(D) Ave N Shift Values>> N :: 121.14(4.54) 1.G60 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.96 S 0.03 C Shift Assignments>> C :: 174.244 CA :: 61.055 CB :: 67.548 CG2 :: 21.871(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.393 HG21 :: 1.273(D) HG22 :: 1.273(D) HG23 :: 1.273(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.130 Ave N Shift Values>> N :: 115.42(4.75) 1.L62 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.69 K 0.24 G 0.02 A 0.02 R 0.01 HN Overlap>> 1.K101 1.K101 C Shift Assignments>> C :: 176.056(D) CA :: 53.573(D) CB :: 42.504(D) CD2 :: 23.823(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.092(D) HD21 :: 0.885(D) HD22 :: 0.885(D) HD23 :: 0.885(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.710(D) Ave N Shift Values>> N :: 121.86(3.9) 1.I63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 C Shift Assignments>> C :: 175.473(D) CA :: 60.795(D) CB :: 39.868 CD1 :: 14.239(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.753(D) HD11 :: 0.732(D) HD12 :: 0.732(D) HD13 :: 0.732(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.215(D) Ave N Shift Values>> N :: 121.46(4.28) 1.V64 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.83 M 0.14 A 0.01 C Shift Assignments>> C :: 174.905(D) CA :: 58.955(D) CB :: 33.454(D) CG2 :: 20.447(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.040(D) HG21 :: 0.902(D) HG22 :: 0.902(D) HG23 :: 0.902(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.559(D) Ave N Shift Values>> N :: 121.14(4.54) 1.K65 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.27 K 0.27 Q 0.17 R 0.15 E 0.07 V 0.02 C Shift Assignments>> C :: 175.757(D) CA :: 56.401(D) CB :: 32.673 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 :: 8.013(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 126.210(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.T66 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.73 A 0.26 C Shift Assignments>> C :: 172.948(D) CA :: 58.290(D) CB :: 69.927(D) CG2 :: 19.292(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.839(D) HG21 :: 1.206(D) HG22 :: 1.206(D) HG23 :: 1.206(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 122.974(D) Ave N Shift Values>> N :: 115.42(4.75) 1.T67 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> T 0.98 A 0.01 C Shift Assignments>> C :: 174.914 CA :: 58.798 CB :: 71.580 CG2 :: 22.144(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.302 HG21 :: 1.342(D) HG22 :: 1.342(D) HG23 :: 1.342(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 112.204 Ave N Shift Values>> N :: 115.42(4.75) 1.K68 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.36 R 0.13 K 0.13 E 0.11 P 0.08 M 0.08 Q 0.04 I 0.02 C Shift Assignments>> C :: 177.198 CA :: 60.409 CB :: 31.729(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.106(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.283(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.22 K 0.21 E 0.19 Q 0.16 R 0.12 M 0.02 V 0.01 L 0.01 C Shift Assignments>> C :: 178.912 CA :: 59.339 CB :: 28.801 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 :: 8.257 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.157 Ave N Shift Values>> N :: 120.67(3.48) 1.K70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.22 K 0.19 E 0.19 M 0.17 Q 0.1 V 0.09 I 0.01 HN Overlap>> 2.N78 2.N78 C Shift Assignments>> C :: 178.222 CA :: 58.447 CB :: 31.473 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.353 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 :: 119.271 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A71 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.51 A 0.45 I 0.02 C Shift Assignments>> C :: 179.129(D) CA :: 54.861(D) CB :: 18.095(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.127(D) HB1 :: 1.218(D) HB2 :: 1.218(D) HB3 :: 1.218(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.875(D) Ave N Shift Values>> N :: 123.23(3.54) 1.V72 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> V 0.99 C Shift Assignments>> C :: 177.613 CA :: 66.578 CB :: 30.699 CG2 :: 22.961(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.350(D) HG21 :: 1.034(D) HG22 :: 1.034(D) HG23 :: 1.034(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 115.379(D) Ave N Shift Values>> N :: 121.14(4.54) 1.Q73 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.26 I 0.25 Q 0.14 L 0.1 K 0.1 E 0.1 C Shift Assignments>> C :: 178.748(D) CA :: 58.958 CB :: 27.425(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.496(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.679(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.24 Q 0.22 E 0.22 R 0.15 I 0.07 M 0.04 L 0.02 C Shift Assignments>> C :: 179.452 CA :: 57.795 CB :: 29.018 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 :: 7.474 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.407 Ave N Shift Values>> N :: 120.67(3.48) 1.L75 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.21 E 0.18 K 0.17 V 0.16 M 0.13 Q 0.08 I 0.02 P 0.01 C Shift Assignments>> C :: 178.740 CA :: 59.258 CB :: 31.456 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.957 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 :: 122.317 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.22 E 0.2 I 0.19 Q 0.17 R 0.13 M 0.02 V 0.01 L 0.01 C Shift Assignments>> CA :: 59.170 CB :: 28.901 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 :: 8.027 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.530 Ave N Shift Values>> N :: 120.67(3.48) 1.K78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.26 K 0.2 R 0.17 M 0.13 E 0.13 Q 0.05 P 0.02 I 0.01 C Shift Assignments>> C :: 178.757 CA :: 59.611 CB :: 32.028 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 :: 8.257 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.005 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.99 HN Overlap>> 2.I125 2.I125 C Shift Assignments>> C :: 177.190(D) CA :: 65.918(D) CB :: 38.150(D) CD1 :: 14.960(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.609(D) HD11 :: 0.861(D) HD12 :: 0.861(D) HD13 :: 0.861(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.012(D) Ave N Shift Values>> N :: 121.46(4.28) 1.E80 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.27 K 0.2 E 0.18 Q 0.15 R 0.11 V 0.02 M 0.02 L 0.01 HN Overlap>> 1.D16 2.Q27 1.D16 2.Q27 C Shift Assignments>> C :: 179.184(D) CA :: 59.625(D) CB :: 28.788(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.862(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.100(D) Ave N Shift Values>> N :: 120.67(3.48) 1.T81 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 177.334(D) CA :: 66.260(D) CB :: 68.657(D) CG2 :: 21.456 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.000(D) HG21 :: 1.357 HG22 :: 1.357 HG23 :: 1.357 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.197(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L82 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.69 K 0.27 I 0.01 C Shift Assignments>> C :: 178.759(D) CA :: 57.916(D) CB :: 40.990(D) CD2 :: 22.934 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 :: 8.417(D) HD21 :: 1.060 HD22 :: 1.060 HD23 :: 1.060 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 :: 123.569(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.37 K 0.16 E 0.15 Q 0.11 R 0.09 V 0.03 P 0.02 M 0.01 C Shift Assignments>> C :: 180.107 CA :: 60.258 CB :: 28.790 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 :: 8.686 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 :: 120.634 Ave N Shift Values>> N :: 120.67(3.48) 1.V84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 179.494 CA :: 66.393 CB :: 30.868 CG2 :: 22.754 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 :: 7.790 HG21 :: 1.237 HG22 :: 1.237 HG23 :: 1.237 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 :: 120.345 Ave N Shift Values>> N :: 121.14(4.54) 1.R85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.22 K 0.21 Q 0.19 E 0.17 R 0.1 L 0.05 M 0.01 C Shift Assignments>> C :: 178.697 CA :: 58.812 CB :: 28.179 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 :: 7.802 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 121.803 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.L86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.36 L 0.3 K 0.28 R 0.05 C Shift Assignments>> C :: 178.690 CA :: 57.966 CB :: 40.775 CD2 :: 26.494 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 :: 8.740 HD21 :: 1.001 HD22 :: 1.001 HD23 :: 1.001 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.154 Ave N Shift Values>> N :: 121.86(3.9) 1.N87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.31 F 0.26 N 0.12 D 0.07 E 0.07 I 0.07 L 0.04 M 0.02 HN Overlap>> 1.Q30 1.Q30 2.Q19 2.Q19 C Shift Assignments>> C :: 177.942 CA :: 56.530 CB :: 38.276 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 :: 8.082 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 :: 117.804 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.75 A 0.2 I 0.03 C Shift Assignments>> C :: 181.221 CA :: 55.152 CB :: 16.492(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.935 HB1 :: 1.677 HB2 :: 1.677 HB3 :: 1.677 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.938 Ave N Shift Values>> N :: 123.23(3.54) 1.L89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.37 K 0.34 I 0.25 R 0.02 HN Overlap>> 1.T58 2.A26 1.T58 2.A26 C Shift Assignments>> C :: 178.906 CA :: 57.863 CB :: 40.652 CD2 :: 25.963 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 :: 8.326 HD21 :: 0.972 HD22 :: 0.972 HD23 :: 0.972 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.063 Ave N Shift Values>> N :: 121.86(3.9) 1.N90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.28 F 0.22 N 0.16 E 0.11 D 0.07 I 0.05 M 0.03 L 0.03 C Shift Assignments>> C :: 178.610 CA :: 56.177 CB :: 37.978 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 :: 8.541 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.084 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.24 K 0.21 Q 0.18 E 0.17 R 0.1 L 0.04 M 0.01 HN Overlap>> 1.E102 1.E102 C Shift Assignments>> C :: 178.902 CA :: 59.051 CB :: 28.258 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 :: 7.840 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 :: 120.063 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.Q92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.29 I 0.26 Q 0.13 L 0.12 E 0.08 K 0.07 HN Overlap>> 2.K112 2.K112 C Shift Assignments>> C :: 178.105 CA :: 58.965 CB :: 27.186 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.979 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 120.716 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.21 E 0.21 K 0.19 Q 0.15 R 0.14 V 0.04 M 0.03 C Shift Assignments>> C :: 178.144 CA :: 59.682 CB :: 29.280 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 :: 8.567 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 :: 120.725 Ave N Shift Values>> N :: 120.67(3.48) 1.Q94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.29 I 0.25 Q 0.13 L 0.13 E 0.08 K 0.07 C Shift Assignments>> C :: 178.724 CA :: 58.857 CB :: 27.178 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.720 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.480 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.28 R 0.23 Q 0.19 K 0.08 M 0.07 I 0.07 V 0.04 HN Overlap>> 2.V74 2.E38 2.V74 2.E38 C Shift Assignments>> C :: 179.677 CA :: 58.712 CB :: 30.064 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.854 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 :: 119.586 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.I46 1.I46 C Shift Assignments>> C :: 178.140 CA :: 65.254 CB :: 35.674 CD1 :: 13.911 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.309 HD11 :: 0.912 HD12 :: 0.912 HD13 :: 0.912 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 :: 120.063 Ave N Shift Values>> N :: 121.46(4.28) 1.N97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.13 R 0.13 K 0.12 M 0.11 E 0.1 L 0.08 F 0.08 Y 0.07 D 0.04 S 0.04 N 0.01 A 0.01 C Shift Assignments>> C :: 178.320 CA :: 56.635 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 :: 8.418 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 :: 118.994 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E98 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.29 Q 0.26 R 0.23 M 0.07 I 0.06 K 0.05 V 0.01 C Shift Assignments>> C :: 179.236(D) CA :: 57.731(D) CB :: 29.505(D) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.484(D) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.473(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 179.038 CA :: 66.648 CB :: 30.880 CG2 :: 23.558 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 :: 8.400 HG21 :: 1.042 HG22 :: 1.042 HG23 :: 1.042 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 :: 120.272 Ave N Shift Values>> N :: 121.14(4.54) 1.K101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.24 R 0.21 V 0.13 Q 0.13 I 0.11 K 0.08 M 0.06 P 0.01 HN Overlap>> 1.L62 1.L62 C Shift Assignments>> C :: 178.727 CA :: 59.780 CB :: 30.385 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 :: 8.090 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 :: 122.742 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E102 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.22 I 0.21 E 0.19 Q 0.17 R 0.12 M 0.02 L 0.02 V 0.01 HN Overlap>> 1.R91 1.R91 C Shift Assignments>> C :: 179.154(D) CA :: 59.155(D) CB :: 28.717(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.785(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.000(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L103 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.51 L 0.45 I 0.01 R 0.01 C Shift Assignments>> C :: 179.137 CA :: 57.783 CB :: 41.841 CD2 :: 24.082(D) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.287 HD21 :: 1.090(D) HD22 :: 1.090(D) HD23 :: 1.090(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.582 Ave N Shift Values>> N :: 121.86(3.9) 1.T104 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> T 0.99 C Shift Assignments>> C :: 176.713 CA :: 67.259(D) CB :: 67.497(D) CG2 :: 21.251(D) Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.469(D) HG21 :: 1.289(D) HG22 :: 1.289(D) HG23 :: 1.289(D) Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.417(D) Ave N Shift Values>> N :: 115.42(4.75) 1.Q105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.23 I 0.23 Q 0.15 K 0.13 E 0.12 L 0.08 M 0.01 C Shift Assignments>> C :: 178.855 CA :: 58.883 CB :: 27.717 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.622 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 120.339 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.19 V 0.19 K 0.18 E 0.17 M 0.13 Q 0.07 I 0.02 P 0.01 C Shift Assignments>> C :: 179.681 CA :: 59.434 CB :: 31.571 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.843 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 :: 120.609 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.369 CA :: 65.475 CB :: 37.785 CD1 :: 14.450 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.458 HD11 :: 0.839 HD12 :: 0.839 HD13 :: 0.839 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.277 Ave N Shift Values>> N :: 121.46(4.28) 1.Q108 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.25 I 0.21 Q 0.16 K 0.12 E 0.11 L 0.1 M 0.01 HN Overlap>> 2.Q21 2.Q23 2.Q21 2.Q23 C Shift Assignments>> C :: 178.595(D) CA :: 58.719(D) CB :: 27.591 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.846(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.277(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A109 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.56 A 0.42 I 0.01 C Shift Assignments>> C :: 179.030 CA :: 53.927 CB :: 16.836(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.639 HB1 :: 1.551 HB2 :: 1.551 HB3 :: 1.551 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.519 Ave N Shift Values>> N :: 123.23(3.54) 1.A110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.78 M 0.21 C Shift Assignments>> C :: 178.548 CA :: 53.080 CB :: 18.517(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.535 HB1 :: 1.481 HB2 :: 1.481 HB3 :: 1.481 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.390 Ave N Shift Values>> N :: 123.23(3.54) 1.L111 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.7 K 0.24 A 0.04 C Shift Assignments>> C :: 176.830(D) CA :: 54.903(D) CB :: 41.683(D) CD2 :: 23.046 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 :: 7.487(D) HD21 :: 0.934 HD22 :: 0.934 HD23 :: 0.934 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 :: 117.225(D) Ave N Shift Values>> N :: 121.86(3.9) 1.R112 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> Q 0.27 R 0.23 K 0.19 E 0.15 M 0.11 L 0.01 C Shift Assignments>> C :: 173.428(D) CA :: 53.807(D) CB :: 29.563(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.449(D) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 120.866(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.P113 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P114 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.43 T 0.41 A 0.07 L 0.05 C Shift Assignments>> CG2 :: 21.477 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>> HG21 :: 1.269 HG22 :: 1.269 HG23 :: 1.269 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) 1.A116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.54 V 0.21 I 0.09 M 0.07 T 0.06 C Shift Assignments>> CB :: 19.626 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HB1 :: 1.445 HB2 :: 1.445 HB3 :: 1.445 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 1.G117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> C :: 176.837 CA :: 46.780 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.888 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.870 Ave N Shift Values>> N :: 109.67(3.87) 2.M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.4 T 0.39 L 0.13 A 0.05 C Shift Assignments>> CB :: 22.002 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HB1 :: 1.365 HB2 :: 1.365 HB3 :: 1.365 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 2.Q3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.N4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.N5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K6 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.46 V 0.24 T 0.17 K 0.08 A 0.02 C Shift Assignments>> CD2 :: 22.981 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>> HD21 :: 0.926 HD22 :: 0.926 HD23 :: 0.926 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) 2.E9 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K10 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.62 K 0.23 V 0.07 T 0.03 I 0.01 C Shift Assignments>> CD2 :: 23.796 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>> HD21 :: 0.893 HD22 :: 0.893 HD23 :: 0.893 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) 2.A12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.35 I 0.34 M 0.26 V 0.02 C Shift Assignments>> CB :: 18.184 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HB1 :: 1.483 HB2 :: 1.483 HB3 :: 1.483 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 2.Y13 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E14 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Y15 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Q16 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.38 V 0.37 L 0.17 A 0.05 C Shift Assignments>> CG2 :: 22.146 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>> HG21 :: 1.066 HG22 :: 1.066 HG23 :: 1.066 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) 2.L18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.58 K 0.15 V 0.14 T 0.08 A 0.01 C Shift Assignments>> CD2 :: 23.383 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>> HD21 :: 0.936 HD22 :: 0.936 HD23 :: 0.936 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) 2.Q19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.22 I 0.2 Q 0.17 K 0.15 E 0.13 L 0.07 M 0.01 HN Overlap>> 1.Q30 1.N87 1.Q30 1.N87 C Shift Assignments>> C :: 178.703 CA :: 58.733 CB :: 27.858 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 :: 8.069 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.747 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.A20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.64 A 0.32 I 0.02 C Shift Assignments>> C :: 180.408 CA :: 54.783 CB :: 17.150(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.630 HB1 :: 1.593 HB2 :: 1.593 HB3 :: 1.593 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.964 Ave N Shift Values>> N :: 123.23(3.54) 2.Q21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.2 K 0.18 Q 0.18 I 0.18 E 0.15 L 0.06 M 0.01 HN Overlap>> 1.Q108 1.Q108 2.Q23 2.Q23 C Shift Assignments>> C :: 178.386 CA :: 58.581 CB :: 28.056 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.826 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.375 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.A22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.73 A 0.23 I 0.03 C Shift Assignments>> C :: 179.515 CA :: 54.978 CB :: 16.587(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.348 HB1 :: 1.569 HB2 :: 1.569 HB3 :: 1.569 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.379 Ave N Shift Values>> N :: 123.23(3.54) 2.Q23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.2 I 0.18 K 0.18 Q 0.18 E 0.15 L 0.06 M 0.01 HN Overlap>> 1.Q108 2.Q21 1.Q108 2.Q21 C Shift Assignments>> C :: 178.927 CA :: 58.644 CB :: 28.037 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.823 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.282 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.I24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 2.K123 2.K123 C Shift Assignments>> C :: 178.847 CA :: 63.796 CB :: 37.015 CD1 :: 13.060 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 :: 7.470 HD11 :: 0.673 HD12 :: 0.673 HD13 :: 0.673 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 :: 120.064 Ave N Shift Values>> N :: 121.46(4.28) 2.L25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.51 L 0.43 I 0.03 C Shift Assignments>> C :: 178.926 CA :: 58.101 CB :: 41.258 CD2 :: 24.272 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 :: 7.959 HD21 :: 0.943 HD22 :: 0.943 HD23 :: 0.943 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.061 Ave N Shift Values>> N :: 121.86(3.9) 2.A26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.67 A 0.27 I 0.03 HN Overlap>> 1.L89 1.T58 1.L89 1.T58 C Shift Assignments>> C :: 180.918 CA :: 55.132 CB :: 17.214(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.283 HB1 :: 1.559 HB2 :: 1.559 HB3 :: 1.559 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.044 Ave N Shift Values>> N :: 123.23(3.54) 2.Q27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.25 I 0.19 Q 0.16 K 0.13 E 0.12 L 0.1 M 0.01 HN Overlap>> 1.E80 1.D16 1.E80 1.D16 C Shift Assignments>> C :: 178.875 CA :: 58.534 CB :: 27.658 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.868 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 :: 119.169 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.N28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.26 F 0.21 N 0.19 E 0.11 D 0.07 I 0.04 M 0.04 L 0.03 HN Overlap>> 1.I46 1.I46 2.K113 2.K113 C Shift Assignments>> C :: 177.740 CA :: 55.932 CB :: 37.960 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 :: 8.297 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.939 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.L29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.44 L 0.35 I 0.15 R 0.04 C Shift Assignments>> C :: 178.664 CA :: 57.796 CB :: 40.976 CD2 :: 25.829 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 :: 8.329 HD21 :: 0.981 HD22 :: 0.981 HD23 :: 0.981 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 :: 120.659 Ave N Shift Values>> N :: 121.86(3.9) 2.E30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.23 E 0.2 Q 0.18 I 0.17 R 0.13 M 0.02 L 0.01 V 0.01 C Shift Assignments>> C :: 179.117 CA :: 58.987 CB :: 28.857 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 :: 7.524 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 :: 119.766 Ave N Shift Values>> N :: 120.67(3.48) 2.L31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.55 V 0.17 K 0.12 T 0.11 A 0.01 C Shift Assignments>> CD2 :: 23.241 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> HD21 :: 0.898 HD22 :: 0.898 HD23 :: 0.898 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) 2.L32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.47 V 0.24 T 0.17 K 0.08 A 0.02 C Shift Assignments>> CD2 :: 22.988 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>> HD21 :: 0.987 HD22 :: 0.987 HD23 :: 0.987 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 2.N33 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.45 V 0.24 T 0.18 K 0.07 A 0.02 C Shift Assignments>> CD2 :: 22.951 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>> HD21 :: 0.995 HD22 :: 0.995 HD23 :: 0.995 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) 2.A35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.67 A 0.3 I 0.02 C Shift Assignments>> C :: 179.973 CA :: 54.593 CB :: 16.696(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.972 HB1 :: 1.455 HB2 :: 1.455 HB3 :: 1.455 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.533 Ave N Shift Values>> N :: 123.23(3.54) 2.K36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.23 R 0.18 K 0.16 E 0.16 M 0.11 Q 0.07 I 0.02 P 0.02 C Shift Assignments>> C :: 177.720 CA :: 59.690 CB :: 31.530 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.978 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.267 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.A37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.37 I 0.02 C Shift Assignments>> C :: 180.723 CA :: 54.600 CB :: 17.295(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.550 HB1 :: 1.187 HB2 :: 1.187 HB3 :: 1.187 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.608 Ave N Shift Values>> N :: 123.23(3.54) 2.E38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.23 K 0.21 E 0.19 Q 0.16 R 0.12 M 0.02 V 0.02 L 0.01 HN Overlap>> 1.K95 1.Q27 1.K95 1.Q27 C Shift Assignments>> C :: 179.162 CA :: 59.491 CB :: 28.873 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 :: 7.854 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 :: 119.663 Ave N Shift Values>> N :: 120.67(3.48) 2.V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.96 P 0.02 C Shift Assignments>> C :: 178.117 CA :: 66.745 CB :: 30.670 CG2 :: 24.027 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 :: 8.009 HG21 :: 1.212 HG22 :: 1.212 HG23 :: 1.212 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 :: 119.307 Ave N Shift Values>> N :: 121.14(4.54) 2.Q40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.31 R 0.22 Q 0.13 K 0.11 E 0.1 L 0.07 P 0.01 HN Overlap>> 1.I26 1.I26 C Shift Assignments>> C :: 178.544 CA :: 59.354 CB :: 27.640 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 :: 8.463 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 120.537 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.T41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 177.579 CA :: 66.405 CB :: 68.249 CG2 :: 22.037 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 :: 7.909 HG21 :: 1.294 HG22 :: 1.294 HG23 :: 1.294 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 :: 116.773 Ave N Shift Values>> N :: 115.42(4.75) 2.V42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 177.641 CA :: 67.101 CB :: 30.465 CG2 :: 22.811 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 :: 8.128 HG21 :: 1.095 HG22 :: 1.095 HG23 :: 1.095 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 126.074 Ave N Shift Values>> N :: 121.14(4.54) 2.R43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.45 K 0.14 E 0.12 Q 0.09 R 0.07 P 0.04 V 0.03 M 0.01 L 0.01 HN Overlap>> 1.D35 1.D35 C Shift Assignments>> C :: 177.946 CA :: 60.499 CB :: 28.604 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 :: 8.385 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 121.481 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.E44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.22 I 0.2 E 0.19 Q 0.18 R 0.12 M 0.02 L 0.01 V 0.01 HN Overlap>> 2.T45 2.T45 C Shift Assignments>> C :: 179.600 CA :: 59.111 CB :: 28.744 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 :: 8.163 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.945 Ave N Shift Values>> N :: 120.67(3.48) 2.T45 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.88 I 0.11 HN Overlap>> 2.E44 2.E44 C Shift Assignments>> C :: 179.783 CA :: 67.540 CB :: 28.964(A) CG2 :: 21.044 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 :: 8.189 HG21 :: 1.348 HG22 :: 1.348 HG23 :: 1.348 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.031 Ave N Shift Values>> N :: 115.42(4.75) 2.L46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.89 K 0.05 A 0.03 I 0.01 HN Overlap>> 1.Q20 1.Q20 C Shift Assignments>> C :: 178.456 CA :: 57.744 CB :: 40.215 CD2 :: 22.246 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 :: 8.083 HD21 :: 0.708 HD22 :: 0.708 HD23 :: 0.708 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.795 Ave N Shift Values>> N :: 121.86(3.9) 2.E47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.24 K 0.21 E 0.19 Q 0.15 R 0.12 M 0.02 V 0.02 L 0.01 C Shift Assignments>> C :: 179.427 CA :: 59.531 CB :: 28.845 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 :: 8.300 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.326 Ave N Shift Values>> N :: 120.67(3.48) 2.N48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.25 D 0.19 L 0.12 N 0.1 I 0.04 C Shift Assignments>> C :: 178.240 CA :: 56.281 CB :: 39.682 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 :: 7.824 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.089 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.L49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.74 K 0.22 A 0.01 C Shift Assignments>> C :: 178.740 CA :: 57.537 CB :: 41.290 CD2 :: 22.556 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 :: 8.256 HD21 :: 1.055 HD22 :: 1.055 HD23 :: 1.055 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 :: 123.431 Ave N Shift Values>> N :: 121.86(3.9) 2.K50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.23 E 0.2 K 0.18 M 0.16 Q 0.1 V 0.08 I 0.01 C Shift Assignments>> C :: 177.373 CA :: 58.304 CB :: 31.386 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.440 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 116.095 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.K51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.29 K 0.25 R 0.2 E 0.11 Q 0.09 V 0.02 C Shift Assignments>> C :: 176.877 CA :: 56.005 CB :: 32.122 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.098 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 115.171 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.I52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 176.442 CA :: 61.442 CB :: 37.048 CD1 :: 13.720 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 :: 7.263 HD11 :: 0.212 HD12 :: 0.212 HD13 :: 0.212 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 :: 122.076 Ave N Shift Values>> N :: 121.46(4.28) 2.E53 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E54 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E55 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K56 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.P57 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.26 E 0.23 Q 0.19 M 0.15 K 0.12 V 0.01 C Shift Assignments>> C :: 175.830 CA :: 56.500 CB :: 30.652 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 :: 8.464 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 :: 123.676 Ave N Shift Values>> N :: 120.67(3.48) 2.I59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.87 G 0.11 A 0.01 C Shift Assignments>> C :: 176.888 CA :: 58.636 CB :: 42.232 CD1 :: 15.034 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.437 HD11 :: 0.729 HD12 :: 0.729 HD13 :: 0.729 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 114.691 Ave N Shift Values>> N :: 121.46(4.28) 2.L60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.7 A 0.19 K 0.08 C Shift Assignments>> C :: 175.621 CA :: 52.818 CB :: 41.568 CD2 :: 22.689 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 :: 7.677 HD21 :: 0.105 HD22 :: 0.105 HD23 :: 0.105 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.687 Ave N Shift Values>> N :: 121.86(3.9) 2.V61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.84 M 0.13 A 0.01 C Shift Assignments>> C :: 174.518 CA :: 59.160 CB :: 32.759 CG2 :: 20.339 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 :: 9.577 HG21 :: 0.773 HG22 :: 0.773 HG23 :: 0.773 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.357 Ave N Shift Values>> N :: 121.14(4.54) 2.P62 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.I63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 174.816 CA :: 59.995 CB :: 38.543 CD1 :: 14.371 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 :: 7.656 HD11 :: 0.663 HD12 :: 0.663 HD13 :: 0.663 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 115.173 Ave N Shift Values>> N :: 121.46(4.28) 2.G64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.39 L 0.31 G 0.11 D 0.05 F 0.05 Y 0.03 K 0.02 C Shift Assignments>> C :: 173.442 CA :: 43.585 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.445 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.610 Ave N Shift Values>> N :: 109.67(3.87) 2.A65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.8 M 0.19 C Shift Assignments>> C :: 183.020 CA :: 52.109 CB :: 17.899 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.859 HB1 :: 1.303 HB2 :: 1.303 HB3 :: 1.303 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.268 Ave N Shift Values>> N :: 123.23(3.54) 2.G66 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.S67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.123 CA :: 57.622 CB :: 64.111 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.225 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.803 Ave N Shift Values>> N :: 116.28(3.52) 2.F68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.73 L 0.18 R 0.02 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 174.640 CA :: 56.321 CB :: 45.393 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 :: 9.290 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.776 Ave N Shift Values>> N :: 120.45(4.18) 2.L69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.83 L 0.13 R 0.03 C Shift Assignments>> C :: 176.302 CA :: 52.221 CB :: 44.923 CD2 :: 26.017 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 :: 8.422 HD21 :: 0.952 HD22 :: 0.952 HD23 :: 0.952 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 :: 118.163 Ave N Shift Values>> N :: 121.86(3.9) 2.K70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.26 M 0.25 R 0.2 E 0.13 Q 0.09 V 0.04 C Shift Assignments>> C :: 176.459 CA :: 57.076 CB :: 32.133 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 :: 9.391 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 :: 122.009 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.G71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.65 L 0.2 R 0.08 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 172.476 CA :: 44.709 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.404 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.535 Ave N Shift Values>> N :: 109.67(3.87) 2.V72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.89 I 0.05 M 0.02 K 0.01 C Shift Assignments>> C :: 175.554 CA :: 59.885 CB :: 36.202 CG2 :: 21.577 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 :: 8.467 HG21 :: 0.836 HG22 :: 0.836 HG23 :: 0.836 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 116.308 Ave N Shift Values>> N :: 121.14(4.54) 2.I73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 2.F99 2.F99 C Shift Assignments>> C :: 175.432 CA :: 59.942 CB :: 37.678 CD1 :: 12.806 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.206 HD11 :: 0.826 HD12 :: 0.826 HD13 :: 0.826 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 :: 124.218 Ave N Shift Values>> N :: 121.46(4.28) 2.V74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.87 I 0.08 M 0.04 HN Overlap>> 1.K95 1.K95 C Shift Assignments>> C :: 175.317 CA :: 61.934 CB :: 31.696 CG2 :: 19.396 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 :: 7.933 HG21 :: 0.813 HG22 :: 0.813 HG23 :: 0.813 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 :: 119.549 Ave N Shift Values>> N :: 121.14(4.54) 2.D75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.35 L 0.26 K 0.12 N 0.1 F 0.06 Y 0.04 R 0.03 C Shift Assignments>> C :: 175.139 CA :: 53.382 CB :: 41.641 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 :: 6.901 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 :: 119.473 Ave N Shift Values>> N :: 120.65(3.86) 2.K76 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.N77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.36 N 0.22 L 0.18 F 0.1 Y 0.08 K 0.03 C Shift Assignments>> C :: 175.152 CA :: 53.847 CB :: 40.505 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 :: 8.444 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 :: 115.236 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.N78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.32 D 0.27 R 0.16 G 0.07 K 0.05 N 0.04 F 0.03 Y 0.01 HN Overlap>> 1.K70 1.K70 C Shift Assignments>> C :: 172.214 CA :: 52.241 CB :: 42.880 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 :: 7.363 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.309 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.A79 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 L 0.1 C Shift Assignments>> C :: 174.731 CA :: 50.183 CB :: 21.653(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.063 HB1 :: 1.099 HB2 :: 1.099 HB3 :: 1.099 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.102 Ave N Shift Values>> N :: 123.23(3.54) 2.I80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 175.491 CA :: 61.022 CB :: 37.944 CD1 :: 12.816 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.570 HD11 :: 0.947 HD12 :: 0.947 HD13 :: 0.947 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 :: 122.011 Ave N Shift Values>> N :: 121.46(4.28) 2.V81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.83 M 0.13 I 0.01 C Shift Assignments>> C :: 176.378 CA :: 59.289 CB :: 33.752 CG2 :: 20.306 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 :: 8.615 HG21 :: 0.845 HG22 :: 0.845 HG23 :: 0.845 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.885 Ave N Shift Values>> N :: 121.14(4.54) 2.S82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.Q14 1.Q14 C Shift Assignments>> C :: 175.266 CA :: 59.254 CB :: 63.360 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.719 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 122.440 Ave N Shift Values>> N :: 116.28(3.52) 2.V83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.97 M 0.01 C Shift Assignments>> C :: 175.492 CA :: 60.465 CB :: 31.921 CG2 :: 21.243 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 :: 8.555 HG21 :: 0.864 HG22 :: 0.864 HG23 :: 0.864 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 116.911 Ave N Shift Values>> N :: 121.14(4.54) 2.G84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.31 L 0.31 G 0.22 D 0.04 F 0.04 Y 0.02 K 0.01 C Shift Assignments>> C :: 173.338 CA :: 43.900 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.569 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.077 Ave N Shift Values>> N :: 109.67(3.87) 2.S85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.659 CB :: 64.344 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.687 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.194 Ave N Shift Values>> N :: 116.28(3.52) 2.G86 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Y87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.22 L 0.16 K 0.15 D 0.11 I 0.04 N 0.01 R 0.01 C Shift Assignments>> C :: 175.708 CA :: 57.496 CB :: 40.951 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 :: 7.737 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 118.022 Ave N Shift Values>> N :: 120.52(4.2) 2.A88 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.81 L 0.17 C Shift Assignments>> C :: 174.991 CA :: 50.817 CB :: 21.823(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.278 HB1 :: 1.250 HB2 :: 1.250 HB3 :: 1.250 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.957 Ave N Shift Values>> N :: 123.23(3.54) 2.V89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.48 M 0.28 I 0.2 A 0.01 C Shift Assignments>> C :: 174.834 CA :: 59.278 CB :: 35.079 CG2 :: 19.582 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 :: 8.558 HG21 :: 0.887 HG22 :: 0.887 HG23 :: 0.887 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 :: 118.049 Ave N Shift Values>> N :: 121.14(4.54) 2.E90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.26 E 0.2 M 0.18 Q 0.17 K 0.14 V 0.01 C Shift Assignments>> C :: 175.169 CA :: 56.187 CB :: 30.915 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 :: 8.494 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 :: 128.189 Ave N Shift Values>> N :: 120.67(3.48) 2.R91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.38 Q 0.26 K 0.16 E 0.06 N 0.05 R 0.03 Y 0.01 C Shift Assignments>> C :: 175.021 CA :: 53.299 CB :: 34.518 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 :: 9.099 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 :: 126.201 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.S92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.937 CA :: 58.132 CB :: 63.706 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.445 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.982 Ave N Shift Values>> N :: 116.28(3.52) 2.I93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.99 C Shift Assignments>> CD1 :: 12.097 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>> HD11 :: 0.848 HD12 :: 0.848 HD13 :: 0.848 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) 2.D94 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.25 R 0.2 Q 0.19 K 0.18 I 0.07 M 0.06 V 0.02 C Shift Assignments>> C :: 179.780 CA :: 58.506 CB :: 29.751 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 :: 7.593 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 :: 121.256 Ave N Shift Values>> N :: 120.67(3.48) 2.A96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.61 A 0.34 I 0.03 C Shift Assignments>> C :: 178.970 CA :: 55.141 CB :: 17.708(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.144 HB1 :: 1.479 HB2 :: 1.479 HB3 :: 1.479 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.159 Ave N Shift Values>> N :: 123.23(3.54) 2.I97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.957 CA :: 66.617 CB :: 37.395 CD1 :: 13.635 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.460 HD11 :: 0.856 HD12 :: 0.856 HD13 :: 0.856 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.853 Ave N Shift Values>> N :: 121.46(4.28) 2.G98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> C :: 176.698 CA :: 46.970 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.767 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.306 Ave N Shift Values>> N :: 109.67(3.87) 2.F99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.28 E 0.26 Y 0.2 F 0.12 M 0.04 V 0.04 K 0.02 HN Overlap>> 2.I73 2.I73 C Shift Assignments>> C :: 176.991 CA :: 59.863 CB :: 36.540 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.181 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 124.213 Ave N Shift Values>> N :: 120.45(4.18) 2.L100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.87 A 0.07 K 0.03 I 0.01 C Shift Assignments>> C :: 179.088 CA :: 57.711 CB :: 40.471 CD2 :: 21.728 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 :: 8.391 HD21 :: 0.988 HD22 :: 0.988 HD23 :: 0.988 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 :: 120.425 Ave N Shift Values>> N :: 121.86(3.9) 2.E101 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K102 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.R103 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.L104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.46 L 0.29 I 0.09 R 0.06 P 0.05 Q 0.01 C Shift Assignments>> CD2 :: 25.275 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>> HD21 :: 1.004 HD22 :: 1.004 HD23 :: 1.004 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) 2.K105 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E106 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Y107 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.D108 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E109 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.57 A 0.39 I 0.03 C Shift Assignments>> C :: 181.622 CA :: 54.907 CB :: 17.778(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.034 HB1 :: 1.685 HB2 :: 1.685 HB3 :: 1.685 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.091 Ave N Shift Values>> N :: 123.23(3.54) 2.I111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.537 CA :: 66.062 CB :: 37.638 CD1 :: 13.502 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.043 HD11 :: 0.848 HD12 :: 0.848 HD13 :: 0.848 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 :: 124.046 Ave N Shift Values>> N :: 121.46(4.28) 2.K112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.2 E 0.2 V 0.19 K 0.14 M 0.1 Q 0.09 I 0.04 P 0.02 HN Overlap>> 1.Q92 1.Q92 C Shift Assignments>> C :: 176.491 CA :: 59.656 CB :: 31.138 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.955 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 :: 120.691 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.K113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.21 K 0.18 E 0.18 V 0.15 M 0.14 Q 0.08 I 0.01 HN Overlap>> 1.I46 1.V32 2.N28 1.I46 1.V32 2.N28 C Shift Assignments>> C :: 179.817 CA :: 59.130 CB :: 31.551 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 :: 8.198 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 :: 119.957 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.T114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.66 T 0.33 C Shift Assignments>> C :: 180.000 CA :: 67.513 CG2 :: 22.699 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 :: 8.223 HG21 :: 1.319 HG22 :: 1.319 HG23 :: 1.319 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.150 Ave N Shift Values>> N :: 115.42(4.75) 2.Q115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.31 R 0.2 Q 0.13 K 0.13 E 0.11 L 0.06 P 0.01 M 0.01 C Shift Assignments>> C :: 179.459 CA :: 59.391 CB :: 27.792 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 :: 8.965 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 :: 121.729 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.G116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> C :: 176.045 CA :: 46.861 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.048 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.321 Ave N Shift Values>> N :: 109.67(3.87) 2.A117 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.51 A 0.45 I 0.02 C Shift Assignments>> C :: 180.708 CA :: 54.416 CB :: 17.656(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.800 HB1 :: 1.604 HB2 :: 1.604 HB3 :: 1.604 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.673 Ave N Shift Values>> N :: 123.23(3.54) 2.L118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.49 L 0.37 I 0.09 R 0.03 C Shift Assignments>> C :: 178.225 CA :: 57.811 CB :: 41.113 CD2 :: 25.359 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 :: 8.346 HD21 :: 0.957 HD22 :: 0.957 HD23 :: 0.957 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 :: 120.864 Ave N Shift Values>> N :: 121.86(3.9) 2.A119 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.63 A 0.33 I 0.02 C Shift Assignments>> C :: 181.120 CA :: 54.691 CB :: 17.147(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.052 HB1 :: 1.548 HB2 :: 1.548 HB3 :: 1.548 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.736 Ave N Shift Values>> N :: 123.23(3.54) 2.E120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.23 E 0.21 Q 0.19 I 0.15 R 0.13 M 0.03 L 0.01 V 0.01 C Shift Assignments>> C :: 179.374 CA :: 58.845 CB :: 28.889 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 :: 7.573 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.268 Ave N Shift Values>> N :: 120.67(3.48) 2.L121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.76 K 0.2 A 0.01 C Shift Assignments>> C :: 179.168 CA :: 57.966 CB :: 41.272 CD2 :: 22.409 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 :: 7.891 HD21 :: 0.869 HD22 :: 0.869 HD23 :: 0.869 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.314 Ave N Shift Values>> N :: 121.86(3.9) 2.E122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.25 Q 0.22 E 0.21 R 0.14 I 0.08 M 0.03 L 0.02 C Shift Assignments>> C :: 179.995 CA :: 57.876 CB :: 28.804 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 :: 8.609 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.993 Ave N Shift Values>> N :: 120.67(3.48) 2.K123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.21 E 0.19 K 0.17 V 0.14 M 0.13 Q 0.09 I 0.02 HN Overlap>> 2.I24 2.I24 C Shift Assignments>> C :: 179.163 CA :: 59.092 CB :: 31.371 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.524 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 :: 119.976 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.R124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.24 K 0.2 Q 0.19 R 0.17 I 0.09 M 0.04 V 0.02 C Shift Assignments>> C :: 178.873 CA :: 58.634 CB :: 29.474 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 :: 7.718 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 :: 120.184 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.I125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.I79 1.I79 C Shift Assignments>> C :: 177.802 CA :: 65.376 CB :: 37.437 CD1 :: 12.741 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.633 HD11 :: 0.865 HD12 :: 0.865 HD13 :: 0.865 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 119.971 Ave N Shift Values>> N :: 121.46(4.28) 2.G126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.93 L 0.05 C Shift Assignments>> C :: 176.057 CA :: 46.761 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.798 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.443 Ave N Shift Values>> N :: 109.67(3.87) 2.E127 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.46 T 0.35 A 0.11 L 0.04 C Shift Assignments>> CG2 :: 21.167 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>> HG21 :: 1.013 HG22 :: 1.013 HG23 :: 1.013 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) 2.A129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.41 I 0.3 M 0.23 V 0.03 C Shift Assignments>> CB :: 18.361 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HB1 :: 1.387 HB2 :: 1.387 HB3 :: 1.387 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 2.R130 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K131 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.A132 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Q133 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.E134 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.38 V 0.37 L 0.17 A 0.05 K 0.01 C Shift Assignments>> CG2 :: 22.158 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>> HG21 :: 0.906 HG22 :: 0.906 HG23 :: 0.906 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) 2.Q136 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Q137 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K138 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.Q139 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.S140 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.M141 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.T142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.43 V 0.42 A 0.07 L 0.06 C Shift Assignments>> CG2 :: 21.538 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>> HG21 :: 1.193 HG22 :: 1.193 HG23 :: 1.193 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) 2.S143 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.F144 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K145 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.V146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.42 A 0.28 T 0.23 L 0.02 M 0.02 I 0.01 C Shift Assignments>> CG2 :: 20.495 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>> HG21 :: 0.952 HG22 :: 0.952 HG23 :: 0.952 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) 2.K147 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.K148 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable ########################################################################### Overall Results: #Consistent: 199 #Clerical: 64 #Suspicious: 0 #Anomalous: 0 #Mistyped: 2 #Indeterminable: 0 Typing Results: #Consistent: 197 #Suspicious: 0 #Mistyped: 2 #Indeterminable: 66 Shift Relative Order (SRO) Results: #Consistent: 265 #Suspicious: 0 C Shift Results: #Consistent: 461 #Duplicate: 142 #Unknown: 0 #Suspicious: 1 #Anomalous: 1 H Shift Results: #Consistent: 374 #Duplicate: 116 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 140 #Duplicate: 38 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.L12 CD2 = 23.256(D), Expected = 24.05, Std = 1.7000, ChiSquare = 6.4046e-01 1.L12 HD21 = 0.958(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.3175e-01 1.L12 HD22 = 0.958(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.3175e-01 1.L12 HD23 = 0.958(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.3175e-01 1.L15 CD2 = 25.871(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.8409e-01 1.L15 HD21 = 1.010(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.3429e-01 1.L15 HD22 = 1.010(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.3429e-01 1.L15 HD23 = 1.010(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.3429e-01 1.L22 CD2 = 25.685(D), Expected = 24.05, Std = 1.7000, ChiSquare = 3.3617e-01 1.L22 HD21 = 1.059(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.5659e-01 1.L22 HD22 = 1.059(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.5659e-01 1.L22 HD23 = 1.059(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.5659e-01 1.Q23 C = 178.687(D), Expected = 176.31, Std = 1.9500, ChiSquare = 2.2285e-01 1.Q23 CA = 58.799(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.9760e-01 1.Q23 CB = 27.360(D), Expected = 29.19, Std = 1.8200, ChiSquare = 3.1466e-01 1.Q23 H = 7.695(D), Expected = 8.22, Std = 0.5900, ChiSquare = 3.7356e-01 1.Q23 N = 116.596(D), Expected = 119.89, Std = 3.6000, ChiSquare = 3.6019e-01 1.L24 CD2 = 23.633(D), Expected = 24.05, Std = 1.7000, ChiSquare = 8.0623e-01 1.L24 HD21 = 0.961(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.2571e-01 1.L24 HD22 = 0.961(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.2571e-01 1.L24 HD23 = 0.961(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.2571e-01 1.V25 C = 178.005(D), Expected = 175.62, Std = 1.9000, ChiSquare = 2.0938e-01 1.V25 CA = 66.549(D), Expected = 62.49, Std = 2.8600, ChiSquare = 1.5583e-01 1.V25 CB = 30.806(D), Expected = 32.73, Std = 1.7900, ChiSquare = 2.8244e-01 1.V25 CG2 = 23.541(D), Expected = 21.26, Std = 1.5600, ChiSquare = 1.4369e-01 1.V25 H = 8.066(D), Expected = 8.29, Std = 0.6700, ChiSquare = 7.3813e-01 1.V25 HG21 = 1.120(D), Expected = 0.80, Std = 0.2800, ChiSquare = 2.5310e-01 1.V25 HG22 = 1.120(D), Expected = 0.80, Std = 0.2800, ChiSquare = 2.5310e-01 1.V25 HG23 = 1.120(D), Expected = 0.80, Std = 0.2800, ChiSquare = 2.5310e-01 1.V25 N = 121.231(D), Expected = 121.14, Std = 4.5400, ChiSquare = 9.8401e-01 1.I26 CD1 = 12.893(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.4779e-01 1.I26 HD11 = 0.876(D), Expected = 0.68, Std = 0.2900, ChiSquare = 4.9913e-01 1.I26 HD12 = 0.876(D), Expected = 0.68, Std = 0.2900, ChiSquare = 4.9913e-01 1.I26 HD13 = 0.876(D), Expected = 0.68, Std = 0.2900, ChiSquare = 4.9913e-01 1.Q28 Typing: Mistyped 1.Q28 C = 178.292(D), Expected = 176.31, Std = 1.9500, ChiSquare = 3.0943e-01 1.Q28 CA = 66.324(S), Expected = 56.57, Std = 2.1400, ChiSquare = 5.1657e-06 1.Q28 CB = 28.387(D), Expected = 29.19, Std = 1.8200, ChiSquare = 6.5906e-01 1.Q28 H = 8.232(D), Expected = 8.22, Std = 0.5900, ChiSquare = 9.8377e-01 1.Q28 N = 119.808(D), Expected = 119.89, Std = 3.6000, ChiSquare = 9.8183e-01 1.K29 C = 178.111(D), Expected = 176.64, Std = 2.0000, ChiSquare = 4.6204e-01 1.K29 CA = 60.136(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.4757e-01 1.K29 CB = 31.553(D), Expected = 32.79, Std = 1.7800, ChiSquare = 4.8709e-01 1.K29 H = 8.932(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.1621e-01 1.K29 N = 120.777(D), Expected = 121.05, Std = 3.7700, ChiSquare = 9.4227e-01 1.Q33 C = 178.220(D), Expected = 176.31, Std = 1.9500, ChiSquare = 3.2734e-01 1.Q33 CA = 59.214(D), Expected = 56.57, Std = 2.1400, ChiSquare = 2.1664e-01 1.Q33 CB = 28.317(D), Expected = 29.19, Std = 1.8200, ChiSquare = 6.3146e-01 1.Q33 H = 8.572(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.5077e-01 1.Q33 N = 118.289(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.5652e-01 1.A34 C = 180.470(D), Expected = 177.74, Std = 2.1300, ChiSquare = 1.9995e-01 1.A34 CA = 55.202(D), Expected = 53.14, Std = 1.9800, ChiSquare = 2.9768e-01 1.A34 CB = 15.990(D), Expected = 19.01, Std = 1.8300, ChiSquare = 9.8887e-02 1.A34 H = 7.686(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.9163e-01 1.A34 N = 122.637(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.6697e-01 1.D35 C = 179.562(D), Expected = 176.40, Std = 1.7500, ChiSquare = 7.0785e-02 1.D35 CA = 57.273(D), Expected = 54.69, Std = 2.0300, ChiSquare = 2.0323e-01 1.D35 CB = 39.784(D), Expected = 40.88, Std = 1.6200, ChiSquare = 4.9870e-01 1.D35 H = 8.351(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.4365e-01 1.D35 N = 121.464(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.3298e-01 1.L36 C = 177.954(D), Expected = 176.99, Std = 1.9800, ChiSquare = 6.2635e-01 1.L36 CA = 58.160(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.3307e-01 1.L36 CB = 41.308(D), Expected = 42.31, Std = 1.8800, ChiSquare = 5.9405e-01 1.L36 CD2 = 25.974(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.5773e-01 1.L36 H = 8.864(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.2937e-01 1.L36 HD21 = 0.978(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.9246e-01 1.L36 HD22 = 0.978(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.9246e-01 1.L36 HD23 = 0.978(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.9246e-01 1.L36 N = 124.315(D), Expected = 121.86, Std = 3.9000, ChiSquare = 5.2903e-01 1.N37 C = 177.963(D), Expected = 175.27, Std = 1.7900, ChiSquare = 1.3246e-01 1.N37 CA = 56.298(D), Expected = 53.54, Std = 1.8800, ChiSquare = 1.4237e-01 1.N37 CB = 37.840(D), Expected = 38.69, Std = 1.6900, ChiSquare = 6.1499e-01 1.N37 H = 8.333(D), Expected = 8.34, Std = 0.6300, ChiSquare = 9.9113e-01 1.N37 N = 118.648(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.4421e-01 1.A39 CB = 17.253(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.3700e-01 1.A39 HB1 = 1.526(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.9845e-01 1.A39 HB2 = 1.526(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.9845e-01 1.A39 HB3 = 1.526(D), Expected = 1.35, Std = 0.2600, ChiSquare = 4.9845e-01 1.A42 CB = 17.342(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.6205e-01 1.L43 CD2 = 26.559(D), Expected = 24.05, Std = 1.7000, ChiSquare = 1.3998e-01 1.L43 HD21 = 0.943(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.6265e-01 1.L43 HD22 = 0.943(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.6265e-01 1.L43 HD23 = 0.943(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.6265e-01 1.E44 C = 179.711(D), Expected = 176.87, Std = 1.9500, ChiSquare = 1.4514e-01 1.E44 CA = 58.955(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.3404e-01 1.E44 CB = 29.062(D), Expected = 30.01, Std = 1.7200, ChiSquare = 5.8152e-01 1.E44 H = 8.361(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.5810e-01 1.E44 N = 119.256(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.8451e-01 1.E45 C = 178.817(D), Expected = 176.87, Std = 1.9500, ChiSquare = 3.1806e-01 1.E45 CA = 58.924(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.4281e-01 1.E45 CB = 27.656(D), Expected = 30.01, Std = 1.7200, ChiSquare = 1.7112e-01 1.E45 H = 7.983(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.5644e-01 1.E45 N = 119.738(D), Expected = 120.67, Std = 3.4800, ChiSquare = 7.8884e-01 1.I46 C = 178.220(D), Expected = 175.85, Std = 1.9200, ChiSquare = 2.1706e-01 1.I46 CA = 63.927(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.8728e-01 1.I46 CB = 36.193(D), Expected = 38.63, Std = 2.0200, ChiSquare = 2.2765e-01 1.I46 CD1 = 12.762(D), Expected = 13.43, Std = 1.6700, ChiSquare = 6.8916e-01 1.I46 H = 8.272(D), Expected = 8.28, Std = 0.6800, ChiSquare = 9.9061e-01 1.I46 HD11 = 0.416(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.6264e-01 1.I46 HD12 = 0.416(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.6264e-01 1.I46 HD13 = 0.416(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.6264e-01 1.I46 N = 119.999(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.3284e-01 1.E47 C = 178.102(D), Expected = 176.87, Std = 1.9500, ChiSquare = 5.2752e-01 1.E47 CA = 59.845(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.2700e-01 1.E47 CB = 29.212(D), Expected = 30.01, Std = 1.7200, ChiSquare = 6.4268e-01 1.E47 H = 8.670(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.6443e-01 1.E47 N = 117.765(D), Expected = 120.67, Std = 3.4800, ChiSquare = 4.0385e-01 1.T48 CG2 = 21.596(D), Expected = 21.55, Std = 1.1100, ChiSquare = 9.6694e-01 1.T48 HG21 = 1.418(D), Expected = 1.14, Std = 0.2300, ChiSquare = 2.2678e-01 1.T48 HG22 = 1.418(D), Expected = 1.14, Std = 0.2300, ChiSquare = 2.2678e-01 1.T48 HG23 = 1.418(D), Expected = 1.14, Std = 0.2300, ChiSquare = 2.2678e-01 1.L49 CA = 53.200(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.5589e-01 1.L49 CB = 40.229(D), Expected = 42.31, Std = 1.8800, ChiSquare = 2.6833e-01 1.L49 CD2 = 21.886(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.0304e-01 1.L49 H = 7.316(D), Expected = 8.23, Std = 0.6500, ChiSquare = 1.5968e-01 1.L49 HD21 = 0.926(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.9913e-01 1.L49 HD22 = 0.926(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.9913e-01 1.L49 HD23 = 0.926(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.9913e-01 1.L49 N = 122.663(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.3687e-01 1.A53 CB = 18.880(D), Expected = 19.01, Std = 1.8300, ChiSquare = 9.4337e-01 1.A53 HB1 = 1.517(D), Expected = 1.35, Std = 0.2600, ChiSquare = 5.2067e-01 1.A53 HB2 = 1.517(D), Expected = 1.35, Std = 0.2600, ChiSquare = 5.2067e-01 1.A53 HB3 = 1.517(D), Expected = 1.35, Std = 0.2600, ChiSquare = 5.2067e-01 1.I55 C = 173.216(D), Expected = 175.85, Std = 1.9200, ChiSquare = 1.7010e-01 1.I55 CA = 58.716(D), Expected = 61.61, Std = 2.6800, ChiSquare = 2.8021e-01 1.I55 CB = 38.656(D), Expected = 38.63, Std = 2.0200, ChiSquare = 9.8973e-01 1.I55 CD1 = 13.381(D), Expected = 13.43, Std = 1.6700, ChiSquare = 9.7659e-01 1.I55 H = 7.453(D), Expected = 8.28, Std = 0.6800, ChiSquare = 2.2392e-01 1.I55 HD11 = 0.725(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.7669e-01 1.I55 HD12 = 0.725(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.7669e-01 1.I55 HD13 = 0.725(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.7669e-01 1.I55 N = 124.734(D), Expected = 121.46, Std = 4.2800, ChiSquare = 4.4430e-01 1.Y56 C = 174.479(D), Expected = 175.40, Std = 1.9900, ChiSquare = 6.4350e-01 1.Y56 CA = 56.331(D), Expected = 58.13, Std = 2.5100, ChiSquare = 4.7354e-01 1.Y56 CB = 40.203(D), Expected = 39.32, Std = 2.1600, ChiSquare = 6.8269e-01 1.Y56 H = 9.260(D), Expected = 8.32, Std = 0.7300, ChiSquare = 1.9786e-01 1.Y56 N = 125.155(D), Expected = 120.52, Std = 4.2000, ChiSquare = 2.6978e-01 1.K57 C = 175.169(D), Expected = 176.64, Std = 2.0000, ChiSquare = 4.6204e-01 1.K57 CA = 53.719(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.4193e-01 1.K57 CB = 35.781(D), Expected = 32.79, Std = 1.7800, ChiSquare = 9.2892e-02 1.K57 H = 9.341(D), Expected = 8.19, Std = 0.6000, ChiSquare = 5.5069e-02 1.K57 N = 122.903(D), Expected = 121.05, Std = 3.7700, ChiSquare = 6.2306e-01 1.T58 C = 174.327(D), Expected = 174.54, Std = 1.7600, ChiSquare = 9.0367e-01 1.T58 CA = 61.992(D), Expected = 62.22, Std = 2.5900, ChiSquare = 9.2985e-01 1.T58 CB = 68.901(D), Expected = 69.73, Std = 1.6300, ChiSquare = 6.1104e-01 1.T58 H = 8.224(D), Expected = 8.24, Std = 0.6200, ChiSquare = 9.7941e-01 1.T58 N = 121.041(D), Expected = 115.42, Std = 4.7500, ChiSquare = 2.3666e-01 1.V59 C = 175.465(D), Expected = 175.62, Std = 1.9000, ChiSquare = 9.3498e-01 1.V59 CA = 60.225(D), Expected = 62.49, Std = 2.8600, ChiSquare = 4.2839e-01 1.V59 CB = 32.000(D), Expected = 32.73, Std = 1.7900, ChiSquare = 6.8340e-01 1.V59 CG2 = 20.613(D), Expected = 21.26, Std = 1.5600, ChiSquare = 6.7833e-01 1.V59 H = 8.930(D), Expected = 8.29, Std = 0.6700, ChiSquare = 3.3946e-01 1.V59 HG21 = 0.844(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.7513e-01 1.V59 HG22 = 0.844(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.7513e-01 1.V59 HG23 = 0.844(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.7513e-01 1.V59 N = 129.557(D), Expected = 121.14, Std = 4.5400, ChiSquare = 6.3744e-02 1.T61 CG2 = 21.871(D), Expected = 21.55, Std = 1.1100, ChiSquare = 7.7244e-01 1.T61 HG21 = 1.273(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.6309e-01 1.T61 HG22 = 1.273(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.6309e-01 1.T61 HG23 = 1.273(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.6309e-01 1.L62 C = 176.056(D), Expected = 176.99, Std = 1.9800, ChiSquare = 6.3713e-01 1.L62 CA = 53.573(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.3654e-01 1.L62 CB = 42.504(D), Expected = 42.31, Std = 1.8800, ChiSquare = 9.1781e-01 1.L62 CD2 = 23.823(D), Expected = 24.05, Std = 1.7000, ChiSquare = 8.9377e-01 1.L62 H = 8.092(D), Expected = 8.23, Std = 0.6500, ChiSquare = 8.3187e-01 1.L62 HD21 = 0.885(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.9301e-01 1.L62 HD22 = 0.885(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.9301e-01 1.L62 HD23 = 0.885(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.9301e-01 1.L62 N = 122.710(D), Expected = 121.86, Std = 3.9000, ChiSquare = 8.2747e-01 1.I63 C = 175.473(D), Expected = 175.85, Std = 1.9200, ChiSquare = 8.4433e-01 1.I63 CA = 60.795(D), Expected = 61.61, Std = 2.6800, ChiSquare = 7.6105e-01 1.I63 CD1 = 14.239(D), Expected = 13.43, Std = 1.6700, ChiSquare = 6.2808e-01 1.I63 H = 8.753(D), Expected = 8.28, Std = 0.6800, ChiSquare = 4.8669e-01 1.I63 HD11 = 0.732(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.5769e-01 1.I63 HD12 = 0.732(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.5769e-01 1.I63 HD13 = 0.732(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.5769e-01 1.I63 N = 122.215(D), Expected = 121.46, Std = 4.2800, ChiSquare = 8.5998e-01 1.V64 C = 174.905(D), Expected = 175.62, Std = 1.9000, ChiSquare = 7.0668e-01 1.V64 CA = 58.955(D), Expected = 62.49, Std = 2.8600, ChiSquare = 2.1645e-01 1.V64 CB = 33.454(D), Expected = 32.73, Std = 1.7900, ChiSquare = 6.8587e-01 1.V64 CG2 = 20.447(D), Expected = 21.26, Std = 1.5600, ChiSquare = 6.0226e-01 1.V64 H = 9.040(D), Expected = 8.29, Std = 0.6700, ChiSquare = 2.6297e-01 1.V64 HG21 = 0.902(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.1564e-01 1.V64 HG22 = 0.902(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.1564e-01 1.V64 HG23 = 0.902(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.1564e-01 1.V64 N = 122.559(D), Expected = 121.14, Std = 4.5400, ChiSquare = 7.5462e-01 1.K65 C = 175.757(D), Expected = 176.64, Std = 2.0000, ChiSquare = 6.5885e-01 1.K65 CA = 56.401(D), Expected = 56.95, Std = 2.2000, ChiSquare = 8.0294e-01 1.K65 H = 8.013(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.6799e-01 1.K65 N = 126.210(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.7109e-01 1.T66 C = 172.948(D), Expected = 174.54, Std = 1.7600, ChiSquare = 3.6571e-01 1.T66 CA = 58.290(D), Expected = 62.22, Std = 2.5900, ChiSquare = 1.2917e-01 1.T66 CB = 69.927(D), Expected = 69.73, Std = 1.6300, ChiSquare = 9.0380e-01 1.T66 CG2 = 19.292(D), Expected = 21.55, Std = 1.1100, ChiSquare = 4.1928e-02 1.T66 H = 8.839(D), Expected = 8.24, Std = 0.6200, ChiSquare = 3.3398e-01 1.T66 HG21 = 1.206(D), Expected = 1.14, Std = 0.2300, ChiSquare = 7.7415e-01 1.T66 HG22 = 1.206(D), Expected = 1.14, Std = 0.2300, ChiSquare = 7.7415e-01 1.T66 HG23 = 1.206(D), Expected = 1.14, Std = 0.2300, ChiSquare = 7.7415e-01 1.T66 N = 122.974(D), Expected = 115.42, Std = 4.7500, ChiSquare = 1.1176e-01 1.T67 CG2 = 22.144(D), Expected = 21.55, Std = 1.1100, ChiSquare = 5.9256e-01 1.T67 HG21 = 1.342(D), Expected = 1.14, Std = 0.2300, ChiSquare = 3.7980e-01 1.T67 HG22 = 1.342(D), Expected = 1.14, Std = 0.2300, ChiSquare = 3.7980e-01 1.T67 HG23 = 1.342(D), Expected = 1.14, Std = 0.2300, ChiSquare = 3.7980e-01 1.K68 CB = 31.729(D), Expected = 32.79, Std = 1.7800, ChiSquare = 5.5113e-01 1.K68 H = 9.106(D), Expected = 8.19, Std = 0.6000, ChiSquare = 1.2684e-01 1.K68 N = 123.283(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.5364e-01 1.A71 C = 179.129(D), Expected = 177.74, Std = 2.1300, ChiSquare = 5.1433e-01 1.A71 CA = 54.861(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.8474e-01 1.A71 CB = 18.095(D), Expected = 19.01, Std = 1.8300, ChiSquare = 6.1707e-01 1.A71 H = 8.127(D), Expected = 8.20, Std = 0.6000, ChiSquare = 9.0316e-01 1.A71 HB1 = 1.218(D), Expected = 1.35, Std = 0.2600, ChiSquare = 6.1167e-01 1.A71 HB2 = 1.218(D), Expected = 1.35, Std = 0.2600, ChiSquare = 6.1167e-01 1.A71 HB3 = 1.218(D), Expected = 1.35, Std = 0.2600, ChiSquare = 6.1167e-01 1.A71 N = 121.875(D), Expected = 123.23, Std = 3.5400, ChiSquare = 7.0189e-01 1.V72 CG2 = 22.961(D), Expected = 21.26, Std = 1.5600, ChiSquare = 2.7554e-01 1.V72 H = 8.350(D), Expected = 8.29, Std = 0.6700, ChiSquare = 9.2864e-01 1.V72 HG21 = 1.034(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.0332e-01 1.V72 HG22 = 1.034(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.0332e-01 1.V72 HG23 = 1.034(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.0332e-01 1.V72 N = 115.379(D), Expected = 121.14, Std = 4.5400, ChiSquare = 2.0446e-01 1.Q73 C = 178.748(D), Expected = 176.31, Std = 1.9500, ChiSquare = 2.1121e-01 1.Q73 CB = 27.425(D), Expected = 29.19, Std = 1.8200, ChiSquare = 3.3216e-01 1.Q73 H = 7.496(D), Expected = 8.22, Std = 0.5900, ChiSquare = 2.1978e-01 1.Q73 N = 118.679(D), Expected = 119.89, Std = 3.6000, ChiSquare = 7.3658e-01 1.I79 C = 177.190(D), Expected = 175.85, Std = 1.9200, ChiSquare = 4.8523e-01 1.I79 CA = 65.918(D), Expected = 61.61, Std = 2.6800, ChiSquare = 1.0795e-01 1.I79 CB = 38.150(D), Expected = 38.63, Std = 2.0200, ChiSquare = 8.1217e-01 1.I79 CD1 = 14.960(D), Expected = 13.43, Std = 1.6700, ChiSquare = 3.5958e-01 1.I79 H = 8.609(D), Expected = 8.28, Std = 0.6800, ChiSquare = 6.2851e-01 1.I79 HD11 = 0.861(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.3254e-01 1.I79 HD12 = 0.861(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.3254e-01 1.I79 HD13 = 0.861(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.3254e-01 1.I79 N = 120.012(D), Expected = 121.46, Std = 4.2800, ChiSquare = 7.3512e-01 1.E80 C = 179.184(D), Expected = 176.87, Std = 1.9500, ChiSquare = 2.3536e-01 1.E80 CA = 59.625(D), Expected = 57.32, Std = 2.0900, ChiSquare = 2.7008e-01 1.E80 CB = 28.788(D), Expected = 30.01, Std = 1.7200, ChiSquare = 4.7742e-01 1.E80 H = 7.862(D), Expected = 8.33, Std = 0.5900, ChiSquare = 4.2765e-01 1.E80 N = 119.100(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.5188e-01 1.T81 C = 177.334(D), Expected = 174.54, Std = 1.7600, ChiSquare = 1.1240e-01 1.T81 CA = 66.260(D), Expected = 62.22, Std = 2.5900, ChiSquare = 1.1880e-01 1.T81 CB = 68.657(D), Expected = 69.73, Std = 1.6300, ChiSquare = 5.1036e-01 1.T81 H = 8.000(D), Expected = 8.24, Std = 0.6200, ChiSquare = 6.9868e-01 1.T81 N = 114.197(D), Expected = 115.42, Std = 4.7500, ChiSquare = 7.9681e-01 1.L82 C = 178.759(D), Expected = 176.99, Std = 1.9800, ChiSquare = 3.7162e-01 1.L82 CA = 57.916(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.8106e-01 1.L82 CB = 40.990(D), Expected = 42.31, Std = 1.8800, ChiSquare = 4.8260e-01 1.L82 H = 8.417(D), Expected = 8.23, Std = 0.6500, ChiSquare = 7.7358e-01 1.L82 N = 123.569(D), Expected = 121.86, Std = 3.9000, ChiSquare = 6.6124e-01 1.A88 CB = 16.492(D), Expected = 19.01, Std = 1.8300, ChiSquare = 1.6883e-01 1.K99 C = 179.236(D), Expected = 176.64, Std = 2.0000, ChiSquare = 1.9429e-01 1.K99 CA = 57.731(D), Expected = 56.95, Std = 2.2000, ChiSquare = 7.2259e-01 1.K99 CB = 29.505(D), Expected = 32.79, Std = 1.7800, ChiSquare = 6.4964e-02 1.K99 H = 7.484(D), Expected = 8.19, Std = 0.6000, ChiSquare = 2.3933e-01 1.K99 N = 120.473(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.7836e-01 1.E102 C = 179.154(D), Expected = 176.87, Std = 1.9500, ChiSquare = 2.4149e-01 1.E102 CA = 59.155(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.7995e-01 1.E102 CB = 28.717(D), Expected = 30.01, Std = 1.7200, ChiSquare = 4.5221e-01 1.E102 H = 7.785(D), Expected = 8.33, Std = 0.5900, ChiSquare = 3.5563e-01 1.E102 N = 120.000(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.4733e-01 1.L103 CD2 = 24.082(D), Expected = 24.05, Std = 1.7000, ChiSquare = 9.8498e-01 1.L103 HD21 = 1.090(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.1447e-01 1.L103 HD22 = 1.090(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.1447e-01 1.L103 HD23 = 1.090(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.1447e-01 1.T104 CA = 67.259(D), Expected = 62.22, Std = 2.5900, ChiSquare = 5.1708e-02 1.T104 CB = 67.497(D), Expected = 69.73, Std = 1.6300, ChiSquare = 1.7071e-01 1.T104 CG2 = 21.251(D), Expected = 21.55, Std = 1.1100, ChiSquare = 7.8765e-01 1.T104 H = 8.469(D), Expected = 8.24, Std = 0.6200, ChiSquare = 7.1186e-01 1.T104 HG21 = 1.289(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.1710e-01 1.T104 HG22 = 1.289(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.1710e-01 1.T104 HG23 = 1.289(D), Expected = 1.14, Std = 0.2300, ChiSquare = 5.1710e-01 1.T104 N = 114.417(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.3276e-01 1.Q108 C = 178.595(D), Expected = 176.31, Std = 1.9500, ChiSquare = 2.4128e-01 1.Q108 CA = 58.719(D), Expected = 56.57, Std = 2.1400, ChiSquare = 3.1528e-01 1.Q108 H = 7.846(D), Expected = 8.22, Std = 0.5900, ChiSquare = 5.2615e-01 1.Q108 N = 117.277(D), Expected = 119.89, Std = 3.6000, ChiSquare = 4.6794e-01 1.A109 CB = 16.836(D), Expected = 19.01, Std = 1.8300, ChiSquare = 2.3484e-01 1.A110 CB = 18.517(D), Expected = 19.01, Std = 1.8300, ChiSquare = 7.8762e-01 1.L111 C = 176.830(D), Expected = 176.99, Std = 1.9800, ChiSquare = 9.3559e-01 1.L111 CA = 54.903(D), Expected = 55.62, Std = 2.1300, ChiSquare = 7.3640e-01 1.L111 CB = 41.683(D), Expected = 42.31, Std = 1.8800, ChiSquare = 7.3875e-01 1.L111 H = 7.487(D), Expected = 8.23, Std = 0.6500, ChiSquare = 2.5301e-01 1.L111 N = 117.225(D), Expected = 121.86, Std = 3.9000, ChiSquare = 2.3465e-01 1.R112 C = 173.428(D), Expected = 176.41, Std = 2.0300, ChiSquare = 1.4184e-01 1.R112 CA = 53.807(D), Expected = 56.77, Std = 2.3100, ChiSquare = 1.9960e-01 1.R112 CB = 29.563(D), Expected = 30.70, Std = 1.8300, ChiSquare = 5.3439e-01 1.R112 H = 7.449(D), Expected = 8.24, Std = 0.6100, ChiSquare = 1.9473e-01 1.R112 N = 120.866(D), Expected = 120.80, Std = 3.6800, ChiSquare = 9.8569e-01 2.A20 CB = 17.150(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.0944e-01 2.A22 CB = 16.587(D), Expected = 19.01, Std = 1.8300, ChiSquare = 1.8549e-01 2.A26 CB = 17.214(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.2639e-01 2.A35 CB = 16.696(D), Expected = 19.01, Std = 1.8300, ChiSquare = 2.0606e-01 2.A37 CB = 17.295(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.4868e-01 2.T45 Typing: Mistyped 2.T45 CB = 28.964(A), Expected = 69.73, Std = 1.6300, ChiSquare = 0.0000e+00 2.A79 CB = 21.653(D), Expected = 19.01, Std = 1.8300, ChiSquare = 1.4866e-01 2.A88 CB = 21.823(D), Expected = 19.01, Std = 1.8300, ChiSquare = 1.2425e-01 2.A96 CB = 17.708(D), Expected = 19.01, Std = 1.8300, ChiSquare = 4.7679e-01 2.A110 CB = 17.778(D), Expected = 19.01, Std = 1.8300, ChiSquare = 5.0080e-01 2.A117 CB = 17.656(D), Expected = 19.01, Std = 1.8300, ChiSquare = 4.5937e-01 2.A119 CB = 17.147(D), Expected = 19.01, Std = 1.8300, ChiSquare = 3.0866e-01