Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.A1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.16 Q 0.14 R 0.14 W 0.12 E 0.12 C 0.11 K 0.09 M 0.06 C Shift Assignments>> C :: 174.904 CA :: 55.700 CB :: 29.982 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.358 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 119.603 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.M4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.22 K 0.16 C 0.15 Q 0.11 R 0.11 H 0.1 W 0.06 E 0.04 C Shift Assignments>> C :: 175.599 CA :: 54.774 CB :: 32.599 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.353 HA :: 4.320 HB2 :: 1.911 HB3 :: 1.911 HG2 :: 2.363 HG3 :: 2.363 HE1 :: 1.807 HE2 :: 1.807 HE3 :: 1.807 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 122.517 Ave N Shift Values>> N :: 120.09(3.57) 1.E5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.38 C 0.29 Q 0.1 K 0.09 M 0.09 I 0.01 C Shift Assignments>> C :: 176.268 CA :: 56.036 CB :: 30.000 CG :: 35.939 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 :: 8.329 HA :: 4.187 HB2 :: 1.856 HB3 :: 1.856 HG2 :: 2.104 HG3 :: 2.104 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.995 Ave N Shift Values>> N :: 120.67(3.48) 1.I6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.62 C 0.37 C Shift Assignments>> C :: 174.932 CA :: 59.849 CB :: 38.546 CG1 :: 26.596 CG2 :: 16.639 CD1 :: 12.771(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 :: 8.078 HA :: 4.067 HB :: 1.654 HG12 :: 1.014 HG21 :: 1.328 HG22 :: 1.328 HG23 :: 1.328 HD11 :: 0.657(D) HD12 :: 0.657(D) HD13 :: 0.657(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.992 Ave N Shift Values>> N :: 121.46(4.28) 1.D7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 L 0.28 K 0.13 R 0.08 N 0.06 F 0.05 C 0.04 Y 0.03 C Shift Assignments>> C :: 176.990 CA :: 53.469 CB :: 42.090 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 :: 8.134 HA :: 4.448 HB2 :: 2.553 HB3 :: 2.675 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.720 Ave N Shift Values>> N :: 120.65(3.86) 1.K8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 K 0.4 R 0.06 C Shift Assignments>> C :: 178.286 CA :: 58.484 CB :: 31.646 CG :: 23.679 CD :: 28.882 CE :: 41.295 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 :: 8.526 HA :: 3.945 HB2 :: 1.708 HB3 :: 1.708 HG2 :: 1.289 HG3 :: 1.289 HD2 :: 1.525 HD3 :: 1.525 HE2 :: 2.845 HE3 :: 2.845 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 :: 123.362 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.26 C 0.19 Y 0.15 E 0.11 F 0.11 D 0.05 M 0.04 I 0.01 L 0.01 C Shift Assignments>> C :: 177.126 CA :: 55.010 CB :: 37.568 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 :: 8.417 HA :: 4.399 HB2 :: 2.717 HB3 :: 2.717 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 :: 118.958 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.87 C 0.12 C Shift Assignments>> C :: 177.771 CA :: 65.781 CB :: 31.021 CG1 :: 20.508(D) CG2 :: 22.177(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.658 HA :: 3.303 HB :: 2.033 HG11 :: 0.542(D) HG12 :: 0.542(D) HG13 :: 0.542(D) HG21 :: 0.910(D) HG22 :: 0.910(D) HG23 :: 0.910(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 :: 122.426 Ave N Shift Values>> N :: 121.14(4.54) 1.G11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 C 0.05 L 0.05 C Shift Assignments>> C :: 174.677 CA :: 46.876 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.137 HA2 :: 3.661 HA3 :: 3.661 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.010 Ave N Shift Values>> N :: 109.67(3.87) 1.A12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.55 A 0.39 I 0.02 C 0.01 C Shift Assignments>> C :: 180.667 CA :: 54.760 CB :: 17.704 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.831 HA :: 3.912 HB1 :: 1.320 HB2 :: 1.320 HB3 :: 1.320 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.212 Ave N Shift Values>> N :: 123.23(3.54) 1.D13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.22 Y 0.19 D 0.16 L 0.15 C 0.09 K 0.07 N 0.03 I 0.03 C Shift Assignments>> C :: 179.316 CA :: 56.680 CB :: 40.588 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 :: 7.597 HA :: 4.315 HB2 :: 2.602 HB3 :: 2.602 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.402 Ave N Shift Values>> N :: 120.65(3.86) 1.L14 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.73 L 0.25 A 0.01 HN Overlap>> 1.E66 1.E66 C Shift Assignments>> C :: 180.737 CA :: 58.168 CB :: 39.390 CD1 :: 22.382(D) CD2 :: 25.009(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 :: 8.290 HA :: 4.348 HB2 :: 2.334 HB3 :: 2.334 HG :: 1.260 HD11 :: -0.252(S) HD12 :: -0.252(S) HD13 :: -0.252(S) HD21 :: -0.175(D) HD22 :: -0.175(D) HD23 :: -0.175(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 :: 121.419 Ave N Shift Values>> N :: 121.86(3.9) 1.I15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.86 C 0.13 C Shift Assignments>> C :: 177.633 CA :: 65.003 CB :: 36.991 CG2 :: 17.090 CD1 :: 12.614(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 :: 8.278 HG12 :: 1.021 HD11 :: 0.656(D) HD12 :: 0.656(D) HD13 :: 0.656(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 :: 122.852 Ave N Shift Values>> N :: 121.46(4.28) 1.S16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 178.480 CA :: 61.203 CB :: 62.685 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.228 HA :: 3.988 HB2 :: 3.863 HB3 :: 3.863 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.015 Ave N Shift Values>> N :: 116.28(3.52) 1.N17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.25 F 0.23 C 0.16 N 0.1 D 0.1 L 0.05 I 0.05 E 0.02 M 0.01 C Shift Assignments>> C :: 176.742 CA :: 56.444 CB :: 38.793 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 :: 8.263 HA :: 4.385 HB2 :: 2.551 HB3 :: 2.551 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 :: 118.402 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 68.273 CB :: 68.152 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 :: 8.016 HA :: 3.979 HB :: 3.817 HG21 :: 0.920 HG22 :: 0.920 HG23 :: 0.920 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 120.492 Ave N Shift Values>> N :: 115.42(4.75) 1.R19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 R 0.37 G 0.07 K 0.03 C Shift Assignments>> C :: 177.712 CA :: 60.122 CB :: 29.184 CG :: 27.889 CD :: 43.178 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 :: 7.698 HA :: 4.418 HD2 :: 3.023 HD3 :: 3.023 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.698 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.R20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 R 0.43 K 0.09 G 0.02 HN Overlap>> 1.R23 1.D120 1.R23 1.D120 C Shift Assignments>> C :: 179.582 CA :: 58.511 CB :: 30.962 CG :: 26.876 CD :: 42.846 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 :: 7.313 HA :: 3.997 HB2 :: 1.701 HB3 :: 1.701 HG2 :: 1.561 HG3 :: 1.561 HD2 :: 3.123 HD3 :: 3.123 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.493 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.I21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.83 C 0.16 C Shift Assignments>> C :: 176.917 CA :: 64.160 CB :: 37.268 CG2 :: 18.144 CD1 :: 13.007(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 :: 8.701 HA :: 3.624 HB :: 1.831 HG12 :: 0.896 HG21 :: 0.906 HG22 :: 0.906 HG23 :: 0.906 HD11 :: 0.499(D) HD12 :: 0.499(D) HD13 :: 0.499(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 :: 120.429 Ave N Shift Values>> N :: 121.46(4.28) 1.L22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.58 C 0.25 L 0.15 C Shift Assignments>> C :: 174.219 CA :: 54.194 CB :: 39.422 CD1 :: 25.367(D) CD2 :: 20.722(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 :: 7.657 HA :: 4.429 HD11 :: 0.177(D) HD12 :: 0.177(D) HD13 :: 0.177(D) HD21 :: 0.475(D) HD22 :: 0.475(D) HD23 :: 0.475(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 113.455 Ave N Shift Values>> N :: 121.86(3.9) 1.R23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 C 0.31 R 0.1 G 0.09 K 0.02 HN Overlap>> 1.D120 1.R20 1.D120 1.R20 C Shift Assignments>> C :: 175.510 CA :: 56.563 CB :: 26.241 CG :: 26.692 CD :: 43.510 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 :: 7.426 HA :: 3.790 HB2 :: 1.781 HB3 :: 1.781 HG2 :: 1.467 HG3 :: 1.467 HD2 :: 3.080 HD3 :: 3.080 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.490 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.L24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.35 C 0.29 L 0.2 G 0.13 K 0.01 HN Overlap>> 1.C38 1.C38 C Shift Assignments>> C :: 177.666 CA :: 53.213 CB :: 43.173 CD1 :: 27.735(D) CD2 :: 21.941(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 :: 7.838 HA :: 4.429 HB2 :: 1.479 HB3 :: 1.479 HG :: 1.396 HD11 :: 0.613(D) HD12 :: 0.613(D) HD13 :: 0.613(D) HD21 :: 0.674(D) HD22 :: 0.674(D) HD23 :: 0.674(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.889 Ave N Shift Values>> N :: 121.86(3.9) 1.D25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.35 L 0.24 N 0.11 K 0.1 F 0.05 C 0.04 Y 0.03 R 0.03 C Shift Assignments>> C :: 177.635 CA :: 52.920 CB :: 41.677 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.054 HA :: 4.600 HB2 :: 2.617 HB3 :: 2.617 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 123.603 Ave N Shift Values>> N :: 120.65(3.86) 1.E26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 E 0.32 I 0.13 K 0.1 Q 0.07 M 0.01 C Shift Assignments>> C :: 177.870 CA :: 59.193 CB :: 29.161 CG :: 35.837 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 :: 8.751 HA :: 3.697 HB2 :: 1.876 HB3 :: 1.876 HG2 :: 2.127 HG3 :: 2.127 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 :: 121.248 Ave N Shift Values>> N :: 120.67(3.48) 1.N27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 C 0.17 Y 0.08 E 0.08 F 0.06 M 0.05 D 0.05 L 0.01 C Shift Assignments>> C :: 176.157 CA :: 53.691 CB :: 37.324 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 :: 8.529 HA :: 4.556 HB2 :: 2.789 HB3 :: 2.789 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 114.149 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 E 0.4 M 0.12 I 0.02 K 0.01 Q 0.01 C Shift Assignments>> C :: 173.671 CA :: 55.830 CB :: 30.775 CG :: 37.106 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 :: 7.629 HA :: 4.192 HB2 :: 1.957 HB3 :: 1.957 HG2 :: 2.231 HG3 :: 2.231 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 :: 118.122 Ave N Shift Values>> N :: 120.67(3.48) 1.L29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.4 L 0.34 C 0.18 A 0.06 C Shift Assignments>> C :: 174.621 CA :: 53.050 CB :: 44.251 CD1 :: 26.807(D) CD2 :: 23.320(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 :: 7.085 HA :: 4.873 HB2 :: 1.730 HB3 :: 1.730 HG :: 1.171 HD11 :: 0.684(D) HD12 :: 0.684(D) HD13 :: 0.684(D) HD21 :: 0.637(D) HD22 :: 0.637(D) HD23 :: 0.637(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.567 Ave N Shift Values>> N :: 121.86(3.9) 1.R30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.51 C 0.31 K 0.12 G 0.03 C Shift Assignments>> C :: 175.313 CA :: 54.536 CB :: 30.936 CG :: 26.564 CD :: 42.846 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 :: 8.900 HA :: 4.418 HB2 :: 1.664 HB3 :: 1.664 HG2 :: 1.466 HG3 :: 1.466 HD2 :: 2.982 HD3 :: 2.982 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 128.665 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.I31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.64 C 0.35 C Shift Assignments>> C :: 175.980 CA :: 60.549 CB :: 39.572 CG1 :: 27.197 CG2 :: 17.799 CD1 :: 13.706(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 :: 8.574 HA :: 4.160 HB :: 1.611 HG12 :: 1.307 HD11 :: 0.714(D) HD12 :: 0.714(D) HD13 :: 0.714(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.102 Ave N Shift Values>> N :: 121.46(4.28) 1.T32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.87 C 0.11 C Shift Assignments>> C :: 173.317 CA :: 62.309 CB :: 68.515 CG2 :: 22.193 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 :: 7.821 HA :: 4.155 HB :: 3.962 HG21 :: 1.033 HG22 :: 1.033 HG23 :: 1.033 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 :: 125.971 Ave N Shift Values>> N :: 115.42(4.75) 1.D33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 L 0.25 K 0.14 F 0.07 N 0.06 Y 0.05 C 0.04 R 0.04 C Shift Assignments>> C :: 177.503 CA :: 54.205 CB :: 41.648 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 :: 8.350 HA :: 4.371 HB2 :: 2.546 HB3 :: 2.546 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.457 Ave N Shift Values>> N :: 120.65(3.86) 1.T34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.93 C 0.06 C Shift Assignments>> C :: 175.840 CA :: 64.195 CB :: 68.046 CG2 :: 21.816 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 :: 8.157 HA :: 3.706 HB :: 4.036 HG21 :: 1.081 HG22 :: 1.081 HG23 :: 1.081 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 :: 119.372 Ave N Shift Values>> N :: 115.42(4.75) 1.A35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.59 M 0.37 C 0.01 I 0.01 C Shift Assignments>> C :: 179.698 CA :: 54.015 CB :: 18.126 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.342 HA :: 4.049 HB1 :: 1.269 HB2 :: 1.269 HB3 :: 1.269 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.078 Ave N Shift Values>> N :: 123.23(3.54) 1.L36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.67 C 0.29 A 0.02 C Shift Assignments>> C :: 178.159 CA :: 56.077 CB :: 40.768 CD1 :: 22.952(D) CD2 :: 24.430(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 :: 7.448 HA :: 4.006 HB2 :: 1.589 HB3 :: 1.589 HG :: 1.388 HD11 :: 0.585(D) HD12 :: 0.585(D) HD13 :: 0.585(D) HD21 :: 0.709(D) HD22 :: 0.709(D) HD23 :: 0.709(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.275 Ave N Shift Values>> N :: 121.86(3.9) 1.I37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.7 C 0.29 C Shift Assignments>> C :: 177.087 CA :: 61.877 CB :: 37.498 CD1 :: 13.021(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 :: 7.160 HA :: 4.074 HB :: 1.835 HG12 :: 1.102 HD11 :: 0.694(D) HD12 :: 0.694(D) HD13 :: 0.694(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.795 Ave N Shift Values>> N :: 121.46(4.28) 1.C38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.29 C 0.2 W 0.11 R 0.09 K 0.06 Q 0.05 E 0.05 H 0.04 P 0.03 L 0.01 HN Overlap>> 1.L24 1.L24 C Shift Assignments>> C :: 175.191 CA :: 60.248 CB :: 27.893 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.803 HA :: 4.122 HB2 :: 2.853 HB3 :: 2.853 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 117.818 Ave N Shift Values>> N :: 120.17(4.64) 1.K39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.46 C 0.41 R 0.11 HN Overlap>> 1.K97 1.K97 C Shift Assignments>> C :: 176.317 CA :: 56.744 CB :: 32.575 CG :: 24.341 CD :: 28.879 CE :: 41.798 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 :: 7.435 HA :: 4.139 HB2 :: 1.686 HB3 :: 1.686 HG2 :: 1.309 HG3 :: 1.309 HD2 :: 1.539 HD3 :: 1.539 HE2 :: 2.865 HE3 :: 2.865 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 :: 118.674 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.66 D 0.15 C 0.1 L 0.02 F 0.02 Y 0.02 C Shift Assignments>> C :: 172.675 CA :: 49.903 CB :: 39.158 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 :: 7.965 HA :: 4.886 HB2 :: 2.599 HB3 :: 2.599 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 117.845 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.P41 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.47 D 0.16 C 0.1 Y 0.09 F 0.08 L 0.04 M 0.01 E 0.01 C Shift Assignments>> C :: 174.864 CA :: 53.667 CB :: 38.645 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 :: 8.085 HA :: 4.530 HB2 :: 2.493 HB3 :: 2.493 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 :: 115.917 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Y43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.22 F 0.21 D 0.14 C 0.13 N 0.13 L 0.07 I 0.03 E 0.01 C Shift Assignments>> C :: 174.606 CA :: 56.035 CB :: 39.152 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 :: 7.443 HA :: 4.674 HB2 :: 3.037 HB3 :: 3.037 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.328 Ave N Shift Values>> N :: 120.52(4.2) 1.S44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.605 CA :: 57.176 CB :: 62.492 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.155 HA :: 4.684 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 :: 116.477 Ave N Shift Values>> N :: 116.28(3.52) 1.L45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.49 C 0.37 K 0.09 G 0.02 HN Overlap>> 1.V151 1.V151 C Shift Assignments>> CA :: 56.901 CB :: 42.446 CD1 :: 24.195(D) CD2 :: 26.266(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 :: 8.486 HA :: 4.229 HB2 :: 1.880 HB3 :: 1.880 HG :: 1.572 HD11 :: 0.888(D) HD12 :: 0.888(D) HD13 :: 0.888(D) HD21 :: 0.713(D) HD22 :: 0.713(D) HD23 :: 0.713(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 123.075 Ave N Shift Values>> N :: 121.86(3.9) 1.C46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.16 R 0.16 C 0.12 M 0.11 W 0.11 Q 0.11 E 0.1 K 0.07 C Shift Assignments>> C :: 170.995 CA :: 54.970 CB :: 30.792 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.178 HA :: 5.171 HB2 :: 2.586 HB3 :: 2.586 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 108.079 Ave N Shift Values>> N :: 120.17(4.64) 1.D47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.29 G 0.2 D 0.19 R 0.16 C 0.04 N 0.02 K 0.02 F 0.02 Y 0.01 HN Overlap>> 1.N111 1.N111 C Shift Assignments>> C :: 173.834 CA :: 51.894 CB :: 43.310 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 :: 8.621 HA :: 5.362 HB2 :: 2.116 HB3 :: 2.116 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 :: 119.554 Ave N Shift Values>> N :: 120.65(3.86) 1.A48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.71 G 0.09 C 0.09 L 0.08 C Shift Assignments>> C :: 175.815 CA :: 49.125 CB :: 21.918 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.473 HA :: 4.907 HB1 :: 0.831 HB2 :: 0.831 HB3 :: 0.831 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.853 Ave N Shift Values>> N :: 123.23(3.54) 1.M49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.18 H 0.16 C 0.16 R 0.15 K 0.09 W 0.09 Q 0.07 E 0.05 C Shift Assignments>> C :: 174.727 CA :: 53.347 CB :: 31.421 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.590 HA :: 4.433 HB2 :: 2.278 HB3 :: 2.278 HG2 :: 2.577 HG3 :: 2.577 HE1 :: 1.939 HE2 :: 1.939 HE3 :: 1.939 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 122.039 Ave N Shift Values>> N :: 120.09(3.57) 1.L50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.82 C 0.15 L 0.01 HN Overlap>> 1.Y161 1.Y161 C Shift Assignments>> C :: 177.519 CA :: 53.495 CB :: 40.805 CD1 :: 25.486(D) CD2 :: 18.794(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 :: 7.970 HA :: 4.335 HB2 :: 1.586 HB3 :: 1.586 HG :: 1.281 HD11 :: 0.440(D) HD12 :: 0.440(D) HD13 :: 0.440(D) HD21 :: -0.155(D) HD22 :: -0.155(D) HD23 :: -0.155(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 :: 121.143 Ave N Shift Values>> N :: 121.86(3.9) 1.T51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.86 C 0.13 C Shift Assignments>> C :: 173.604 CA :: 61.253 CB :: 70.539 CG2 :: 20.034 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 :: 8.885 HA :: 4.605 HB :: 3.879 HG21 :: 1.333 HG22 :: 1.333 HG23 :: 1.333 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 :: 121.832 Ave N Shift Values>> N :: 115.42(4.75) 1.T52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.82 C 0.17 C Shift Assignments>> C :: 174.421 CA :: 62.447 CB :: 68.998 CG2 :: 22.951 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 :: 8.252 HA :: 4.140 HB :: 4.275 HG21 :: 1.220 HG22 :: 1.220 HG23 :: 1.220 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.274 Ave N Shift Values>> N :: 115.42(4.75) 1.D53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 F 0.24 C 0.16 D 0.08 N 0.07 I 0.06 L 0.05 E 0.02 M 0.01 C Shift Assignments>> C :: 174.146 CA :: 56.741 CB :: 38.826 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.119 HA :: 4.699 HB2 :: 2.741 HB3 :: 2.741 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 114.595 Ave N Shift Values>> N :: 120.65(3.86) 1.I54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> C 0.74 I 0.23 A 0.02 HN Overlap>> 1.E59 1.E59 C Shift Assignments>> C :: 174.674 CA :: 57.971 CB :: 38.198 CG1 :: 26.520 CG2 :: 16.325 CD1 :: 10.058(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 :: 7.737 HA :: 4.050 HB :: 1.363 HG12 :: 1.047 HG21 :: 0.105 HG22 :: 0.105 HG23 :: 0.105 HD11 :: 0.592(D) HD12 :: 0.592(D) HD13 :: 0.592(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.247 Ave N Shift Values>> N :: 121.46(4.28) 1.V55 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.59 C 0.4 C Shift Assignments>> C :: 175.376 CA :: 62.266 CB :: 30.638 CG1 :: 20.487(D) CG2 :: 22.199(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 :: 8.119 HA :: 3.720 HB :: 1.734 HG11 :: 0.740(D) HG12 :: 0.740(D) HG13 :: 0.740(D) HG21 :: 0.587(D) HG22 :: 0.587(D) HG23 :: 0.587(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 :: 124.474 Ave N Shift Values>> N :: 121.14(4.54) 1.Y56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 N 0.21 L 0.15 F 0.11 Y 0.09 C 0.07 K 0.02 C Shift Assignments>> C :: 176.676 CA :: 54.259 CB :: 40.247 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 :: 8.944 HA :: 5.163 HB2 :: 2.895 HB3 :: 2.895 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 :: 125.438 Ave N Shift Values>> N :: 120.52(4.2) 1.P57 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.9 C 0.09 C Shift Assignments>> CA :: 66.800 CB :: 32.010 CG1 :: 20.691(D) CG2 :: 23.211(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 :: 8.364 HA :: 3.459 HB :: 2.009 HG11 :: 0.830(D) HG12 :: 0.830(D) HG13 :: 0.830(D) HG21 :: 0.949(D) HG22 :: 0.949(D) HG23 :: 0.949(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 :: 124.890 Ave N Shift Values>> N :: 121.14(4.54) 1.E59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.21 I 0.21 W 0.15 K 0.08 E 0.08 H 0.06 Q 0.06 R 0.05 V 0.02 P 0.01 HN Overlap>> 1.S140 1.S140 1.I54 1.I54 C Shift Assignments>> C :: 177.683 CA :: 60.479 CB :: 29.031 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 :: 7.813 HA :: 4.697 HB2 :: 1.950 HB3 :: 1.950 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 :: 121.203 Ave N Shift Values>> N :: 120.67(3.48) 1.Y60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.38 C 0.2 Y 0.2 F 0.15 E 0.02 C Shift Assignments>> C :: 177.609 CA :: 60.758 CB :: 38.049 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 :: 8.984 HA :: 4.010 HB2 :: 3.055 HB3 :: 3.055 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 120.453 Ave N Shift Values>> N :: 120.52(4.2) 1.L61 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.48 C 0.43 K 0.06 C Shift Assignments>> C :: 178.330 CA :: 57.838 CB :: 41.837 CD1 :: 24.053(D) CD2 :: 26.029(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 :: 8.157 HB2 :: 1.765 HB3 :: 1.765 HD11 :: 1.156(D) HD12 :: 1.156(D) HD13 :: 1.156(D) HD21 :: 0.674(D) HD22 :: 0.674(D) HD23 :: 0.674(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 :: 119.525 Ave N Shift Values>> N :: 121.86(3.9) 1.L62 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.51 L 0.27 R 0.16 G 0.02 A 0.01 C Shift Assignments>> C :: 178.995 CA :: 57.940 CB :: 42.519 CG :: 27.116 CD1 :: 21.934(D) CD2 :: 25.926(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 :: 8.590 HD11 :: -0.536(S) HD12 :: -0.536(S) HD13 :: -0.536(S) HD21 :: 0.176(D) HD22 :: 0.176(D) HD23 :: 0.176(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.474 Ave N Shift Values>> N :: 121.86(3.9) 1.S63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.488 CA :: 61.653 CB :: 62.708 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.037 HA :: 3.986 HB2 :: 3.857 HB3 :: 3.857 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 :: 114.249 Ave N Shift Values>> N :: 116.28(3.52) 1.Y64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.53 C 0.2 Y 0.13 F 0.1 E 0.01 C Shift Assignments>> C :: 177.264 CA :: 62.125 CB :: 37.845 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 :: 8.564 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 124.401 Ave N Shift Values>> N :: 120.52(4.2) 1.W65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.42 P 0.24 C 0.17 W 0.05 R 0.03 K 0.01 E 0.01 Q 0.01 H 0.01 C Shift Assignments>> C :: 180.515 CA :: 61.859 CB :: 27.565 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 8.918 HB2 :: 3.378 HB3 :: 3.378 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 120.055 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.E66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 I 0.33 E 0.24 K 0.03 HN Overlap>> 1.L14 1.L14 C Shift Assignments>> C :: 179.582 CA :: 59.752 CB :: 28.613 CG :: 36.885 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 :: 8.230 HA :: 3.704 HB2 :: 1.885 HB3 :: 1.885 HG2 :: 2.425 HG3 :: 2.425 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 :: 121.354 Ave N Shift Values>> N :: 120.67(3.48) 1.C67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.4 P 0.28 C 0.2 R 0.03 K 0.02 W 0.02 HN Overlap>> 1.M144 1.M144 C Shift Assignments>> C :: 177.230 CA :: 62.057 CB :: 26.059 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.307 HA :: 3.927 HB2 :: 2.721 HB3 :: 2.721 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 120.248 Ave N Shift Values>> N :: 120.17(4.64) 1.R68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.38 C 0.31 L 0.21 I 0.04 R 0.04 C Shift Assignments>> C :: 177.648 CA :: 55.840 CB :: 28.517 CD :: 41.170 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 :: 8.330 HD2 :: 3.029 HD3 :: 3.029 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.497 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.S69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.96 T 0.03 C Shift Assignments>> C :: 175.447 CA :: 59.201 CB :: 65.552 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.869 HA :: 4.110 HB2 :: 3.513 HB3 :: 3.513 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 :: 110.500 Ave N Shift Values>> N :: 116.28(3.52) 1.G70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 173.122 CA :: 45.694 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.817 HA2 :: 4.408 HA3 :: 4.408 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.723 Ave N Shift Values>> N :: 109.67(3.87) 1.R71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 K 0.31 R 0.28 G 0.06 C Shift Assignments>> C :: 174.522 CA :: 52.949 CB :: 32.967 CG :: 25.957 CD :: 42.736 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 :: 7.930 HA :: 4.580 HB2 :: 1.793 HB3 :: 1.793 HG2 :: 1.439 HG3 :: 1.439 HD2 :: 2.990 HD3 :: 2.990 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 :: 120.267 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.T72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.92 C 0.07 C Shift Assignments>> C :: 172.962 CA :: 62.311 CB :: 69.482 CG2 :: 21.124 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 :: 7.842 HA :: 3.976 HB :: 3.830 HG21 :: 1.097 HG22 :: 1.097 HG23 :: 1.097 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 :: 114.509 Ave N Shift Values>> N :: 115.42(4.75) 1.A73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.71 L 0.17 C 0.09 C Shift Assignments>> C :: 176.342 CA :: 50.257 CB :: 22.065 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.224 HA :: 4.965 HB1 :: 1.289 HB2 :: 1.289 HB3 :: 1.289 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.798 Ave N Shift Values>> N :: 123.23(3.54) 1.C74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.15 Q 0.14 W 0.13 C 0.13 E 0.13 H 0.11 R 0.09 I 0.03 M 0.02 L 0.01 C Shift Assignments>> C :: 172.377 CA :: 57.518 CB :: 28.878 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.081 HA :: 4.367 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 121.347 Ave N Shift Values>> N :: 120.17(4.64) 1.F75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 D 0.26 C 0.07 L 0.06 F 0.03 Y 0.02 C Shift Assignments>> C :: 174.359 CA :: 50.895 CB :: 39.879 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 :: 8.339 HA :: 5.896 HB2 :: 2.602 HB3 :: 2.602 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 126.797 Ave N Shift Values>> N :: 120.45(4.18) 1.V76 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> C 0.67 V 0.31 C Shift Assignments>> C :: 177.445 CA :: 59.999 CB :: 35.518 CG1 :: 21.695(D) CG2 :: 22.910(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 :: 9.066 HA :: 4.984 HB :: 1.866 HG11 :: 0.710(D) HG12 :: 0.710(D) HG13 :: 0.710(D) HG21 :: 0.752(D) HG22 :: 0.752(D) HG23 :: 0.752(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.023 Ave N Shift Values>> N :: 121.14(4.54) 1.F77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.21 L 0.2 D 0.15 F 0.15 Y 0.11 C 0.06 R 0.03 N 0.01 I 0.01 C Shift Assignments>> C :: 175.023 CA :: 56.446 CB :: 41.484 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 :: 9.309 HA :: 5.277 HB2 :: 2.453 HB3 :: 2.453 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 :: 128.618 Ave N Shift Values>> N :: 120.45(4.18) 1.K78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 K 0.44 R 0.05 C Shift Assignments>> C :: 174.897 CA :: 54.745 CB :: 36.220 CG :: 24.522 CD :: 28.625 CE :: 41.853 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 :: 8.886 HA :: 5.100 HG2 :: 0.847 HG3 :: 0.847 HD2 :: 1.300 HD3 :: 1.300 HE2 :: 2.609 HE3 :: 2.609 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 :: 120.908 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.71 C 0.11 D 0.07 Y 0.02 F 0.02 L 0.01 M 0.01 C Shift Assignments>> C :: 175.985 CA :: 51.073 CB :: 37.936 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 :: 7.850 HA :: 4.797 HB2 :: 2.852 HB3 :: 2.852 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 121.783 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.89 C 0.1 C Shift Assignments>> C :: 175.201 CA :: 61.239 CB :: 69.354 CG2 :: 21.277 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.401 HA :: 4.465 HG21 :: 1.033 HG22 :: 1.033 HG23 :: 1.033 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.732 Ave N Shift Values>> N :: 115.42(4.75) 1.G81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 174.243 CA :: 45.670 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.997 HA2 :: 3.394 HA3 :: 3.394 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.578 Ave N Shift Values>> N :: 109.67(3.87) 1.C82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.15 C 0.14 W 0.14 Q 0.13 E 0.12 H 0.1 R 0.08 I 0.06 L 0.02 M 0.01 C Shift Assignments>> C :: 173.263 CA :: 58.004 CB :: 28.593 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.205 HA :: 4.558 HB2 :: 2.870 HB3 :: 2.870 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 116.968 Ave N Shift Values>> N :: 120.17(4.64) 1.R83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 R 0.33 K 0.19 G 0.1 C Shift Assignments>> C :: 173.852 CA :: 54.184 CB :: 32.700 CG :: 25.791 CD :: 43.343 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 :: 7.390 HD2 :: 3.071 HD3 :: 3.071 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.962 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.V84 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.51 C 0.48 C Shift Assignments>> C :: 173.900 CA :: 60.494 CB :: 31.687 CG1 :: 21.843(D) CG2 :: 22.275(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 :: 8.547 HA :: 4.732 HB :: 1.397 HG11 :: 0.673(D) HG12 :: 0.673(D) HG13 :: 0.673(D) HG21 :: -0.126(S) HG22 :: -0.126(S) HG23 :: -0.126(S) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 123.231 Ave N Shift Values>> N :: 121.14(4.54) 1.S85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.92 T 0.07 C Shift Assignments>> C :: 172.611 CA :: 55.021 CB :: 66.540 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.957 HA :: 5.112 HB2 :: 3.449 HB3 :: 3.449 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.779 Ave N Shift Values>> N :: 116.28(3.52) 1.L86 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.67 A 0.18 C 0.06 L 0.06 HN Overlap>> 1.R138 1.R138 C Shift Assignments>> C :: 175.252 CA :: 52.112 CB :: 45.104 CD1 :: 21.961(D) CD2 :: 25.131(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 :: 9.108 HA :: 4.790 HD11 :: -0.504(S) HD12 :: -0.504(S) HD13 :: -0.504(S) HD21 :: -0.196(D) HD22 :: -0.196(D) HD23 :: -0.196(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 :: 125.394 Ave N Shift Values>> N :: 121.86(3.9) 1.S87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 T 0.01 C Shift Assignments>> C :: 173.578 CA :: 57.576 CB :: 65.337 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.160 HA :: 4.980 HB2 :: 3.502 HB3 :: 3.502 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 :: 124.332 Ave N Shift Values>> N :: 116.28(3.52) 1.C88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.11 C 0.11 F 0.11 W 0.09 S 0.09 E 0.08 K 0.06 R 0.06 H 0.05 Q 0.05 M 0.04 L 0.02 I 0.02 V 0.01 T 0.01 D 0.01 C Shift Assignments>> C :: 172.191 CA :: 58.181 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.017 HA :: 4.166 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 123.723 Ave N Shift Values>> N :: 120.17(4.64) 1.Y89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.28 F 0.27 C 0.14 D 0.09 L 0.07 I 0.07 N 0.03 C Shift Assignments>> C :: 175.307 CA :: 57.277 CB :: 39.542 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 :: 8.678 HA :: 4.706 HB2 :: 3.169 HB3 :: 3.169 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 :: 123.655 Ave N Shift Values>> N :: 120.52(4.2) 1.I90 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.63 C 0.36 C Shift Assignments>> C :: 176.921 CA :: 60.325 CB :: 37.879 CG1 :: 27.075 CG2 :: 17.426 CD1 :: 12.912(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 :: 8.396 HA :: 4.521 HB :: 1.704 HG12 :: 1.139 HD11 :: 0.721(D) HD12 :: 0.721(D) HD13 :: 0.721(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 :: 120.055 Ave N Shift Values>> N :: 121.46(4.28) 1.G91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.35 L 0.3 G 0.14 D 0.05 F 0.04 C 0.04 Y 0.02 K 0.01 C Shift Assignments>> C :: 170.022 CA :: 43.707 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.370 HA2 :: 3.981 HA3 :: 3.981 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 116.789 Ave N Shift Values>> N :: 109.67(3.87) 1.F92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.57 D 0.17 C 0.08 F 0.05 Y 0.05 L 0.04 C Shift Assignments>> C :: 173.071 CA :: 52.602 CB :: 38.816 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.834 HA :: 4.574 HB2 :: 3.212 HB3 :: 3.212 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.052 Ave N Shift Values>> N :: 120.45(4.18) 1.P93 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.27 K 0.15 Q 0.12 I 0.09 M 0.01 C Shift Assignments>> C :: 179.302 CA :: 58.966 CB :: 29.052 CG :: 35.361 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 :: 8.489 HA :: 4.152 HB2 :: 1.871 HB3 :: 1.871 HG2 :: 2.170 HG3 :: 2.170 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 124.965 Ave N Shift Values>> N :: 120.67(3.48) 1.R95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.3 C 0.29 K 0.22 L 0.14 G 0.02 C Shift Assignments>> C :: 177.184 CA :: 56.812 CB :: 28.643 CG :: 26.343 CD :: 42.846 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 :: 8.402 HA :: 4.061 HB2 :: 1.579 HB3 :: 1.579 HG2 :: 1.235 HG3 :: 1.235 HD2 :: 3.007 HD3 :: 3.007 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 :: 115.957 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.L96 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> A 0.42 C 0.41 L 0.15 HN Overlap>> 1.R166 1.R166 C Shift Assignments>> C :: 178.151 CA :: 54.182 CB :: 40.221 CG :: 28.220 CD1 :: 21.405(D) CD2 :: 25.327(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 :: 7.584 HA :: 4.233 HB2 :: 1.741 HB3 :: 1.741 HG :: 0.981 HD11 :: 0.388(D) HD12 :: 0.388(D) HD13 :: 0.388(D) HD21 :: -0.087(D) HD22 :: -0.087(D) HD23 :: -0.087(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 :: 118.563 Ave N Shift Values>> N :: 121.86(3.9) 1.K97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 K 0.45 R 0.07 HN Overlap>> 1.K39 1.K39 C Shift Assignments>> C :: 176.689 CA :: 58.877 CB :: 31.786 CG :: 24.964 CD :: 28.936 CE :: 41.522 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 :: 7.384 HA :: 3.824 HB2 :: 1.616 HB3 :: 1.616 HG2 :: 0.988 HG3 :: 0.988 HD2 :: 1.316 HD3 :: 1.316 HE2 :: 2.609 HE3 :: 2.609 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 :: 118.626 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.35 N 0.19 L 0.18 F 0.08 Y 0.06 C 0.05 K 0.04 C Shift Assignments>> C :: 176.381 CA :: 53.623 CB :: 40.738 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 :: 7.875 HA :: 4.602 HB2 :: 2.534 HB3 :: 2.534 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.606 Ave N Shift Values>> N :: 120.65(3.86) 1.L99 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.56 C 0.31 A 0.06 K 0.03 G 0.01 C Shift Assignments>> C :: 177.582 CA :: 54.575 CB :: 41.975 CD1 :: 23.051(D) CD2 :: 26.233(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 :: 7.059 HA :: 4.251 HB2 :: 1.806 HB3 :: 1.806 HG :: 1.623 HD11 :: 0.757(D) HD12 :: 0.757(D) HD13 :: 0.757(D) HD21 :: 0.711(D) HD22 :: 0.711(D) HD23 :: 0.711(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.939 Ave N Shift Values>> N :: 121.86(3.9) 1.K100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.48 C 0.43 R 0.06 C Shift Assignments>> C :: 174.793 CA :: 56.397 CB :: 32.598 CG :: 24.379 CD :: 29.931 CE :: 42.129 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 :: 8.695 HA :: 4.111 HB2 :: 1.900 HB3 :: 1.900 HG2 :: 1.371 HG3 :: 1.371 HD2 :: 1.540 HD3 :: 1.540 HE2 :: 2.843 HE3 :: 2.843 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 :: 122.945 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 K 0.33 R 0.21 G 0.01 C Shift Assignments>> C :: 178.078 CA :: 52.148 CB :: 31.342 CD :: 41.810 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 :: 8.103 HA :: 4.951 HB2 :: 1.661 HB3 :: 1.661 HG2 :: 1.544 HG3 :: 1.544 HD2 :: 3.088 HD3 :: 3.088 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 :: 118.732 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.V102 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.67 C 0.32 HN Overlap>> 1.D128 1.D128 C Shift Assignments>> C :: 173.093 CA :: 62.433 CB :: 31.803 CG1 :: 21.207(D) CG2 :: 20.488(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 :: 8.089 HA :: 4.568 HB :: 1.918 HG11 :: 0.796(D) HG12 :: 0.796(D) HG13 :: 0.796(D) HG21 :: 0.796(D) HG22 :: 0.796(D) HG23 :: 0.796(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.883 Ave N Shift Values>> N :: 121.14(4.54) 1.C103 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.24 Y 0.22 D 0.16 C 0.11 L 0.11 N 0.07 I 0.03 K 0.01 C Shift Assignments>> C :: 175.364 CA :: 56.433 CB :: 39.847 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 :: 8.651 HA :: 4.228 HB2 :: 2.576 HB3 :: 2.576 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.154 Ave N Shift Values>> N :: 120.65(3.86) 1.F105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.25 Y 0.21 L 0.14 D 0.12 C 0.1 K 0.08 I 0.04 N 0.01 C Shift Assignments>> C :: 173.740 CA :: 57.275 CB :: 40.657 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.646 HA :: 4.612 HB2 :: 2.831 HB3 :: 2.831 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.259 Ave N Shift Values>> N :: 120.45(4.18) 1.N106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.37 N 0.3 L 0.15 C 0.06 F 0.04 K 0.02 Y 0.02 C Shift Assignments>> C :: 172.426 CA :: 51.349 CB :: 40.956 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 :: 7.956 HA :: 4.818 HB2 :: 2.712 HB3 :: 2.712 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 122.869 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.F107 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L108 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.59 L 0.29 C 0.1 C Shift Assignments>> C :: 176.876 CA :: 53.004 CB :: 45.017 CD1 :: 24.660(D) CD2 :: 25.287(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 HA :: 4.742 HB2 :: 1.520 HB3 :: 1.520 HG :: 1.271 HD11 :: 0.561(D) HD12 :: 0.561(D) HD13 :: 0.561(D) HD21 :: 0.569(D) HD22 :: 0.569(D) HD23 :: 0.569(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 :: 125.731 Ave N Shift Values>> N :: 121.86(3.9) 1.S109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.832 CA :: 57.709 CB :: 63.704 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.126 HA :: 4.451 HB2 :: 3.811 HB3 :: 3.811 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 125.145 Ave N Shift Values>> N :: 116.28(3.52) 1.V110 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.83 C 0.16 C Shift Assignments>> C :: 176.674 CA :: 65.653 CB :: 30.644 CG1 :: 20.116(D) CG2 :: 22.108(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 :: 8.242 HA :: 3.202 HB :: 1.854 HG11 :: 0.765(D) HG12 :: 0.765(D) HG13 :: 0.765(D) HG21 :: 0.915(D) HG22 :: 0.915(D) HG23 :: 0.915(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 :: 122.050 Ave N Shift Values>> N :: 121.14(4.54) 1.N111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.22 E 0.21 N 0.18 Y 0.12 M 0.09 F 0.08 K 0.02 D 0.02 I 0.01 HN Overlap>> 1.D47 1.D47 C Shift Assignments>> C :: 173.894 CA :: 55.172 CB :: 36.913 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 :: 8.524 HA :: 4.222 HB2 :: 2.973 HB3 :: 2.973 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 :: 119.543 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 E 0.39 M 0.16 Q 0.01 I 0.01 K 0.01 C Shift Assignments>> C :: 173.874 CA :: 56.024 CB :: 31.109 CG :: 36.830 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 :: 8.131 HA :: 4.312 HB2 :: 1.974 HB3 :: 1.974 HG2 :: 2.222 HG3 :: 2.222 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.098 Ave N Shift Values>> N :: 120.67(3.48) 1.A113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.39 C 0.24 A 0.23 P 0.05 K 0.03 G 0.03 C Shift Assignments>> C :: 175.718 CA :: 49.626 CB :: 23.471 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.966 HA :: 5.580 HB1 :: 1.119 HB2 :: 1.119 HB3 :: 1.119 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.867 Ave N Shift Values>> N :: 123.23(3.54) 1.L114 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> C 0.47 G 0.39 L 0.11 A 0.01 C Shift Assignments>> C :: 175.130 CA :: 52.892 CB :: 47.433 CD1 :: 25.083(D) CD2 :: 25.867(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 :: 8.784 HA :: 4.874 HB2 :: 1.437 HB3 :: 1.437 HG :: 1.269 HD11 :: 0.575(D) HD12 :: 0.575(D) HD13 :: 0.575(D) HD21 :: 0.547(D) HD22 :: 0.547(D) HD23 :: 0.547(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 :: 119.262 Ave N Shift Values>> N :: 121.86(3.9) 1.V115 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> C 0.59 V 0.4 C Shift Assignments>> C :: 174.218 CA :: 61.272 CB :: 34.061 CG1 :: 21.540(D) CG2 :: 23.982(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 :: 8.881 HA :: 4.551 HB :: 1.734 HG11 :: 0.750(D) HG12 :: 0.750(D) HG13 :: 0.750(D) HG21 :: 0.825(D) HG22 :: 0.825(D) HG23 :: 0.825(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 :: 124.985 Ave N Shift Values>> N :: 121.14(4.54) 1.V116 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.62 C 0.37 C Shift Assignments>> C :: 172.485 CA :: 61.964 CB :: 34.312 CG1 :: 21.074(D) CG2 :: 22.031(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 :: 9.318 HA :: 3.838 HB :: 1.866 HG11 :: 0.764(D) HG12 :: 0.764(D) HG13 :: 0.764(D) HG21 :: 0.782(D) HG22 :: 0.782(D) HG23 :: 0.782(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 :: 125.356 Ave N Shift Values>> N :: 121.14(4.54) 1.T117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 T 0.45 A 0.01 C Shift Assignments>> C :: 175.034 CA :: 58.998 CB :: 72.888 CG2 :: 21.266 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 :: 7.372 HA :: 4.434 HG21 :: 1.009 HG22 :: 1.009 HG23 :: 1.009 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 :: 114.570 Ave N Shift Values>> N :: 115.42(4.75) 1.L118 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.62 C 0.37 C Shift Assignments>> C :: 178.506 CA :: 57.871 CB :: 40.482 CD1 :: 24.160(D) CD2 :: 24.528(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 :: 9.949 HB2 :: 1.559 HB3 :: 1.559 HG :: 1.447 HD11 :: 0.732(D) HD12 :: 0.732(D) HD13 :: 0.732(D) HD21 :: 0.743(D) HD22 :: 0.743(D) HD23 :: 0.743(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 :: 125.153 Ave N Shift Values>> N :: 121.86(3.9) 1.A119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 A 0.47 I 0.02 C 0.01 C Shift Assignments>> C :: 180.865 CA :: 54.461 CB :: 17.840 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.330 HA :: 3.963 HB1 :: 1.217 HB2 :: 1.217 HB3 :: 1.217 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.071 Ave N Shift Values>> N :: 123.23(3.54) 1.D120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.24 L 0.19 F 0.14 R 0.12 Y 0.1 D 0.08 C 0.06 I 0.01 HN Overlap>> 1.R23 1.R23 1.R20 1.R20 C Shift Assignments>> C :: 178.348 CA :: 57.271 CB :: 42.119 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 :: 7.342 HA :: 4.311 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.509 Ave N Shift Values>> N :: 120.65(3.86) 1.I121 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.7 C 0.29 C Shift Assignments>> C :: 177.551 CA :: 63.294 CB :: 36.411 CG1 :: 28.395 CG2 :: 17.273 CD1 :: 11.233(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 :: 7.556 HA :: 3.415 HB :: 1.866 HG12 :: 0.898 HG21 :: 0.620 HG22 :: 0.620 HG23 :: 0.620 HD11 :: 0.423(D) HD12 :: 0.423(D) HD13 :: 0.423(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 Ave N Shift Values>> N :: 121.46(4.28) 1.E122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 E 0.33 I 0.16 K 0.09 Q 0.05 C Shift Assignments>> C :: 178.151 CA :: 58.919 CB :: 28.893 CG :: 36.134 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 :: 8.307 HA :: 3.632 HB2 :: 1.917 HB3 :: 1.917 HG2 :: 2.262 HG3 :: 2.262 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 :: 118.926 Ave N Shift Values>> N :: 120.67(3.48) 1.R123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.45 C 0.43 K 0.08 G 0.02 C Shift Assignments>> C :: 177.896 CA :: 58.081 CB :: 30.228 CG :: 27.232 CD :: 42.846 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 :: 7.105 HA :: 4.413 HB2 :: 1.859 HB3 :: 1.859 HG2 :: 1.585 HG3 :: 1.585 HD2 :: 3.156 HD3 :: 3.156 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.295 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.I124 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.66 C 0.33 C Shift Assignments>> C :: 176.744 CA :: 60.581 CB :: 38.863 CG1 :: 26.000 CG2 :: 18.413 CD1 :: 14.023(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 :: 7.282 HA :: 4.295 HB :: 1.978 HG12 :: 1.113 HG21 :: 0.811 HG22 :: 0.811 HG23 :: 0.811 HD11 :: 0.521(D) HD12 :: 0.521(D) HD13 :: 0.521(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 :: 111.377 Ave N Shift Values>> N :: 121.46(4.28) 1.K125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.17 H 0.15 R 0.15 C 0.13 K 0.1 W 0.1 Q 0.08 E 0.08 C Shift Assignments>> CA :: 54.557 CB :: 31.327 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 :: 7.588 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 :: 122.973 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P126 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.C127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.16 K 0.16 H 0.12 W 0.12 C 0.12 E 0.11 R 0.09 L 0.03 I 0.02 M 0.02 C Shift Assignments>> C :: 173.391 CA :: 56.584 CB :: 28.633 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.842 HA :: 4.448 HB2 :: 2.739 HB3 :: 2.739 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 117.280 Ave N Shift Values>> N :: 120.17(4.64) 1.D128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 L 0.24 K 0.12 N 0.09 F 0.08 Y 0.05 C 0.05 R 0.02 HN Overlap>> 1.V102 1.E160 1.V102 1.E160 C Shift Assignments>> C :: 175.876 CA :: 53.996 CB :: 41.430 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 :: 8.096 HA :: 4.335 HB2 :: 2.438 HB3 :: 2.438 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 :: 119.860 Ave N Shift Values>> N :: 120.65(3.86) 1.K129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 K 0.37 R 0.2 HN Overlap>> 1.I148 1.I148 C Shift Assignments>> C :: 177.719 CA :: 57.402 CB :: 31.875 CG :: 23.719 CD :: 28.317 CE :: 41.853 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 :: 8.165 HA :: 3.959 HB2 :: 1.669 HB3 :: 1.669 HG2 :: 1.287 HG3 :: 1.287 HD2 :: 1.490 HD3 :: 1.490 HE2 :: 2.841 HE3 :: 2.841 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 :: 121.044 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.74 L 0.14 R 0.03 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.710 CA :: 44.974 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.571 HA2 :: 3.632 HA3 :: 3.632 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.073 Ave N Shift Values>> N :: 109.67(3.87) 1.V131 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.58 C 0.41 C Shift Assignments>> C :: 175.263 CA :: 61.148 CB :: 32.559 CG1 :: 21.012(D) CG2 :: 20.728(D) Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.364 HA :: 4.015 HB :: 1.908 HG11 :: 0.755(D) HG12 :: 0.755(D) HG13 :: 0.755(D) HG21 :: 0.724(D) HG22 :: 0.724(D) HG23 :: 0.724(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.649 Ave N Shift Values>> N :: 121.14(4.54) 1.L132 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.57 C 0.22 A 0.12 G 0.07 C Shift Assignments>> C :: 176.668 CA :: 53.956 CB :: 42.901 CD1 :: 22.679(D) CD2 :: 25.466(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 :: 8.275 HA :: 4.244 HD11 :: 0.596(D) HD12 :: 0.596(D) HD13 :: 0.596(D) HD21 :: 0.693(D) HD22 :: 0.693(D) HD23 :: 0.693(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 :: 126.999 Ave N Shift Values>> N :: 121.86(3.9) 1.T133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.8 C 0.19 C Shift Assignments>> C :: 174.224 CA :: 61.930 CB :: 70.936 CG2 :: 22.811 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 :: 8.770 HA :: 4.437 HB :: 3.923 HG21 :: 0.936 HG22 :: 0.936 HG23 :: 0.936 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 :: 114.262 Ave N Shift Values>> N :: 115.42(4.75) 1.N134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.27 G 0.21 D 0.21 R 0.14 C 0.05 N 0.03 K 0.02 F 0.02 Y 0.01 C Shift Assignments>> C :: 174.802 CA :: 51.475 CB :: 43.179 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 :: 8.903 HA :: 5.500 HB2 :: 2.216 HB3 :: 2.216 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 122.071 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.C135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.15 C 0.15 K 0.14 R 0.13 H 0.12 W 0.1 E 0.09 Q 0.05 V 0.02 C Shift Assignments>> C :: 172.604 CA :: 56.817 CB :: 31.794 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.127 HA :: 5.859 HB2 :: 2.562 HB3 :: 2.562 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 114.964 Ave N Shift Values>> N :: 120.17(4.64) 1.V136 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> C 0.62 V 0.37 C Shift Assignments>> C :: 173.317 CA :: 60.348 CB :: 35.255 CG1 :: 20.048(D) CG2 :: 21.132(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 :: 8.775 HA :: 4.546 HB :: 1.738 HG11 :: 0.697(D) HG12 :: 0.697(D) HG13 :: 0.697(D) HG21 :: 0.674(D) HG22 :: 0.674(D) HG23 :: 0.674(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 :: 121.740 Ave N Shift Values>> N :: 121.14(4.54) 1.V137 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.51 C 0.48 C Shift Assignments>> C :: 174.993 CA :: 61.199 CB :: 31.325 CG1 :: 20.364(D) CG2 :: 22.474(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 :: 10.076 HA :: 4.382 HB :: 1.997 HG11 :: 0.779(D) HG12 :: 0.779(D) HG13 :: 0.779(D) HG21 :: 0.656(D) HG22 :: 0.656(D) HG23 :: 0.656(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 :: 129.400 Ave N Shift Values>> N :: 121.14(4.54) 1.R138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 R 0.28 K 0.21 G 0.15 HN Overlap>> 1.L86 1.L86 C Shift Assignments>> C :: 176.228 CA :: 52.563 CB :: 32.705 CG :: 25.681 CD :: 43.178 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 :: 9.112 HA :: 4.888 HB2 :: 1.795 HB3 :: 1.795 HG2 :: 1.542 HG3 :: 1.542 HD2 :: 3.061 HD3 :: 3.061 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 :: 125.282 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.K139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.46 C 0.38 R 0.14 C Shift Assignments>> C :: 176.676 CA :: 56.204 CB :: 32.713 CG :: 24.412 CD :: 28.772 CE :: 41.963 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 :: 9.039 HA :: 4.025 HB2 :: 1.690 HB3 :: 1.690 HG2 :: 1.106 HG3 :: 1.106 HD2 :: 1.539 HD3 :: 1.539 HE2 :: 2.835 HE3 :: 2.835 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.733 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.S140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.Y161 1.Y161 1.E59 1.E59 C Shift Assignments>> C :: 174.881 CA :: 57.645 CB :: 63.932 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.817 HA :: 4.339 HB2 :: 3.593 HB3 :: 3.593 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 121.139 Ave N Shift Values>> N :: 116.28(3.52) 1.N141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 C 0.16 Y 0.14 F 0.11 D 0.08 E 0.06 M 0.03 L 0.02 I 0.01 C Shift Assignments>> C :: 175.718 CA :: 54.653 CB :: 37.909 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 :: 8.742 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 121.859 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.S142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.731 CA :: 57.521 CB :: 63.991 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.057 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 :: 113.472 Ave N Shift Values>> N :: 116.28(3.52) 1.G143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 L 0.11 C 0.03 R 0.01 F 0.01 C Shift Assignments>> C :: 174.163 CA :: 45.182 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.065 HA2 :: 3.950 HA3 :: 3.950 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.117 Ave N Shift Values>> N :: 109.67(3.87) 1.M144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.5 C 0.33 Q 0.09 K 0.05 HN Overlap>> 1.C67 1.C67 C Shift Assignments>> C :: 175.188 CA :: 54.600 CB :: 31.404 CG :: 31.842 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.252 HA :: 4.365 HB2 :: 2.151 HB3 :: 2.151 HG2 :: 2.471 HG3 :: 2.471 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 120.165 Ave N Shift Values>> N :: 120.09(3.57) 1.S145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.525 CA :: 57.255 CB :: 64.436 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.290 HA :: 4.407 HB2 :: 3.384 HB3 :: 3.384 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.817 Ave N Shift Values>> N :: 116.28(3.52) 1.Y146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.27 L 0.25 K 0.13 F 0.09 D 0.09 Y 0.06 C 0.05 G 0.01 C Shift Assignments>> C :: 173.777 CA :: 56.533 CB :: 42.884 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 :: 7.743 HA :: 4.913 HB2 :: 2.647 HB3 :: 2.647 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 :: 118.363 Ave N Shift Values>> N :: 120.52(4.2) 1.N147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.38 N 0.25 L 0.17 C 0.06 K 0.04 F 0.03 Y 0.02 C Shift Assignments>> C :: 174.471 CA :: 51.093 CB :: 41.283 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.262 HA :: 5.393 HB2 :: 2.170 HB3 :: 2.170 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 :: 118.054 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I148 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.51 C 0.48 HN Overlap>> 1.K129 1.K129 C Shift Assignments>> C :: 175.270 CA :: 58.715 CB :: 37.769 CG1 :: 26.376 CG2 :: 16.633 CD1 :: 12.293(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 :: 8.092 HA :: 4.558 HB :: 1.808 HG12 :: 1.237 HG21 :: 0.686 HG22 :: 0.686 HG23 :: 0.686 HD11 :: 0.065(D) HD12 :: 0.065(D) HD13 :: 0.065(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.052 Ave N Shift Values>> N :: 121.46(4.28) 1.E149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 E 0.3 M 0.29 Q 0.03 K 0.01 C Shift Assignments>> C :: 175.257 CA :: 54.359 CB :: 31.471 CG :: 36.223 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.144 HA :: 4.554 HB2 :: 1.764 HB3 :: 1.764 HG2 :: 2.010 HG3 :: 2.010 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 :: 130.990 Ave N Shift Values>> N :: 120.67(3.48) 1.V150 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.58 C 0.41 C Shift Assignments>> C :: 175.512 CA :: 61.633 CB :: 31.404 CG1 :: 20.330(D) CG2 :: 20.985(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 :: 8.398 HA :: 4.608 HB :: 1.917 HG11 :: 0.632(D) HG12 :: 0.632(D) HG13 :: 0.632(D) HG21 :: 0.680(D) HG22 :: 0.680(D) HG23 :: 0.680(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 :: 125.778 Ave N Shift Values>> N :: 121.14(4.54) 1.V151 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> C 0.78 V 0.2 HN Overlap>> 1.L45 1.L45 C Shift Assignments>> C :: 174.217 CA :: 59.335 CB :: 35.002 CG1 :: 19.259(D) CG2 :: 20.825(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 :: 8.468 HA :: 4.432 HB :: 1.688 HG11 :: 0.509(D) HG12 :: 0.509(D) HG13 :: 0.509(D) HG21 :: 0.641(D) HG22 :: 0.641(D) HG23 :: 0.641(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 :: 123.081 Ave N Shift Values>> N :: 121.14(4.54) 1.A152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.95 M 0.02 C 0.01 C Shift Assignments>> C :: 176.775 CA :: 50.560 CB :: 19.918 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.685 HA :: 4.519 HB1 :: 1.112 HB2 :: 1.112 HB3 :: 1.112 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.098 Ave N Shift Values>> N :: 123.23(3.54) 1.F153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 Y 0.21 D 0.18 L 0.12 C 0.11 N 0.07 I 0.03 K 0.01 C Shift Assignments>> C :: 175.217 CA :: 56.326 CB :: 39.976 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.956 HA :: 4.636 HB2 :: 3.003 HB3 :: 3.003 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 :: 119.721 Ave N Shift Values>> N :: 120.45(4.18) 1.G154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.3 L 0.3 G 0.2 D 0.04 F 0.04 C 0.04 Y 0.02 K 0.01 C Shift Assignments>> C :: 172.254 CA :: 43.883 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.482 HA2 :: 4.177 HA3 :: 4.177 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.381 Ave N Shift Values>> N :: 109.67(3.87) 1.P155 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.28 N 0.25 L 0.12 F 0.12 Y 0.11 C 0.08 C Shift Assignments>> C :: 176.568 CA :: 54.380 CB :: 39.836 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 :: 8.457 HA :: 4.421 HB2 :: 2.466 HB3 :: 2.466 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.303 Ave N Shift Values>> N :: 120.65(3.86) 1.N157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.53 D 0.18 C 0.08 F 0.06 Y 0.06 L 0.04 C Shift Assignments>> C :: 175.221 CA :: 52.980 CB :: 38.868 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 :: 8.005 HA :: 4.753 HB2 :: 2.573 HB3 :: 2.573 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 :: 119.039 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.32 K 0.11 I 0.11 Q 0.08 M 0.01 C Shift Assignments>> C :: 177.671 CA :: 58.879 CB :: 29.176 CG :: 35.782 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 :: 7.963 HA :: 3.939 HB2 :: 1.946 HB3 :: 1.946 HG2 :: 2.160 HG3 :: 2.160 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 :: 121.561 Ave N Shift Values>> N :: 120.67(3.48) 1.A159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.52 A 0.43 I 0.02 C 0.01 C Shift Assignments>> C :: 180.540 CA :: 54.443 CB :: 17.591 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.322 HA :: 3.995 HB1 :: 1.260 HB2 :: 1.260 HB3 :: 1.260 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.212 Ave N Shift Values>> N :: 123.23(3.54) 1.E160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.35 C 0.34 I 0.14 K 0.09 Q 0.04 HN Overlap>> 1.D128 1.D128 C Shift Assignments>> C :: 178.375 CA :: 58.321 CB :: 28.801 CG :: 36.278 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 :: 8.064 HA :: 3.897 HB2 :: 1.746 HB3 :: 1.746 HG2 :: 2.061 HG3 :: 2.061 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 :: 119.768 Ave N Shift Values>> N :: 120.67(3.48) 1.Y161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.28 Y 0.24 C 0.21 F 0.18 E 0.04 HN Overlap>> 1.S140 1.L50 1.S140 1.L50 C Shift Assignments>> C :: 176.933 CA :: 59.887 CB :: 38.070 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 :: 7.930 HA :: 4.088 HB2 :: 2.868 HB3 :: 2.868 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 :: 121.134 Ave N Shift Values>> N :: 120.52(4.2) 1.Q162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 Q 0.23 K 0.2 R 0.18 M 0.02 E 0.01 C Shift Assignments>> C :: 178.421 CA :: 57.696 CB :: 27.547 CG :: 33.152 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 :: 8.192 HA :: 3.700 HB2 :: 1.926 HB3 :: 1.926 HG2 :: 2.360 HG3 :: 2.360 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 :: 117.843 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A163 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.51 M 0.45 C 0.01 I 0.01 C Shift Assignments>> C :: 179.251 CA :: 54.139 CB :: 17.770 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.670 HA :: 3.914 HB1 :: 1.318 HB2 :: 1.318 HB3 :: 1.318 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.851 Ave N Shift Values>> N :: 123.23(3.54) 1.L164 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.71 C 0.27 C Shift Assignments>> C :: 178.661 CA :: 56.712 CB :: 40.934 CD1 :: 24.202(D) CD2 :: 24.311(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 :: 7.591 HA :: 4.217 HB2 :: 1.561 HB3 :: 1.561 HG :: 1.491 HD11 :: 0.718(D) HD12 :: 0.718(D) HD13 :: 0.718(D) HD21 :: 0.728(D) HD22 :: 0.728(D) HD23 :: 0.728(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.534 Ave N Shift Values>> N :: 121.86(3.9) 1.L165 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.56 C 0.36 A 0.06 C Shift Assignments>> C :: 178.607 CA :: 56.276 CB :: 40.934 CD1 :: 22.276(D) CD2 :: 24.609(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 :: 7.653 HA :: 3.843 HB2 :: 1.487 HB3 :: 1.487 HG :: 1.253 HD11 :: 0.534(D) HD12 :: 0.534(D) HD13 :: 0.534(D) HD21 :: 0.538(D) HD22 :: 0.538(D) HD23 :: 0.538(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 :: 118.835 Ave N Shift Values>> N :: 121.86(3.9) 1.R166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.45 C 0.41 K 0.06 G 0.04 L 0.01 HN Overlap>> 1.L96 1.L96 C Shift Assignments>> C :: 177.574 CA :: 57.646 CB :: 29.785 CG :: 27.116 CD :: 43.178 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 :: 7.576 HA :: 3.962 HB2 :: 1.715 HB3 :: 1.715 HG2 :: 1.482 HG3 :: 1.482 HD2 :: 3.052 HD3 :: 3.052 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 :: 118.583 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.D167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.26 L 0.2 F 0.14 Y 0.12 K 0.08 N 0.08 C 0.07 I 0.01 C Shift Assignments>> C :: 177.510 CA :: 55.356 CB :: 40.795 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 :: 7.786 HA :: 4.409 HB2 :: 2.591 HB3 :: 2.591 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 :: 119.466 Ave N Shift Values>> N :: 120.65(3.86) 1.I168 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> I 0.76 C 0.23 C Shift Assignments>> C :: 176.704 CA :: 62.664 CB :: 37.732 CG1 :: 26.798 CG2 :: 16.591 CD1 :: 13.004(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 :: 7.744 HA :: 4.036 HB :: 1.549 HG12 :: 0.846 HG21 :: 0.347 HG22 :: 0.347 HG23 :: 0.347 HD11 :: 0.504(D) HD12 :: 0.504(D) HD13 :: 0.504(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.693 Ave N Shift Values>> N :: 121.46(4.28) 1.Y169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.25 C 0.22 F 0.19 E 0.12 I 0.1 N 0.02 M 0.02 D 0.01 L 0.01 C Shift Assignments>> C :: 175.516 CA :: 57.640 CB :: 37.784 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 :: 7.751 HA :: 4.429 HB2 :: 3.029 HB3 :: 3.029 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 120.118 Ave N Shift Values>> N :: 120.52(4.2) 1.A170 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.86 M 0.12 C 0.01 C Shift Assignments>> C :: 176.542 CA :: 51.960 CB :: 18.515 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.694 HA :: 4.187 HB1 :: 1.253 HB2 :: 1.253 HB3 :: 1.253 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.979 Ave N Shift Values>> N :: 123.23(3.54) 1.R171 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.15 H 0.14 C 0.13 W 0.13 E 0.13 M 0.09 Q 0.09 K 0.08 V 0.01 C Shift Assignments>> C :: 181.128 CA :: 57.034 CB :: 30.942 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 :: 7.652 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 :: 125.858 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) ########################################################################### Overall Results: #Consistent: 128 #Clerical: 39 #Suspicious: 4 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 162 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 9 Shift Relative Order (SRO) Results: #Consistent: 171 #Suspicious: 0 C Shift Results: #Consistent: 557 #Duplicate: 75 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 755 #Duplicate: 213 #Unknown: 0 #Suspicious: 12 #Anomalous: 0 N Shift Results: #Consistent: 162 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.I6 CD1 = 12.771(D), Expected = 13.43, Std = 1.6700, ChiSquare = 6.9313e-01 1.I6 HD11 = 0.657(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3679e-01 1.I6 HD12 = 0.657(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3679e-01 1.I6 HD13 = 0.657(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3679e-01 1.V10 CG1 = 20.508(D), Expected = 21.49, Std = 1.3600, ChiSquare = 4.7026e-01 1.V10 CG2 = 22.177(D), Expected = 21.26, Std = 1.5600, ChiSquare = 5.5665e-01 1.V10 HG11 = 0.542(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.6799e-01 1.V10 HG12 = 0.542(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.6799e-01 1.V10 HG13 = 0.542(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.6799e-01 1.V10 HG21 = 0.910(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9442e-01 1.V10 HG22 = 0.910(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9442e-01 1.V10 HG23 = 0.910(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9442e-01 1.L14 CD1 = 22.382(D), Expected = 24.72, Std = 1.5900, ChiSquare = 1.4144e-01 1.L14 CD2 = 25.009(D), Expected = 24.05, Std = 1.7000, ChiSquare = 5.7267e-01 1.L14 HD11 = -0.252(S), Expected = 0.75, Std = 0.2800, ChiSquare = 3.4548e-04 1.L14 HD12 = -0.252(S), Expected = 0.75, Std = 0.2800, ChiSquare = 3.4548e-04 1.L14 HD13 = -0.252(S), Expected = 0.75, Std = 0.2800, ChiSquare = 3.4548e-04 1.L14 HD21 = -0.175(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.8043e-03 1.L14 HD22 = -0.175(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.8043e-03 1.L14 HD23 = -0.175(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.8043e-03 1.I15 CD1 = 12.614(D), Expected = 13.43, Std = 1.6700, ChiSquare = 6.2511e-01 1.I15 HD11 = 0.656(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3404e-01 1.I15 HD12 = 0.656(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3404e-01 1.I15 HD13 = 0.656(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.3404e-01 1.I21 CD1 = 13.007(D), Expected = 13.43, Std = 1.6700, ChiSquare = 8.0004e-01 1.I21 HD11 = 0.499(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.3254e-01 1.I21 HD12 = 0.499(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.3254e-01 1.I21 HD13 = 0.499(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.3254e-01 1.L22 CD1 = 25.367(D), Expected = 24.72, Std = 1.5900, ChiSquare = 6.8407e-01 1.L22 CD2 = 20.722(D), Expected = 24.05, Std = 1.7000, ChiSquare = 5.0271e-02 1.L22 HD11 = 0.177(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.0714e-02 1.L22 HD12 = 0.177(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.0714e-02 1.L22 HD13 = 0.177(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.0714e-02 1.L22 HD21 = 0.475(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7923e-01 1.L22 HD22 = 0.475(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7923e-01 1.L22 HD23 = 0.475(D), Expected = 0.73, Std = 0.2900, ChiSquare = 3.7923e-01 1.L24 CD1 = 27.735(D), Expected = 24.72, Std = 1.5900, ChiSquare = 5.7930e-02 1.L24 CD2 = 21.941(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.1476e-01 1.L24 HD11 = 0.613(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2464e-01 1.L24 HD12 = 0.613(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2464e-01 1.L24 HD13 = 0.613(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2464e-01 1.L24 HD21 = 0.674(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.4688e-01 1.L24 HD22 = 0.674(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.4688e-01 1.L24 HD23 = 0.674(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.4688e-01 1.L29 CD1 = 26.807(D), Expected = 24.72, Std = 1.5900, ChiSquare = 1.8932e-01 1.L29 CD2 = 23.320(D), Expected = 24.05, Std = 1.7000, ChiSquare = 6.6762e-01 1.L29 HD11 = 0.684(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.1365e-01 1.L29 HD12 = 0.684(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.1365e-01 1.L29 HD13 = 0.684(D), Expected = 0.75, Std = 0.2800, ChiSquare = 8.1365e-01 1.L29 HD21 = 0.637(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.4845e-01 1.L29 HD22 = 0.637(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.4845e-01 1.L29 HD23 = 0.637(D), Expected = 0.73, Std = 0.2900, ChiSquare = 7.4845e-01 1.I31 CD1 = 13.706(D), Expected = 13.43, Std = 1.6700, ChiSquare = 8.6873e-01 1.I31 HD11 = 0.714(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.0667e-01 1.I31 HD12 = 0.714(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.0667e-01 1.I31 HD13 = 0.714(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.0667e-01 1.L36 CD1 = 22.952(D), Expected = 24.72, Std = 1.5900, ChiSquare = 2.6616e-01 1.L36 CD2 = 24.430(D), Expected = 24.05, Std = 1.7000, ChiSquare = 8.2312e-01 1.L36 HD11 = 0.585(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.5567e-01 1.L36 HD12 = 0.585(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.5567e-01 1.L36 HD13 = 0.585(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.5567e-01 1.L36 HD21 = 0.709(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.4227e-01 1.L36 HD22 = 0.709(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.4227e-01 1.L36 HD23 = 0.709(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.4227e-01 1.I37 CD1 = 13.021(D), Expected = 13.43, Std = 1.6700, ChiSquare = 8.0653e-01 1.I37 HD11 = 0.694(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.6150e-01 1.I37 HD12 = 0.694(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.6150e-01 1.I37 HD13 = 0.694(D), Expected = 0.68, Std = 0.2900, ChiSquare = 9.6150e-01 1.L45 CD1 = 24.195(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.4126e-01 1.L45 CD2 = 26.266(D), Expected = 24.05, Std = 1.7000, ChiSquare = 1.9239e-01 1.L45 HD11 = 0.888(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2211e-01 1.L45 HD12 = 0.888(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2211e-01 1.L45 HD13 = 0.888(D), Expected = 0.75, Std = 0.2800, ChiSquare = 6.2211e-01 1.L45 HD21 = 0.713(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.5325e-01 1.L45 HD22 = 0.713(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.5325e-01 1.L45 HD23 = 0.713(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.5325e-01 1.L50 CD1 = 25.486(D), Expected = 24.72, Std = 1.5900, ChiSquare = 6.2998e-01 1.L50 CD2 = 18.794(D), Expected = 24.05, Std = 1.7000, ChiSquare = 1.9897e-03 1.L50 HD11 = 0.440(D), Expected = 0.75, Std = 0.2800, ChiSquare = 2.6823e-01 1.L50 HD12 = 0.440(D), Expected = 0.75, Std = 0.2800, ChiSquare = 2.6823e-01 1.L50 HD13 = 0.440(D), Expected = 0.75, Std = 0.2800, ChiSquare = 2.6823e-01 1.L50 HD21 = -0.155(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.2753e-03 1.L50 HD22 = -0.155(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.2753e-03 1.L50 HD23 = -0.155(D), Expected = 0.73, Std = 0.2900, ChiSquare = 2.2753e-03 1.I54 CD1 = 10.058(D), Expected = 13.43, Std = 1.6700, ChiSquare = 4.3470e-02 1.I54 HD11 = 0.592(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.6155e-01 1.I54 HD12 = 0.592(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.6155e-01 1.I54 HD13 = 0.592(D), Expected = 0.68, Std = 0.2900, ChiSquare = 7.6155e-01 1.V55 CG1 = 20.487(D), Expected = 21.49, Std = 1.3600, ChiSquare = 4.6082e-01 1.V55 CG2 = 22.199(D), Expected = 21.26, Std = 1.5600, ChiSquare = 5.4723e-01 1.V55 HG11 = 0.740(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.2923e-01 1.V55 HG12 = 0.740(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.2923e-01 1.V55 HG13 = 0.740(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.2923e-01 1.V55 HG21 = 0.587(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.4683e-01 1.V55 HG22 = 0.587(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.4683e-01 1.V55 HG23 = 0.587(D), Expected = 0.80, Std = 0.2800, ChiSquare = 4.4683e-01 1.V58 CG1 = 20.691(D), Expected = 21.49, Std = 1.3600, ChiSquare = 5.5687e-01 1.V58 CG2 = 23.211(D), Expected = 21.26, Std = 1.5600, ChiSquare = 2.1107e-01 1.V58 HG11 = 0.830(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.0000e+00 1.V58 HG12 = 0.830(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.0000e+00 1.V58 HG13 = 0.830(D), Expected = 0.83, Std = 0.2600, ChiSquare = 1.0000e+00 1.V58 HG21 = 0.949(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.9463e-01 1.V58 HG22 = 0.949(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.9463e-01 1.V58 HG23 = 0.949(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.9463e-01 1.L61 CD1 = 24.053(D), Expected = 24.72, Std = 1.5900, ChiSquare = 6.7485e-01 1.L61 CD2 = 26.029(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.4438e-01 1.L61 HD11 = 1.156(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.4706e-01 1.L61 HD12 = 1.156(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.4706e-01 1.L61 HD13 = 1.156(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.4706e-01 1.L61 HD21 = 0.674(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.4688e-01 1.L61 HD22 = 0.674(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.4688e-01 1.L61 HD23 = 0.674(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.4688e-01 1.L62 CD1 = 21.934(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.9739e-02 1.L62 CD2 = 25.926(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.6980e-01 1.L62 HD11 = -0.536(S), Expected = 0.75, Std = 0.2800, ChiSquare = 4.3722e-06 1.L62 HD12 = -0.536(S), Expected = 0.75, Std = 0.2800, ChiSquare = 4.3722e-06 1.L62 HD13 = -0.536(S), Expected = 0.75, Std = 0.2800, ChiSquare = 4.3722e-06 1.L62 HD21 = 0.176(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.6089e-02 1.L62 HD22 = 0.176(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.6089e-02 1.L62 HD23 = 0.176(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.6089e-02 1.V76 CG1 = 21.695(D), Expected = 21.49, Std = 1.3600, ChiSquare = 8.8018e-01 1.V76 CG2 = 22.910(D), Expected = 21.26, Std = 1.5600, ChiSquare = 2.9020e-01 1.V76 HG11 = 0.710(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.4441e-01 1.V76 HG12 = 0.710(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.4441e-01 1.V76 HG13 = 0.710(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.4441e-01 1.V76 HG21 = 0.752(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.6389e-01 1.V76 HG22 = 0.752(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.6389e-01 1.V76 HG23 = 0.752(D), Expected = 0.80, Std = 0.2800, ChiSquare = 8.6389e-01 1.V84 CG1 = 21.843(D), Expected = 21.49, Std = 1.3600, ChiSquare = 7.9520e-01 1.V84 CG2 = 22.275(D), Expected = 21.26, Std = 1.5600, ChiSquare = 5.1528e-01 1.V84 HG11 = 0.673(D), Expected = 0.83, Std = 0.2600, ChiSquare = 5.4595e-01 1.V84 HG12 = 0.673(D), Expected = 0.83, Std = 0.2600, ChiSquare = 5.4595e-01 1.V84 HG13 = 0.673(D), Expected = 0.83, Std = 0.2600, ChiSquare = 5.4595e-01 1.V84 HG21 = -0.126(S), Expected = 0.80, Std = 0.2800, ChiSquare = 9.4253e-04 1.V84 HG22 = -0.126(S), Expected = 0.80, Std = 0.2800, ChiSquare = 9.4253e-04 1.V84 HG23 = -0.126(S), Expected = 0.80, Std = 0.2800, ChiSquare = 9.4253e-04 1.L86 CD1 = 21.961(D), Expected = 24.72, Std = 1.5900, ChiSquare = 8.2702e-02 1.L86 CD2 = 25.131(D), Expected = 24.05, Std = 1.7000, ChiSquare = 5.2485e-01 1.L86 HD11 = -0.504(S), Expected = 0.75, Std = 0.2800, ChiSquare = 7.5144e-06 1.L86 HD12 = -0.504(S), Expected = 0.75, Std = 0.2800, ChiSquare = 7.5144e-06 1.L86 HD13 = -0.504(S), Expected = 0.75, Std = 0.2800, ChiSquare = 7.5144e-06 1.L86 HD21 = -0.196(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.4075e-03 1.L86 HD22 = -0.196(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.4075e-03 1.L86 HD23 = -0.196(D), Expected = 0.73, Std = 0.2900, ChiSquare = 1.4075e-03 1.I90 CD1 = 12.912(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.5642e-01 1.I90 HD11 = 0.721(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.8757e-01 1.I90 HD12 = 0.721(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.8757e-01 1.I90 HD13 = 0.721(D), Expected = 0.68, Std = 0.2900, ChiSquare = 8.8757e-01 1.L96 CD1 = 21.405(D), Expected = 24.72, Std = 1.5900, ChiSquare = 3.7078e-02 1.L96 CD2 = 25.327(D), Expected = 24.05, Std = 1.7000, ChiSquare = 4.5255e-01 1.L96 HD11 = 0.388(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.9606e-01 1.L96 HD12 = 0.388(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.9606e-01 1.L96 HD13 = 0.388(D), Expected = 0.75, Std = 0.2800, ChiSquare = 1.9606e-01 1.L96 HD21 = -0.087(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.8438e-03 1.L96 HD22 = -0.087(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.8438e-03 1.L96 HD23 = -0.087(D), Expected = 0.73, Std = 0.2900, ChiSquare = 4.8438e-03 1.L99 CD1 = 23.051(D), Expected = 24.72, Std = 1.5900, ChiSquare = 2.9386e-01 1.L99 CD2 = 26.233(D), Expected = 24.05, Std = 1.7000, ChiSquare = 1.9910e-01 1.L99 HD11 = 0.757(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.8006e-01 1.L99 HD12 = 0.757(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.8006e-01 1.L99 HD13 = 0.757(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.8006e-01 1.L99 HD21 = 0.711(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.4776e-01 1.L99 HD22 = 0.711(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.4776e-01 1.L99 HD23 = 0.711(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.4776e-01 1.V102 CG1 = 21.207(D), Expected = 21.49, Std = 1.3600, ChiSquare = 8.3516e-01 1.V102 CG2 = 20.488(D), Expected = 21.26, Std = 1.5600, ChiSquare = 6.2069e-01 1.V102 HG11 = 0.796(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.9596e-01 1.V102 HG12 = 0.796(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.9596e-01 1.V102 HG13 = 0.796(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.9596e-01 1.V102 HG21 = 0.796(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.8860e-01 1.V102 HG22 = 0.796(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.8860e-01 1.V102 HG23 = 0.796(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.8860e-01 1.L108 CD1 = 24.660(D), Expected = 24.72, Std = 1.5900, ChiSquare = 9.6990e-01 1.L108 CD2 = 25.287(D), Expected = 24.05, Std = 1.7000, ChiSquare = 4.6683e-01 1.L108 HD11 = 0.561(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.9968e-01 1.L108 HD12 = 0.561(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.9968e-01 1.L108 HD13 = 0.561(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.9968e-01 1.L108 HD21 = 0.569(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.7878e-01 1.L108 HD22 = 0.569(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.7878e-01 1.L108 HD23 = 0.569(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.7878e-01 1.V110 CG1 = 20.116(D), Expected = 21.49, Std = 1.3600, ChiSquare = 3.1235e-01 1.V110 CG2 = 22.108(D), Expected = 21.26, Std = 1.5600, ChiSquare = 5.8672e-01 1.V110 HG11 = 0.765(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.0259e-01 1.V110 HG12 = 0.765(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.0259e-01 1.V110 HG13 = 0.765(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.0259e-01 1.V110 HG21 = 0.915(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.8128e-01 1.V110 HG22 = 0.915(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.8128e-01 1.V110 HG23 = 0.915(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.8128e-01 1.L114 CD1 = 25.083(D), Expected = 24.72, Std = 1.5900, ChiSquare = 8.1941e-01 1.L114 CD2 = 25.867(D), Expected = 24.05, Std = 1.7000, ChiSquare = 2.8515e-01 1.L114 HD11 = 0.575(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.3197e-01 1.L114 HD12 = 0.575(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.3197e-01 1.L114 HD13 = 0.575(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.3197e-01 1.L114 HD21 = 0.547(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.2802e-01 1.L114 HD22 = 0.547(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.2802e-01 1.L114 HD23 = 0.547(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.2802e-01 1.V115 CG1 = 21.540(D), Expected = 21.49, Std = 1.3600, ChiSquare = 9.7067e-01 1.V115 CG2 = 23.982(D), Expected = 21.26, Std = 1.5600, ChiSquare = 8.1007e-02 1.V115 HG11 = 0.750(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5832e-01 1.V115 HG12 = 0.750(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5832e-01 1.V115 HG13 = 0.750(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5832e-01 1.V115 HG21 = 0.825(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.2886e-01 1.V115 HG22 = 0.825(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.2886e-01 1.V115 HG23 = 0.825(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.2886e-01 1.V116 CG1 = 21.074(D), Expected = 21.49, Std = 1.3600, ChiSquare = 7.5969e-01 1.V116 CG2 = 22.031(D), Expected = 21.26, Std = 1.5600, ChiSquare = 6.2114e-01 1.V116 HG11 = 0.764(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.9961e-01 1.V116 HG12 = 0.764(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.9961e-01 1.V116 HG13 = 0.764(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.9961e-01 1.V116 HG21 = 0.782(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.4874e-01 1.V116 HG22 = 0.782(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.4874e-01 1.V116 HG23 = 0.782(D), Expected = 0.80, Std = 0.2800, ChiSquare = 9.4874e-01 1.L118 CD1 = 24.160(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.2469e-01 1.L118 CD2 = 24.528(D), Expected = 24.05, Std = 1.7000, ChiSquare = 7.7857e-01 1.L118 HD11 = 0.732(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.4874e-01 1.L118 HD12 = 0.732(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.4874e-01 1.L118 HD13 = 0.732(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.4874e-01 1.L118 HD21 = 0.743(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.6424e-01 1.L118 HD22 = 0.743(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.6424e-01 1.L118 HD23 = 0.743(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.6424e-01 1.I121 CD1 = 11.233(D), Expected = 13.43, Std = 1.6700, ChiSquare = 1.8832e-01 1.I121 HD11 = 0.423(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.7551e-01 1.I121 HD12 = 0.423(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.7551e-01 1.I121 HD13 = 0.423(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.7551e-01 1.I124 CD1 = 14.023(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.2252e-01 1.I124 HD11 = 0.521(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.8350e-01 1.I124 HD12 = 0.521(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.8350e-01 1.I124 HD13 = 0.521(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.8350e-01 1.V131 CG1 = 21.012(D), Expected = 21.49, Std = 1.3600, ChiSquare = 7.2524e-01 1.V131 CG2 = 20.728(D), Expected = 21.26, Std = 1.5600, ChiSquare = 7.3308e-01 1.V131 HG11 = 0.755(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.7299e-01 1.V131 HG12 = 0.755(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.7299e-01 1.V131 HG13 = 0.755(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.7299e-01 1.V131 HG21 = 0.724(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.8606e-01 1.V131 HG22 = 0.724(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.8606e-01 1.V131 HG23 = 0.724(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.8606e-01 1.L132 CD1 = 22.679(D), Expected = 24.72, Std = 1.5900, ChiSquare = 1.9926e-01 1.L132 CD2 = 25.466(D), Expected = 24.05, Std = 1.7000, ChiSquare = 4.0488e-01 1.L132 HD11 = 0.596(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.8232e-01 1.L132 HD12 = 0.596(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.8232e-01 1.L132 HD13 = 0.596(D), Expected = 0.75, Std = 0.2800, ChiSquare = 5.8232e-01 1.L132 HD21 = 0.693(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.9848e-01 1.L132 HD22 = 0.693(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.9848e-01 1.L132 HD23 = 0.693(D), Expected = 0.73, Std = 0.2900, ChiSquare = 8.9848e-01 1.V136 CG1 = 20.048(D), Expected = 21.49, Std = 1.3600, ChiSquare = 2.8901e-01 1.V136 CG2 = 21.132(D), Expected = 21.26, Std = 1.5600, ChiSquare = 9.3461e-01 1.V136 HG11 = 0.697(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0897e-01 1.V136 HG12 = 0.697(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0897e-01 1.V136 HG13 = 0.697(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.0897e-01 1.V136 HG21 = 0.674(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.5271e-01 1.V136 HG22 = 0.674(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.5271e-01 1.V136 HG23 = 0.674(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.5271e-01 1.V137 CG1 = 20.364(D), Expected = 21.49, Std = 1.3600, ChiSquare = 4.0770e-01 1.V137 CG2 = 22.474(D), Expected = 21.26, Std = 1.5600, ChiSquare = 4.3645e-01 1.V137 HG11 = 0.779(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.4449e-01 1.V137 HG12 = 0.779(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.4449e-01 1.V137 HG13 = 0.779(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.4449e-01 1.V137 HG21 = 0.656(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.0705e-01 1.V137 HG22 = 0.656(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.0705e-01 1.V137 HG23 = 0.656(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.0705e-01 1.I148 CD1 = 12.293(D), Expected = 13.43, Std = 1.6700, ChiSquare = 4.9597e-01 1.I148 HD11 = 0.065(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.3948e-02 1.I148 HD12 = 0.065(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.3948e-02 1.I148 HD13 = 0.065(D), Expected = 0.68, Std = 0.2900, ChiSquare = 3.3948e-02 1.V150 CG1 = 20.330(D), Expected = 21.49, Std = 1.3600, ChiSquare = 3.9369e-01 1.V150 CG2 = 20.985(D), Expected = 21.26, Std = 1.5600, ChiSquare = 8.6007e-01 1.V150 HG11 = 0.632(D), Expected = 0.83, Std = 0.2600, ChiSquare = 4.4634e-01 1.V150 HG12 = 0.632(D), Expected = 0.83, Std = 0.2600, ChiSquare = 4.4634e-01 1.V150 HG13 = 0.632(D), Expected = 0.83, Std = 0.2600, ChiSquare = 4.4634e-01 1.V150 HG21 = 0.680(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.6823e-01 1.V150 HG22 = 0.680(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.6823e-01 1.V150 HG23 = 0.680(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.6823e-01 1.V151 CG1 = 19.259(D), Expected = 21.49, Std = 1.3600, ChiSquare = 1.0091e-01 1.V151 CG2 = 20.825(D), Expected = 21.26, Std = 1.5600, ChiSquare = 7.8036e-01 1.V151 HG11 = 0.509(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.1697e-01 1.V151 HG12 = 0.509(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.1697e-01 1.V151 HG13 = 0.509(D), Expected = 0.83, Std = 0.2600, ChiSquare = 2.1697e-01 1.V151 HG21 = 0.641(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.7013e-01 1.V151 HG22 = 0.641(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.7013e-01 1.V151 HG23 = 0.641(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.7013e-01 1.L164 CD1 = 24.202(D), Expected = 24.72, Std = 1.5900, ChiSquare = 7.4459e-01 1.L164 CD2 = 24.311(D), Expected = 24.05, Std = 1.7000, ChiSquare = 8.7798e-01 1.L164 HD11 = 0.718(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.0901e-01 1.L164 HD12 = 0.718(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.0901e-01 1.L164 HD13 = 0.718(D), Expected = 0.75, Std = 0.2800, ChiSquare = 9.0901e-01 1.L164 HD21 = 0.728(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.9450e-01 1.L164 HD22 = 0.728(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.9450e-01 1.L164 HD23 = 0.728(D), Expected = 0.73, Std = 0.2900, ChiSquare = 9.9450e-01 1.L165 CD1 = 22.276(D), Expected = 24.72, Std = 1.5900, ChiSquare = 1.2427e-01 1.L165 CD2 = 24.609(D), Expected = 24.05, Std = 1.7000, ChiSquare = 7.4229e-01 1.L165 HD11 = 0.534(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.4045e-01 1.L165 HD12 = 0.534(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.4045e-01 1.L165 HD13 = 0.534(D), Expected = 0.75, Std = 0.2800, ChiSquare = 4.4045e-01 1.L165 HD21 = 0.538(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.0793e-01 1.L165 HD22 = 0.538(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.0793e-01 1.L165 HD23 = 0.538(D), Expected = 0.73, Std = 0.2900, ChiSquare = 5.0793e-01 1.I168 CD1 = 13.004(D), Expected = 13.43, Std = 1.6700, ChiSquare = 7.9865e-01 1.I168 HD11 = 0.504(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.4392e-01 1.I168 HD12 = 0.504(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.4392e-01 1.I168 HD13 = 0.504(D), Expected = 0.68, Std = 0.2900, ChiSquare = 5.4392e-01