Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> A 0.85 M 0.12 C 0.01 C Shift Assignments>> C :: 177.7490 CA :: 52.8470 CB :: 19.1360 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) 1.E4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.39 C 0.35 M 0.13 Q 0.05 K 0.04 I 0.02 C Shift Assignments>> C :: 176.1500 CA :: 56.8360 CB :: 30.6480 CG :: 36.2320 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 :: 8.2880 HA :: 4.2130 HB2 :: 2.0500 HB3 :: 1.9230 HG2 :: 2.2570 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 :: 119.6290 Ave N Shift Values>> N :: 120.67(3.48) 1.A5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.1 C 0.01 C Shift Assignments>> C :: 177.3550 CA :: 52.5320 CB :: 19.1880 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1710 HA :: 4.2540 HB1 :: 1.2970 HB2 :: 1.2970 HB3 :: 1.2970 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.2100 Ave N Shift Values>> N :: 123.23(3.54) 1.R6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.49 C 0.36 K 0.08 G 0.04 C Shift Assignments>> C :: 176.2990 CA :: 55.9230 CB :: 30.8360 CG :: 27.2280 CD :: 43.1500 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 :: 8.1770 HA :: 4.2980 HB2 :: 1.7460 HB3 :: 1.6800 HG2 :: 1.5050 HG3 :: 1.5050 HD2 :: 3.1270 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 :: 120.1810 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.W7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.52 C 0.47 HN Overlap>> 1.V17 1.V17 C Shift Assignments>> C :: 175.7860 CA :: 57.5870 CB :: 29.9690 CD1 :: 127.0400 CE3 :: 121.1230 CZ2 :: 114.7110 CZ3 :: 122.2730 CH2 :: 124.8400 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 :: 8.1820 HA :: 4.6740 HB2 :: 3.3490 HB3 :: 3.7020 HD1 :: 7.2330 HE1 :: 10.1300 HE3 :: 7.6500 HZ2 :: 7.5000 HZ3 :: 7.1590 HH2 :: 7.2730 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 :: 122.2520 NE1 :: 129.4400 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.D8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.47 N 0.19 F 0.11 K 0.11 C 0.07 R 0.01 HN Overlap>> 1.E9 1.W66 1.E9 1.W66 1.V39 1.V39 C Shift Assignments>> C :: 175.7860 CA :: 53.8200 CB :: 41.0490 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 :: 8.1160 HA :: 4.4930 HB2 :: 2.4970 HB3 :: 2.4120 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.7220 Ave N Shift Values>> N :: 120.65(3.86) 1.E9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.39 C 0.34 K 0.07 M 0.06 Q 0.06 I 0.04 HN Overlap>> 1.W66 1.D8 1.V39 1.W66 1.D8 1.V39 C Shift Assignments>> C :: 176.2070 CA :: 57.2830 CB :: 30.0080 CG :: 36.2320 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 :: 8.1100 HA :: 4.0980 HB2 :: 2.0530 HB3 :: 1.9400 HG2 :: 2.2570 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 :: 121.7260 Ave N Shift Values>> N :: 120.67(3.48) 1.A10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.86 M 0.1 C 0.01 HN Overlap>> 1.R31 1.R31 C Shift Assignments>> C :: 180.0430 CA :: 52.7480 CB :: 19.2750 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2420 HA :: 4.2900 HB1 :: 1.4080 HB2 :: 1.4080 HB3 :: 1.4080 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.6510 Ave N Shift Values>> N :: 123.23(3.54) 1.S11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.8790 CB :: 63.5070 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.0700 HA :: 4.3940 HB2 :: 3.8710 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 :: 113.8830 Ave N Shift Values>> N :: 116.28(3.52) 1.N12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 D 0.19 C 0.11 F 0.08 M 0.01 C Shift Assignments>> CA :: 53.3400 CB :: 38.7280 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 :: 8.2760 HA :: 4.7290 HB2 :: 2.8510 HB3 :: 2.7710 HD21 :: 7.5780 HD22 :: 6.8610 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 120.5660 ND2 :: 112.7700 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.67 C 0.32 C Shift Assignments>> CA :: 62.3290 CB :: 32.6260 CG2 :: 20.9200 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 :: 7.9500 HA :: 4.1760 HB :: 2.1190 HG21 :: 0.9320 HG22 :: 0.9320 HG23 :: 0.9320 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 :: 119.3900 Ave N Shift Values>> N :: 121.14(4.54) 1.T14 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>> CA :: 62.2300 CB :: 69.5610 CG2 :: 22.0200 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 :: 8.2180 HA :: 4.3590 HB :: 4.1660 HG21 :: 1.2000 HG22 :: 1.2000 HG23 :: 1.2000 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 :: 118.2030 Ave N Shift Values>> N :: 115.42(4.75) 1.I15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.66 C 0.33 C Shift Assignments>> CA :: 60.8990 CB :: 38.7150 CG1 :: 27.0880 CG2 :: 17.5150 CD1 :: 12.7200 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 :: 8.1350 HA :: 4.1870 HB :: 1.8640 HG12 :: 1.4810 HG13 :: 1.1700 HG21 :: 0.9000 HG22 :: 0.9000 HG23 :: 0.9000 HD11 :: 0.8570 HD12 :: 0.8570 HD13 :: 0.8570 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.0640 Ave N Shift Values>> N :: 121.46(4.28) 1.K16 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.49 C 0.38 R 0.1 C Shift Assignments>> CA :: 55.8800 CB :: 33.3870 CG :: 24.6600 CD :: 29.0460 CE :: 42.1940 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 :: 8.4040 HA :: 4.4360 HB2 :: 1.8430 HB3 :: 1.7720 HG2 :: 1.4600 HG3 :: 1.3960 HD2 :: 1.6890 HE2 :: 3.0230 HE3 :: 1.4060(S) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 126.2890 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) SRO Rule Breaks>> (HE3 > HB2 : 0.9970) (HE3 > HB3 : 0.9974) (HE3 > HG2 : 0.9993) (HE3 > HD2 : 0.9989) 1.V17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.67 C 0.32 HN Overlap>> 1.W7 1.W7 C Shift Assignments>> CA :: 62.3840 CB :: 33.2740 CG1 :: 21.1270 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 :: 8.2800 HA :: 4.2960 HB :: 2.1730 HG11 :: 1.0100 HG12 :: 1.0100 HG13 :: 1.0100 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 :: 122.1970 Ave N Shift Values>> N :: 121.14(4.54) 1.S18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 173.7770 CA :: 58.6500 CB :: 64.5340 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.4860 HB2 :: 3.9010 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.T19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.71 C 0.28 C Shift Assignments>> C :: 174.1140 CA :: 60.6410 CB :: 72.1800 CG2 :: 21.9450 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 :: 7.8300 HA :: 5.4520 HB :: 3.9720 HG21 :: 1.1290 HG22 :: 1.1290 HG23 :: 1.1290 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 :: 114.3040 Ave N Shift Values>> N :: 115.42(4.75) 1.K20 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.5 C 0.39 K 0.08 G 0.01 C Shift Assignments>> CA :: 54.4000 CB :: 36.9590 CG :: 26.3810 CD :: 29.8000 CE :: 42.2330 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 :: 8.8870 HA :: 4.7090 HB2 :: 1.4670 HB3 :: 1.3450 HG2 :: 1.1010 HG3 :: 0.7770 HD2 :: 1.0060 HD3 :: -0.0980(S) HE2 :: 2.4250 HE3 :: 1.9880(S) 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 :: 122.1270 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.6 P 0.39 C Shift Assignments>> C :: 175.2920 CA :: 60.7740 CB :: 30.9130 CG :: 27.1810 CD :: 50.1540 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.2600 HB2 :: 1.8320 HB3 :: 1.3070 HG2 :: 1.9350 HG3 :: 1.8150 HD2 :: 3.6920 HD3 :: 3.4120 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.C22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.14 M 0.14 R 0.14 K 0.13 H 0.12 W 0.11 E 0.1 Q 0.06 V 0.02 HN Overlap>> 1.E48 1.E48 C Shift Assignments>> CA :: 56.9400 CB :: 31.6900 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.7900 HA :: 3.4770 HB2 :: 3.1100 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 :: 125.2270 Ave N Shift Values>> N :: 120.17(4.64) 1.P23 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> P 0.78 C 0.21 C Shift Assignments>> C :: 176.3990 CA :: 64.2370 CB :: 32.5340 CG :: 27.2880 CD :: 49.2170 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 3.8140 HB2 :: 2.2250 HB3 :: 1.5000 HG2 :: 1.4100 HG3 :: 1.2840 HD2 :: 2.0560(S) HD3 :: 1.6960(S) Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.K24 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.45 C 0.43 R 0.1 C Shift Assignments>> C :: 176.9160 CA :: 57.5540 CB :: 33.3740 CG :: 24.7680 CD :: 28.9690 CE :: 42.1960 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 :: 8.3600 HA :: 3.9760 HB2 :: 1.4330 HB3 :: 0.4040(S) HG2 :: 0.8620 HG3 :: 0.7850 HD2 :: 1.6050 HD3 :: 1.3150 HE2 :: 2.7550 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 :: 118.2390 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.C25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.21 W 0.13 R 0.11 V 0.1 K 0.1 E 0.09 H 0.09 M 0.07 Q 0.04 I 0.01 C Shift Assignments>> C :: 176.5940 CA :: 59.3330 CB :: 31.5550 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.3360 HA :: 4.7590 HB2 :: 3.2020 HB3 :: 2.8890 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 118.6630 Ave N Shift Values>> N :: 120.17(4.64) 1.R26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.68 K 0.15 R 0.13 G 0.02 C Shift Assignments>> C :: 175.2700 CA :: 57.1830 CB :: 26.2330 CG :: 26.4190 CD :: 42.2220 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 :: 8.1080 HA :: 3.9710 HB2 :: 2.1780 HB3 :: 1.9850 HG2 :: 1.4790 HG3 :: 1.3590 HD2 :: 3.0370 HD3 :: 2.9910 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 :: 116.9570 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.T27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.94 C 0.05 C Shift Assignments>> CA :: 63.2290 CB :: 68.8470 CG2 :: 21.0230 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 :: 8.6800 HA :: 4.3740 HB :: 4.0340 HG21 :: 1.2850 HG22 :: 1.2850 HG23 :: 1.2850 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 122.1420 Ave N Shift Values>> N :: 115.42(4.75) 1.P28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.68 C 0.31 C Shift Assignments>> C :: 176.2230 CA :: 64.2190 CB :: 31.8000 CG :: 28.0870 CD :: 51.9280 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.1560 HB2 :: 2.2020 HB3 :: 1.9410 HG2 :: 2.2040 HG3 :: 1.9420 HD2 :: 4.2270 HD3 :: 3.7830 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.T29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.9 C 0.09 C Shift Assignments>> C :: 172.2210 CA :: 62.5240 CB :: 71.5650 CG2 :: 21.1410 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 :: 9.1100 HA :: 4.7300 HB :: 4.6900 HG21 :: 1.5540 HG22 :: 1.5540 HG23 :: 1.5540 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 122.8540 Ave N Shift Values>> N :: 115.42(4.75) 1.E30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 E 0.31 M 0.23 Q 0.01 C Shift Assignments>> C :: 175.3080 CA :: 55.0000 CB :: 31.6990 CG :: 36.9200 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 :: 8.7300 HA :: 4.9330 HB2 :: 1.9870 HB3 :: 1.8820 HG2 :: 2.2570 HG3 :: 2.6360 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 :: 126.0540 Ave N Shift Values>> N :: 120.67(3.48) 1.R31 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.47 C 0.38 K 0.09 G 0.04 HN Overlap>> 1.A10 1.A10 C Shift Assignments>> C :: 175.2470 CA :: 56.2150 CB :: 30.7970 CG :: 26.6400 CD :: 43.1330 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 :: 8.1800 HA :: 3.7130 HB2 :: 0.8830(S) HB3 :: 0.2150(S) HG2 :: 0.7840 HG3 :: 0.6090 HD2 :: 2.0930(S) HD3 :: 1.6310(S) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.5580 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.D32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.49 N 0.2 K 0.11 F 0.08 C 0.06 R 0.02 C Shift Assignments>> C :: 176.0480 CA :: 52.9000 CB :: 41.3650 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 :: 8.4870 HA :: 4.6580 HB2 :: 2.6460 HB3 :: 2.4680 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 :: 126.5900 Ave N Shift Values>> N :: 120.65(3.86) 1.G33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.95 C 0.03 C Shift Assignments>> C :: 174.2200 CA :: 45.8320 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.0470 HA2 :: 3.7460 HA3 :: 3.8400 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.2120 Ave N Shift Values>> N :: 109.67(3.87) 1.G34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.93 C 0.03 R 0.01 F 0.01 C Shift Assignments>> C :: 174.0950 CA :: 45.2670 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3800 HA2 :: 3.6500 HA3 :: 3.9500 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.6550 Ave N Shift Values>> N :: 109.67(3.87) 1.C35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.18 I 0.16 W 0.13 K 0.11 R 0.1 Q 0.09 E 0.09 H 0.07 C Shift Assignments>> C :: 174.8670 CA :: 59.2600 CB :: 28.1330 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8310 HA :: 4.0130 HB2 :: 2.8420 HB3 :: 2.7090 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 :: 120.5670 Ave N Shift Values>> N :: 120.17(4.64) 1.M36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.36 C 0.34 M 0.28 C Shift Assignments>> C :: 174.7430 CA :: 54.9700 CB :: 34.1600 CG :: 33.8160 CE :: 18.4300 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 :: 8.9200 HA :: 4.5510 HB2 :: 3.0560 HB3 :: 2.7210 HG2 :: 2.8540 HG3 :: 2.7190 HE1 :: 1.9600 HE2 :: 1.9600 HE3 :: 1.9600 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 :: 124.0500 Ave N Shift Values>> N :: 120.09(3.57) 1.H37 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> W 0.48 C 0.36 H 0.14 C Shift Assignments>> C :: 172.2240 CA :: 53.8120 CB :: 28.9000 CD2 :: 113.8410 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.5750 HA :: 3.6790 HB2 :: 2.6090 HB3 :: 1.0840(S) HD2 :: 5.8090 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 :: 120.1600 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.M38 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.44 C 0.43 M 0.12 C Shift Assignments>> C :: 175.6610 CA :: 52.5890 CB :: 28.0740 CG :: 30.7020 CE :: 15.9100 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.1300 HA :: 4.3330 HB2 :: 0.9030(S) HB3 :: 0.1110(S) HG2 :: 1.9980 HG3 :: 0.6560(S) HE1 :: 1.6780 HE2 :: 1.6780 HE3 :: 1.6780 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 :: 128.4130 Ave N Shift Values>> N :: 120.09(3.57) 1.V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.58 C 0.41 HN Overlap>> 1.E9 1.W66 1.D8 1.E9 1.W66 1.D8 C Shift Assignments>> C :: 175.3770 CA :: 61.4850 CB :: 33.2950 CG1 :: 20.6180 CG2 :: 20.2160 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 :: 8.0500 HA :: 4.3300 HB :: 1.7590 HG11 :: 0.7300 HG12 :: 0.7300 HG13 :: 0.7300 HG21 :: 0.4060 HG22 :: 0.4060 HG23 :: 0.4060 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 :: 121.7840 Ave N Shift Values>> N :: 121.14(4.54) 1.C40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.32 C 0.23 P 0.2 W 0.07 R 0.03 K 0.03 E 0.02 H 0.02 I 0.01 M 0.01 C Shift Assignments>> C :: 177.7660 CA :: 61.6230 CB :: 31.8260 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.0000 HA :: 4.6040 HB2 :: 3.5000 HB3 :: 3.3430 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 :: 130.3330 Ave N Shift Values>> N :: 120.17(4.64) 1.T41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.88 C 0.11 C Shift Assignments>> C :: 175.2400 CA :: 61.5880 CB :: 69.3200 CG2 :: 21.9240 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 :: 8.5020 HA :: 4.3990 HB :: 4.6250 HG21 :: 1.3340 HG22 :: 1.3340 HG23 :: 1.3340 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 :: 118.6780 Ave N Shift Values>> N :: 115.42(4.75) 1.R42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.47 C 0.41 K 0.06 G 0.04 C Shift Assignments>> C :: 177.7630 CA :: 57.2150 CB :: 29.9600 CG :: 27.1280 CD :: 43.1420 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 :: 9.0600 HA :: 4.2320 HB2 :: 2.1460 HB3 :: 1.8400 HG2 :: 1.7790 HD2 :: 3.3090 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 :: 128.7090 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.A43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 M 0.42 C 0.01 I 0.01 C Shift Assignments>> CA :: 53.8080 CB :: 17.6420 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.0400 HA :: 4.1530 HB1 :: 1.4150 HB2 :: 1.4150 HB3 :: 1.4150 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 133.1230 Ave N Shift Values>> N :: 123.23(3.54) 1.G44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 C 0.03 R 0.03 F 0.01 D 0.01 C Shift Assignments>> CA :: 45.0840 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.8300 HA3 :: 3.6620 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.2000 Ave N Shift Values>> N :: 109.67(3.87) 1.C45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.23 W 0.17 I 0.11 E 0.1 R 0.08 V 0.07 H 0.07 K 0.05 Q 0.05 M 0.01 P 0.01 C Shift Assignments>> C :: 173.5380 CA :: 60.4900 CB :: 30.0020 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.0500 HA :: 4.6360 HB2 :: 3.1840 HB3 :: 2.5020 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 :: 122.9700 Ave N Shift Values>> N :: 120.17(4.64) 1.G46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.94 C 0.04 C Shift Assignments>> C :: 173.7420 CA :: 46.2000 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.6700 HA2 :: 4.2600 HA3 :: 4.0800 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.3380 Ave N Shift Values>> N :: 109.67(3.87) 1.F47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.75 C 0.24 C Shift Assignments>> C :: 174.4380 CA :: 60.0870 CB :: 41.3330 CD1 :: 132.1300 CE1 :: 131.2200 CZ :: 128.9200 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 :: 8.9100 HA :: 4.5900 HB2 :: 3.3690 HB3 :: 3.0620 HD1 :: 7.3590 HE1 :: 7.1720 HZ :: 7.3240 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 124.8420 Ave N Shift Values>> N :: 120.45(4.18) 1.E48 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.43 E 0.32 M 0.21 HN Overlap>> 1.C22 1.C22 C Shift Assignments>> C :: 176.0330 CA :: 54.5780 CB :: 31.3880 CG :: 37.0630 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 :: 7.8400 HA :: 5.7250(S) HB2 :: 2.1790 HB3 :: 1.8930 HG2 :: 2.6220 HG3 :: 2.2670 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 :: 125.2450 Ave N Shift Values>> N :: 120.67(3.48) 1.W49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.52 C 0.47 C Shift Assignments>> C :: 172.9360 CA :: 53.7710 CB :: 31.6950 CD1 :: 128.6600 CE3 :: 121.0500 CZ2 :: 113.4200 CZ3 :: 120.9500 CH2 :: 125.2500 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 :: 9.2350 HA :: 5.5050 HB2 :: 3.0990 HB3 :: 3.0570 HD1 :: 7.2250 HE1 :: 10.0050 HE3 :: 7.5320 HZ2 :: 7.4960 HZ3 :: 6.7960 HH2 :: 7.0270 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 121.3020 NE1 :: 131.4910 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.C50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.2 K 0.17 M 0.13 Q 0.1 R 0.09 W 0.08 H 0.08 V 0.06 E 0.05 C Shift Assignments>> C :: 177.2410 CA :: 58.0910 CB :: 32.6930 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.7150 HA :: 5.4150 HB2 :: 3.5250 HB3 :: 3.1750 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 :: 120.8920 Ave N Shift Values>> N :: 120.17(4.64) 1.W51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 W 0.42 C Shift Assignments>> C :: 176.0270 CA :: 60.7460 CB :: 31.2300 CD1 :: 126.1800 CE3 :: 122.4500 CZ2 :: 114.3800 CZ3 :: 122.1830 CH2 :: 126.2400 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 :: 9.7980 HA :: 4.4400 HB2 :: 3.4530 HB3 :: 3.4010 HD1 :: 6.9840 HE1 :: 10.2460 HE3 :: 7.2560 HZ2 :: 7.5020 HZ3 :: 7.1050 HH2 :: 7.3810 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 :: 131.1630 NE1 :: 128.3400 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.V52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.88 C 0.11 C Shift Assignments>> CA :: 65.6200 CB :: 33.3600 CG1 :: 22.7440 CG2 :: 21.1170 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 :: 8.6300 HA :: 3.6340 HB :: 1.5670 HG11 :: 1.0470 HG12 :: 1.0470 HG13 :: 1.0470 HG21 :: 0.6950 HG22 :: 0.6950 HG23 :: 0.6950 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.1980 Ave N Shift Values>> N :: 121.14(4.54) 1.C53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.15 M 0.14 R 0.14 K 0.13 H 0.12 W 0.11 E 0.1 Q 0.06 V 0.02 C Shift Assignments>> CA :: 57.1340 CB :: 31.6580 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8200 HA :: 3.4780 HB2 :: 3.1000 HB3 :: 2.9400 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) 1.Q54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 I 0.18 E 0.14 K 0.07 Q 0.03 R 0.01 C Shift Assignments>> CA :: 58.0510 CB :: 26.4760 CG :: 36.1530 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>> HA :: 4.0360 HB2 :: 2.3210 HG2 :: 2.2120 HG3 :: 2.0520 HE21 :: 6.7820 HE22 :: 7.6050 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>> NE2 :: 111.7290 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.T55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.7 C 0.28 C Shift Assignments>> C :: 173.2450 CA :: 59.1300 CB :: 71.6550 CG2 :: 21.1150 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 :: 7.0800 HA :: 4.7120 HB :: 4.4720 HG21 :: 1.2190 HG22 :: 1.2190 HG23 :: 1.2190 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) 1.E56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.34 C 0.3 Q 0.12 K 0.11 M 0.07 I 0.02 C Shift Assignments>> C :: 175.6030 CA :: 57.1140 CB :: 29.9400 CG :: 35.6700 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 :: 8.9020 HA :: 4.2960 HB2 :: 2.2390 HB3 :: 2.0730 HG2 :: 2.4000 HG3 :: 2.3400 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.9500 Ave N Shift Values>> N :: 120.67(3.48) 1.W57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 W 0.04 C Shift Assignments>> CA :: 58.2600 CB :: 29.4820 CD1 :: 121.8500 CE3 :: 121.3100 CZ2 :: 114.2300 CZ3 :: 124.7200 CH2 :: 125.6760 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 :: 8.3500 HA :: 4.3000 HB2 :: 2.7780 HB3 :: 2.6430 HD1 :: 7.1900 HE1 :: 10.2460 HE3 :: 7.7340 HZ2 :: 7.5430 HZ3 :: 7.2720 HH2 :: 7.2400 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 :: 127.1270 NE1 :: 128.3480 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.T58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.42 T 0.38 C 0.15 I 0.01 M 0.01 C Shift Assignments>> CA :: 58.9300 CG2 :: 21.2100 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 :: 8.0690 HA :: 4.4250 HG21 :: 1.1600 HG22 :: 1.1600 HG23 :: 1.1600 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 :: 117.4800 Ave N Shift Values>> N :: 115.42(4.75) 1.R59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.45 C 0.42 K 0.06 G 0.04 C Shift Assignments>> C :: 177.9910 CA :: 58.1000 CB :: 29.4600 CG :: 27.2400 CD :: 43.1510 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>> HA :: 3.7920 HB2 :: 1.7860 HG2 :: 1.6200 HD2 :: 3.1810 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) 1.D60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.4 D 0.21 C 0.17 K 0.07 I 0.07 N 0.04 C Shift Assignments>> C :: 178.1620 CA :: 57.0680 CB :: 40.3660 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 :: 7.7400 HA :: 4.2280 HB2 :: 2.5360 HB3 :: 2.4270 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 :: 119.7390 Ave N Shift Values>> N :: 120.65(3.86) 1.C61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.47 P 0.18 C 0.17 V 0.12 W 0.02 C Shift Assignments>> CA :: 64.6100 CB :: 29.0920 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 6.9710 HA :: 3.4050 HB2 :: 2.7090 HB3 :: 1.4610 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 :: 120.9280 Ave N Shift Values>> N :: 120.17(4.64) 1.M62 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.94 A 0.02 I 0.01 M 0.01 C Shift Assignments>> CA :: 58.0100 CB :: 32.5500 CG :: 36.1800(S) CE :: 16.9700 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>> HA :: 4.0140 HB2 :: 2.1100 HB3 :: 1.8730 HG2 :: 2.2100 HE1 :: 1.9300 HE2 :: 1.9300 HE3 :: 1.9300 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) 1.G63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.94 C 0.03 C Shift Assignments>> C :: 174.4180 CA :: 45.6060 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.1550 HA2 :: 4.0300 HA3 :: 3.7400 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.9380 Ave N Shift Values>> N :: 109.67(3.87) 1.A64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.06 C 0.05 C Shift Assignments>> C :: 178.2150 CA :: 53.4600 CB :: 20.3900 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.3460 HA :: 4.2900 HB1 :: 0.9840 HB2 :: 0.9840 HB3 :: 0.9840 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.6920 Ave N Shift Values>> N :: 123.23(3.54) 1.H65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.46 C 0.3 H 0.23 C Shift Assignments>> C :: 173.5120 CA :: 54.4800 CB :: 27.7330 CD2 :: 125.9800 CE1 :: 138.6000 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 :: 8.3010 HA :: 4.9000 HB2 :: 3.3030 HB3 :: 3.2180 HD1 :: 9.6200 HD2 :: 7.1800 HE1 :: 7.7100 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 114.9620 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.W66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.52 C 0.47 HN Overlap>> 1.E9 1.E9 1.D8 1.V39 1.D8 1.V39 C Shift Assignments>> CA :: 58.2600 CB :: 29.5500 CD1 :: 126.4700 CE3 :: 119.5700 CZ2 :: 113.7000 CZ3 :: 122.7400 CH2 :: 123.7700 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 :: 8.0980 HA :: 4.3010 HB2 :: 2.7810 HB3 :: 2.6470 HD1 :: 6.6320 HE1 :: 9.4330 HE3 :: 7.2590 HZ2 :: 6.9730 HZ3 :: 7.4130 HH2 :: 7.1160 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 121.7990 NE1 :: 128.8290 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.F67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> F 0.74 C 0.25 C Shift Assignments>> C :: 175.0660 CA :: 56.6000 CB :: 41.0060 CD1 :: 131.6800 CE1 :: 130.9300 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>> HA :: 4.8320 HB2 :: 3.0610 HB3 :: 2.8050 HD1 :: 7.0220 HE1 :: 6.9000 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) 1.G68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.94 C 0.04 C Shift Assignments>> CA :: 46.5200 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.6700 HA2 :: 3.7000 HA3 :: 3.6500 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 115.0550 Ave N Shift Values>> N :: 109.67(3.87) 2.ZN1 Overall Status: Residue type ZN not supported. ########################################################################### Overall Results: #Consistent: 59 #Clerical: 0 #Suspicious: 9 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 66 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 2 Shift Relative Order (SRO) Results: #Consistent: 67 #Suspicious: 1 C Shift Results: #Consistent: 255 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 H Shift Results: #Consistent: 373 #Duplicate: 0 #Unknown: 0 #Suspicious: 15 #Anomalous: 0 N Shift Results: #Consistent: 62 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.K16 HE3 = 1.4060(S), Expected = 2.91, Std = 0.2000, ChiSquare = 5.4776e-14 1.K16 SRO Rule Break>> HE3 > HB2 : 0.99703557312253 1.K16 SRO Rule Break>> HE3 > HB3 : 0.997380484610347 1.K16 SRO Rule Break>> HE3 > HG2 : 0.999326372515999 1.K16 SRO Rule Break>> HE3 > HD2 : 0.998931243320271 1.K20 HD3 = -0.0980(S), Expected = 1.60, Std = 0.2200, ChiSquare = 1.1800e-14 1.K20 HE3 = 1.9880(S), Expected = 2.91, Std = 0.2000, ChiSquare = 4.0267e-06 1.P23 HD2 = 2.0560(S), Expected = 3.65, Std = 0.3500, ChiSquare = 5.2564e-06 1.P23 HD3 = 1.6960(S), Expected = 3.61, Std = 0.3900, ChiSquare = 9.2154e-07 1.K24 HB3 = 0.4040(S), Expected = 1.74, Std = 0.2700, ChiSquare = 7.4923e-07 1.R31 HB2 = 0.8830(S), Expected = 1.79, Std = 0.2700, ChiSquare = 7.8152e-04 1.R31 HB3 = 0.2150(S), Expected = 1.76, Std = 0.2800, ChiSquare = 3.4316e-08 1.R31 HD2 = 2.0930(S), Expected = 3.12, Std = 0.2400, ChiSquare = 1.8759e-05 1.R31 HD3 = 1.6310(S), Expected = 3.10, Std = 0.2600, ChiSquare = 1.6045e-08 1.H37 HB3 = 1.0840(S), Expected = 3.04, Std = 0.3800, ChiSquare = 2.6417e-07 1.M38 HB2 = 0.9030(S), Expected = 2.03, Std = 0.3400, ChiSquare = 9.1740e-04 1.M38 HB3 = 0.1110(S), Expected = 1.99, Std = 0.3400, ChiSquare = 3.2674e-08 1.M38 HG3 = 0.6560(S), Expected = 2.39, Std = 0.3800, ChiSquare = 5.0390e-06 1.E48 HA = 5.7250(S), Expected = 4.25, Std = 0.4100, ChiSquare = 3.2122e-04 1.M62 CG = 36.1800(S), Expected = 32.01, Std = 1.2400, ChiSquare = 7.7127e-04