Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.E1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> W 0.14 E 0.14 Q 0.13 K 0.13 C 0.12 H 0.12 R 0.11 M 0.03 I 0.02 C Shift Assignments>> C :: 176.5760 CA :: 57.4880 CB :: 29.4040 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) N Shift Assignments>> N :: 122.8480 Ave N Shift Values>> N :: 120.67(3.48) 1.E2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.14 W 0.14 H 0.14 R 0.14 C 0.13 Q 0.12 K 0.07 M 0.06 I 0.01 HN Overlap>> 1.N64 1.N64 1.N85 1.N85 C Shift Assignments>> C :: 176.5290 CA :: 57.1620 CB :: 30.2040 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 :: 8.2930 HA :: 4.1650 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 :: 121.0450 Ave N Shift Values>> N :: 120.67(3.48) 1.Y3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.48 C 0.3 F 0.2 HN Overlap>> 1.Y68 1.Y68 C Shift Assignments>> C :: 175.8970 CA :: 58.1790 CB :: 38.6000 CD2 :: 133.4510 CE2 :: 118.5260 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 :: 8.0400 HA :: 4.5380 HB2 :: 3.0560 HB3 :: 2.9710 HD2 :: 7.1800 HE2 :: 6.8840 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 :: 121.0000 Ave N Shift Values>> N :: 120.52(4.2) 1.V4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.71 C 0.28 C Shift Assignments>> C :: 176.1430 CA :: 62.8670 CB :: 32.7990 CG1 :: 21.1030 CG2 :: 20.8680 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 :: 7.8560 HA :: 3.9390 HB :: 2.0000 HG11 :: 0.8560 HG12 :: 0.8560 HG13 :: 0.8560 HG21 :: 0.9030 HG22 :: 0.9030 HG23 :: 0.9030 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 :: 121.9000 Ave N Shift Values>> N :: 121.14(4.54) 1.L5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.64 C 0.29 R 0.03 G 0.01 A 0.01 HN Overlap>> 1.A75 1.A75 C Shift Assignments>> C :: 177.7470 CA :: 55.5000 CB :: 42.2520 CG :: 27.0140 CD1 :: 24.8000 CD2 :: 23.7180 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 :: 8.1270 HA :: 4.2430 HB2 :: 1.6540 HB3 :: 1.5850 HG :: 1.6090 HD11 :: 0.9160 HD12 :: 0.9160 HD13 :: 0.9160 HD21 :: 0.8590 HD22 :: 0.8590 HD23 :: 0.8590 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.9500 Ave N Shift Values>> N :: 121.86(3.9) 1.Q6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.31 K 0.27 C 0.24 E 0.06 M 0.06 R 0.03 C Shift Assignments>> C :: 175.8330 CA :: 55.9880 CB :: 29.3750 CG :: 33.7600 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 :: 8.2700 HA :: 4.2860 HB2 :: 2.1270 HB3 :: 1.9930 HG2 :: 2.3790 HE21 :: 7.5110 HE22 :: 6.8470 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 121.4520 NE2 :: 112.2960 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.84 M 0.12 C 0.01 C Shift Assignments>> C :: 177.9290 CA :: 52.7030 CB :: 19.0020 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2270 HA :: 4.3210 HB1 :: 1.3950 HB2 :: 1.3950 HB3 :: 1.3950 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.4660 Ave N Shift Values>> N :: 123.23(3.54) 1.G8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 L 0.1 C 0.03 R 0.01 F 0.01 C Shift Assignments>> C :: 174.2690 CA :: 45.2270 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.2980 HA2 :: 4.0000 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.1930 Ave N Shift Values>> N :: 109.67(3.87) 1.G9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 L 0.15 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 172.9790 CA :: 44.9350 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.1560 HA2 :: 4.4290 HA3 :: 3.8670 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.0730 Ave N Shift Values>> N :: 109.67(3.87) 1.V10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 V 0.44 HN Overlap>> 1.T114 1.T114 C Shift Assignments>> C :: 173.4120 CA :: 60.6630 CB :: 34.8660 CG1 :: 21.2870 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 :: 8.5410 HA :: 4.4160 HB :: 2.0660 HG11 :: 1.0050 HG12 :: 1.0050 HG13 :: 1.0050 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 :: 119.0580 Ave N Shift Values>> N :: 121.14(4.54) 1.L11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.55 C 0.25 A 0.11 G 0.08 C Shift Assignments>> C :: 176.2180 CA :: 53.3410 CB :: 42.7060 CG :: 25.0200 CD1 :: 23.2630 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 :: 8.1510 HA :: 4.7650 HB2 :: 1.4970 HB3 :: 1.1980 HG :: 0.8150 HD11 :: 0.7450 HD12 :: 0.7450 HD13 :: 0.7450 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 :: 125.8000 Ave N Shift Values>> N :: 121.86(3.9) 1.C12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.17 K 0.14 M 0.13 R 0.13 W 0.11 H 0.11 E 0.09 Q 0.05 V 0.03 C Shift Assignments>> C :: 176.6550 CA :: 57.7310 CB :: 31.8650 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.7940 HA :: 4.1070 HB2 :: 3.2590 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 :: 126.8250 Ave N Shift Values>> N :: 120.17(4.64) 1.P13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.72 C 0.27 C Shift Assignments>> C :: 177.5120 CA :: 62.9920 CB :: 32.5670 CG :: 27.0150 CD :: 50.3800 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 :: 4.4200 HB2 :: 2.0330 HG2 :: 1.4660 HD2 :: 3.2430 HD3 :: 2.8600 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.Q14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.17 K 0.15 H 0.14 C 0.12 W 0.1 R 0.09 E 0.08 L 0.06 M 0.03 C Shift Assignments>> C :: 175.5160 CA :: 54.7930 CB :: 28.5470 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.0330 HA :: 4.2750 HB2 :: 2.1210 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 :: 126.8000 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.P15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.42 A 0.23 N 0.15 D 0.05 L 0.02 C 0.02 M 0.01 H 0.01 R 0.01 C Shift Assignments>> CD :: 51.0000 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>> HD2 :: 3.9120 HD3 :: 3.5460 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.G16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.82 L 0.1 C 0.02 R 0.01 F 0.01 C Shift Assignments>> C :: 173.2290 CA :: 45.2540 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 4.0390 HA3 :: 3.7460 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.C17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.21 W 0.16 I 0.15 E 0.1 K 0.08 H 0.07 R 0.07 Q 0.06 V 0.03 M 0.01 C Shift Assignments>> C :: 176.1570 CA :: 60.2680 CB :: 29.3750 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.7200 HA :: 4.5330 HB2 :: 3.0040 HB3 :: 2.5340 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 :: 123.5000 Ave N Shift Values>> N :: 120.17(4.64) 1.G18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.03 HN Overlap>> 1.G119 1.G119 C Shift Assignments>> C :: 174.0800 CA :: 46.0640 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.7560 HA2 :: 4.1390 HA3 :: 3.9270 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.4000 Ave N Shift Values>> N :: 109.67(3.87) 1.M19 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 A 0.32 C Shift Assignments>> C :: 175.6410 CA :: 55.9230 CB :: 33.0910 CG :: 19.0560(A) CE :: 17.1020 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 :: 8.2290 HA :: 4.3430 HB2 :: 2.6540 HB3 :: 2.5250 HG2 :: 2.5790 HE1 :: 2.0620 HE2 :: 2.0620 HE3 :: 2.0620 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 :: 121.3000 Ave N Shift Values>> N :: 120.09(3.57) 1.G20 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 :: 173.7740 CA :: 45.8380 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3470 HA2 :: 4.4170 HA3 :: 3.4950 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.0000 Ave N Shift Values>> N :: 109.67(3.87) 1.L21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.53 G 0.24 C 0.19 A 0.02 C Shift Assignments>> C :: 175.8650 CA :: 54.1900 CB :: 44.0500 CG :: 26.0800 CD1 :: 23.7300 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 :: 8.9350 HA :: 4.6750 HB2 :: 1.7120 HB3 :: 1.3190 HG :: 0.9790 HD11 :: 1.1010 HD12 :: 1.1010 HD13 :: 1.1010 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 :: 126.7250 Ave N Shift Values>> N :: 121.86(3.9) 1.L22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.79 C 0.17 A 0.01 G 0.01 C Shift Assignments>> C :: 176.1620 CA :: 54.3420 CB :: 42.2100 CD1 :: 24.6370 CD2 :: 24.0150 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 :: 8.4810 HA :: 4.6770 HB2 :: 1.6020 HD11 :: 0.9100 HD12 :: 0.9100 HD13 :: 0.9100 HD21 :: 0.8460 HD22 :: 0.8460 HD23 :: 0.8460 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 :: 123.7420 Ave N Shift Values>> N :: 121.86(3.9) 1.V23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.51 C 0.48 HN Overlap>> 1.Y68 1.Y68 C Shift Assignments>> C :: 175.5920 CA :: 60.4600 CB :: 34.1250 CG1 :: 21.9950 CG2 :: 20.4430 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 :: 8.1550 HA :: 4.3970 HB :: 2.0430 HG11 :: 0.8910 HG12 :: 0.8910 HG13 :: 0.8910 HG21 :: 0.8300 HG22 :: 0.8300 HG23 :: 0.8300 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 :: 120.9800 Ave N Shift Values>> N :: 121.14(4.54) 1.E24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.42 C 0.32 K 0.08 M 0.07 Q 0.06 I 0.01 C Shift Assignments>> C :: 175.4270 CA :: 54.5510 CB :: 29.7800 CG :: 36.3210 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 :: 8.9000 HA :: 4.6100 HB2 :: 2.1340 HB3 :: 1.9300 HG2 :: 2.3280 HG3 :: 2.2970 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 :: 126.9500 Ave N Shift Values>> N :: 120.67(3.48) 1.P25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.83 C 0.16 C Shift Assignments>> C :: 177.0130 CA :: 64.4630 CB :: 32.0480 CG :: 27.6000 CD :: 50.7000 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 :: 4.2620 HB2 :: 2.2720 HB3 :: 1.9190 HG2 :: 2.0710 HG3 :: 1.9530 HD2 :: 3.8160 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.D26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 N 0.2 L 0.14 F 0.12 Y 0.11 C 0.07 K 0.01 C Shift Assignments>> C :: 175.1230 CA :: 54.5030 CB :: 40.1230 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 :: 8.4390 HA :: 4.4950 HB2 :: 2.7590 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 115.4590 Ave N Shift Values>> N :: 120.65(3.86) 1.C27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.16 W 0.14 K 0.13 Q 0.12 E 0.11 I 0.09 H 0.09 R 0.08 L 0.02 M 0.01 C Shift Assignments>> C :: 173.8060 CA :: 58.5810 CB :: 28.4500 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.5150 HA :: 4.5700 HB2 :: 2.8880 HB3 :: 2.8060 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 :: 118.7000 Ave N Shift Values>> N :: 120.17(4.64) 1.R28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.51 R 0.23 G 0.13 K 0.11 C Shift Assignments>> C :: 174.9080 CA :: 57.6690 CB :: 32.2740 CG :: 29.0000 CD :: 43.8240 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 :: 4.2650 HB2 :: 2.1350 HB3 :: 1.8790 HG2 :: 1.6760 HD2 :: 3.4910 HD3 :: 3.1700 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.K29 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.48 C 0.47 R 0.02 HN Overlap>> 1.R74 1.R74 C Shift Assignments>> C :: 174.8680 CA :: 56.5540 CB :: 33.1400 CG :: 23.8750 CD :: 29.0050 CE :: 41.1150 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 :: 7.7400 HA :: 4.1700 HB2 :: 1.4300 HG2 :: 0.5370 HD2 :: 0.9790 HE2 :: 2.2040(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 :: 121.0220 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.7 V 0.29 C Shift Assignments>> C :: 173.4020 CA :: 60.7770 CB :: 33.0000 CG1 :: 24.3380 CG2 :: 21.3380 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 :: 8.6470 HA :: 4.1330 HB :: 0.9400 HG11 :: 0.6210 HG12 :: 0.6210 HG13 :: 0.6210 HG21 :: 0.5780 HG22 :: 0.5780 HG23 :: 0.5780 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 128.3620 Ave N Shift Values>> N :: 121.14(4.54) 1.T31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.87 C 0.12 C Shift Assignments>> C :: 174.3390 CA :: 60.8810 CB :: 70.4710 CG2 :: 20.7510 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 :: 8.0870 HA :: 5.0320 HB :: 3.7890 HG21 :: 0.9220 HG22 :: 0.9220 HG23 :: 0.9220 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 :: 119.6670 Ave N Shift Values>> N :: 115.42(4.75) 1.C32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.16 W 0.13 K 0.13 Q 0.12 E 0.1 R 0.1 I 0.09 H 0.09 L 0.03 M 0.01 C Shift Assignments>> C :: 176.7910 CA :: 58.5040 CB :: 28.3110 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.3220 HA :: 4.8020 HB2 :: 3.4640 HB3 :: 3.0420 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 :: 132.5540 Ave N Shift Values>> N :: 120.17(4.64) 1.Q33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 Q 0.26 K 0.26 M 0.07 E 0.03 R 0.02 C Shift Assignments>> C :: 176.8270 CA :: 58.3000 CB :: 29.6640 CG :: 33.3090 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.8560 HA :: 4.0000 HB2 :: 1.9720 HG2 :: 2.3260 HE21 :: 7.5330 HE22 :: 6.8650 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 125.8900 NE2 :: 111.9370 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.N34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.51 D 0.18 C 0.08 F 0.06 Y 0.06 L 0.05 C Shift Assignments>> C :: 174.0490 CA :: 53.0470 CB :: 38.9160 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 :: 8.9130 HA :: 4.8870 HB2 :: 3.0100 HB3 :: 2.7370 HD21 :: 7.6840 HD22 :: 6.9790 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 :: 115.3420 ND2 :: 113.3250 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.G35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.04 C Shift Assignments>> C :: 174.1100 CA :: 46.3860 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.1620 HA2 :: 4.3340 HA3 :: 3.9760 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.0980 Ave N Shift Values>> N :: 109.67(3.87) 1.C36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 V 0.2 K 0.11 W 0.1 R 0.07 M 0.06 H 0.05 E 0.05 Q 0.03 P 0.02 C Shift Assignments>> C :: 177.3550 CA :: 59.9880 CB :: 32.3650 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.8000 HA :: 4.7640 HB2 :: 3.1800 HB3 :: 2.8800 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 :: 132.5460 Ave N Shift Values>> N :: 120.17(4.64) 1.G37 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 :: 173.4040 CA :: 45.8630 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.8200 HA2 :: 4.2010 HA3 :: 3.5720 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.8510 Ave N Shift Values>> N :: 109.67(3.87) 1.Y38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.69 C 0.3 C Shift Assignments>> C :: 173.6610 CA :: 59.1800 CB :: 40.1080 CD1 :: 132.8260 CE1 :: 117.9960 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.0540 HA :: 4.4780 HB2 :: 3.5980 HB3 :: 2.7490 HD1 :: 7.0380 HE1 :: 6.6480 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 :: 125.5320 Ave N Shift Values>> N :: 120.52(4.2) 1.V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.56 C 0.43 C Shift Assignments>> C :: 175.8760 CA :: 60.7970 CB :: 32.6100 CG1 :: 21.0700 CG2 :: 21.0700 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 :: 7.2380 HA :: 4.8180 HB :: 1.7460 HG11 :: 0.9050 HG12 :: 0.9050 HG13 :: 0.9050 HG21 :: 0.9110 HG22 :: 0.9110 HG23 :: 0.9110 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 :: 124.4610 Ave N Shift Values>> N :: 121.14(4.54) 1.F40 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.73 C 0.24 G 0.02 C Shift Assignments>> C :: 173.2420 CA :: 55.2100 CB :: 42.0900 CD2 :: 133.1570 CE2 :: 130.6100 CZ :: 118.1230(S) 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 :: 9.4240 HA :: 5.2730 HB2 :: 2.7640 HB3 :: 2.4960 HD2 :: 6.9040 HE2 :: 7.1060 HZ :: 6.7440 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 :: 124.5880 Ave N Shift Values>> N :: 120.45(4.18) 1.C41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.18 K 0.17 M 0.14 R 0.1 H 0.09 W 0.08 Q 0.08 E 0.06 V 0.04 C Shift Assignments>> C :: 177.1650 CA :: 57.6910 CB :: 32.4750 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.6730 HA :: 4.9020 HB2 :: 3.6530 HB3 :: 2.5360 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 :: 120.2210 Ave N Shift Values>> N :: 120.17(4.64) 1.R42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 R 0.4 G 0.11 K 0.01 C Shift Assignments>> C :: 175.0120 CA :: 58.6860 CB :: 30.9000 CG :: 26.8090 CD :: 43.7730 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 :: 9.5340 HA :: 4.0210 HB2 :: 1.9880 HB3 :: 1.6870 HG2 :: 1.8450 HG3 :: 1.5910 HD2 :: 3.1310 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 :: 129.3470 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.N43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.2 Y 0.2 D 0.18 N 0.13 C 0.12 L 0.1 I 0.02 C Shift Assignments>> C :: 175.6560 CA :: 55.7780 CB :: 39.4750 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 :: 8.8400 HA :: 4.7080 HB2 :: 2.9690 HB3 :: 2.7560 HD21 :: 7.8190 HD22 :: 7.0270 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 :: 117.7720 ND2 :: 113.6410 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.C44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.19 K 0.16 M 0.12 R 0.11 W 0.09 H 0.09 E 0.07 Q 0.06 V 0.06 C Shift Assignments>> C :: 175.7030 CA :: 58.1120 CB :: 32.3590 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8680 HA :: 5.0280 HB2 :: 3.4130 HB3 :: 3.0590 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 :: 115.8760 Ave N Shift Values>> N :: 120.17(4.64) 1.L45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.82 L 0.14 A 0.02 C Shift Assignments>> C :: 175.7220 CA :: 57.0090 CB :: 38.4120 CG :: 25.3780 CD1 :: 22.8620 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 :: 8.5140 HA :: 4.3130 HB2 :: 2.1310 HB3 :: 1.6490 HG :: 0.9430 HD11 :: 0.9060 HD12 :: 0.9060 HD13 :: 0.9060 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 :: 120.0820 Ave N Shift Values>> N :: 121.86(3.9) 1.Q46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.31 C 0.23 M 0.2 K 0.14 E 0.1 C Shift Assignments>> C :: 175.2990 CA :: 54.0170 CB :: 30.3070 CG :: 34.3230 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 :: 8.2480 HA :: 4.7760 HB2 :: 2.4320 HB3 :: 2.4320 HG2 :: 2.5210 HG3 :: 2.5210 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 :: 117.5790 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.G47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.03 C Shift Assignments>> C :: 173.6930 CA :: 46.1800 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.6950 HA2 :: 4.0140 HA3 :: 3.8550 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.1070 Ave N Shift Values>> N :: 109.67(3.87) 1.Y48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.54 C 0.45 C Shift Assignments>> C :: 172.8600 CA :: 62.9870 CB :: 38.0520 CD1 :: 132.0220 CE1 :: 118.7540 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 :: 7.9230 HA :: 3.6580 HB2 :: 2.5580 HB3 :: 2.4650 HD1 :: 6.7800 HE1 :: 6.5220 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 :: 122.5140 Ave N Shift Values>> N :: 120.52(4.2) 1.H49 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.53 W 0.35 H 0.11 C Shift Assignments>> C :: 173.2350 CA :: 51.4310 CB :: 31.9000 CD2 :: 127.1510 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 :: 5.2910(S) HA :: 4.7080 HB2 :: 3.1090 HB3 :: 2.9850 HD2 :: 6.8160 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 :: 120.0800 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.I50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 I 0.14 C Shift Assignments>> C :: 178.2080 CA :: 60.8770 CB :: 39.0340 CG1 :: 26.7490 CD1 :: 18.0990 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 :: 8.4180 HA :: 4.1160 HB :: 1.9260 HG12 :: 1.3550 HD11 :: 0.9350 HD12 :: 0.9350 HD13 :: 0.9350 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 :: 117.8100 Ave N Shift Values>> N :: 121.46(4.28) 1.G51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.83 L 0.1 C 0.02 R 0.01 F 0.01 C Shift Assignments>> C :: 173.5650 CA :: 45.2580 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.6540 HA2 :: 4.1070 HA3 :: 3.9150 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.3870 Ave N Shift Values>> N :: 109.67(3.87) 1.E52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.41 C 0.34 M 0.12 Q 0.05 K 0.04 I 0.02 C Shift Assignments>> C :: 176.8990 CA :: 56.4330 CB :: 30.4700 CG :: 36.3250 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 :: 8.3910 HA :: 4.2890 HB2 :: 2.0660 HB3 :: 1.8790 HG2 :: 2.3550 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 :: 119.0980 Ave N Shift Values>> N :: 120.67(3.48) 1.C53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.22 W 0.16 E 0.11 R 0.1 V 0.09 H 0.08 K 0.05 Q 0.05 I 0.03 M 0.03 P 0.01 C Shift Assignments>> C :: 175.4610 CA :: 59.8350 CB :: 30.7610 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.4740 HA :: 3.7660 HB2 :: 2.8060 HB3 :: 2.6770 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 :: 122.8450 Ave N Shift Values>> N :: 120.17(4.64) 1.L54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 K 0.15 C 0.12 A 0.1 C Shift Assignments>> C :: 175.2590 CA :: 52.8350 CB :: 41.4360 CD1 :: 23.1690 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 :: 8.4180 HA :: 4.5040 HB2 :: 1.4870 HB3 :: 1.4300 HD11 :: 0.8160 HD12 :: 0.8160 HD13 :: 0.8160 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.4030 Ave N Shift Values>> N :: 121.86(3.9) 1.P55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.73 C 0.26 C Shift Assignments>> C :: 177.0060 CA :: 63.0960 CB :: 32.0720 CG :: 27.4360 CD :: 50.4000 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 :: 4.3700 HB2 :: 2.2630 HB3 :: 1.8780 HG2 :: 1.9870 HD2 :: 3.7550 HD3 :: 3.5770 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.E56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.39 C 0.34 M 0.09 K 0.06 Q 0.06 I 0.03 C Shift Assignments>> C :: 177.2020 CA :: 57.0340 CB :: 30.2630 CG :: 36.2190 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 :: 8.5680 HA :: 4.2250 HB2 :: 2.2640 HG2 :: 2.4160 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 :: 121.5740 Ave N Shift Values>> N :: 120.67(3.48) 1.G57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 174.5790 CA :: 45.4620 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5150 HA2 :: 4.0150 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.4950 Ave N Shift Values>> N :: 109.67(3.87) 1.T58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.3330 CA :: 62.2330 CB :: 69.8330 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 :: 8.0900 HA :: 4.3980 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 :: 113.2340 Ave N Shift Values>> N :: 115.42(4.75) 1.G59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 174.0480 CA :: 45.4390 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5240 HA2 :: 3.9860 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.4790 Ave N Shift Values>> N :: 109.67(3.87) 1.A60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.85 M 0.11 C 0.01 HN Overlap>> 1.I88 1.I88 1.A83 1.A83 C Shift Assignments>> C :: 177.9420 CA :: 52.7300 CB :: 19.1420 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1790 HA :: 4.2510 HB1 :: 1.2860 HB2 :: 1.2860 HB3 :: 1.2860 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.9190 Ave N Shift Values>> N :: 123.23(3.54) 1.S61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.4260 CA :: 58.2890 CB :: 63.7720 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.3050 HA :: 4.4480 HB2 :: 3.8890 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 :: 114.9040 Ave N Shift Values>> N :: 116.28(3.52) 1.A62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.86 M 0.11 C 0.01 HN Overlap>> 1.D71 1.D71 C Shift Assignments>> C :: 177.9840 CA :: 52.6550 CB :: 19.1380 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3450 HA :: 4.3990 HB1 :: 1.4190 HB2 :: 1.4190 HB3 :: 1.4190 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.9650 Ave N Shift Values>> N :: 123.23(3.54) 1.T63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.91 C 0.08 C Shift Assignments>> C :: 174.4200 CA :: 61.9880 CB :: 69.6880 CG2 :: 20.8510 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 :: 8.1180 HB :: 4.7940 HG21 :: 1.2790 HG22 :: 1.2790 HG23 :: 1.2790 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 112.7900 Ave N Shift Values>> N :: 115.42(4.75) 1.N64 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Consistent HN Overlap>> 1.E2 1.N85 1.E2 1.N85 H Shift Assignments>> H :: 8.3960 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 :: 121.0500 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.S65 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.C66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.16 W 0.13 I 0.12 R 0.11 K 0.11 Q 0.11 E 0.09 H 0.08 L 0.03 M 0.01 C Shift Assignments>> C :: 174.4890 CA :: 58.7130 CB :: 28.1020 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> HA :: 4.5780 HB2 :: 2.8850 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.E67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.15 R 0.14 E 0.14 W 0.14 C 0.12 Q 0.12 M 0.07 K 0.06 C Shift Assignments>> C :: 175.9540 CA :: 56.8020 CB :: 30.3280 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 :: 8.4150 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 123.0210 Ave N Shift Values>> N :: 120.67(3.48) 1.Y68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.63 C 0.36 HN Overlap>> 1.V23 1.Y3 1.V23 1.Y3 C Shift Assignments>> C :: 175.6130 CA :: 57.6690 CB :: 38.8250 CD1 :: 133.1730 CE1 :: 118.2050 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 :: 8.1350 HA :: 4.6540 HB2 :: 3.0630 HB3 :: 2.9530 HD1 :: 7.1030 HE1 :: 6.8120 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 :: 121.0150 Ave N Shift Values>> N :: 120.52(4.2) 1.T69 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 :: 173.8460 CA :: 61.7300 CB :: 69.9140 CG2 :: 21.3350 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 :: 8.0600 HA :: 4.3060 HB :: 4.1040 HG21 :: 1.1560 HG22 :: 1.1560 HG23 :: 1.1560 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.9750 Ave N Shift Values>> N :: 115.42(4.75) 1.V70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.61 C 0.37 C Shift Assignments>> C :: 175.2750 CA :: 61.8530 CB :: 32.9760 CG1 :: 20.6880 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 :: 8.0890 HA :: 4.0530 HB :: 2.0240 HG11 :: 0.8910 HG12 :: 0.8910 HG13 :: 0.8910 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 :: 122.9000 Ave N Shift Values>> N :: 121.14(4.54) 1.D71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.38 L 0.2 N 0.19 K 0.06 C 0.05 F 0.04 Y 0.02 R 0.01 HN Overlap>> 1.A62 1.A62 C Shift Assignments>> CA :: 51.5780 CB :: 41.5380 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 :: 8.3970 HA :: 4.8500 HB2 :: 2.7860 HB3 :: 2.5890 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 :: 125.9240 Ave N Shift Values>> N :: 120.65(3.86) 1.P72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.79 C 0.2 C Shift Assignments>> C :: 177.3520 CA :: 63.9100 CB :: 32.2680 CG :: 26.9490 CD :: 50.9600 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 :: 4.3860 HB2 :: 2.2790 HB3 :: 1.9460 HG2 :: 1.9990 HG3 :: 1.9490 HD2 :: 3.8800 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.N73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.44 D 0.17 C 0.1 Y 0.1 F 0.09 L 0.05 M 0.01 C Shift Assignments>> C :: 175.5320 CA :: 53.8240 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 :: 8.4960 HA :: 4.6770 HB2 :: 2.8540 HB3 :: 2.7690 HD21 :: 7.8300 HD22 :: 6.9740 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 :: 117.0350 ND2 :: 114.3090 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.R74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.15 H 0.15 E 0.13 W 0.13 C 0.12 Q 0.11 M 0.09 K 0.07 HN Overlap>> 1.K29 1.K29 C Shift Assignments>> C :: 176.2430 CA :: 56.4040 CB :: 30.6370 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 :: 7.8040 HA :: 4.2440 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 121.0000 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.A75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.83 M 0.13 C 0.01 HN Overlap>> 1.L5 1.L5 C Shift Assignments>> C :: 177.8310 CA :: 52.9570 CB :: 19.0590 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1890 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.8800 Ave N Shift Values>> N :: 123.23(3.54) 1.A76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.84 M 0.12 C 0.01 C Shift Assignments>> C :: 178.0240 CA :: 52.7890 CB :: 19.0420 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1690 HA :: 4.2470 HB1 :: 1.3870 HB2 :: 1.3870 HB3 :: 1.3870 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.6140 Ave N Shift Values>> N :: 123.23(3.54) 1.E77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.4 C 0.33 M 0.1 K 0.06 Q 0.06 I 0.02 C Shift Assignments>> C :: 176.2660 CA :: 56.5760 CB :: 30.3070 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 :: 8.1840 HA :: 4.1890 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 :: 119.5000 Ave N Shift Values>> N :: 120.67(3.48) 1.A78 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 :: 177.4880 CA :: 52.5090 CB :: 19.1610 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1350 HA :: 4.2500 HB1 :: 1.2940 HB2 :: 1.2940 HB3 :: 1.2940 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.6430 Ave N Shift Values>> N :: 123.23(3.54) 1.R79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.5 C 0.37 G 0.06 K 0.05 C Shift Assignments>> C :: 176.2970 CA :: 55.9330 CB :: 30.8500 CG :: 26.9610 CD :: 43.2880 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 :: 8.1350 HA :: 4.2930 HB2 :: 1.7450 HB3 :: 1.6690 HG2 :: 1.4870 HG3 :: 1.5050 HD2 :: 3.1120 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 :: 120.0030 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.W80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 W 0.3 C Shift Assignments>> C :: 175.8560 CA :: 57.4040 CB :: 29.4370 CD1 :: 124.8070 CE3 :: 120.8910 CZ2 :: 114.5400 CZ3 :: 122.0840 CH2 :: 127.1300 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 :: 8.1590 HA :: 4.6630 HB2 :: 3.3130 HB3 :: 3.2400 HD1 :: 7.2640 HE1 :: 10.1350 HE3 :: 7.6320 HZ2 :: 7.4920 HZ3 :: 7.1590 HH2 :: 7.2600 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 :: 122.2800 NE1 :: 129.4170 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.D81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 L 0.2 N 0.14 F 0.08 K 0.07 Y 0.06 C 0.05 HN Overlap>> 1.E82 1.E82 C Shift Assignments>> C :: 176.1840 CA :: 53.8990 CB :: 40.9480 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 :: 8.1350 HA :: 4.4950 HB2 :: 2.5040 HB3 :: 2.4310 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 :: 121.9800 Ave N Shift Values>> N :: 120.65(3.86) 1.E82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.4 C 0.35 M 0.08 K 0.06 Q 0.05 I 0.04 HN Overlap>> 1.D81 1.D81 C Shift Assignments>> C :: 176.7200 CA :: 57.1690 CB :: 30.1560 CG :: 36.2890 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 :: 8.1530 HA :: 4.0900 HB2 :: 2.0420 HB3 :: 1.9440 HG2 :: 2.2530 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 :: 121.9900 Ave N Shift Values>> N :: 120.67(3.48) 1.A83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.82 M 0.14 C 0.01 HN Overlap>> 1.I88 1.A60 1.I88 1.A60 C Shift Assignments>> C :: 178.0950 CA :: 53.0170 CB :: 19.0860 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2430 HA :: 4.2800 HB1 :: 1.3950 HB2 :: 1.3950 HB3 :: 1.3950 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.9000 Ave N Shift Values>> N :: 123.23(3.54) 1.S84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.3380 CA :: 58.5460 CB :: 63.7840 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.0630 HA :: 4.3870 HB2 :: 3.8500 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 :: 113.8810 Ave N Shift Values>> N :: 116.28(3.52) 1.N85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 D 0.18 C 0.09 Y 0.08 F 0.08 L 0.05 HN Overlap>> 1.N64 1.E2 1.N64 1.E2 C Shift Assignments>> C :: 175.0460 CA :: 53.4450 CB :: 38.8470 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 :: 8.3910 HA :: 4.7060 HB2 :: 2.8420 HB3 :: 2.7620 HD21 :: 7.5820 HD22 :: 6.8700 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 :: 121.0320 ND2 :: 112.8690 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V86 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>> C :: 176.2130 CA :: 62.4490 CB :: 32.8650 CG1 :: 20.6050 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 :: 7.9540 HA :: 4.1930 HB :: 2.1140 HG11 :: 0.9280 HG12 :: 0.9280 HG13 :: 0.9280 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 :: 119.4630 Ave N Shift Values>> N :: 121.14(4.54) 1.T87 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 :: 174.3610 CA :: 62.0650 CB :: 69.7290 CG2 :: 21.5370 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 :: 8.2250 HA :: 4.3530 HB :: 4.2640 HG21 :: 1.1960 HG22 :: 1.1960 HG23 :: 1.1960 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 :: 118.2260 Ave N Shift Values>> N :: 115.42(4.75) 1.I88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.65 C 0.34 HN Overlap>> 1.A60 1.A83 1.A60 1.A83 C Shift Assignments>> C :: 175.7740 CA :: 60.8190 CB :: 38.7190 CG1 :: 27.3510 CG2 :: 17.4780 CD1 :: 12.8120 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 :: 8.1480 HA :: 4.1880 HB :: 1.8590 HG12 :: 1.4730 HG13 :: 1.1790 HG21 :: 0.8960 HG22 :: 0.8960 HG23 :: 0.8960 HD11 :: 0.8450 HD12 :: 0.8450 HD13 :: 0.8450 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 :: 123.9100 Ave N Shift Values>> N :: 121.46(4.28) 1.K89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.49 C 0.38 R 0.11 C Shift Assignments>> C :: 176.2410 CA :: 55.9370 CB :: 33.1640 CG :: 24.8130 CD :: 29.0460 CE :: 42.1770 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 :: 8.4060 HA :: 4.4340 HB2 :: 1.8340 HB3 :: 1.7690 HG2 :: 1.4480 HG3 :: 1.3830 HD2 :: 1.6750 HE2 :: 2.9900 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 :: 126.4530 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V90 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 :: 62.3030 CB :: 33.1320 CG1 :: 21.3700 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 :: 8.3120 HA :: 4.2800 HB :: 2.1660 HG11 :: 1.0020 HG12 :: 1.0020 HG13 :: 1.0020 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 :: 122.4960 Ave N Shift Values>> N :: 121.14(4.54) 1.S91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 173.8340 CA :: 58.6500 CB :: 64.1520 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 :: 4.0780 HB3 :: 4.0010 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.T92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.76 C 0.23 C Shift Assignments>> C :: 173.9790 CA :: 60.4120 CB :: 71.8960 CG2 :: 21.6810 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 :: 7.8330 HA :: 5.4460 HB :: 3.9620 HG21 :: 1.1330 HG22 :: 1.1330 HG23 :: 1.1330 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 :: 114.7060 Ave N Shift Values>> N :: 115.42(4.75) 1.K93 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.49 C 0.4 K 0.08 G 0.01 C Shift Assignments>> C :: 173.5890 CA :: 54.3750 CB :: 36.9250 CG :: 26.6100 CD :: 29.5240 CE :: 42.1400 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 :: 8.9370 HA :: 4.7090 HB2 :: 1.4590 HB3 :: 1.3530 HG2 :: 1.0890 HG3 :: 0.7820 HD2 :: 1.0050 HD3 :: -0.0880(S) HE2 :: 2.4040 HE3 :: 1.9850(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 :: 122.4920 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.56 P 0.43 C Shift Assignments>> C :: 175.2380 CA :: 60.9230 CB :: 31.0860 CG :: 26.8910 CD :: 50.0630 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 :: 4.2670 HB2 :: 1.8260 HB3 :: 1.3200 HG2 :: 1.9370 HG3 :: 1.8310 HD2 :: 3.6990 HD3 :: 3.4080 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.C95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent 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>> C :: 176.7700 CA :: 57.0160 CB :: 31.6980 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.7680 HA :: 3.4300 HB2 :: 3.0910 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 :: 125.4220 Ave N Shift Values>> N :: 120.17(4.64) 1.P96 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 :: 173.6080 CA :: 64.2130 CB :: 32.4490 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 :: 3.8580 HB2 :: 2.2070 HB3 :: 1.4950 HG2 :: 1.4270 HG3 :: 1.2910 HD2 :: 2.0780(S) HD3 :: 1.7300(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.K97 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.44 C 0.43 R 0.11 C Shift Assignments>> C :: 176.8870 CA :: 57.6870 CB :: 33.1240 CG :: 24.9480 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 :: 8.3900 HA :: 3.9700 HB2 :: 1.4310 HB3 :: 0.3490(S) HG2 :: 0.8470 HG3 :: 0.7900 HD2 :: 1.6340 HD3 :: 1.3260 HE2 :: 2.7790 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 :: 118.6000 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.C98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.21 W 0.15 R 0.11 E 0.11 H 0.09 V 0.08 K 0.08 M 0.06 Q 0.05 I 0.01 C Shift Assignments>> C :: 176.6500 CA :: 59.3480 CB :: 31.1960 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.3570 HA :: 4.7460 HB2 :: 3.1760 HB3 :: 2.8930 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 :: 118.9500 Ave N Shift Values>> N :: 120.17(4.64) 1.R99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.31 K 0.13 R 0.05 G 0.01 C Shift Assignments>> C :: 175.2530 CA :: 56.9000 CB :: 26.0410 CG :: 26.7210 CD :: 42.2210 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 :: 8.0650 HA :: 3.9680 HB2 :: 2.1600 HB3 :: 1.9610 HG2 :: 1.4670 HG3 :: 1.3350 HD2 :: 3.0060 HD3 :: 2.9650 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 :: 117.2000 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.T100 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>> C :: 173.7020 CA :: 63.1940 CB :: 68.9330 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 :: 8.6430 HA :: 4.3710 HB :: 4.0240 HG21 :: 1.2760 HG22 :: 1.2760 HG23 :: 1.2760 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 :: 122.4000 Ave N Shift Values>> N :: 115.42(4.75) 1.P101 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 :: 176.2150 CA :: 64.1970 CB :: 32.0440 CG :: 27.9010 CD :: 51.9960 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 :: 4.1470 HB2 :: 2.2010 HB3 :: 1.9410 HG2 :: 2.1990 HG3 :: 1.9410 HD2 :: 4.2200 HD3 :: 3.7780 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.T102 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 :: 172.1330 CA :: 62.5660 CB :: 71.5620 CG2 :: 21.1930 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 :: 9.1160 HA :: 4.6650 HB :: 4.6930 HG21 :: 1.5500 HG22 :: 1.5500 HG23 :: 1.5500 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 :: 122.9320 Ave N Shift Values>> N :: 115.42(4.75) 1.E103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 E 0.3 M 0.24 C Shift Assignments>> C :: 175.2920 CA :: 55.0490 CB :: 31.8610 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 :: 8.7200 HA :: 4.9420 HB2 :: 1.9880 HB3 :: 1.8770 HG2 :: 2.2620 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 :: 126.3900 Ave N Shift Values>> N :: 120.67(3.48) 1.R104 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.49 C 0.36 K 0.07 G 0.05 C Shift Assignments>> C :: 175.2890 CA :: 55.8560 CB :: 30.6750 CG :: 26.6280 CD :: 43.2350 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 :: 8.1570 HA :: 3.7110 HB2 :: 0.8680(S) HB3 :: 0.1830(S) HG2 :: 0.7690 HG3 :: 0.6000 HD2 :: 1.6330(S) HD3 :: 1.6330(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 :: 123.5050 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.D105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.36 L 0.22 N 0.14 K 0.08 F 0.06 C 0.05 Y 0.04 R 0.01 C Shift Assignments>> C :: 176.0200 CA :: 52.9520 CB :: 41.4000 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 :: 8.4760 HA :: 4.6410 HB2 :: 2.6330 HB3 :: 2.4660 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 :: 126.8000 Ave N Shift Values>> N :: 120.65(3.86) 1.G106 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 :: 174.0730 CA :: 45.8320 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.0560 HA2 :: 3.8530 HA3 :: 3.7380 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.2620 Ave N Shift Values>> N :: 109.67(3.87) 1.G107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.83 L 0.1 C 0.02 R 0.01 F 0.01 C Shift Assignments>> C :: 174.0200 CA :: 45.2670 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3800 HA2 :: 3.9400 HA3 :: 3.6570 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.C108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.18 I 0.17 W 0.12 R 0.11 K 0.09 Q 0.09 E 0.08 H 0.07 L 0.03 C Shift Assignments>> C :: 174.8550 CA :: 59.2910 CB :: 28.0000 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8320 HA :: 3.9970 HB2 :: 2.8220 HB3 :: 2.6920 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 :: 120.6280 Ave N Shift Values>> N :: 120.17(4.64) 1.M109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.33 C 0.33 A 0.33 C Shift Assignments>> C :: 174.6580 CA :: 54.9700 CB :: 34.1000 CG :: 33.6120 CE :: 18.2190 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 :: 8.9160 HA :: 4.5510 HB2 :: 3.0380 HB3 :: 2.7100 HG2 :: 2.8370 HG3 :: 2.7000 HE1 :: 1.9480 HE2 :: 1.9480 HE3 :: 1.9480 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.9470 Ave N Shift Values>> N :: 120.09(3.57) 1.H110 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> W 0.47 C 0.38 H 0.13 C Shift Assignments>> C :: 172.4430 CA :: 53.8120 CB :: 28.9000 CD2 :: 113.6740 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 :: 7.5570 HA :: 3.6790 HB2 :: 2.6090 HB3 :: 1.1120(S) HD2 :: 5.7510 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 :: 120.4900 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.M111 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.48 C 0.4 M 0.11 HN Overlap>> 1.R115 1.R115 C Shift Assignments>> C :: 175.4790 CA :: 52.5890 CB :: 28.0740 CG :: 30.5770 CE :: 16.0790 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 :: 9.0870 HA :: 4.3200 HB2 :: 0.8910(S) HB3 :: 0.1140(S) HG2 :: 1.9970 HG3 :: 0.6410(S) HE1 :: 1.6700 HE2 :: 1.6700 HE3 :: 1.6700 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 :: 128.8000 Ave N Shift Values>> N :: 120.09(3.57) 1.V112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.57 C 0.42 C Shift Assignments>> C :: 175.4760 CA :: 61.3800 CB :: 33.0890 CG1 :: 20.6120 CG2 :: 20.1650 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 :: 8.0160 HA :: 4.7940 HB :: 1.7520 HG11 :: 0.7180 HG12 :: 0.7180 HG13 :: 0.7180 HG21 :: 0.3820 HG22 :: 0.3820 HG23 :: 0.3820 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 :: 122.2000 Ave N Shift Values>> N :: 121.14(4.54) 1.C113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.33 C 0.23 P 0.19 W 0.07 K 0.03 R 0.03 E 0.02 H 0.02 M 0.01 I 0.01 C Shift Assignments>> C :: 177.8330 CA :: 61.5710 CB :: 32.0450 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.9890 HA :: 4.5950 HB2 :: 3.4880 HB3 :: 3.3420 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 :: 130.3530 Ave N Shift Values>> N :: 120.17(4.64) 1.T114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.89 C 0.1 HN Overlap>> 1.V10 1.V10 C Shift Assignments>> C :: 175.2640 CA :: 61.6440 CB :: 69.4000 CG2 :: 21.6300 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 :: 8.5330 HA :: 4.3930 HB :: 4.6180 HG21 :: 1.3260 HG22 :: 1.3260 HG23 :: 1.3260 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 :: 119.0000 Ave N Shift Values>> N :: 115.42(4.75) 1.R115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.46 C 0.39 K 0.07 G 0.05 L 0.01 HN Overlap>> 1.M111 1.M111 C Shift Assignments>> C :: 177.7820 CA :: 56.9500 CB :: 30.0500 CG :: 26.8810 CD :: 43.1980 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 :: 9.0360 HA :: 4.2250 HB2 :: 2.1340 HB3 :: 1.8390 HG2 :: 1.7510 HD2 :: 3.3040 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 :: 128.9000 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.A116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 M 0.43 C 0.01 I 0.01 C Shift Assignments>> C :: 178.7570 CA :: 53.9290 CB :: 17.7100 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.0420 HA :: 4.1460 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 :: 133.1520 Ave N Shift Values>> N :: 123.23(3.54) 1.G117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 173.5580 CA :: 45.4360 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.8300 HA2 :: 4.1430 HA3 :: 3.7330 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.C118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.23 W 0.17 E 0.1 I 0.1 V 0.09 R 0.08 H 0.07 Q 0.05 K 0.04 M 0.02 P 0.02 C Shift Assignments>> C :: 176.5910 CA :: 60.4990 CB :: 30.1740 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.0420 HA :: 4.6220 HB2 :: 3.1740 HB3 :: 2.4970 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 :: 123.0400 Ave N Shift Values>> N :: 120.17(4.64) 1.G119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.03 HN Overlap>> 1.G18 1.G18 C Shift Assignments>> C :: 173.7160 CA :: 46.0080 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.7050 HA2 :: 4.2380 HA3 :: 4.0840 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.5000 Ave N Shift Values>> N :: 109.67(3.87) 1.F120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.47 Y 0.36 C 0.15 C Shift Assignments>> C :: 174.4470 CA :: 59.9460 CB :: 41.3000 CD1 :: 132.1810 CE1 :: 131.2350 CZ :: 129.0510 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 :: 8.9470 HA :: 4.5800 HB2 :: 3.3680 HB3 :: 3.0510 HD1 :: 7.3560 HE1 :: 7.1650 HZ :: 7.3160 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 :: 124.9490 Ave N Shift Values>> N :: 120.45(4.18) 1.E121 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.43 E 0.34 M 0.2 C Shift Assignments>> C :: 176.0670 CA :: 54.6240 CB :: 31.2550 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 :: 7.7990 HA :: 5.7210(S) HB2 :: 2.1630 HB3 :: 1.8890 HG2 :: 2.6120 HG3 :: 2.2500 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 :: 125.2720 Ave N Shift Values>> N :: 120.67(3.48) 1.W122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.5 C 0.49 C Shift Assignments>> C :: 172.8440 CA :: 53.7710 CB :: 31.7360 CD1 :: 124.7070 CE3 :: 121.0500 CZ2 :: 113.4410 CZ3 :: 120.0910 CH2 :: 125.2870 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 :: 9.3000 HA :: 5.5060 HB2 :: 3.0990 HB3 :: 3.0570 HD1 :: 7.2320 HE1 :: 10.0360 HE3 :: 7.5320 HZ2 :: 7.4900 HZ3 :: 6.7980 HH2 :: 7.0220 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 :: 121.5240 NE1 :: 131.6300 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.C123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.19 K 0.18 M 0.15 Q 0.12 R 0.08 H 0.07 W 0.06 V 0.05 E 0.04 C Shift Assignments>> C :: 177.2130 CA :: 57.7760 CB :: 32.9300 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.7520 HA :: 5.4160 HB2 :: 3.5210 HB3 :: 3.1700 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 :: 120.8680 Ave N Shift Values>> N :: 120.17(4.64) 1.W124 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 176.0510 CA :: 60.7630 CB :: 31.1260 CD1 :: 126.2300 CE3 :: 126.2660 CZ2 :: 114.5400 CZ3 :: 128.6670(S) CH2 :: 122.5310 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 :: 9.8090 HA :: 4.4270 HB2 :: 3.4480 HB3 :: 3.4010 HD1 :: 6.9920 HE1 :: 10.2260 HE3 :: 7.3940 HZ2 :: 7.5040 HZ3 :: 7.2360 HH2 :: 7.1110 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 :: 131.2090 NE1 :: 128.2170 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.V125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.89 C 0.1 C Shift Assignments>> C :: 178.9430 CA :: 65.6020 CB :: 33.1720 CG1 :: 22.5500 CG2 :: 21.1590 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 :: 8.6270 HA :: 3.6240 HB :: 1.5580 HG11 :: 1.0370 HG12 :: 1.0370 HG13 :: 1.0370 HG21 :: 0.6770 HG22 :: 0.6770 HG23 :: 0.6770 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 :: 118.2330 Ave N Shift Values>> N :: 121.14(4.54) 1.C126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.15 M 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>> CA :: 56.9990 CB :: 31.8700 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 :: 3.4310 HB2 :: 3.0990 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.Q127 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.T128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.69 C 0.29 C Shift Assignments>> C :: 173.3510 CA :: 59.1760 CB :: 71.7750 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>> HA :: 4.6850 HB :: 4.4560 HG21 :: 1.1820 HG22 :: 1.1820 HG23 :: 1.1820 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.E129 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 0.08 I 0.02 C Shift Assignments>> C :: 175.5390 CA :: 57.0150 CB :: 29.9650 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 :: 8.9120 HA :: 4.2930 HB2 :: 2.2310 HB3 :: 2.0800 HG2 :: 2.3990 HG3 :: 2.3470 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 :: 120.9400 Ave N Shift Values>> N :: 120.67(3.48) 1.W130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.96 W 0.03 C Shift Assignments>> C :: 175.4080 CA :: 58.2200 CB :: 29.5000 CD1 :: 122.0840 CE3 :: 121.1690 CZ2 :: 114.4520 CZ3 :: 124.8810 CH2 :: 125.9220 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 :: 4.2930 HB2 :: 2.7750 HB3 :: 2.6460 HD1 :: 7.1800 HE1 :: 10.2780 HE3 :: 7.7390 HZ2 :: 7.5330 HZ3 :: 7.2660 HH2 :: 7.2090 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 :: 126.9980 NE1 :: 128.4420 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.T131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.39 T 0.36 C 0.14 L 0.06 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 :: 4.4440 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.R132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.44 C 0.42 K 0.06 G 0.04 L 0.02 C Shift Assignments>> C :: 178.0530 CA :: 58.0880 CB :: 29.4260 CG :: 27.2400 CD :: 43.1690 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 :: 3.7730 HB2 :: 1.7730 HG2 :: 1.6090 HD2 :: 3.1830 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.D133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.25 Y 0.23 D 0.15 L 0.12 C 0.11 N 0.04 I 0.04 K 0.03 C Shift Assignments>> C :: 178.1970 CA :: 56.8020 CB :: 40.1820 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 :: 7.7180 HA :: 4.2150 HB2 :: 2.5120 HB3 :: 2.4180 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 :: 119.9000 Ave N Shift Values>> N :: 120.65(3.86) 1.C134 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 0.11 W 0.03 C Shift Assignments>> CA :: 64.5330 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 :: 6.9530 HA :: 3.3670 HB2 :: 2.6800 HB3 :: 1.4290 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 :: 121.0000 Ave N Shift Values>> N :: 120.17(4.64) 1.M135 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 :: 16.9530 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 :: 4.0210 HB2 :: 2.0870 HB3 :: 1.8540 HG2 :: 2.2100 HE1 :: 1.8750 HE2 :: 1.8750 HE3 :: 1.8750 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.G136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 174.4060 CA :: 45.6160 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.1550 HA2 :: 4.0450 HA3 :: 3.7510 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.A137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.81 L 0.06 M 0.05 C 0.04 C Shift Assignments>> C :: 178.1960 CA :: 53.4400 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 :: 7.3470 HA :: 4.2910 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 :: 121.9000 Ave N Shift Values>> N :: 123.23(3.54) 1.H138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.46 C 0.31 H 0.22 C Shift Assignments>> C :: 173.3250 CA :: 54.5260 CB :: 27.6000 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 :: 8.2970 HA :: 4.9030 HB2 :: 3.3100 HB3 :: 3.2050 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 :: 115.2000 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.W139 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 :: 175.5680 CA :: 58.3580 CB :: 29.5500 CD1 :: 126.5500 CE3 :: 119.5390 CZ2 :: 113.7020 CZ3 :: 122.7410 CH2 :: 123.7470 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 :: 8.0810 HA :: 4.2950 HB2 :: 2.7730 HB3 :: 2.6420 HD1 :: 6.6290 HE1 :: 9.3930 HE3 :: 7.2550 HZ2 :: 6.9580 HZ3 :: 7.4240 HH2 :: 7.1140 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 :: 121.7800 NE1 :: 128.9340 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.F140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> F 0.46 Y 0.38 C 0.15 C Shift Assignments>> C :: 175.1260 CA :: 56.4710 CB :: 41.0060 CD2 :: 131.7400 CE2 :: 130.9590 CZ :: 128.9610 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 :: 4.8450 HB2 :: 3.0600 HB3 :: 2.7920 HD2 :: 7.0280 HE2 :: 6.8670 HZ :: 7.1350 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.G141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.06 C 0.04 C Shift Assignments>> C :: 178.2980 CA :: 46.3790 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.7190 HA2 :: 3.7250 HA3 :: 3.6590 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.9060 Ave N Shift Values>> N :: 109.67(3.87) 2.ZN1 Overall Status: Residue type ZN not supported. ########################################################################### Overall Results: #Consistent: 128 #Clerical: 0 #Suspicious: 11 #Anomalous: 0 #Mistyped: 2 #Indeterminable: 0 Typing Results: #Consistent: 136 #Suspicious: 1 #Mistyped: 2 #Indeterminable: 2 Shift Relative Order (SRO) Results: #Consistent: 141 #Suspicious: 0 C Shift Results: #Consistent: 536 #Duplicate: 0 #Unknown: 0 #Suspicious: 3 #Anomalous: 1 H Shift Results: #Consistent: 744 #Duplicate: 0 #Unknown: 0 #Suspicious: 16 #Anomalous: 0 N Shift Results: #Consistent: 134 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.M19 Typing: Mistyped 1.M19 CG = 19.0560(A), Expected = 32.01, Std = 1.2400, ChiSquare = 1.5159e-25 1.K29 HE2 = 2.2040(S), Expected = 2.92, Std = 0.1900, ChiSquare = 1.6428e-04 1.F40 Typing: Mistyped 1.F40 CZ = 118.1230(S), Expected = 129.21, Std = 1.4300, ChiSquare = 8.9643e-15 1.H49 H = 5.2910(S), Expected = 8.24, Std = 0.6800, ChiSquare = 1.4460e-05 1.K93 HD3 = -0.0880(S), Expected = 1.60, Std = 0.2200, ChiSquare = 1.6838e-14 1.K93 HE3 = 1.9850(S), Expected = 2.91, Std = 0.2000, ChiSquare = 3.7460e-06 1.P96 HD2 = 2.0780(S), Expected = 3.65, Std = 0.3500, ChiSquare = 7.0747e-06 1.P96 HD3 = 1.7300(S), Expected = 3.61, Std = 0.3900, ChiSquare = 1.4319e-06 1.K97 HB3 = 0.3490(S), Expected = 1.74, Std = 0.2700, ChiSquare = 2.5793e-07 1.R104 HB2 = 0.8680(S), Expected = 1.79, Std = 0.2700, ChiSquare = 6.3825e-04 1.R104 HB3 = 0.1830(S), Expected = 1.76, Std = 0.2800, ChiSquare = 1.7798e-08 1.R104 HD2 = 1.6330(S), Expected = 3.12, Std = 0.2400, ChiSquare = 5.7977e-10 1.R104 HD3 = 1.6330(S), Expected = 3.10, Std = 0.2600, ChiSquare = 1.6779e-08 1.H110 HB3 = 1.1120(S), Expected = 3.04, Std = 0.3800, ChiSquare = 3.9019e-07 1.M111 HB2 = 0.8910(S), Expected = 2.03, Std = 0.3400, ChiSquare = 8.0812e-04 1.M111 HB3 = 0.1140(S), Expected = 1.99, Std = 0.3400, ChiSquare = 3.4357e-08 1.M111 HG3 = 0.6410(S), Expected = 2.39, Std = 0.3800, ChiSquare = 4.1719e-06 1.E121 HA = 5.7210(S), Expected = 4.25, Std = 0.4100, ChiSquare = 3.3347e-04 1.W124 Typing: Suspicious 1.W124 CZ3 = 128.6670(S), Expected = 121.35, Std = 1.5300, ChiSquare = 1.7326e-06 1.M135 CG = 36.1800(S), Expected = 32.01, Std = 1.2400, ChiSquare = 7.7127e-04