Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.M4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> M 0.22 K 0.18 C 0.15 Q 0.14 R 0.09 H 0.09 W 0.05 E 0.03 V 0.01 C Shift Assignments>> C :: 175.8000 CA :: 55.3500 CB :: 32.8800 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) 1.A5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 M 0.08 C 0.01 C Shift Assignments>> CA :: 52.4300 CB :: 19.3700 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3200 HA :: 4.3500 HB1 :: 1.4000 HB2 :: 1.4000 HB3 :: 1.4000 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.2300 Ave N Shift Values>> N :: 123.23(3.54) 1.S6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 58.2000 CB :: 63.7000 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.4900 HB2 :: 3.8600 HB3 :: 3.9400 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.S7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 58.2000 CB :: 63.7000 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.5300 HB2 :: 3.8800 HB3 :: 3.9500 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.C8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.15 K 0.14 W 0.14 Q 0.12 E 0.11 H 0.09 R 0.08 I 0.08 L 0.02 M 0.01 C Shift Assignments>> C :: 173.5000 CA :: 58.3400 CB :: 28.4900 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> HA :: 4.6100 HB3 :: 2.9800 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.A9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 L 0.04 C 0.03 M 0.02 C Shift Assignments>> C :: 177.4000 CA :: 52.0700 CB :: 20.6290 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9600 HA :: 4.7900 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 :: 124.7000 Ave N Shift Values>> N :: 123.23(3.54) 1.V10 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 :: 173.9000 CA :: 61.5500 CB :: 34.9000 CG1 :: 22.1000 CG2 :: 21.8000 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 :: 8.4240 HA :: 4.2900 HB :: 1.7600 HG11 :: 0.7700 HG12 :: 0.7700 HG13 :: 0.7700 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 :: 120.1240 Ave N Shift Values>> N :: 121.14(4.54) 1.Q11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.46 C 0.28 Q 0.15 E 0.08 C Shift Assignments>> C :: 175.4000 CA :: 54.1230 CB :: 32.0290 CG :: 34.4800 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 :: 8.6360 HA :: 5.5600 HB3 :: 1.8700 HG2 :: 2.1600 HG3 :: 2.2100 HE21 :: 7.4100 HE22 :: 6.8800 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 :: 125.8180 NE2 :: 112.0900 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 V 0.31 HN Overlap>> 1.L14 1.L14 C Shift Assignments>> C :: 173.8000 CA :: 59.8000 CB :: 35.7110 CG1 :: 21.9000 CG2 :: 20.1000 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 :: 8.8270 HA :: 4.6300 HB :: 2.1000 HG11 :: 0.6900 HG12 :: 0.6900 HG13 :: 0.6900 HG21 :: 0.6500 HG22 :: 0.6500 HG23 :: 0.6500 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 :: 119.1060 Ave N Shift Values>> N :: 121.14(4.54) 1.K13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 K 0.35 R 0.22 C Shift Assignments>> C :: 175.0300 CA :: 55.4300 CB :: 35.9200 CG :: 25.8500 CD :: 29.2500 CE :: 41.7700 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 :: 8.2340 HA :: 5.2000 HB2 :: 1.6400 HB3 :: 1.8200 HG2 :: 1.2600 HG3 :: 1.4700 HD3 :: 1.6700 HE3 :: 2.9100 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 :: 121.7000 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.39 C 0.36 L 0.22 A 0.02 HN Overlap>> 1.V12 1.V12 C Shift Assignments>> C :: 175.1100 CA :: 53.3570 CB :: 46.9210 CG :: 27.1600 CD1 :: 26.3800 CD2 :: 24.2800 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 :: 8.8400 HA :: 4.9500 HB2 :: 1.3700 HB3 :: 1.5100 HG :: 1.7300 HD11 :: 0.9900 HD12 :: 0.9900 HD13 :: 0.9900 HD21 :: 1.0200 HD22 :: 1.0200 HD23 :: 1.0200 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.1000 Ave N Shift Values>> N :: 121.86(3.9) 1.E15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 E 0.31 M 0.22 HN Overlap>> 1.M36 1.M36 C Shift Assignments>> C :: 173.8000 CA :: 55.4280 CB :: 31.8260 CG :: 36.9600 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.1810 HA :: 4.9900 HB3 :: 1.8500 HG2 :: 2.0900 HG3 :: 2.2300 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 :: 120.9780 Ave N Shift Values>> N :: 120.67(3.48) 1.L16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.6 C 0.19 L 0.12 R 0.07 C Shift Assignments>> C :: 174.7000 CA :: 53.0760 CB :: 44.8920 CG :: 28.7000 CD1 :: 26.3700 CD2 :: 25.3300 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 :: 8.8910 HA :: 5.1100 HB2 :: 1.3500 HB3 :: 1.4600 HG :: 1.5200 HD11 :: 0.4900 HD12 :: 0.4900 HD13 :: 0.4900 HD21 :: 0.3300 HD22 :: 0.3300 HD23 :: 0.3300 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 :: 124.4380 Ave N Shift Values>> N :: 121.86(3.9) 1.G17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 C 0.06 L 0.05 C Shift Assignments>> C :: 170.3500 CA :: 46.9840 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.2270 HA2 :: 3.6800 HA3 :: 4.5400 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.0670 Ave N Shift Values>> N :: 109.67(3.87) 1.H18 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.59 H 0.28 W 0.06 Y 0.04 C Shift Assignments>> C :: 172.4000 CA :: 54.9400 CB :: 34.1600 CD2 :: 117.1400 CE1 :: 137.1000 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 :: 8.1500 HA :: 5.6200 HB2 :: 2.8800 HB3 :: 3.3200 HD2 :: 6.0700 HE1 :: 6.3500(S) 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 :: 111.2000 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.R19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 G 0.28 R 0.16 K 0.08 C Shift Assignments>> C :: 175.8000 CA :: 53.5000 CB :: 34.6500 CG :: 27.9400 CD :: 43.6400 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 :: 9.0100 HA :: 5.1000 HB2 :: 1.7800 HB3 :: 2.0000 HG3 :: 1.8100 HD3 :: 3.2100 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 :: 117.8000 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.A20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.62 C 0.14 K 0.13 A 0.07 C Shift Assignments>> C :: 175.8000 CA :: 52.1900 CB :: 23.7500 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0700 HA :: 5.5300 HB1 :: 1.4400 HB2 :: 1.4400 HB3 :: 1.4400 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.3900 Ave N Shift Values>> N :: 123.23(3.54) 1.Q21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.53 C 0.34 Q 0.1 E 0.01 C Shift Assignments>> CA :: 54.3300 CB :: 32.9000 CG :: 33.4400 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 :: 9.2400 HA :: 5.2300 HB3 :: 2.1400 HG2 :: 2.3500 HG3 :: 2.5200 HE21 :: 7.7200 HE22 :: 6.8500 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 :: 121.7900 NE2 :: 111.8800 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.72 C 0.27 C Shift Assignments>> C :: 176.5000 CA :: 63.0300 CB :: 31.6000 CG1 :: 21.9300 CG2 :: 21.1000 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>> HA :: 3.6300 HB :: 1.8900 HG11 :: 0.6900 HG12 :: 0.6900 HG13 :: 0.6900 HG21 :: 0.8900 HG22 :: 0.8900 HG23 :: 0.8900 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) 1.R23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 R 0.22 K 0.19 G 0.09 C Shift Assignments>> CA :: 56.6000 CB :: 32.1500 CG :: 29.3400 CD :: 43.5500 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 :: 8.7200 HA :: 4.1300 HB2 :: 1.1900 HB3 :: 2.0300 HG2 :: 1.2000 HG3 :: 1.7400 HD2 :: 3.0400 HD3 :: 3.4900 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 :: 127.8400 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.K24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.43 K 0.42 R 0.12 C Shift Assignments>> C :: 176.9600 CA :: 58.8000 CB :: 32.0600 CG :: 25.0700 CD :: 28.6500 CE :: 41.8500 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>> HA :: 4.0400 HB3 :: 1.8600 HG2 :: 1.5100 HG3 :: 1.5900 HD3 :: 1.7300 HE3 :: 3.0300 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) 1.K25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.55 C 0.37 R 0.04 A 0.02 G 0.01 C Shift Assignments>> CA :: 52.9600 CB :: 35.0800 CG :: 24.3700 CD :: 29.4400 CE :: 41.8800 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 :: 7.7200 HA :: 4.8300 HB2 :: 1.6800 HB3 :: 1.7800 HG3 :: 1.4500 HD3 :: 1.6900 HE3 :: 3.0100 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 115.8700 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.66 C 0.32 C Shift Assignments>> C :: 177.4000 CA :: 62.6500 CB :: 32.3900 CG :: 27.3200 CD :: 51.2300 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 :: 4.8300 HB2 :: 1.8900 HB3 :: 2.0500 HG3 :: 2.0500 HD2 :: 3.6600 HD3 :: 3.8100 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.T27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.85 C 0.14 C Shift Assignments>> C :: 177.3000 CA :: 61.3000 CB :: 71.4600 CG2 :: 21.4000 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 :: 8.3800 HA :: 4.5300 HB :: 4.9000 HG1 :: 5.5700 HG21 :: 1.5100 HG22 :: 1.5100 HG23 :: 1.5100 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 111.2700 Ave N Shift Values>> N :: 115.42(4.75) 1.V28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.85 C 0.14 C Shift Assignments>> C :: 177.0300 CA :: 65.2000 CB :: 31.4000 CG1 :: 20.6000 CG2 :: 20.2000 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 :: 8.9100 HA :: 3.8830 HB :: 2.1060 HG11 :: 0.9700 HG12 :: 0.9700 HG13 :: 0.9700 HG21 :: 0.9500 HG22 :: 0.9500 HG23 :: 0.9500 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 :: 121.1700 Ave N Shift Values>> N :: 121.14(4.54) 1.E29 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.33 E 0.3 K 0.13 Q 0.11 I 0.08 R 0.01 C Shift Assignments>> C :: 176.2000 CA :: 57.2500 CB :: 28.1700 CG :: 35.8000 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 :: 7.9900 HA :: 3.9200 HB2 :: 0.2300(A) HB3 :: 1.4400 HG2 :: 1.9200 HG3 :: 2.0600 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.8000 Ave N Shift Values>> N :: 120.67(3.48) 1.G30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.49 L 0.24 R 0.13 C 0.04 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 174.9000 CA :: 44.4600 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.9500 HA2 :: 3.4900 HA3 :: 4.1600 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.5000 Ave N Shift Values>> N :: 109.67(3.87) 1.F31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.66 F 0.2 Y 0.12 C Shift Assignments>> C :: 176.4000 CA :: 55.9000 CB :: 35.5000 CD1 :: 130.5500 CD2 :: 130.5500 CE1 :: 131.1600 CE2 :: 131.1600 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.5200 HA :: 4.7600 HB2 :: 3.2800 HB3 :: 3.4900 HD1 :: 7.0900 HD2 :: 7.0900 HE1 :: 7.3300 HE2 :: 7.3300 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.3000 Ave N Shift Values>> N :: 120.45(4.18) 1.T32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.92 C 0.07 C Shift Assignments>> C :: 175.2000 CA :: 62.7800 CB :: 70.3500 CG2 :: 21.7100 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 :: 7.7700 HA :: 4.3300 HB :: 4.5200 HG21 :: 1.4500 HG22 :: 1.4500 HG23 :: 1.4500 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 :: 112.3000 Ave N Shift Values>> N :: 115.42(4.75) 1.H33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 F 0.16 Y 0.07 H 0.05 W 0.03 C Shift Assignments>> C :: 173.8800 CA :: 56.7800 CB :: 35.6400 CE1 :: 138.6600 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 :: 9.1100 HA :: 5.5000 HB2 :: 2.7800 HB3 :: 2.8100 HD2 :: 6.8400 HE1 :: 7.7800 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 121.9000 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.D34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.33 R 0.21 D 0.2 G 0.06 K 0.05 C 0.04 F 0.03 Y 0.02 N 0.02 C Shift Assignments>> C :: 175.1000 CA :: 53.3100 CB :: 43.1000 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 :: 8.8100 HA :: 5.4000 HB2 :: 2.5500 HB3 :: 2.9200 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.3000 Ave N Shift Values>> N :: 120.65(3.86) 1.W35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.76 W 0.23 C Shift Assignments>> C :: 174.9000 CA :: 54.9000 CB :: 35.0700 CD1 :: 127.1300 CE3 :: 121.4000 CZ2 :: 114.8800 CZ3 :: 120.8000 CH2 :: 122.4300 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 :: 9.2500 HA :: 5.7300 HB2 :: 3.1000 HB3 :: 3.4200 HD1 :: 6.4500 HE1 :: 10.3300 HE3 :: 7.1300 HZ2 :: 7.1900 HZ3 :: 6.5300 HH2 :: 6.4900 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 :: 119.8000 NE1 :: 127.4400 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.M36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.47 C 0.32 A 0.2 HN Overlap>> 1.E15 1.E43 1.E15 1.E43 C Shift Assignments>> C :: 173.7000 CA :: 54.8300 CB :: 35.2200 CG :: 31.6100 CE :: 16.9000 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 :: 9.0800 HA :: 5.7500 HB2 :: 2.1400 HB3 :: 2.2000 HG2 :: 2.4500 HG3 :: 2.7000 HE1 :: 2.0300 HE2 :: 2.0300 HE3 :: 2.0300 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 120.9800 Ave N Shift Values>> N :: 120.09(3.57) 1.V37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.68 V 0.3 A 0.01 C Shift Assignments>> C :: 172.3000 CA :: 58.5400 CB :: 35.0700 CG1 :: 21.4000 CG2 :: 20.3200 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.0800 HA :: 5.3100 HB :: 1.6100 HG11 :: 0.5900 HG12 :: 0.5900 HG13 :: 0.5900 HG21 :: 0.7300 HG22 :: 0.7300 HG23 :: 0.7300 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 126.2200 Ave N Shift Values>> N :: 121.14(4.54) 1.F38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.68 C 0.21 G 0.09 C Shift Assignments>> C :: 172.9600 CA :: 56.1300 CB :: 43.0000 CD1 :: 132.5000 CD2 :: 132.5000 CE1 :: 129.5000 CE2 :: 129.5000 CZ :: 129.8000 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 :: 8.3200 HA :: 5.9700 HB2 :: 2.9500 HB3 :: 3.0900 HD1 :: 6.8000 HD2 :: 6.8000 HE1 :: 6.9000 HE2 :: 6.9000 HZ :: 7.1700 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.6400 Ave N Shift Values>> N :: 120.45(4.18) 1.V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 V 0.49 C Shift Assignments>> C :: 174.7000 CA :: 61.6400 CB :: 35.4000 CG1 :: 22.7400 CG2 :: 20.9000 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 :: 8.5800 HA :: 5.0100 HB :: 1.9300 HG11 :: 0.9140 HG12 :: 0.9140 HG13 :: 0.9140 HG21 :: 0.8000 HG22 :: 0.8000 HG23 :: 0.8000 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 116.5000 Ave N Shift Values>> N :: 121.14(4.54) 1.R40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 R 0.28 K 0.18 G 0.1 C Shift Assignments>> C :: 173.8000 CA :: 54.9300 CB :: 33.5800 CG :: 26.0400 CD :: 43.3800 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 :: 9.8800 HA :: 5.0800 HB2 :: 1.8800 HB3 :: 2.2300 HG2 :: 1.7200 HG3 :: 1.8100 HD2 :: 2.6900 HD3 :: 2.8600 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 124.1000 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.G41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.29 R 0.28 G 0.24 F 0.04 D 0.04 C 0.04 Y 0.02 C Shift Assignments>> CA :: 43.9700 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.9100 HA2 :: 3.8700 HA3 :: 4.7900 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.6400 Ave N Shift Values>> N :: 109.67(3.87) 1.P42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.65 C 0.33 C Shift Assignments>> C :: 177.3000 CA :: 62.4400 CB :: 32.1100 CG :: 28.0700 CD :: 50.1600 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 :: 4.4900 HB2 :: 1.9600 HB3 :: 2.3300 HG2 :: 1.9500 HG3 :: 2.1000 HD2 :: 3.6300 HD3 :: 3.6800 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.E43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 E 0.29 I 0.14 K 0.09 Q 0.07 R 0.01 HN Overlap>> 1.M36 1.M36 C Shift Assignments>> C :: 176.1100 CA :: 57.8500 CB :: 27.8500 CG :: 36.0500 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.0600 HA :: 3.7900 HB3 :: 1.9300 HG2 :: 1.9600 HG3 :: 2.1000 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 :: 121.0500 Ave N Shift Values>> N :: 120.67(3.48) 1.H44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.35 H 0.32 C 0.31 C Shift Assignments>> C :: 175.1700 CA :: 57.6500 CB :: 28.3700 CD2 :: 120.1900 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 :: 8.4200 HA :: 4.3510 HB2 :: 3.3200 HB3 :: 3.3900 HD2 :: 6.9900 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 114.1000 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.S45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.7000 CA :: 58.7100 CB :: 65.0400 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.8700 HA :: 4.5600 HB2 :: 3.9500 HB3 :: 4.0100 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.5400 Ave N Shift Values>> N :: 116.28(3.52) 1.N46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.57 D 0.16 C 0.08 F 0.05 Y 0.05 L 0.04 C Shift Assignments>> C :: 176.3000 CA :: 52.6900 CB :: 38.7300 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.4800 HA :: 5.1200 HB2 :: 2.8400 HB3 :: 2.9000 HD21 :: 7.6800 HD22 :: 7.0100 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 :: 123.9000 ND2 :: 113.2000 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.7 C 0.29 C Shift Assignments>> C :: 176.0000 CA :: 63.2000 CB :: 36.7000 CG1 :: 25.3300 CG2 :: 17.7400 CD1 :: 14.0000 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 :: 8.1700 HA :: 3.9400 HB :: 1.5400 HG12 :: 1.1900 HG13 :: 1.4100 HG21 :: 1.0700 HG22 :: 1.0700 HG23 :: 1.0700 HD11 :: 0.6500 HD12 :: 0.6500 HD13 :: 0.6500 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 115.2400 Ave N Shift Values>> N :: 121.46(4.28) 1.Q48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 R 0.28 Q 0.16 K 0.12 M 0.01 C Shift Assignments>> C :: 175.6700 CA :: 57.9000 CB :: 26.9900 CG :: 32.6500 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 :: 8.8500 HA :: 4.2800 HB2 :: 2.0800 HB3 :: 2.1800 HG2 :: 2.0800 HG3 :: 2.4800 HE21 :: 7.6300 HE22 :: 7.0900 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 :: 123.2000 NE2 :: 112.2700 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.H49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 W 0.34 H 0.29 C Shift Assignments>> C :: 176.3800 CA :: 58.7500 CB :: 31.6200 CD2 :: 120.6900 CE1 :: 138.8500 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 :: 7.4000 HA :: 4.5700 HB2 :: 3.0300 HB3 :: 3.2700 HD2 :: 7.3680 HE1 :: 7.8600 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 :: 115.4000 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.F50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.64 C 0.35 C Shift Assignments>> C :: 173.8000 CA :: 56.6600 CB :: 41.0000 CD1 :: 133.1900 CD2 :: 133.1900 CE1 :: 130.9300 CE2 :: 131.2300 CZ :: 129.9000 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.5700 HA :: 5.2300 HB2 :: 2.3100 HB3 :: 3.4600 HD1 :: 7.1700 HD2 :: 7.1700 HE1 :: 7.2800 HE2 :: 7.2800 HZ :: 7.2600 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 :: 109.8000 Ave N Shift Values>> N :: 120.45(4.18) 1.V51 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 :: 174.5000 CA :: 63.0000 CB :: 33.2800 CG1 :: 22.7000 CG2 :: 21.6000 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 :: 7.8100 HA :: 4.3700 HB :: 1.6200 HG11 :: 0.3500 HG12 :: 0.3500 HG13 :: 0.3500 HG21 :: 0.3300 HG22 :: 0.3300 HG23 :: 0.3300 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 :: 127.8100 Ave N Shift Values>> N :: 121.14(4.54) 1.E52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 E 0.33 M 0.18 Q 0.04 I 0.01 K 0.01 C Shift Assignments>> C :: 175.4000 CA :: 58.1000 CB :: 31.5800 CG :: 35.9000 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.3800 HA :: 3.9800 HB2 :: 1.6400 HB3 :: 1.7300 HG2 :: 1.9500 HG3 :: 2.1300 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 130.7000 Ave N Shift Values>> N :: 120.67(3.48) 1.K53 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.66 K 0.29 A 0.04 C Shift Assignments>> C :: 172.3000 CA :: 54.8400 CB :: 34.2500 CG :: 23.5000 CD :: 29.8500 CE :: 40.5000 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 :: 7.1900 HA :: 4.8000 HB2 :: 1.2600 HB3 :: 2.1100 HG2 :: 0.6600 HG3 :: 0.8600 HD3 :: 1.1100 HE2 :: 1.5400(S) HE3 :: 1.6200(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 :: 109.2000 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) SRO Rule Breaks>> (HE2 > HB3 : 0.9957) (HE3 > HB3 : 0.9974) 1.V54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 V 0.48 C Shift Assignments>> C :: 173.6000 CA :: 61.0400 CB :: 34.7000 CG1 :: 22.7000 CG2 :: 22.1900 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 :: 8.4500 HA :: 4.7700 HB :: 1.5600 HG11 :: 0.0890 HG12 :: 0.0890 HG13 :: 0.0890 HG21 :: 0.1700 HG22 :: 0.1700 HG23 :: 0.1700 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 :: 120.3800 Ave N Shift Values>> N :: 121.14(4.54) 1.V55 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 :: 173.8000 CA :: 60.8700 CB :: 34.1000 CG1 :: 21.4000 CG2 :: 21.1400 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.2600 HA :: 4.7000 HB :: 2.1500 HG11 :: 0.8500 HG12 :: 0.8500 HG13 :: 0.8500 HG21 :: 0.3900 HG22 :: 0.3900 HG23 :: 0.3900 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 126.9200 Ave N Shift Values>> N :: 121.14(4.54) 1.F56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.72 C 0.27 C Shift Assignments>> C :: 174.0000 CA :: 56.5800 CB :: 40.8900 CD1 :: 132.7000 CD2 :: 132.7000 CE1 :: 130.7500 CE2 :: 130.7500 CZ :: 128.9000 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 :: 9.2900 HA :: 4.6900 HB2 :: 2.7340 HB3 :: 3.0500 HD1 :: 7.0600 HD2 :: 7.0600 HE1 :: 7.0100 HE2 :: 7.0100 HZ :: 7.0440 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 126.1300 Ave N Shift Values>> N :: 120.45(4.18) 1.H57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.45 C 0.31 W 0.22 HN Overlap>> 1.Y91 1.Y91 C Shift Assignments>> C :: 174.7000 CA :: 55.3200 CB :: 30.1000 CD2 :: 117.3500 CE1 :: 137.5000 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 :: 8.6900 HA :: 4.8000 HB2 :: 2.9400 HB3 :: 3.4200 HD2 :: 6.7300 HE1 :: 7.6900 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 :: 124.1800 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.51 C 0.45 R 0.01 A 0.01 C Shift Assignments>> C :: 174.4000 CA :: 55.4100 CB :: 41.1600 CG :: 28.7000 CD1 :: 24.5700 CD2 :: 24.0100 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.0500 HA :: 4.2400 HB2 :: 1.4200 HB3 :: 2.0300 HG :: 1.8700 HD11 :: 0.6600 HD12 :: 0.6600 HD13 :: 0.6600 HD21 :: 0.6900 HD22 :: 0.6900 HD23 :: 0.6900 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.0500 Ave N Shift Values>> N :: 121.86(3.9) 1.H59 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.19 W 0.16 E 0.12 R 0.12 H 0.1 K 0.07 Q 0.06 V 0.06 M 0.05 I 0.02 C Shift Assignments>> C :: 175.3000 CA :: 59.1100 CB :: 30.9300 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 :: 5.1600(S) 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 :: 118.5100 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.E60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 E 0.3 I 0.13 K 0.11 Q 0.07 C Shift Assignments>> C :: 175.1300 CA :: 59.0100 CB :: 28.8200 CG :: 35.8000 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 :: 7.9600 HA :: 3.9600 HB3 :: 1.9400 HG3 :: 2.0600 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.1900 Ave N Shift Values>> N :: 120.67(3.48) 1.S61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 60.0100 CB :: 63.1400 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.5400 HA :: 4.2000 HB2 :: 3.9800 HB3 :: 4.2200 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 116.9400 Ave N Shift Values>> N :: 116.28(3.52) 1.F62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.39 Y 0.35 C 0.24 C Shift Assignments>> CA :: 57.9400 CB :: 38.4000 CD1 :: 131.7200 CD2 :: 131.7200 CE1 :: 130.4600 CE2 :: 130.4600 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 :: 8.6400 HA :: 4.5500 HB2 :: 2.7100 HB3 :: 3.0300 HD1 :: 7.3400 HD2 :: 7.3400 HE1 :: 7.0800 HE2 :: 7.0800 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 :: 123.7000 Ave N Shift Values>> N :: 120.45(4.18) 1.P63 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 :: 176.4000 CA :: 62.6000 CB :: 31.8600 CG :: 27.5700 CD :: 50.9000 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 :: 4.4100 HB2 :: 1.9400 HB3 :: 2.3600 HG3 :: 2.1600 HD2 :: 3.8400 HD3 :: 3.9300 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.R64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.45 C 0.32 L 0.09 G 0.07 K 0.04 C Shift Assignments>> CA :: 55.6100 CB :: 28.8300 CG :: 27.2200 CD :: 43.4000 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 :: 8.8900 HA :: 4.1000 HB3 :: 1.8800 HG3 :: 1.6500 HD2 :: 3.2700 HD3 :: 3.3400 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 116.8400 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.P65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.88 C 0.11 C Shift Assignments>> C :: 175.8000 CA :: 65.8100 CB :: 31.8800 CG :: 27.3600 CD :: 49.9000 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 :: 3.9900 HB2 :: 2.0000 HB3 :: 2.2300 HG2 :: 1.9200 HG3 :: 2.1000 HD2 :: 3.6600 HD3 :: 3.9500 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.K66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.48 C 0.36 R 0.14 C Shift Assignments>> C :: 175.4000 CA :: 55.4530 CB :: 31.7300 CG :: 25.5900 CD :: 29.3200 CE :: 41.7500 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 :: 7.6300 HA :: 4.6100 HB2 :: 1.6100 HB3 :: 1.7100 HG2 :: 0.9500 HG3 :: 1.0200 HD3 :: 1.6160 HE3 :: 2.8900 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 119.0350 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.39 C 0.33 R 0.19 L 0.06 HN Overlap>> 1.V117 1.V117 C Shift Assignments>> C :: 174.5000 CA :: 52.8000 CB :: 29.7140 CG :: 26.0400 CD :: 41.7000 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 :: 8.8550 HA :: 4.7400 HB2 :: 1.8500 HB3 :: 2.1700 HG3 :: 1.7400 HD3 :: 3.2400 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 :: 127.3940 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.V68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.65 C 0.34 C Shift Assignments>> C :: 176.8500 CA :: 62.0730 CB :: 33.6040 CG1 :: 21.6600 CG2 :: 21.4000 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 :: 8.6810 HA :: 4.5800 HB :: 2.0600 HG11 :: 0.9100 HG12 :: 0.9100 HG13 :: 0.9100 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 :: 124.3880 Ave N Shift Values>> N :: 121.14(4.54) 1.C69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.16 W 0.15 E 0.14 R 0.13 H 0.12 Q 0.08 K 0.07 M 0.06 V 0.03 I 0.01 C Shift Assignments>> CA :: 58.3460 CB :: 30.7700 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 9.4550 HA :: 5.0700 HB2 :: 3.1500 HB3 :: 3.3700 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 :: 127.0800 Ave N Shift Values>> N :: 120.17(4.64) 1.K70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 K 0.45 R 0.08 C Shift Assignments>> C :: 174.3000 CA :: 57.7600 CB :: 33.1700 CG :: 25.5900 CD :: 29.0400 CE :: 41.5500 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.0500 HA :: 4.4900 HB2 :: 1.8300 HB3 :: 1.9600 HG2 :: 1.3800 HG3 :: 1.5300 HD3 :: 1.7200 HE3 :: 2.9800 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 :: 125.4800 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.37 L 0.23 D 0.16 R 0.12 C 0.04 N 0.02 F 0.01 K 0.01 C Shift Assignments>> CA :: 51.0800 CB :: 43.3800 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 :: 7.6200 HA :: 5.1000 HB2 :: 2.2000 HB3 :: 2.6200 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.9400 Ave N Shift Values>> N :: 120.65(3.86) 1.P72 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> C 0.77 P 0.22 C Shift Assignments>> CA :: 60.6500 CB :: 30.0400 CG :: 26.6400 CD :: 49.9200 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 :: 3.2600(S) HB2 :: 1.6400 HB3 :: 1.8400 HG3 :: 1.8600 HD2 :: 3.5600 HD3 :: 3.6100 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.P73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.91 P 0.08 C Shift Assignments>> C :: 174.7000 CA :: 61.6900 CB :: 34.0400 CG :: 24.8000 CD :: 50.1800 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 :: 4.1000 HB2 :: 1.8400 HB3 :: 2.3300 HG3 :: 1.9000 HD2 :: 3.3950 HD3 :: 3.6100 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.Y74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 Y 0.36 H 0.03 C Shift Assignments>> C :: 172.9000 CA :: 55.6700 CB :: 35.4000 CD1 :: 133.4000 CD2 :: 133.4000 CE1 :: 117.1700 CE2 :: 117.1700 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 :: 8.9600 HA :: 4.8500 HB2 :: 2.6600 HB3 :: 4.1080 HD1 :: 7.0600 HD2 :: 7.0600 HE1 :: 6.3100 HE2 :: 6.3100 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 :: 125.4000 Ave N Shift Values>> N :: 120.52(4.2) 1.K75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 K 0.25 A 0.06 G 0.01 C Shift Assignments>> C :: 173.8000 CA :: 54.6500 CB :: 35.8900 CG :: 23.2300 CD :: 30.0400 CE :: 41.8000 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 :: 7.6700 HA :: 5.5900 HB2 :: 1.7700 HB3 :: 1.8700 HG3 :: 1.2400 HD2 :: 1.5200 HD3 :: 1.5800 HE3 :: 2.8500 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 :: 121.4000 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.53 C 0.46 C Shift Assignments>> C :: 173.9000 CA :: 61.7300 CB :: 35.5400 CG1 :: 22.0000 CG2 :: 21.6000 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 :: 8.1800 HA :: 3.8900 HB :: 1.4500 HG11 :: 0.7100 HG12 :: 0.7100 HG13 :: 0.7100 HG21 :: 0.2800 HG22 :: 0.2800 HG23 :: 0.2800 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 :: 119.8000 Ave N Shift Values>> N :: 121.14(4.54) 1.E77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 E 0.31 M 0.2 C Shift Assignments>> C :: 174.7000 CA :: 54.9400 CB :: 31.5500 CG :: 37.2000 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 :: 8.2700 HA :: 4.9500 HB2 :: 1.7800 HB3 :: 1.9500 HG3 :: 2.0700 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 :: 126.1900 Ave N Shift Values>> N :: 120.67(3.48) 1.E78 Overall: Anomalous Typing: Suspicious SRO: Suspicious C Shifts: Suspicious H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 175.4000 CA :: 54.0420 CB :: 37.1000(S) CG :: 36.7000 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 :: 7.8700 HA :: 4.4500 HB2 :: -0.6820(A) HB3 :: 1.2700 HG2 :: 1.5300(S) HG3 :: 1.8000 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 :: 126.1800 Ave N Shift Values>> N :: 120.67(3.48) SRO Rule Breaks>> (CG > CB : 0.9917) 1.S79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.96 T 0.03 C Shift Assignments>> C :: 172.4900 CA :: 57.7540 CB :: 65.8610 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.7140 HA :: 5.5600 HB2 :: 3.5600 HB3 :: 4.1500 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.1090 Ave N Shift Values>> N :: 116.28(3.52) 1.G80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.88 L 0.05 C 0.04 C Shift Assignments>> C :: 172.6300 CA :: 46.5700 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.8280 HA2 :: 3.8400 HA3 :: 4.5200 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.0480 Ave N Shift Values>> N :: 109.67(3.87) 1.Y81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.75 C 0.24 C Shift Assignments>> C :: 174.1000 CA :: 55.5000 CB :: 41.3400 CD1 :: 133.5000 CD2 :: 133.5000 CE1 :: 118.0000 CE2 :: 118.0000 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 :: 8.7700 HA :: 5.6800 HB2 :: 3.0600 HB3 :: 3.6700 HD1 :: 6.9400 HD2 :: 6.9400 HE1 :: 6.6500 HE2 :: 6.6500 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 :: 115.2800 Ave N Shift Values>> N :: 120.52(4.2) 1.A82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.43 L 0.42 C 0.11 K 0.02 C Shift Assignments>> CA :: 52.0400 CB :: 22.4000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.1600 HA :: 4.4000 HB1 :: 1.1100 HB2 :: 1.1100 HB3 :: 1.1100 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.3500 Ave N Shift Values>> N :: 123.23(3.54) 1.G83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.57 L 0.21 R 0.09 C 0.04 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 172.5000 CA :: 44.6100 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.2200 HA2 :: 3.9000 HA3 :: 4.1700 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.1000 Ave N Shift Values>> N :: 109.67(3.87) 1.F84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.73 F 0.26 C Shift Assignments>> C :: 172.4600 CA :: 56.5000 CB :: 38.5800 CD1 :: 133.9000 CD2 :: 133.9000 CE1 :: 130.9500 CE2 :: 130.9500 CZ :: 129.0900 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.7000 HA :: 4.6900 HB2 :: 3.0700 HB3 :: 3.4100 HD1 :: 7.2300 HD2 :: 7.2300 HE1 :: 7.4400 HE2 :: 7.4400 HZ :: 7.0400 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 :: 111.6600 Ave N Shift Values>> N :: 120.45(4.18) 1.I85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.91 I 0.08 HN Overlap>> 1.T126 1.T126 C Shift Assignments>> CA :: 59.3400 CB :: 35.2600 CG1 :: 26.6400 CG2 :: 16.9600 CD1 :: 9.3700 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 :: 8.3400 HA :: 4.3100 HB :: 2.0000 HG12 :: 1.3200 HG13 :: 1.4000 HG21 :: 0.6400 HG22 :: 0.6400 HG23 :: 0.6400 HD11 :: 0.5500 HD12 :: 0.5500 HD13 :: 0.5500 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.L86 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Suspicious PRTL>> G 0.74 C 0.2 R 0.04 C Shift Assignments>> CA :: 53.2000 CB :: 45.3000 CG :: 29.3000 CD1 :: 27.5300 CD2 :: 27.3000 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.9000 HA :: 4.9800 HB2 :: 1.2200 HB3 :: 2.0800 HG :: 1.8900 HD11 :: 0.7300 HD12 :: 0.7300 HD13 :: 0.7300 HD21 :: 0.9100 HD22 :: 0.9100 HD23 :: 0.9100 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 :: 108.1300(S) Ave N Shift Values>> N :: 121.86(3.9) 1.P87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.67 C 0.32 C Shift Assignments>> C :: 175.3400 CA :: 63.1100 CB :: 31.5600 CG :: 28.5800 CD :: 50.9000 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 :: 5.1000 HB2 :: 1.7500 HB3 :: 2.0500 HG2 :: 1.8200 HG3 :: 2.0400 HD2 :: 4.2100 HD3 :: 4.5700 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.I88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.52 C 0.46 C Shift Assignments>> C :: 176.1000 CA :: 60.5600 CB :: 42.0000 CG1 :: 27.8000 CG2 :: 16.9000 CD1 :: 14.0600 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.3800 HA :: 4.7900 HB :: 1.6600 HG12 :: 0.7500 HG13 :: 2.2400 HG21 :: 0.2970 HG22 :: 0.2970 HG23 :: 0.2970 HD11 :: 0.5880 HD12 :: 0.5880 HD13 :: 0.5880 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 :: 126.0000 Ave N Shift Values>> N :: 121.46(4.28) 1.E89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.92 M 0.05 E 0.02 C Shift Assignments>> C :: 173.8000 CA :: 53.9700 CB :: 34.3800 CG :: 37.9700 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.3200 HA :: 5.2000 HB2 :: 1.6600 HB3 :: 2.2200 HG2 :: 1.8100 HG3 :: 2.1400 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 :: 123.9000 Ave N Shift Values>> N :: 120.67(3.48) 1.V90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.64 C 0.35 C Shift Assignments>> C :: 174.8000 CA :: 61.9900 CB :: 32.4900 CG1 :: 22.2000 CG2 :: 20.6000 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.6300 HA :: 4.1600 HB :: 1.8300 HG11 :: 0.5700 HG12 :: 0.5700 HG13 :: 0.5700 HG21 :: 0.8200 HG22 :: 0.8200 HG23 :: 0.8200 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 123.9800 Ave N Shift Values>> N :: 121.14(4.54) 1.Y91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.7 C 0.29 HN Overlap>> 1.H57 1.H57 C Shift Assignments>> C :: 176.8000 CA :: 56.7000 CB :: 40.2400 CD1 :: 133.1800 CD2 :: 133.1800 CE1 :: 118.9300 CE2 :: 118.9300 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 :: 8.6400 HA :: 4.6600 HB3 :: 2.9800 HD1 :: 6.9900 HD2 :: 6.9900 HE1 :: 6.7100 HE2 :: 6.7100 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 124.2300 Ave N Shift Values>> N :: 120.52(4.2) 1.F92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.78 C 0.17 G 0.04 C Shift Assignments>> CA :: 56.5100 CB :: 42.7000 CD1 :: 131.6000 CD2 :: 131.6000 CE1 :: 130.5500 CE2 :: 130.5500 CZ :: 129.7000 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 :: 8.7500 HA :: 5.6600 HB2 :: 2.8300 HB3 :: 3.4200 HD1 :: 7.4500 HD2 :: 7.4500 HE1 :: 7.1900 HE2 :: 7.1900 HZ :: 7.2100 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.2000 Ave N Shift Values>> N :: 120.45(4.18) 1.K93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.42 C 0.35 R 0.21 C Shift Assignments>> C :: 174.2000 CA :: 55.1800 CB :: 31.6800 CG :: 25.5400 CD :: 30.1100 CE :: 42.0300 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 :: 8.5600 HA :: 4.6000 HB2 :: 1.6100 HB3 :: 2.1300 HG2 :: 1.1000 HG3 :: 1.3700 HD2 :: 1.5500 HD3 :: 1.7100 HE2 :: 3.0200 HE3 :: 3.1800 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.4500 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.N94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 D 0.26 C 0.06 L 0.06 F 0.03 Y 0.03 C Shift Assignments>> CA :: 51.2100 CB :: 39.8000 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.8200 HA :: 4.4400 HB3 :: 1.9000 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 118.8000 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.K95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.48 C 0.39 R 0.11 C Shift Assignments>> C :: 175.8000 CA :: 56.2100 CB :: 33.0100 CG :: 25.0700 CD :: 29.1000 CE :: 42.0300 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>> HA :: 4.3300 HB2 :: 1.7500 HB3 :: 1.9300 HG2 :: 1.4000 HG3 :: 1.4400 HD3 :: 1.6900 HE3 :: 2.9800 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) 1.E96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.33 C 0.31 E 0.25 Q 0.08 K 0.01 HN Overlap>> 1.K137 1.K137 C Shift Assignments>> C :: 173.2000 CA :: 54.1000 CB :: 31.4700 CG :: 35.6900 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 :: 7.1200 HA :: 4.5100 HB2 :: 1.9000 HB3 :: 2.1400 HG2 :: 2.0200 HG3 :: 2.1500 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.3300 Ave N Shift Values>> N :: 120.67(3.48) 1.E97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.3 C 0.26 Q 0.19 K 0.17 M 0.04 I 0.01 C Shift Assignments>> CA :: 54.8600 CB :: 29.2700 CG :: 35.5000 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 :: 8.0600 HA :: 4.4300 HB2 :: 1.8200 HB3 :: 2.0600 HG2 :: 2.3100 HG3 :: 2.4200 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 :: 115.6300 Ave N Shift Values>> N :: 120.67(3.48) 1.P98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.87 P 0.12 C Shift Assignments>> C :: 175.9000 CA :: 62.1600 CB :: 34.0000 CG :: 24.8000 CD :: 50.1000 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 :: 5.0000 HB2 :: 2.2100 HB3 :: 2.4400 HG2 :: 2.0600 HG3 :: 2.2000 HD3 :: 3.6800 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.R99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 R 0.34 K 0.22 C Shift Assignments>> C :: 175.8000 CA :: 56.4900 CB :: 30.4100 CG :: 27.4200 CD :: 41.8000 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 :: 8.6020 HA :: 4.6300 HB2 :: 1.8100 HB3 :: 1.9800 HG3 :: 1.6100 HD2 :: 3.0900 HD3 :: 3.3200 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 :: 122.8000 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.K100 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.55 A 0.28 K 0.1 G 0.03 R 0.01 C Shift Assignments>> C :: 174.1000 CA :: 53.9100 CB :: 34.7200 CG :: 22.1900 CD :: 30.0400 CE :: 42.3300 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 :: 7.6500 HA :: 4.9400 HB2 :: 0.6000(S) HB3 :: 0.8600 HG2 :: 0.5400 HG3 :: 0.8800 HD2 :: 0.8000(S) HD3 :: 0.9800 HE2 :: 2.6400 HE3 :: 2.7300 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 :: 113.2200 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 V 0.44 C Shift Assignments>> C :: 171.6000 CA :: 60.2600 CB :: 35.1800 CG1 :: 21.2000 CG2 :: 20.6000 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 :: 8.1200 HA :: 4.2700 HB :: 1.8100 HG11 :: 0.8100 HG12 :: 0.8100 HG13 :: 0.8100 HG21 :: 0.6900 HG22 :: 0.6900 HG23 :: 0.6900 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 116.2300 Ave N Shift Values>> N :: 121.14(4.54) 1.R102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.37 C 0.36 G 0.13 K 0.13 C Shift Assignments>> C :: 174.3400 CA :: 53.7500 CB :: 33.3500 CG :: 27.6800 CD :: 43.3800 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 :: 7.9300 HA :: 5.1600 HB2 :: 1.4100 HB3 :: 1.5200 HG3 :: 1.2000 HD2 :: 2.9000 HD3 :: 3.0300 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 124.9800 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.F103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.79 C 0.18 G 0.01 C Shift Assignments>> C :: 174.2800 CA :: 55.9800 CB :: 42.2500 CD1 :: 131.9400 CD2 :: 131.9400 CE1 :: 130.5500 CE2 :: 130.5000 CZ :: 128.9000 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 :: 9.3900 HA :: 4.7920 HB2 :: 2.6100 HB3 :: 2.8800 HD1 :: 7.0400 HD2 :: 7.0400 HE1 :: 7.0800 HE2 :: 7.0800 HZ :: 7.0600 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 :: 124.5900 Ave N Shift Values>> N :: 120.45(4.18) 1.D104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 N 0.2 L 0.15 F 0.12 Y 0.1 C 0.07 K 0.02 C Shift Assignments>> C :: 174.5000 CA :: 54.3900 CB :: 40.2300 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.0100 HA :: 4.7990 HB2 :: 2.1800 HB3 :: 2.5500 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 :: 124.7000 Ave N Shift Values>> N :: 120.65(3.86) 1.Y105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.66 C 0.32 C Shift Assignments>> C :: 173.1000 CA :: 58.6800 CB :: 41.8500 CD1 :: 131.6000 CD2 :: 131.6000 CE1 :: 117.1700 CE2 :: 117.1700 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 :: 8.1400 HA :: 4.1000 HB2 :: 2.4200 HB3 :: 3.5400 HD1 :: 6.4300 HD2 :: 6.4300 HE1 :: 6.0800 HE2 :: 6.0800 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 :: 129.8400 Ave N Shift Values>> N :: 120.52(4.2) 1.D106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.39 D 0.25 L 0.08 F 0.08 Y 0.08 C 0.07 C Shift Assignments>> C :: 172.9000 CA :: 53.5100 CB :: 39.5000 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 :: 7.7300 HA :: 4.2200 HB2 :: 2.1300 HB3 :: 2.5100 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.L107 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.61 C 0.32 A 0.05 C Shift Assignments>> C :: 172.1000 CA :: 53.7000 CB :: 39.2400 CG :: 27.6000 CD1 :: 24.2700 CD2 :: 23.5000 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.7700 HA :: 2.8400 HB2 :: 0.1800(S) HB3 :: 1.1300 HG :: -0.1400(S) HD11 :: -0.6400(S) HD12 :: -0.6400(S) HD13 :: -0.6400(S) HD21 :: -0.8800(S) HD22 :: -0.8800(S) HD23 :: -0.8800(S) 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 :: 132.1500 Ave N Shift Values>> N :: 121.86(3.9) 1.F108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.62 C 0.37 C Shift Assignments>> C :: 174.3000 CA :: 54.6900 CB :: 40.2900 CD1 :: 132.9900 CD2 :: 132.9900 CE1 :: 131.9700 CE2 :: 131.9700 CZ :: 130.3500 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 6.0600 HA :: 4.6900 HB2 :: 2.6400 HB3 :: 2.9500 HD1 :: 6.8160 HD2 :: 6.8160 HE1 :: 6.8800 HE2 :: 6.8800 HZ :: 7.0600 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.9600 Ave N Shift Values>> N :: 120.45(4.18) 1.L109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 A 0.24 C 0.14 G 0.11 C Shift Assignments>> CA :: 52.1600 CB :: 43.0800 CG :: 26.5000 CD1 :: 23.0000 CD2 :: 22.2000 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 :: 8.3880 HA :: 4.4000 HB2 :: 0.7040 HB3 :: 1.1100 HG :: 1.0100 HD11 :: -0.0700 HD12 :: -0.0700 HD13 :: -0.0700 HD21 :: 0.2380 HD22 :: 0.2380 HD23 :: 0.2380 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.9000 Ave N Shift Values>> N :: 121.86(3.9) 1.H110 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.52 C 0.19 G 0.16 R 0.06 A 0.05 C Shift Assignments>> C :: 177.3000 CA :: 54.2200 CB :: 43.8700 CG :: 27.3000 CD1 :: 25.3300 CD2 :: 22.8900 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>> HA :: 4.4400 HB2 :: 1.4200 HB3 :: 1.6600 HG :: 1.4600 HD11 :: 0.8100 HD12 :: 0.8100 HD13 :: 0.8100 HD21 :: 0.9650 HD22 :: 0.9650 HD23 :: 0.9650 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 1.E112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 I 0.08 K 0.08 Q 0.06 M 0.03 C Shift Assignments>> CA :: 58.4600 CB :: 29.6900 CG :: 36.0900 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 :: 8.7800 HA :: 4.1700 HB2 :: 2.0300 HB3 :: 2.0900 HG3 :: 2.3100 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 :: 120.6600 Ave N Shift Values>> N :: 120.67(3.48) 1.G113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.73 L 0.15 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.9000 CA :: 44.9500 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.6800 HA3 :: 4.3000 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.H114 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.55 C 0.41 H 0.02 C Shift Assignments>> CA :: 54.7700 CB :: 30.5900 CD2 :: 110.5800(A) 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 :: 7.9340 HA :: 4.9060 HB2 :: 3.1400 HB3 :: 3.2870 HD2 :: 6.8900 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 :: 120.8900 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.P115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.58 C 0.41 C Shift Assignments>> CA :: 62.0900 CB :: 30.6800 CG :: 27.8000 CD :: 50.6700 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 :: 4.8000 HB2 :: 1.9800 HB3 :: 2.5500 HG2 :: 2.1000 HG3 :: 2.1600 HD2 :: 3.6700 HD3 :: 3.9100 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.P116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.9 C 0.04 R 0.02 C Shift Assignments>> C :: 176.6000 CB :: 32.3000 CG :: 27.5700 CD :: 50.1600 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>> HB2 :: 1.9600 HB3 :: 2.4500 HG2 :: 2.1000 HG3 :: 2.1600 HD2 :: 3.7000 HD3 :: 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.V117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.7 C 0.29 HN Overlap>> 1.R67 1.R67 C Shift Assignments>> CA :: 62.7000 CB :: 33.2000 CG1 :: 21.7000 CG2 :: 21.4000 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 :: 8.8900 HA :: 3.7900 HB :: 1.7100 HG11 :: 0.1800 HG12 :: 0.1800 HG13 :: 0.1800 HG21 :: 0.6100 HG22 :: 0.6100 HG23 :: 0.6100 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 :: 127.4800 Ave N Shift Values>> N :: 121.14(4.54) 1.N118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 D 0.22 C 0.08 F 0.08 Y 0.07 L 0.06 C Shift Assignments>> C :: 172.7000 CA :: 53.3600 CB :: 39.2000 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>> HA :: 4.9900 HB2 :: 2.6300 HB3 :: 2.8700 HD21 :: 7.5680 HD22 :: 6.7760 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>> ND2 :: 111.6400 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.H119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.22 Q 0.18 M 0.18 K 0.14 E 0.12 H 0.02 R 0.02 Y 0.02 V 0.02 W 0.01 C Shift Assignments>> C :: 173.5000 CA :: 56.9700 CB :: 34.6700 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 :: 8.7900 HA :: 4.8200 HB2 :: 2.5400 HB3 :: 3.0400 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 :: 124.9300 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.34 C 0.33 L 0.31 A 0.01 C Shift Assignments>> C :: 174.0300 CA :: 54.4400 CB :: 46.6000 CG :: 27.1600 CD1 :: 25.4200 CD2 :: 24.2600 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.4600 HA :: 4.9500 HB2 :: 1.3700 HB3 :: 1.6200 HG :: 1.4500 HD11 :: 0.8400 HD12 :: 0.8400 HD13 :: 0.8400 HD21 :: 0.9500 HD22 :: 0.9500 HD23 :: 0.9500 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 :: 128.2800 Ave N Shift Values>> N :: 121.86(3.9) 1.R121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.58 C 0.37 R 0.04 C Shift Assignments>> C :: 173.4000 CA :: 54.3600 CB :: 34.2600 CG :: 26.3700 CD :: 44.9000 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 :: 9.8600 HA :: 4.6400 HB2 :: 1.9100 HB3 :: 2.0900 HG2 :: 1.5300 HG3 :: 1.8700 HD2 :: 2.9900 HD3 :: 3.5200 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 :: 128.0600 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.C122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.15 R 0.13 W 0.12 Q 0.12 K 0.11 E 0.09 I 0.09 H 0.08 L 0.04 M 0.01 C Shift Assignments>> C :: 174.6000 CA :: 58.2900 CB :: 28.0300 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.8350 HA :: 5.0200 HB2 :: 2.8800 HB3 :: 2.9500 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 :: 125.2900 Ave N Shift Values>> N :: 120.17(4.64) 1.E123 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> M 0.47 C 0.33 Q 0.1 E 0.08 C Shift Assignments>> C :: 174.5000 CA :: 54.4200 CB :: 32.5830 CG :: 34.6700 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 :: 8.9700 HA :: 4.6800 HB2 :: 1.2100(S) HB3 :: 2.0300 HG2 :: 1.4700(S) HG3 :: 1.7600 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 :: 125.9200 Ave N Shift Values>> N :: 120.67(3.48) 1.K124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.53 C 0.36 R 0.08 C Shift Assignments>> C :: 175.7000 CA :: 55.3570 CB :: 34.1890 CG :: 25.0800 CD :: 29.1500 CE :: 41.8000 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 :: 8.6520 HA :: 4.9600 HB3 :: 1.6500 HG2 :: 1.2100 HG3 :: 1.3800 HD3 :: 1.6100 HE3 :: 2.8800 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 :: 121.8370 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.43 G 0.27 C 0.19 R 0.09 C Shift Assignments>> C :: 175.1100 CA :: 53.8540 CB :: 44.2670 CG :: 27.4000 CD1 :: 26.3000 CD2 :: 24.8100 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.1750 HA :: 4.6500 HB2 :: 1.1100 HB3 :: 1.5800 HG :: 1.6700 HD11 :: 1.0700 HD12 :: 1.0700 HD13 :: 1.0700 HD21 :: 1.0500 HD22 :: 1.0500 HD23 :: 1.0500 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 :: 127.0000 Ave N Shift Values>> N :: 121.86(3.9) 1.T126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.9 C 0.09 HN Overlap>> 1.I85 1.I85 C Shift Assignments>> C :: 173.2000 CA :: 62.0360 CB :: 70.2840 CG2 :: 21.7600 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 :: 8.3310 HA :: 4.6500 HB :: 3.7700 HG21 :: 0.9400 HG22 :: 0.9400 HG23 :: 0.9400 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 :: 117.7790 Ave N Shift Values>> N :: 115.42(4.75) 1.F127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.65 C 0.34 C Shift Assignments>> C :: 174.8600 CA :: 56.8640 CB :: 39.0000 CD1 :: 132.2100 CD2 :: 132.2100 CE1 :: 130.6500 CE2 :: 130.6500 CZ :: 128.7000 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 :: 9.0510 HA :: 4.5900 HB2 :: 2.6500 HB3 :: 2.9500 HD1 :: 6.9800 HD2 :: 6.9800 HE1 :: 6.6400 HE2 :: 6.6400 HZ :: 5.8900 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 126.5760 Ave N Shift Values>> N :: 120.45(4.18) 1.N128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.28 D 0.24 F 0.13 Y 0.12 L 0.09 C 0.09 C Shift Assignments>> CA :: 54.4800 CB :: 39.4600 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 :: 8.8800 HA :: 4.6200 HB3 :: 2.6700 HD21 :: 7.5400 HD22 :: 6.8400 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 :: 123.0400 ND2 :: 112.7400 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.N129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.55 D 0.16 C 0.09 Y 0.06 F 0.06 L 0.04 C Shift Assignments>> CA :: 52.9000 CB :: 38.7300 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>> HA :: 4.7600 HB2 :: 2.6500 HB3 :: 2.8500 HD21 :: 7.6000 HD22 :: 6.8000 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>> ND2 :: 112.3400 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.P130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.69 C 0.3 C Shift Assignments>> C :: 177.4700 CA :: 62.5740 CB :: 32.3100 CG :: 27.0600 CD :: 50.1500 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 :: 4.7900 HB2 :: 1.9700 HB3 :: 2.0500 HG3 :: 1.6100 HD2 :: 3.4100 HD3 :: 3.7000 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.T131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.88 C 0.11 C Shift Assignments>> C :: 175.2000 CA :: 62.2000 CB :: 70.6000 CG2 :: 22.1900 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 :: 8.9500 HA :: 4.3000 HB :: 4.6700 HG21 :: 1.4500 HG22 :: 1.4500 HG23 :: 1.4500 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 :: 113.4000 Ave N Shift Values>> N :: 115.42(4.75) 1.E132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 E 0.26 I 0.2 K 0.08 Q 0.05 C Shift Assignments>> C :: 178.7000 CA :: 60.2940 CB :: 29.1610 CG :: 35.7900 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 :: 8.9320 HA :: 4.0100 HB2 :: 2.0100 HB3 :: 2.1100 HG3 :: 2.3300 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.1990 Ave N Shift Values>> N :: 120.67(3.48) 1.D133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.25 F 0.17 L 0.16 Y 0.13 D 0.08 R 0.07 C 0.07 I 0.02 C Shift Assignments>> C :: 177.8000 CA :: 57.5460 CB :: 41.8230 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 :: 8.4900 HA :: 4.3300 HB2 :: 2.5700 HB3 :: 2.7100 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.3240 Ave N Shift Values>> N :: 120.65(3.86) 1.F134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.66 C 0.33 C Shift Assignments>> C :: 177.3000 CA :: 59.5380 CB :: 39.2000 CD1 :: 131.8000 CD2 :: 131.8000 CE1 :: 130.7500 CE2 :: 130.7500 CZ :: 128.9000 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.7870 HA :: 4.6100 HB2 :: 2.8700 HB3 :: 3.3100 HD1 :: 7.0800 HD2 :: 7.0800 HE1 :: 6.5200 HE2 :: 6.5200 HZ :: 6.1700 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.9140 Ave N Shift Values>> N :: 120.45(4.18) 1.R135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 R 0.35 K 0.09 G 0.05 C Shift Assignments>> C :: 177.3700 CA :: 60.3760 CB :: 30.3960 CG :: 28.1000 CD :: 43.0000 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 :: 9.0870 HA :: 3.3500 HB2 :: 1.6700 HB3 :: 1.8600 HG2 :: 1.3300 HG3 :: 1.4500 HD2 :: 3.1500 HD3 :: 3.2600 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.7940 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.R136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 R 0.36 G 0.08 K 0.06 C Shift Assignments>> C :: 178.9500 CA :: 59.8000 CB :: 30.2170 CG :: 28.2000 CD :: 43.3800 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 :: 7.7470 HA :: 3.8200 HB2 :: 1.8700 HB3 :: 1.9400 HG2 :: 1.6300 HG3 :: 1.8800 HD3 :: 3.2200 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 :: 114.5540 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.K137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 R 0.28 K 0.18 G 0.01 HN Overlap>> 1.E96 1.E96 C Shift Assignments>> C :: 177.9800 CA :: 60.3950 CB :: 32.4470 CG :: 26.3700 CD :: 30.2700 CE :: 42.4300 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 :: 7.1540 HA :: 3.9000 HB2 :: 1.9500 HB3 :: 2.1200 HG2 :: 1.5400 HG3 :: 1.9400 HD3 :: 1.9500 HE3 :: 3.2200 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 :: 118.2980 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L138 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.56 C 0.37 R 0.02 A 0.01 G 0.01 C Shift Assignments>> C :: 179.1000 CA :: 57.2310 CB :: 42.3280 CG :: 26.0400 CD1 :: 25.0700 CD2 :: 22.1900 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.7090 HA :: 3.4200 HB2 :: 0.6800 HB3 :: 1.4800 HG :: 0.3140(S) HD11 :: -0.3400(S) HD12 :: -0.3400(S) HD13 :: -0.3400(S) HD21 :: -0.6500(S) HD22 :: -0.6500(S) HD23 :: -0.6500(S) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.1590 Ave N Shift Values>> N :: 121.86(3.9) 1.L139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.61 C 0.29 A 0.05 R 0.02 C Shift Assignments>> C :: 177.6000 CA :: 55.5290 CB :: 41.7440 CG :: 26.9000 CD1 :: 25.3000 CD2 :: 22.4800 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.5070 HA :: 4.1500 HB2 :: 1.5900 HB3 :: 1.6500 HG :: 1.6900 HD11 :: 0.7800 HD12 :: 0.7800 HD13 :: 0.7800 HD21 :: 0.7800 HD22 :: 0.7800 HD23 :: 0.7800 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 :: 115.1580 Ave N Shift Values>> N :: 121.86(3.9) 1.K140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.46 C 0.43 R 0.09 C Shift Assignments>> C :: 175.8000 CA :: 57.0520 CB :: 32.6460 CG :: 25.0400 CD :: 29.1200 CE :: 41.8000 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 :: 7.3040 HA :: 4.1100 HB2 :: 1.4040 HB3 :: 1.6990 HG2 :: 1.2100 HG3 :: 1.4230 HD2 :: 1.3490 HD3 :: 1.4770 HE3 :: 2.7600 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.2560 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.67 M 0.12 L 0.08 C 0.08 V 0.02 C Shift Assignments>> CA :: 54.7010 CB :: 20.2400 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 :: 4.2700 HB1 :: 1.5500 HB2 :: 1.5500 HB3 :: 1.5500 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.1440 Ave N Shift Values>> N :: 123.23(3.54) 2.G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.56 L 0.22 R 0.1 C 0.04 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> CA :: 44.6000 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA3 :: 4.0100 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 2.G2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.4 L 0.29 G 0.07 D 0.06 F 0.05 C 0.03 K 0.03 Y 0.03 C Shift Assignments>> CA :: 43.4000 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA3 :: 3.8200 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 2.K3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.99 C Shift Assignments>> CB :: 32.8900 CG :: 24.3200 CD :: 28.8000 CE :: 41.8000 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 :: 8.4100 HA :: 4.3300 HB3 :: 1.8600 HG3 :: 1.4400 HD3 :: 1.6600 HE3 :: 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) 2.A4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.89 M 0.09 C Shift Assignments>> CA :: 50.3100 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 :: 8.5100 HA :: 4.5900 HB1 :: 1.3600 HB2 :: 1.3600 HB3 :: 1.3600 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 2.P5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.69 C 0.3 C Shift Assignments>> CA :: 62.6100 CB :: 31.8600 CG :: 27.1300 CD :: 50.2700 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 :: 4.4100 HB2 :: 1.8800 HB3 :: 2.2900 HG3 :: 2.0160 HD2 :: 3.6500 HD3 :: 3.8300 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) 2.R6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.78 K 0.12 G 0.06 I 0.01 C Shift Assignments>> CB :: 30.4800 CD :: 43.0600 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 :: 8.5100 HA :: 4.2800 HB3 :: 1.8100 HG3 :: 1.6400 HD3 :: 3.2000 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) 2.KCR7 Overall Status: Residue type KCR not supported. 2.Q8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> Q 0.43 K 0.4 M 0.05 E 0.03 R 0.03 P 0.02 I 0.01 C Shift Assignments>> CB :: 29.2200 CG :: 33.4800 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 :: 8.5200 HA :: 4.3100 HB2 :: 1.9600 HB3 :: 2.0600 HG3 :: 2.3500 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) 2.L9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> L 0.97 G 0.02 C Shift Assignments>> CB :: 42.2600 CG :: 26.7700 CD1 :: 24.6400 CD2 :: 23.0900 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 :: 8.3800 HA :: 4.3300 HB2 :: 1.5700 HB3 :: 1.6200 HG :: 1.6200 HD11 :: 0.9200 HD12 :: 0.9200 HD13 :: 0.9200 HD21 :: 0.8600 HD22 :: 0.8600 HD23 :: 0.8600 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) 2.A10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.87 M 0.1 C 0.01 C Shift Assignments>> CA :: 52.1500 CB :: 18.9500 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4400 HA :: 4.3700 HB1 :: 1.4000 HB2 :: 1.4000 HB3 :: 1.4000 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 2.T11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.89 C 0.1 C Shift Assignments>> CA :: 61.5000 CB :: 69.6600 CG2 :: 21.3700 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 :: 8.2100 HA :: 4.2700 HB :: 4.1700 HG21 :: 1.2000 HG22 :: 1.2000 HG23 :: 1.2000 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) 2.K12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.27 L 0.23 D 0.17 F 0.11 Y 0.07 R 0.03 C 0.03 I 0.03 N 0.01 C Shift Assignments>> CE :: 41.8000 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>> HG3 :: 1.3900 HE3 :: 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) 2.A13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.81 M 0.11 C 0.03 L 0.02 C Shift Assignments>> CA :: 53.5600 CB :: 19.6900 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1500 HA :: 4.1000 HB1 :: 1.3200 HB2 :: 1.3200 HB3 :: 1.3200 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) ########################################################################### Overall Results: #Consistent: 141 #Clerical: 0 #Suspicious: 9 #Anomalous: 3 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 148 #Suspicious: 1 #Mistyped: 0 #Indeterminable: 4 Shift Relative Order (SRO) Results: #Consistent: 151 #Suspicious: 2 C Shift Results: #Consistent: 659 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 1 H Shift Results: #Consistent: 973 #Duplicate: 0 #Unknown: 0 #Suspicious: 25 #Anomalous: 2 N Shift Results: #Consistent: 122 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 Error Summary: 1.H18 HE1 = 6.3500(S), Expected = 7.95, Std = 0.4800, ChiSquare = 8.5812e-04 1.E29 HB2 = 0.2300(A), Expected = 2.02, Std = 0.2100, ChiSquare = 1.5439e-17 1.K53 HE2 = 1.5400(S), Expected = 2.92, Std = 0.1900, ChiSquare = 3.7816e-13 1.K53 HE3 = 1.6200(S), Expected = 2.91, Std = 0.2000, ChiSquare = 1.1185e-10 1.K53 SRO Rule Break>> HE2 > HB3 : 0.995656220912194 1.K53 SRO Rule Break>> HE3 > HB3 : 0.997380484610347 1.H59 H = 5.1600(S), Expected = 8.24, Std = 0.6800, ChiSquare = 5.9148e-06 1.P72 HA = 3.2600(S), Expected = 4.40, Std = 0.3300, ChiSquare = 5.5122e-04 1.E78 Typing: Suspicious 1.E78 CB = 37.1000(S), Expected = 30.01, Std = 1.7200, ChiSquare = 3.7545e-05 1.E78 HB2 = -0.6820(A), Expected = 2.02, Std = 0.2100, ChiSquare = 6.9330e-38 1.E78 HG2 = 1.5300(S), Expected = 2.27, Std = 0.2100, ChiSquare = 4.2539e-04 1.E78 SRO Rule Break>> CG > CB : 0.99165623696287 1.L86 N = 108.1300(S), Expected = 121.86, Std = 3.9000, ChiSquare = 4.3071e-04 1.K100 HB2 = 0.6000(S), Expected = 1.78, Std = 0.2500, ChiSquare = 2.3584e-06 1.K100 HD2 = 0.8000(S), Expected = 1.61, Std = 0.2200, ChiSquare = 2.3158e-04 1.L107 HB2 = 0.1800(S), Expected = 1.61, Std = 0.3400, ChiSquare = 2.6007e-05 1.L107 HG = -0.1400(S), Expected = 1.51, Std = 0.3300, ChiSquare = 5.7330e-07 1.L107 HD11 = -0.6400(S), Expected = 0.75, Std = 0.2800, ChiSquare = 6.8954e-07 1.L107 HD12 = -0.6400(S), Expected = 0.75, Std = 0.2800, ChiSquare = 6.8954e-07 1.L107 HD13 = -0.6400(S), Expected = 0.75, Std = 0.2800, ChiSquare = 6.8954e-07 1.L107 HD21 = -0.8800(S), Expected = 0.73, Std = 0.2900, ChiSquare = 2.8287e-08 1.L107 HD22 = -0.8800(S), Expected = 0.73, Std = 0.2900, ChiSquare = 2.8287e-08 1.L107 HD23 = -0.8800(S), Expected = 0.73, Std = 0.2900, ChiSquare = 2.8287e-08 1.H114 CD2 = 110.5800(A), Expected = 120.49, Std = 3.4200, ChiSquare = 3.7596e-03 1.E123 HB2 = 1.2100(S), Expected = 2.02, Std = 0.2100, ChiSquare = 1.1472e-04 1.E123 HG2 = 1.4700(S), Expected = 2.27, Std = 0.2100, ChiSquare = 1.3923e-04 1.L138 HG = 0.3140(S), Expected = 1.51, Std = 0.3300, ChiSquare = 2.8981e-04 1.L138 HD11 = -0.3400(S), Expected = 0.75, Std = 0.2800, ChiSquare = 9.9070e-05 1.L138 HD12 = -0.3400(S), Expected = 0.75, Std = 0.2800, ChiSquare = 9.9070e-05 1.L138 HD13 = -0.3400(S), Expected = 0.75, Std = 0.2800, ChiSquare = 9.9070e-05 1.L138 HD21 = -0.6500(S), Expected = 0.73, Std = 0.2900, ChiSquare = 1.9492e-06 1.L138 HD22 = -0.6500(S), Expected = 0.73, Std = 0.2900, ChiSquare = 1.9492e-06 1.L138 HD23 = -0.6500(S), Expected = 0.73, Std = 0.2900, ChiSquare = 1.9492e-06