Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.P1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.11 C Shift Assignments>> C :: 177.8860 CA :: 52.7820 CB :: 19.2460 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.8140 HA :: 4.2190 HB1 :: 1.3320 HB2 :: 1.3320 HB3 :: 1.3320 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.9600 Ave N Shift Values>> N :: 123.23(3.54) 1.G3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 L 0.12 R 0.02 F 0.01 C Shift Assignments>> C :: 173.7510 CA :: 45.1300 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5240 HA2 :: 3.8910 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.8540 Ave N Shift Values>> N :: 109.67(3.87) 1.K4 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.9 G 0.05 A 0.03 C Shift Assignments>> C :: 176.2440 CA :: 55.9410 CB :: 33.5520 CG :: 28.8600(S) CD :: 24.2110(S) CE :: 41.9540 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 :: 8.2060 HA :: 4.3010 HB2 :: 1.7350 HB3 :: 1.7350 HG2 :: 1.6320 HG3 :: 1.6320 HD2 :: 1.3450 HD3 :: 1.3450 HE2 :: 2.9220 HE3 :: 2.9220 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 :: 120.9110 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.91 M 0.07 C Shift Assignments>> C :: 177.8150 CA :: 52.3460 CB :: 19.4790 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5180 HA :: 4.3540 HB1 :: 1.3300 HB2 :: 1.3300 HB3 :: 1.3300 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.0860 Ave N Shift Values>> N :: 123.23(3.54) 1.T6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.2820 CA :: 61.7400 CB :: 70.2100 CG2 :: 21.9380 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 :: 8.4020 HA :: 4.4340 HB :: 4.2360 HG21 :: 1.2160 HG22 :: 1.2160 HG23 :: 1.2160 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.4530 Ave N Shift Values>> N :: 115.42(4.75) 1.T7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.8510 CA :: 61.8470 CB :: 70.6820 CG2 :: 21.9540 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 :: 8.4290 HA :: 4.3600 HB :: 4.5780 HG21 :: 1.2870 HG22 :: 1.2870 HG23 :: 1.2870 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.2170 Ave N Shift Values>> N :: 115.42(4.75) 1.E8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.51 I 0.34 K 0.09 Q 0.03 M 0.01 HN Overlap>> 1.F166 1.F166 C Shift Assignments>> C :: 179.5170 CA :: 59.5680 CB :: 29.2230 CG :: 36.4560 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 :: 9.0490 HA :: 3.9230 HB2 :: 2.0120 HG2 :: 2.2740 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 :: 120.8430 Ave N Shift Values>> N :: 120.67(3.48) 1.E9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.8 E 0.18 K 0.01 C Shift Assignments>> C :: 177.6350 CA :: 60.8820 CB :: 29.4100 CG :: 37.8100 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 :: 8.8570 HA :: 3.7680 HB2 :: 2.0780 HB3 :: 1.9230 HG2 :: 2.1500 HG3 :: 2.2900 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.9000 Ave N Shift Values>> N :: 120.67(3.48) 1.Q10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.35 K 0.33 E 0.16 R 0.06 I 0.06 M 0.01 HN Overlap>> 1.M221 1.M221 C Shift Assignments>> C :: 178.9860 CA :: 58.8310 CB :: 28.4800 CG :: 34.3120 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.9230 HA :: 3.8210 HB2 :: 2.0150 HB3 :: 2.1900 HG2 :: 2.3630 HG3 :: 2.3630 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.3740 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.89 R 0.09 C Shift Assignments>> C :: 178.9930 CA :: 59.5470 CB :: 32.5020 CG :: 24.9600 CE :: 41.8520 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 :: 8.2580 HA :: 3.9400 HB2 :: 1.7600 HB3 :: 1.7600 HG2 :: 1.4030 HG3 :: 1.4030 HE2 :: 2.8760 HE3 :: 2.8760 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 :: 119.2340 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.95 R 0.03 C Shift Assignments>> C :: 178.7290 CA :: 58.2170 CB :: 41.3280 CG :: 27.4530 CD1 :: 25.2820 CD2 :: 24.0980 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 :: 7.7860 HA :: 4.0600 HB2 :: 1.5610 HB3 :: 1.7790 HG :: 1.3970 HD11 :: 0.6300 HD12 :: 0.6300 HD13 :: 0.6300 HD21 :: 0.7300 HD22 :: 0.7300 HD23 :: 0.7300 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.5000 Ave N Shift Values>> N :: 121.86(3.9) 1.I13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.6440 CA :: 62.8370 CB :: 36.6170 CG1 :: 29.3680 CG2 :: 18.3900 CD1 :: 11.7370 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 :: 8.0490 HA :: 3.8170 HB :: 1.9120 HG12 :: 1.4360 HG21 :: 0.9730 HG22 :: 0.9730 HG23 :: 0.9730 HD11 :: 0.8020 HD12 :: 0.8020 HD13 :: 0.8020 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.5330 Ave N Shift Values>> N :: 121.46(4.28) 1.E14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.47 I 0.42 K 0.06 Q 0.01 M 0.01 C Shift Assignments>> C :: 181.0370 CA :: 59.8000 CB :: 29.3300 CG :: 36.8000 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 :: 8.1780 HA :: 4.1170 HB2 :: 2.1900 HB3 :: 2.1900 HG2 :: 2.3780 HG3 :: 2.2000 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 :: 121.3320 Ave N Shift Values>> N :: 120.67(3.48) 1.K15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.65 R 0.33 G 0.01 C Shift Assignments>> C :: 180.5630 CA :: 59.6670 CB :: 33.4360 CG :: 25.8600 CD :: 29.8600 CE :: 42.1000 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 :: 7.9210 HA :: 4.1200 HB2 :: 1.7650 HB3 :: 2.0710 HG2 :: 1.7470 HG3 :: 1.4730 HD2 :: 1.6360 HD3 :: 1.6360 HE2 :: 2.8600 HE3 :: 2.8600 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 :: 120.5800 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 178.5820 CA :: 63.4420 CB :: 36.1460 CG1 :: 28.2880 CG2 :: 18.6900 CD1 :: 11.1890 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 :: 8.5330 HA :: 3.7610 HB :: 2.2520 HG12 :: 1.3300 HG13 :: 1.3300 HG21 :: 1.5530 HG22 :: 1.5530 HG23 :: 1.5530 HD11 :: 0.7800 HD12 :: 0.7800 HD13 :: 0.7800 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 123.8570 Ave N Shift Values>> N :: 121.46(4.28) 1.N17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.28 F 0.22 N 0.16 E 0.11 D 0.07 I 0.05 M 0.03 L 0.03 C Shift Assignments>> C :: 178.6800 CA :: 56.1160 CB :: 37.9910 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 :: 9.0410 HA :: 4.5960 HB2 :: 2.9470 HB3 :: 2.7420 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 121.1320 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.65 A 0.28 I 0.05 C Shift Assignments>> C :: 181.2060 CA :: 55.4910 CB :: 17.6970 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3610 HA :: 4.2310 HB1 :: 1.5130 HB2 :: 1.5130 HB3 :: 1.5130 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.5740 Ave N Shift Values>> N :: 123.23(3.54) 1.G19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.91 L 0.05 A 0.01 C Shift Assignments>> C :: 175.1460 CA :: 47.1370 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4290 HA2 :: 3.8380 HA3 :: 3.6210 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.9490 Ave N Shift Values>> N :: 109.67(3.87) 1.F20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.55 Y 0.44 C Shift Assignments>> C :: 177.0840 CA :: 62.2950 CB :: 39.6960 CD1 :: 131.8500 CD2 :: 131.8500 CE1 :: 130.2270 CE2 :: 130.2270 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 :: 9.0000 HA :: 4.0790 HB2 :: 3.0950 HB3 :: 3.7480 HD1 :: 6.9800 HD2 :: 6.9800 HE1 :: 6.5590 HE2 :: 6.5590 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 :: 124.8960 Ave N Shift Values>> N :: 120.45(4.18) 1.K21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.91 R 0.08 C Shift Assignments>> C :: 179.8240 CA :: 60.0110 CB :: 32.4500 CG :: 24.6400 CD :: 29.1700 CE :: 41.6300 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 :: 8.1650 HA :: 4.0090 HB2 :: 1.9390 HB3 :: 1.9390 HG2 :: 1.5460 HG3 :: 1.5460 HD2 :: 1.6700 HD3 :: 1.6700 HE2 :: 2.9300 HE3 :: 2.9300 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 :: 118.4570 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.57 A 0.39 I 0.02 HN Overlap>> 1.I170 1.I170 C Shift Assignments>> C :: 180.6540 CA :: 54.7230 CB :: 17.5800 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4290 HA :: 4.1270 HB1 :: 1.4190 HB2 :: 1.4190 HB3 :: 1.4190 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.9830 Ave N Shift Values>> N :: 123.23(3.54) 1.A23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.54 A 0.4 I 0.03 HN Overlap>> 1.A196 1.A196 C Shift Assignments>> C :: 178.9220 CA :: 55.1600 CB :: 18.1700 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4070 HA :: 3.7650 HB1 :: 0.6390 HB2 :: 0.6390 HB3 :: 0.6390 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.9310 Ave N Shift Values>> N :: 123.23(3.54) 1.L24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.7 R 0.21 G 0.08 HN Overlap>> 1.E223 1.E223 C Shift Assignments>> C :: 180.4560 CA :: 58.1600 CB :: 42.8950 CG :: 26.3210 CD1 :: 23.7700 CD2 :: 26.4200 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 :: 8.4120 HA :: 4.1800 HB2 :: 1.9470 HB3 :: 1.4580 HG :: 1.7170 HD11 :: 0.9200 HD12 :: 0.9200 HD13 :: 0.9200 HD21 :: 0.9600 HD22 :: 0.9600 HD23 :: 0.9600 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.0080 Ave N Shift Values>> N :: 121.86(3.9) 1.A25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.56 A 0.41 I 0.02 C Shift Assignments>> C :: 180.3290 CA :: 54.6970 CB :: 17.6620 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8130 HA :: 4.1330 HB1 :: 1.3590 HB2 :: 1.3590 HB3 :: 1.3590 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.5050 Ave N Shift Values>> N :: 123.23(3.54) 1.A26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.64 M 0.33 I 0.01 HN Overlap>> 1.A142 1.A142 C Shift Assignments>> C :: 181.0400 CA :: 54.3400 CB :: 18.7000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2780 HA :: 4.0550 HB1 :: 1.5380 HB2 :: 1.5380 HB3 :: 1.5380 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.5200 Ave N Shift Values>> N :: 123.23(3.54) 1.A27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.72 M 0.25 HN Overlap>> 1.A165 1.A165 C Shift Assignments>> C :: 178.3080 CA :: 53.9500 CB :: 18.9000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4280 HA :: 4.1790 HB1 :: 1.3240 HB2 :: 1.3240 HB3 :: 1.3240 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.4510 Ave N Shift Values>> N :: 123.23(3.54) 1.A28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.56 M 0.41 I 0.01 C Shift Assignments>> C :: 178.6960 CA :: 54.2900 CB :: 18.2000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8600 HA :: 4.0180 HB1 :: 1.4590 HB2 :: 1.4590 HB3 :: 1.4590 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.8680 Ave N Shift Values>> N :: 123.23(3.54) 1.G29 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Suspicious PRTL>> G 0.76 L 0.15 R 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 174.1040 CA :: 44.9780 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.4290 HA2 :: 4.2690 HA3 :: 3.7020 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 128.2650(S) Ave N Shift Values>> N :: 109.67(3.87) 1.V30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.9 A 0.09 C Shift Assignments>> C :: 175.1360 CA :: 58.8750 CB :: 34.4170 CG1 :: 20.8880 CG2 :: 17.9600 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 :: 7.0520 HA :: 4.8010 HB :: 2.3750 HG11 :: 0.8980 HG12 :: 0.8980 HG13 :: 0.8980 HG21 :: 0.8100 HG22 :: 0.8100 HG23 :: 0.8100 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 :: 111.8830 Ave N Shift Values>> N :: 121.14(4.54) 1.Q31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.36 R 0.34 K 0.26 M 0.02 HN Overlap>> 1.K84 1.Y181 1.K84 1.Y181 C Shift Assignments>> CA :: 54.3500 CB :: 26.6630 CG :: 33.3000 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 :: 8.6870 HA :: 4.4100 HB2 :: 2.1540 HB3 :: 1.9560 HG2 :: 2.4360 HG3 :: 2.4360 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.2230 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.P32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.51 P 0.36 K 0.03 R 0.02 H 0.01 E 0.01 M 0.01 I 0.01 C Shift Assignments>> CA :: 62.1300 CB :: 32.3300 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 :: 4.3450 HB2 :: 2.3760 HB3 :: 1.9490 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.A33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.59 M 0.37 I 0.01 C Shift Assignments>> C :: 177.9010 CA :: 54.5800 CB :: 18.6750 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.9490 HA :: 4.1770 HB1 :: 1.3580 HB2 :: 1.3580 HB3 :: 1.3580 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.9680 Ave N Shift Values>> N :: 123.23(3.54) 1.D34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 R 0.25 D 0.17 K 0.08 F 0.05 G 0.03 Y 0.03 N 0.01 C Shift Assignments>> C :: 177.5640 CA :: 54.5000 CB :: 43.0270 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 :: 8.2010 HA :: 5.0320 HB2 :: 2.6630 HB3 :: 2.4370 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 114.8590 Ave N Shift Values>> N :: 120.65(3.86) 1.K35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.67 K 0.15 V 0.07 R 0.05 I 0.02 Q 0.01 C Shift Assignments>> C :: 177.1080 CA :: 62.3000 CB :: 32.5410 CG :: 25.6220 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 :: 7.5530 HA :: 3.3670 HB2 :: 1.2730 HB3 :: 1.2730 HG2 :: 1.3070 HG3 :: 1.3070 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.6910 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Y36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 175.8560 CA :: 62.0700 CB :: 37.3360 CD1 :: 133.0500 CD2 :: 133.0500 CE1 :: 118.7000 CE2 :: 118.7000 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.2440 HA :: 4.2260 HB2 :: 3.2080 HB3 :: 2.9500 HD1 :: 6.7960 HD2 :: 6.7960 HE1 :: 6.5300 HE2 :: 6.5300 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.5220 Ave N Shift Values>> N :: 120.52(4.2) 1.R37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.67 K 0.2 G 0.07 L 0.04 C Shift Assignments>> C :: 179.3470 CA :: 59.1730 CB :: 29.2090 CG :: 26.7630 CD :: 43.0030 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 :: 8.9730 HA :: 3.6030 HB2 :: 1.8920 HB3 :: 1.8920 HG2 :: 1.7350 HG3 :: 1.7350 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 118.2330 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.T38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.4250 CA :: 67.0610 CB :: 68.7620 CG2 :: 19.8000 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 :: 7.9490 HA :: 3.9120 HB :: 3.9900 HG21 :: 0.9840 HG22 :: 0.9840 HG23 :: 0.9840 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.0430 Ave N Shift Values>> N :: 115.42(4.75) 1.F39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.56 Y 0.43 C Shift Assignments>> C :: 177.0080 CA :: 62.7830 CB :: 39.7710 CD1 :: 131.9100 CD2 :: 131.9100 CE1 :: 130.9700 CE2 :: 130.9700 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 :: 9.0470 HA :: 3.7640 HB2 :: 3.1760 HB3 :: 3.1760 HD1 :: 6.9000 HD2 :: 6.9000 HE1 :: 6.7820 HE2 :: 6.7820 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 :: 125.5870 Ave N Shift Values>> N :: 120.45(4.18) 1.V40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 179.6410 CA :: 67.0460 CB :: 31.8900 CG1 :: 21.8000 CG2 :: 20.6800 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 :: 8.5400 HA :: 3.2850 HB :: 1.5850 HG11 :: 0.6330 HG12 :: 0.6330 HG13 :: 0.6330 HG21 :: 0.0530 HG22 :: 0.0530 HG23 :: 0.0530 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.0570 Ave N Shift Values>> N :: 121.14(4.54) 1.A41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.53 A 0.43 I 0.03 HN Overlap>> 1.A224 1.A224 1.A70 1.A70 C Shift Assignments>> C :: 180.4310 CA :: 55.0020 CB :: 18.1350 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0560 HA :: 4.0760 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 :: 121.6590 Ave N Shift Values>> N :: 123.23(3.54) 1.T42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> 1.T160 1.T160 C Shift Assignments>> C :: 176.6050 CA :: 68.4500 CB :: 66.7380 CG2 :: 20.8500 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 :: 7.9040 HA :: 4.1970 HB :: 3.8270 HG21 :: 1.1380 HG22 :: 1.1380 HG23 :: 1.1380 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.3960 Ave N Shift Values>> N :: 115.42(4.75) 1.F43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.59 Y 0.4 C Shift Assignments>> C :: 177.1300 CA :: 61.8830 CB :: 39.3000 CD1 :: 131.0000 CD2 :: 131.0000 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 :: 9.0240 HA :: 3.6280 HB2 :: 2.2580 HB3 :: 2.5390 HD1 :: 6.9310 HD2 :: 6.9310 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 :: 123.5020 Ave N Shift Values>> N :: 120.45(4.18) 1.G44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.05 HN Overlap>> 1.G131 1.G131 C Shift Assignments>> C :: 175.7180 CA :: 46.9260 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4760 HA2 :: 3.4080 HA3 :: 3.7650 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.3480 Ave N Shift Values>> N :: 109.67(3.87) 1.A45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.56 A 0.39 I 0.03 C Shift Assignments>> C :: 180.2990 CA :: 54.8560 CB :: 17.7550 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.4040 HA :: 4.1300 HB1 :: 1.2960 HB2 :: 1.2960 HB3 :: 1.2960 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.3440 Ave N Shift Values>> N :: 123.23(3.54) 1.A46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.54 A 0.42 I 0.02 C Shift Assignments>> C :: 181.1400 CA :: 54.4960 CB :: 17.5430 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.0090 HA :: 4.2070 HB1 :: 1.0690 HB2 :: 1.0690 HB3 :: 1.0690 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.2740 Ave N Shift Values>> N :: 123.23(3.54) 1.S47 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> 1.S73 1.S73 C Shift Assignments>> C :: 176.6870 CA :: 68.5000(A) CB :: 67.0220 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.8610 HA :: 4.2020 HB2 :: 3.8450 HB3 :: 3.8450 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 :: 116.6760 Ave N Shift Values>> N :: 116.28(3.52) 1.N48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> Y 0.25 F 0.19 N 0.18 E 0.16 D 0.05 M 0.05 I 0.04 L 0.02 C Shift Assignments>> CA :: 55.9600 CB :: 37.7010 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 :: 4.2810 HB2 :: 2.7460 HB3 :: 2.7460 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) 1.K49 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.93 G 0.06 C Shift Assignments>> C :: 177.8090 CA :: 59.4370 CB :: 32.6380 CG :: 29.2280(S) CD :: 24.4870(S) CE :: 41.6520 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 :: 7.7160 HA :: 4.0090 HB2 :: 1.7550 HB3 :: 1.7550 HG2 :: 1.5590 HG3 :: 1.5590 HE2 :: 2.8200 HE3 :: 2.8200 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 :: 120.1300 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.53 M 0.44 I 0.02 C Shift Assignments>> C :: 180.1190 CA :: 54.6660 CB :: 18.3690 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.7620 HA :: 3.9940 HB1 :: 1.3280 HB2 :: 1.3280 HB3 :: 1.3280 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.0970 Ave N Shift Values>> N :: 123.23(3.54) 1.F51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.58 Y 0.41 HN Overlap>> 1.N167 1.S65 1.N167 1.S65 C Shift Assignments>> C :: 177.9500 CA :: 59.7750 CB :: 38.3800 CD1 :: 131.0000 CD2 :: 131.0000 CE1 :: 128.9400 CE2 :: 128.9400 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 :: 8.5080 HA :: 4.2310 HB2 :: 3.1260 HD1 :: 7.3000 HD2 :: 7.3000 HE1 :: 7.0940 HE2 :: 7.0940 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 :: 116.9200 Ave N Shift Values>> N :: 120.45(4.18) 1.A52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.63 M 0.34 I 0.01 HN Overlap>> 1.R107 1.R107 C Shift Assignments>> CA :: 54.1640 CB :: 18.4820 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8850 HA :: 4.1800 HB1 :: 1.4540 HB2 :: 1.4540 HB3 :: 1.4540 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.9780 Ave N Shift Values>> N :: 123.23(3.54) 1.E53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.62 M 0.11 K 0.09 I 0.07 Q 0.07 C Shift Assignments>> C :: 177.9330 CA :: 57.6630 CB :: 30.2050 CG :: 36.2900 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 :: 7.9910 HA :: 4.1250 HB2 :: 1.9660 HG2 :: 2.2080 HG3 :: 2.4350 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 :: 118.0060 Ave N Shift Values>> N :: 120.67(3.48) 1.G54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.89 L 0.08 C Shift Assignments>> C :: 174.3270 CA :: 45.6750 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.1060 HA2 :: 3.7630 HA3 :: 4.0090 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.0970 Ave N Shift Values>> N :: 109.67(3.87) 1.L55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.88 R 0.07 A 0.02 G 0.02 C Shift Assignments>> C :: 177.7370 CA :: 55.4040 CB :: 42.2790 CG :: 26.9600 CD1 :: 23.4470 CD2 :: 25.1860 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 :: 7.9650 HA :: 4.3380 HB2 :: 1.6500 HB3 :: 1.6500 HG :: 1.6140 HD11 :: 0.8620 HD12 :: 0.8620 HD13 :: 0.8620 HD21 :: 0.7990 HD22 :: 0.7990 HD23 :: 0.7990 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.2910 Ave N Shift Values>> N :: 121.86(3.9) 1.S56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.0490 CA :: 58.8980 CB :: 63.7240 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.2430 HA :: 4.3500 HB2 :: 3.8460 HB3 :: 3.8460 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 :: 115.9530 Ave N Shift Values>> N :: 116.28(3.52) 1.G57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 L 0.12 R 0.02 F 0.01 C Shift Assignments>> C :: 173.8550 CA :: 45.1270 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3920 HA2 :: 3.9130 HA3 :: 3.9130 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.5680 Ave N Shift Values>> N :: 109.67(3.87) 1.E58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.45 Q 0.22 K 0.21 M 0.08 I 0.01 C Shift Assignments>> CA :: 54.1910 CB :: 29.3900 CG :: 35.6800 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 :: 4.5380 HB2 :: 1.9600 HB3 :: 1.9600 HG2 :: 2.2100 HG3 :: 2.2100 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 :: 121.3800 Ave N Shift Values>> N :: 120.67(3.48) 1.P59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 63.3750 CB :: 32.0520 CG :: 27.4960 CD :: 50.6440 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 :: 4.3490 HB2 :: 1.8440 HB3 :: 2.2140 HG2 :: 1.9600 HG3 :: 1.9600 HD2 :: 3.7570 HD3 :: 3.7570 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.K60 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.95 G 0.03 HN Overlap>> 1.L214 1.L214 1.D140 1.D140 C Shift Assignments>> C :: 177.3240 CA :: 56.2770 CB :: 32.8030 CG :: 28.8550(S) CD :: 24.7400(S) CE :: 41.9000 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 :: 8.5360 HA :: 4.2460 HB2 :: 1.7510 HB3 :: 1.7510 HG2 :: 1.6400 HG3 :: 1.6400 HD2 :: 1.4060 HD3 :: 1.4060 HE2 :: 2.9520 HE3 :: 2.9520 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 :: 121.5710 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.G61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.84 L 0.1 R 0.01 F 0.01 C Shift Assignments>> C :: 174.1020 CA :: 45.2320 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4900 HA2 :: 3.9080 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.1970 Ave N Shift Values>> N :: 109.67(3.87) 1.A62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.11 L 0.01 HN Overlap>> 1.K68 1.K68 C Shift Assignments>> C :: 178.1910 CA :: 53.0810 CB :: 19.4580 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2050 HA :: 4.2100 HB1 :: 1.3710 HB2 :: 1.3710 HB3 :: 1.3710 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.9660 Ave N Shift Values>> N :: 123.23(3.54) 1.A63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.83 M 0.15 HN Overlap>> 1.E124 1.E124 1.L102 1.V161 1.L102 1.V161 C Shift Assignments>> C :: 178.4990 CA :: 53.1460 CB :: 19.1060 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4290 HA :: 4.1990 HB1 :: 1.3350 HB2 :: 1.3350 HB3 :: 1.3350 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.6280 Ave N Shift Values>> N :: 123.23(3.54) 1.E64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.61 M 0.12 K 0.1 Q 0.08 I 0.06 HN Overlap>> 1.E123 1.E123 C Shift Assignments>> C :: 177.2230 CA :: 57.3870 CB :: 30.1680 CG :: 36.2600 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 :: 8.4510 HA :: 4.1990 HB2 :: 1.9610 HB3 :: 1.9610 HG2 :: 2.2550 HG3 :: 2.2550 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.7970 Ave N Shift Values>> N :: 120.67(3.48) 1.S65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.N167 1.N167 1.F51 1.F51 C Shift Assignments>> C :: 175.5640 CA :: 58.9140 CB :: 63.4870 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.4320 HA :: 4.3970 HB2 :: 3.9180 HB3 :: 3.9180 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 :: 116.8500 Ave N Shift Values>> N :: 116.28(3.52) 1.S66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.4210 CA :: 59.9060 CB :: 63.1100 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.5590 HA :: 4.3300 HB2 :: 3.9220 HB3 :: 3.9220 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 :: 118.8120 Ave N Shift Values>> N :: 116.28(3.52) 1.S67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.5930 CA :: 60.4390 CB :: 62.7800 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.4620 HA :: 4.2880 HB2 :: 3.8460 HB3 :: 3.8460 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 :: 118.6690 Ave N Shift Values>> N :: 116.28(3.52) 1.K68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.88 R 0.1 HN Overlap>> 1.A62 1.A62 C Shift Assignments>> CA :: 59.2630 CB :: 32.2960 CG :: 25.0700 CD :: 29.1000 CE :: 41.6200 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 :: 8.2120 HA :: 4.0600 HB2 :: 1.8260 HB3 :: 1.8260 HG2 :: 1.3720 HG3 :: 1.3720 HD2 :: 1.6310 HD3 :: 1.6310 HE2 :: 2.8800 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 :: 123.9780 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.58 M 0.39 I 0.01 C Shift Assignments>> CA :: 54.3300 CB :: 18.3200 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2090 HA :: 4.1360 HB1 :: 1.3650 HB2 :: 1.3650 HB3 :: 1.3650 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.4500 Ave N Shift Values>> N :: 123.23(3.54) 1.A70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.53 M 0.44 I 0.02 HN Overlap>> 1.A41 1.A41 C Shift Assignments>> CA :: 54.5500 CB :: 18.2600 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0930 HA :: 4.1050 HB1 :: 1.4360 HB2 :: 1.4360 HB3 :: 1.4360 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.6800 Ave N Shift Values>> N :: 123.23(3.54) 1.L71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.96 R 0.03 HN Overlap>> 1.I136 1.I136 C Shift Assignments>> C :: 178.6800 CA :: 57.9200 CB :: 41.2540 CG :: 27.2500 CD1 :: 24.0470 CD2 :: 25.3170 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 :: 8.0910 HA :: 4.0720 HB2 :: 1.8320 HB3 :: 1.6410 HG :: 1.4000 HD11 :: 0.6940 HD12 :: 0.6940 HD13 :: 0.6940 HD21 :: 0.6360 HD22 :: 0.6360 HD23 :: 0.6360 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.4260 Ave N Shift Values>> N :: 121.86(3.9) 1.T72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.6620 CA :: 68.0000 CB :: 66.7030 CG2 :: 21.0200 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.4390 HA :: 4.0450 HB :: 3.6300 HG21 :: 0.7950 HG22 :: 0.7950 HG23 :: 0.7950 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 :: 112.9390 Ave N Shift Values>> N :: 115.42(4.75) 1.S73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.S47 1.S47 C Shift Assignments>> C :: 177.5000 CA :: 61.6510 CB :: 62.7700 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.8300 HA :: 4.2300 HB2 :: 3.8600 HB3 :: 3.8600 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 :: 116.6740 Ave N Shift Values>> N :: 116.28(3.52) 1.K74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.69 R 0.29 HN Overlap>> 1.A220 1.A220 C Shift Assignments>> C :: 180.0270 CA :: 59.7200 CB :: 32.8110 CG :: 26.4000 CD :: 29.1600 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 :: 7.8370 HA :: 4.1780 HB2 :: 1.9210 HG2 :: 1.6790 HG3 :: 1.4800 HD2 :: 1.6400 HD3 :: 1.6400 HE2 :: 2.9420 HE3 :: 2.9420 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 122.7480 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.84 R 0.13 A 0.01 HN Overlap>> 1.A100 1.A100 C Shift Assignments>> C :: 176.4940 CA :: 57.8370 CB :: 41.1420 CG :: 27.3300 CD1 :: 22.8700 CD2 :: 26.6100 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 :: 8.3890 HA :: 3.6800 HB2 :: 1.2330 HB3 :: 1.8390 HG :: 1.6400 HD11 :: 0.9000 HD12 :: 0.9000 HD13 :: 0.9000 HD21 :: 0.8900 HD22 :: 0.8900 HD23 :: 0.8900 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 :: 122.1000 Ave N Shift Values>> N :: 121.86(3.9) 1.D76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.25 F 0.22 Y 0.17 L 0.16 D 0.08 R 0.05 I 0.03 C Shift Assignments>> C :: 178.7710 CA :: 57.8280 CB :: 41.5910 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 :: 8.2370 HA :: 4.1040 HB2 :: 2.5600 HB3 :: 2.7040 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 :: 117.7320 Ave N Shift Values>> N :: 120.65(3.86) 1.A77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.58 A 0.37 I 0.03 HN Overlap>> 1.A164 1.A164 C Shift Assignments>> C :: 180.5010 CA :: 55.0800 CB :: 17.8360 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.7010 HA :: 4.0310 HB1 :: 1.4490 HB2 :: 1.4490 HB3 :: 1.4490 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.0430 Ave N Shift Values>> N :: 123.23(3.54) 1.A78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.49 M 0.47 I 0.02 C Shift Assignments>> C :: 179.3690 CA :: 54.7730 CB :: 18.2600 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8620 HA :: 4.0970 HB1 :: 1.4140 HB2 :: 1.4140 HB3 :: 1.4140 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.5530 Ave N Shift Values>> N :: 123.23(3.54) 1.Y79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.98 H 0.01 C Shift Assignments>> C :: 180.4840 CA :: 57.9100 CB :: 35.8380 CD1 :: 131.5000 CD2 :: 131.5000 CE1 :: 118.6800 CE2 :: 118.6800 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 :: 8.8470 HA :: 4.1270 HB2 :: 3.4070 HD1 :: 7.0650 HD2 :: 7.0650 HE1 :: 6.7740 HE2 :: 6.7740 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.3920 Ave N Shift Values>> N :: 120.52(4.2) 1.K80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.71 R 0.27 G 0.01 HN Overlap>> 1.E223 1.E223 C Shift Assignments>> C :: 178.9980 CA :: 59.8610 CB :: 32.5530 CG :: 26.2000 CD :: 29.0000 CE :: 41.9500 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 :: 8.2980 HA :: 4.2120 HB2 :: 1.8500 HG2 :: 1.6620 HG3 :: 1.4490 HD2 :: 1.6120 HD3 :: 1.6120 HE2 :: 2.9340 HE3 :: 2.9340 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 :: 121.0440 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.88 R 0.09 G 0.01 HN Overlap>> 1.A169 1.A169 C Shift Assignments>> C :: 180.3810 CA :: 57.8710 CB :: 41.8520 CG :: 26.9000 CD1 :: 22.8880 CD2 :: 25.5680 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 :: 8.2070 HA :: 4.2010 HB2 :: 1.8940 HB3 :: 1.6330 HG :: 1.3320 HD11 :: 0.8580 HD12 :: 0.8580 HD13 :: 0.8580 HD21 :: 0.8510 HD22 :: 0.8510 HD23 :: 0.8510 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 :: 122.2930 Ave N Shift Values>> N :: 121.86(3.9) 1.A82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.72 A 0.18 I 0.09 C Shift Assignments>> C :: 178.3740 CA :: 56.1030 CB :: 17.5630 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.6140 HA :: 3.7360 HB1 :: 0.9200 HB2 :: 0.9200 HB3 :: 0.9200 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.8970 Ave N Shift Values>> N :: 123.23(3.54) 1.Y83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 177.3900 CA :: 62.3570 CB :: 38.7280 CD1 :: 133.1000 CD2 :: 133.1000 CE1 :: 118.4600 CE2 :: 118.4600 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 :: 8.3200 HA :: 4.3340 HB2 :: 3.5450 HB3 :: 3.2550 HD1 :: 7.1800 HD2 :: 7.1800 HE1 :: 6.8100 HE2 :: 6.8100 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 118.2040 Ave N Shift Values>> N :: 120.52(4.2) 1.K84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.21 V 0.19 R 0.14 M 0.13 H 0.11 E 0.1 Q 0.07 HN Overlap>> 1.Q31 1.Q31 C Shift Assignments>> C :: 179.6950 CA :: 59.2420 CB :: 32.3090 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 :: 8.7220 HA :: 3.8970 HB2 :: 1.9630 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 :: 119.2550 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.T85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.5630 CA :: 68.7500 CB :: 66.8630 CG2 :: 20.7800 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 :: 8.3680 HA :: 4.1200 HB :: 3.8490 HG21 :: 1.1320 HG22 :: 1.1320 HG23 :: 1.1320 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.2440 Ave N Shift Values>> N :: 115.42(4.75) 1.A86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.66 M 0.27 L 0.02 V 0.01 I 0.01 C Shift Assignments>> C :: 179.1230 CA :: 54.8870 CB :: 19.4890 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2070 HA :: 3.8840 HB1 :: 1.5460 HB2 :: 1.5460 HB3 :: 1.5460 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.3100 Ave N Shift Values>> N :: 123.23(3.54) 1.E87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.6 I 0.18 K 0.1 Q 0.05 M 0.04 C Shift Assignments>> C :: 177.6230 CA :: 58.4720 CB :: 29.6330 CG :: 36.4340 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 :: 8.3240 HA :: 3.6960 HB2 :: 1.8540 HG2 :: 1.8930 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.5720 Ave N Shift Values>> N :: 120.67(3.48) 1.G88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.71 L 0.18 R 0.05 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.4800 CA :: 44.8410 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.3330 HA2 :: 3.6410 HA3 :: 4.1130 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.5200 Ave N Shift Values>> N :: 109.67(3.87) 1.A89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.96 M 0.02 C Shift Assignments>> C :: 177.2900 CA :: 50.6150 CB :: 19.8590 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.3390 HA :: 4.4750 HB1 :: 1.2700 HB2 :: 1.2700 HB3 :: 1.2700 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.1540 Ave N Shift Values>> N :: 123.23(3.54) 1.T90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.92 S 0.07 C Shift Assignments>> C :: 174.1050 CA :: 60.6340 CB :: 67.3940 CG2 :: 22.1300 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 :: 8.1160 HA :: 4.4310 HB :: 3.8350 HG21 :: 1.3000 HG22 :: 1.3000 HG23 :: 1.3000 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 :: 112.3530 Ave N Shift Values>> N :: 115.42(4.75) 1.P91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.82 P 0.16 C Shift Assignments>> C :: 179.3000 CA :: 66.8750 CB :: 32.3270 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 :: 3.9140 HB2 :: 2.3770 HB3 :: 1.9350 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.E92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.48 I 0.3 K 0.13 Q 0.06 C Shift Assignments>> C :: 176.4260 CA :: 58.7460 CB :: 28.3470 CG :: 36.2500 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 :: 9.3400 HA :: 4.1780 HB2 :: 2.0080 HB3 :: 2.0080 HG2 :: 2.2950 HG3 :: 2.2950 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 :: 116.3970 Ave N Shift Values>> N :: 120.67(3.48) 1.A93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 L 0.08 M 0.01 HN Overlap>> 1.V209 1.V209 C Shift Assignments>> C :: 177.8080 CA :: 52.0280 CB :: 20.9430 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9840 HA :: 4.6780 HB1 :: 1.4090 HB2 :: 1.4090 HB3 :: 1.4090 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.4840 Ave N Shift Values>> N :: 123.23(3.54) 1.K94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.93 R 0.05 G 0.01 C Shift Assignments>> C :: 177.1650 CA :: 61.6750 CB :: 33.0750 CG :: 24.9500 CD :: 29.3000 CE :: 41.7400 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 :: 7.2850 HA :: 3.4650 HB2 :: 1.3910 HB3 :: 0.9000 HG2 :: 1.1820 HG3 :: 1.3900 HD2 :: 1.2290 HD3 :: 0.9950 HE2 :: 2.9300 HE3 :: 2.9300 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 :: 120.6630 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Y95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 175.3680 CA :: 62.2060 CB :: 37.3860 CD1 :: 132.4500 CD2 :: 132.4500 CE1 :: 119.3000 CE2 :: 119.3000 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 :: 8.7930 HA :: 4.0590 HB2 :: 3.1640 HB3 :: 2.9150 HD1 :: 6.7800 HD2 :: 6.7800 HE1 :: 6.4540 HE2 :: 6.4540 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 118.0610 Ave N Shift Values>> N :: 120.52(4.2) 1.D96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.29 Y 0.26 L 0.14 D 0.13 K 0.07 I 0.05 N 0.02 C Shift Assignments>> C :: 178.9270 CA :: 57.3730 CB :: 40.5110 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 :: 8.4420 HA :: 3.8200 HB2 :: 2.4900 HB3 :: 2.4900 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.1800 Ave N Shift Values>> N :: 120.65(3.86) 1.A97 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Y98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> Y 0.99 C Shift Assignments>> C :: 176.9500 CA :: 62.4800 CB :: 39.1800 CD1 :: 132.9710 CD2 :: 132.9710 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>> HA :: 3.8030 HB2 :: 2.9450 HB3 :: 3.1080 HD1 :: 6.7710 HD2 :: 6.7710 HE1 :: 6.6870 HE2 :: 6.6870 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) 1.V99 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 178.9200 CA :: 66.8000 CB :: 31.7300 CG1 :: 20.9430 CG2 :: 21.2890 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 :: 8.1260 HA :: 2.9800 HB :: 1.4100 HG11 :: -0.3240(S) HG12 :: -0.3240(S) HG13 :: -0.3240(S) HG21 :: 0.4680 HG22 :: 0.4680 HG23 :: 0.4680 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.A100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.51 A 0.44 I 0.03 HN Overlap>> 1.L75 1.L75 C Shift Assignments>> C :: 176.9090 CA :: 55.0370 CB :: 18.2430 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3630 HA :: 3.9810 HB1 :: 1.3730 HB2 :: 1.3730 HB3 :: 1.3730 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.1510 Ave N Shift Values>> N :: 123.23(3.54) 1.T101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.5820 CA :: 66.7310 CB :: 68.5500 CG2 :: 20.8500 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 :: 7.5900 HA :: 3.8070 HB :: 3.9440 HG21 :: 1.0560 HG22 :: 1.0560 HG23 :: 1.0560 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.4780 Ave N Shift Values>> N :: 115.42(4.75) 1.L102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.91 R 0.05 G 0.01 HN Overlap>> 1.E124 1.A63 1.E124 1.A63 1.V161 1.V161 C Shift Assignments>> CA :: 57.8290 CB :: 42.1490 CG :: 26.5100 CD1 :: 25.3400 CD2 :: 22.8050 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 :: 8.4490 HA :: 3.8730 HB2 :: 1.5550 HB3 :: 0.9790 HG :: 1.3220 HD11 :: 0.3750 HD12 :: 0.3750 HD13 :: 0.3750 HD21 :: 0.7930 HD22 :: 0.7930 HD23 :: 0.7930 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 :: 122.5900 Ave N Shift Values>> N :: 121.86(3.9) 1.S103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 177.4850 CA :: 62.5560 CB :: 61.3900 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.7050 HA :: 3.8730 HB2 :: 3.4900 HB3 :: 3.4900 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 :: 112.4860 Ave N Shift Values>> N :: 116.28(3.52) 1.E104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 K 0.25 Q 0.24 I 0.08 M 0.03 R 0.01 C Shift Assignments>> C :: 177.5580 CA :: 58.6150 CB :: 29.2320 CG :: 35.1360 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 :: 7.4080 HA :: 4.1240 HB2 :: 2.0400 HB3 :: 2.0400 HG2 :: 2.1800 HG3 :: 2.2200 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 :: 121.0190 Ave N Shift Values>> N :: 120.67(3.48) 1.A105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 A 0.46 I 0.03 C Shift Assignments>> C :: 181.0060 CA :: 55.1810 CB :: 18.5460 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8030 HA :: 4.1210 HB1 :: 1.4680 HB2 :: 1.4680 HB3 :: 1.4680 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.7310 Ave N Shift Values>> N :: 123.23(3.54) 1.L106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.97 R 0.01 C Shift Assignments>> C :: 179.2160 CA :: 57.8430 CB :: 41.0500 CG :: 26.6800 CD1 :: 25.2500 CD2 :: 22.8000 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 :: 8.6700 HA :: 3.9010 HB2 :: 1.7090 HB3 :: 1.3200 HG :: 1.8380 HD11 :: 0.6830 HD12 :: 0.6830 HD13 :: 0.6830 HD21 :: 0.8120 HD22 :: 0.8120 HD23 :: 0.8120 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 :: 116.6370 Ave N Shift Values>> N :: 121.86(3.9) 1.R107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.82 K 0.1 G 0.07 HN Overlap>> 1.A52 1.A52 C Shift Assignments>> C :: 179.7900 CA :: 59.6570 CB :: 29.9350 CG :: 27.3200 CD :: 42.9100 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 :: 7.9140 HA :: 3.9080 HB2 :: 1.9070 HB3 :: 1.9070 HG2 :: 1.6280 HG3 :: 1.4300 HD2 :: 3.1700 HD3 :: 3.0500 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 121.9860 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.I108 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.96 M 0.03 C Shift Assignments>> C :: 179.6850 CA :: 64.3210 CB :: 37.8320 CG1 :: 28.8910 CG2 :: 12.7080(S) CD1 :: 17.0540 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.8950 HA :: 3.6830 HB :: 1.9290 HG12 :: 1.1370 HG13 :: 1.6320 HG21 :: 0.7890 HG22 :: 0.7890 HG23 :: 0.7890 HD11 :: 0.8200 HD12 :: 0.8200 HD13 :: 0.8200 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.8100 Ave N Shift Values>> N :: 121.46(4.28) 1.I109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.99 C Shift Assignments>> CA :: 65.3670 CB :: 38.5100 CG1 :: 30.1490 CG2 :: 17.3970 CD1 :: 14.1240 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>> HA :: 3.5600 HB :: 1.7400 HG12 :: 0.8340 HG13 :: 1.8910 HG21 :: 0.7310 HG22 :: 0.7310 HG23 :: 0.7310 HD11 :: 0.6690 HD12 :: 0.6690 HD13 :: 0.6690 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) 1.A110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.53 A 0.42 I 0.03 HN Overlap>> 1.L214 1.L214 C Shift Assignments>> C :: 179.9200 CA :: 55.0900 CB :: 18.1700 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5250 HA :: 3.9380 HB1 :: 1.4470 HB2 :: 1.4470 HB3 :: 1.4470 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.4500 Ave N Shift Values>> N :: 123.23(3.54) 1.G111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.05 C Shift Assignments>> C :: 175.8310 CA :: 46.6020 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.9210 HA2 :: 3.9420 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.8760 Ave N Shift Values>> N :: 109.67(3.87) 1.T112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.0950 CA :: 63.0000 CB :: 69.7950 CG2 :: 21.6000 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 :: 7.7860 HA :: 4.3060 HB :: 4.3210 HG21 :: 1.2500 HG22 :: 1.2500 HG23 :: 1.2500 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 :: 111.7340 Ave N Shift Values>> N :: 115.42(4.75) 1.L113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.86 R 0.08 A 0.03 G 0.01 C Shift Assignments>> C :: 177.0040 CA :: 55.0400 CB :: 42.2920 CG :: 26.6000 CD1 :: 25.7600 CD2 :: 23.2300 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 :: 7.4560 HA :: 4.2620 HB2 :: 1.7050 HB3 :: 1.5000 HG :: 1.7410 HD11 :: 0.7630 HD12 :: 0.7630 HD13 :: 0.7630 HD21 :: 0.8020 HD22 :: 0.8020 HD23 :: 0.8020 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.2910 Ave N Shift Values>> N :: 121.86(3.9) 1.E114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.57 M 0.16 Q 0.11 K 0.1 I 0.02 C Shift Assignments>> C :: 176.0010 CA :: 56.2100 CB :: 30.2420 CG :: 36.0620 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.8400 HA :: 4.1510 HB2 :: 1.9180 HB3 :: 1.9180 HG2 :: 2.0800 HG3 :: 2.1800 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.6860 Ave N Shift Values>> N :: 120.67(3.48) 1.V115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.12 H 0.11 Q 0.11 R 0.1 L 0.09 K 0.09 E 0.08 F 0.06 Y 0.05 D 0.05 S 0.03 N 0.01 A 0.01 C Shift Assignments>> C :: 175.8760 CA :: 56.2700 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 :: 8.0600 HA :: 3.9790 HB :: 1.9280 HG11 :: 0.9850 HG12 :: 0.9850 HG13 :: 0.9850 HG21 :: 0.7900 HG22 :: 0.7900 HG23 :: 0.7900 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 :: 120.9220 Ave N Shift Values>> N :: 121.14(4.54) 1.H116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.99 HN Overlap>> 1.A155 1.A200 1.A155 1.A200 C Shift Assignments>> C :: 174.0230 CA :: 55.0250 CB :: 29.6610 CD2 :: 119.6900 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 :: 8.5600 HA :: 4.6260 HB2 :: 3.1930 HB3 :: 3.1930 HD2 :: 7.1300 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 :: 122.8290 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.A117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.82 M 0.16 C Shift Assignments>> C :: 177.3980 CA :: 52.3000 CB :: 18.3000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3930 HA :: 4.2060 HB1 :: 1.4260 HB2 :: 1.4260 HB3 :: 1.4260 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.8570 Ave N Shift Values>> N :: 123.23(3.54) 1.V118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.E132 1.E132 C Shift Assignments>> C :: 175.8330 CA :: 61.9230 CB :: 32.5500 CG1 :: 20.8000 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>> H :: 8.2380 HA :: 4.0110 HB :: 1.9430 HG11 :: 0.8200 HG12 :: 0.8200 HG13 :: 0.8200 HG21 :: 0.8600 HG22 :: 0.8600 HG23 :: 0.8600 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 :: 120.3290 Ave N Shift Values>> N :: 121.14(4.54) 1.K119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.3 K 0.2 H 0.15 R 0.15 Q 0.11 E 0.05 C Shift Assignments>> C :: 174.2050 CA :: 54.0590 CB :: 32.4370 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 :: 8.4420 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 :: 127.0290 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.81 K 0.09 R 0.02 I 0.02 Q 0.02 C Shift Assignments>> CA :: 63.1400 CB :: 32.3200 CG :: 29.0000 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.3220 HB2 :: 1.8280 HB3 :: 2.2160 HG2 :: 1.6400 HG3 :: 1.6400 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.A121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.86 M 0.11 C Shift Assignments>> C :: 178.2960 CA :: 53.0432 CB :: 19.3760 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4300 HA :: 4.1890 HB1 :: 1.3360 HB2 :: 1.3360 HB3 :: 1.3360 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.3300 Ave N Shift Values>> N :: 123.23(3.54) 1.A122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.9 M 0.07 C Shift Assignments>> C :: 177.7180 CA :: 52.4320 CB :: 19.5000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3260 HA :: 4.2040 HB1 :: 1.3050 HB2 :: 1.3050 HB3 :: 1.3050 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.1430 Ave N Shift Values>> N :: 123.23(3.54) 1.E123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.6 M 0.17 Q 0.09 K 0.09 I 0.03 HN Overlap>> 1.E64 1.E64 C Shift Assignments>> C :: 176.3500 CA :: 56.3020 CB :: 30.3330 CG :: 36.2000 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 :: 8.3540 HA :: 4.1420 HB2 :: 1.8450 HB3 :: 1.9330 HG2 :: 2.1800 HG3 :: 2.1800 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.7520 Ave N Shift Values>> N :: 120.67(3.48) 1.E124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.6 M 0.2 Q 0.08 K 0.07 I 0.02 HN Overlap>> 1.A63 1.L102 1.A63 1.L102 C Shift Assignments>> C :: 176.2600 CA :: 56.3070 CB :: 30.5420 CG :: 36.2300 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 :: 8.3950 HA :: 4.1930 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 :: 122.5570 Ave N Shift Values>> N :: 120.67(3.48) 1.V125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.V127 1.V127 C Shift Assignments>> C :: 175.8710 CA :: 62.2250 CB :: 32.4590 CG1 :: 20.6000 CG2 :: 21.0800 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 :: 8.2320 HA :: 3.9830 HB :: 1.9550 HG11 :: 0.8220 HG12 :: 0.8220 HG13 :: 0.8220 HG21 :: 0.8550 HG22 :: 0.8550 HG23 :: 0.8550 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.7870 Ave N Shift Values>> N :: 121.14(4.54) 1.K126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.81 R 0.17 C Shift Assignments>> C :: 176.0900 CA :: 55.8800 CB :: 33.0000 CG :: 24.7000 CD :: 28.9300 CE :: 41.9000 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 :: 8.4270 HA :: 4.3150 HB2 :: 1.6890 HB3 :: 1.6890 HG2 :: 1.3210 HG3 :: 1.3210 HD2 :: 1.6090 HD3 :: 1.6090 HE2 :: 2.8980 HE3 :: 2.8980 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 126.3560 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.V125 1.V125 C Shift Assignments>> C :: 175.7540 CA :: 61.8030 CB :: 33.1550 CG1 :: 20.7300 CG2 :: 21.0900 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 :: 8.2440 HA :: 4.0430 HB :: 1.9270 HG11 :: 0.8500 HG12 :: 0.8500 HG13 :: 0.8500 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 :: 122.7520 Ave N Shift Values>> N :: 121.14(4.54) 1.I128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.37 F 0.31 I 0.18 E 0.04 D 0.03 L 0.02 N 0.01 M 0.01 C Shift Assignments>> C :: 174.2570 CA :: 58.2440 CB :: 38.5550 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 :: 8.3880 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 :: 127.8260 Ave N Shift Values>> N :: 121.46(4.28) 1.P129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.49 P 0.46 C Shift Assignments>> C :: 176.7000 CA :: 63.2300 CB :: 32.3800 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.3300 HB2 :: 2.2610 HB3 :: 1.8720 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.A130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.84 M 0.14 L 0.01 C Shift Assignments>> C :: 178.7580 CA :: 53.3200 CB :: 19.3400 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4850 HA :: 4.1930 HB1 :: 1.3700 HB2 :: 1.3700 HB3 :: 1.3700 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.6900 Ave N Shift Values>> N :: 123.23(3.54) 1.G131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 L 0.08 HN Overlap>> 1.G44 1.G44 C Shift Assignments>> C :: 174.7580 CA :: 45.7170 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5270 HA2 :: 3.9180 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.3240 Ave N Shift Values>> N :: 109.67(3.87) 1.E132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.58 M 0.11 K 0.11 Q 0.1 I 0.07 HN Overlap>> 1.V118 1.V118 C Shift Assignments>> C :: 177.4700 CA :: 57.8900 CB :: 30.1800 CG :: 36.0180 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 :: 8.2620 HA :: 4.1700 HB2 :: 2.0180 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 :: 120.4100 Ave N Shift Values>> N :: 120.67(3.48) 1.L133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.93 R 0.04 G 0.01 C Shift Assignments>> C :: 178.0020 CA :: 56.4580 CB :: 42.0560 CG :: 27.1350 CD1 :: 24.1940 CD2 :: 24.7160 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 :: 8.2470 HA :: 4.1400 HB2 :: 1.6000 HB3 :: 1.6000 HG :: 1.6000 HD11 :: 0.8360 HD12 :: 0.8360 HD13 :: 0.8360 HD21 :: 0.8890 HD22 :: 0.8890 HD23 :: 0.8890 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.6520 Ave N Shift Values>> N :: 121.86(3.9) 1.Q134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.38 K 0.34 E 0.14 R 0.07 I 0.02 M 0.02 C Shift Assignments>> C :: 177.5440 CA :: 57.5840 CB :: 28.4210 CG :: 34.2200 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 :: 8.3770 HA :: 4.2050 HB2 :: 2.0960 HB3 :: 2.0960 HG2 :: 2.4000 HG3 :: 2.4000 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.0630 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 177.4390 CA :: 65.3760 CB :: 31.9700 CG1 :: 22.6320 CG2 :: 20.8900 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 :: 7.8720 HA :: 3.6800 HB :: 2.0970 HG11 :: 0.7500 HG12 :: 0.7500 HG13 :: 0.7500 HG21 :: 0.8950 HG22 :: 0.8950 HG23 :: 0.8950 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 118.8080 Ave N Shift Values>> N :: 121.14(4.54) 1.I136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.L71 1.L71 C Shift Assignments>> C :: 177.3640 CA :: 63.3230 CB :: 36.6430 CG1 :: 28.9000 CG2 :: 18.4000 CD1 :: 12.1400 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 :: 8.1190 HA :: 3.6940 HB :: 1.9140 HG12 :: 1.4600 HG13 :: 1.4600 HG21 :: 0.8570 HG22 :: 0.8570 HG23 :: 0.8570 HD11 :: 0.7910 HD12 :: 0.7910 HD13 :: 0.7910 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.5220 Ave N Shift Values>> N :: 121.46(4.28) 1.E137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.49 I 0.39 K 0.07 Q 0.02 M 0.01 C Shift Assignments>> C :: 179.3100 CA :: 59.7560 CB :: 29.2760 CG :: 36.6400 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 :: 8.1750 HA :: 4.1410 HB2 :: 2.0830 HB3 :: 2.0830 HG2 :: 2.2820 HG3 :: 2.2820 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 :: 120.1850 Ave N Shift Values>> N :: 120.67(3.48) 1.K138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.68 R 0.3 HN Overlap>> 1.L187 1.L187 C Shift Assignments>> C :: 178.9330 CA :: 58.0200 CB :: 31.7100 CG :: 25.8930 CD :: 28.9200 CE :: 41.8700 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 :: 4.2110 HB2 :: 1.8830 HB3 :: 1.8830 HG2 :: 1.5130 HG3 :: 1.5130 HD2 :: 1.5570 HD3 :: 1.5570 HE2 :: 2.9600 HE3 :: 2.9600 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 :: 118.7710 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 176.9120 CA :: 66.9740 CB :: 31.4510 CG1 :: 22.6370 CG2 :: 23.6000 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 :: 8.3360 HA :: 3.5370 HB :: 2.3850 HG11 :: 0.9570 HG12 :: 0.9570 HG13 :: 0.9570 HG21 :: 1.0710 HG22 :: 1.0710 HG23 :: 1.0710 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 :: 121.9790 Ave N Shift Values>> N :: 121.14(4.54) 1.D140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.27 F 0.21 L 0.16 Y 0.16 D 0.07 R 0.07 I 0.03 HN Overlap>> 1.K60 1.K60 C Shift Assignments>> C :: 178.0970 CA :: 57.8990 CB :: 41.7400 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 :: 8.5880 HA :: 4.3960 HB2 :: 2.5430 HB3 :: 2.7040 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.5960 Ave N Shift Values>> N :: 120.65(3.86) 1.A141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.61 A 0.32 I 0.04 HN Overlap>> 1.K226 1.K226 C Shift Assignments>> C :: 180.6380 CA :: 55.3930 CB :: 17.9150 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8340 HA :: 4.1010 HB1 :: 1.4910 HB2 :: 1.4910 HB3 :: 1.4910 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.9980 Ave N Shift Values>> N :: 123.23(3.54) 1.A142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.65 M 0.29 I 0.01 L 0.01 HN Overlap>> 1.A26 1.A26 C Shift Assignments>> C :: 178.9860 CA :: 54.7300 CB :: 19.2200 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1980 HA :: 4.0430 HB1 :: 1.4470 HB2 :: 1.4470 HB3 :: 1.4470 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.5200 Ave N Shift Values>> N :: 123.23(3.54) 1.F143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 176.0550 CA :: 61.8330 CB :: 39.0900 CD1 :: 131.4800 CD2 :: 131.4800 CE1 :: 130.2000 CE2 :: 130.2000 CZ :: 129.2000 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 :: 9.0920 HA :: 3.8610 HB2 :: 3.0760 HB3 :: 3.5440 HD1 :: 6.9390 HD2 :: 6.9390 HE1 :: 6.9850 HE2 :: 6.9850 HZ :: 6.2950 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 :: 120.0350 Ave N Shift Values>> N :: 120.45(4.18) 1.K144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.75 R 0.23 HN Overlap>> 1.M221 1.M221 C Shift Assignments>> C :: 180.1120 CA :: 59.8260 CB :: 32.3470 CG :: 25.9340 CD :: 29.3110 CE :: 41.8900 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 :: 7.8630 HA :: 3.8150 HB2 :: 1.9280 HB3 :: 1.9280 HG2 :: 1.7420 HG3 :: 1.4650 HD2 :: 1.6680 HD3 :: 1.6680 HE2 :: 2.9300 HE3 :: 2.9300 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 :: 118.2650 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 178.6660 CA :: 66.0740 CB :: 31.8310 CG1 :: 22.3750 CG2 :: 21.4750 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 :: 7.5800 HA :: 3.6230 HB :: 2.1310 HG11 :: 0.8980 HG12 :: 0.8980 HG13 :: 0.8980 HG21 :: 1.0570 HG22 :: 1.0570 HG23 :: 1.0570 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 :: 119.7990 Ave N Shift Values>> N :: 121.14(4.54) 1.A146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 M 0.38 I 0.02 C Shift Assignments>> C :: 178.3880 CA :: 54.8430 CB :: 18.8300 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1660 HA :: 3.6350 HB1 :: 1.3810 HB2 :: 1.3810 HB3 :: 1.3810 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.3390 Ave N Shift Values>> N :: 123.23(3.54) 1.A147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.51 M 0.46 I 0.02 HN Overlap>> 1.I184 1.I184 C Shift Assignments>> C :: 180.7400 CA :: 54.5500 CB :: 18.1240 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.3860 HA :: 4.0000 HB1 :: 1.2800 HB2 :: 1.2800 HB3 :: 1.2800 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.8050 Ave N Shift Values>> N :: 123.23(3.54) 1.T148 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.8400 CA :: 60.9200 CB :: 62.0700(S) CG2 :: 21.4400 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 :: 8.3220 HA :: 4.2000 HB :: 3.8270 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.8160 Ave N Shift Values>> N :: 115.42(4.75) 1.A149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.35 I 0.03 C Shift Assignments>> C :: 180.5750 CA :: 55.0420 CB :: 17.6750 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.5920 HA :: 3.9890 HB1 :: 1.2540 HB2 :: 1.2540 HB3 :: 1.2540 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.5500 Ave N Shift Values>> N :: 123.23(3.54) 1.A150 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.5 M 0.44 I 0.03 C Shift Assignments>> C :: 179.8670 CA :: 55.2240 CB :: 18.7910 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.7580 HA :: 4.1870 HB1 :: 1.3160 HB2 :: 1.3160 HB3 :: 1.3160 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.3610 Ave N Shift Values>> N :: 123.23(3.54) 1.N151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.29 F 0.27 D 0.14 N 0.11 L 0.08 I 0.05 E 0.01 HN Overlap>> 1.S222 1.S222 C Shift Assignments>> C :: 175.5550 CA :: 56.4100 CB :: 39.0660 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 :: 8.2200 HA :: 4.1890 HB2 :: 2.8130 HB3 :: 2.6800 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 115.1850 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.65 A 0.24 I 0.09 V 0.01 C Shift Assignments>> C :: 176.8270 CA :: 56.1380 CB :: 18.2000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 6.9650 HA :: 4.2700 HB1 :: 1.3840 HB2 :: 1.3840 HB3 :: 1.3840 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 117.9460 Ave N Shift Values>> N :: 123.23(3.54) 1.A153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.93 M 0.06 C Shift Assignments>> C :: 174.4780 CA :: 50.1960 CB :: 18.2870 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.2400 HA :: 4.6000 HB1 :: 1.2600 HB2 :: 1.2600 HB3 :: 1.2600 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.9160 Ave N Shift Values>> N :: 123.23(3.54) 1.P154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 177.4400 CA :: 62.6000 CB :: 32.2430 CG :: 28.0000 CD :: 50.6000 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 :: 4.3730 HB2 :: 2.3330 HB3 :: 1.9200 HG2 :: 1.9980 HG3 :: 1.9980 HD2 :: 3.8200 HD3 :: 3.5480 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.A155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.5 A 0.36 I 0.07 V 0.03 L 0.01 HN Overlap>> 1.A200 1.H116 1.A200 1.H116 C Shift Assignments>> C :: 179.4740 CA :: 56.1550 CB :: 19.0990 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.6200 HA :: 3.7260 HB1 :: 1.4430 HB2 :: 1.4430 HB3 :: 1.4430 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.8830 Ave N Shift Values>> N :: 123.23(3.54) 1.N156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.31 Y 0.21 F 0.17 D 0.1 E 0.07 L 0.03 M 0.03 I 0.02 C Shift Assignments>> C :: 176.0000 CA :: 55.2260 CB :: 38.0570 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 :: 8.9330 HA :: 4.5190 HB2 :: 2.7480 HB3 :: 2.6810 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 :: 113.0930 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 R 0.23 D 0.19 K 0.08 F 0.05 G 0.03 Y 0.03 N 0.01 C Shift Assignments>> C :: 175.9530 CA :: 54.1100 CB :: 42.9360 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 :: 8.1110 HA :: 5.0500 HB2 :: 2.9510 HB3 :: 2.2760 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 :: 117.6480 Ave N Shift Values>> N :: 120.65(3.86) 1.K158 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.62 R 0.28 G 0.08 C Shift Assignments>> C :: 177.5240 CA :: 61.9840 CB :: 32.7890 CG :: 26.0000 CD :: 29.0000 CE :: 42.5000 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 :: 7.1450 HA :: 3.3240 HB2 :: 0.5440(S) HB3 :: 1.1430 HG2 :: 1.3310 HG3 :: 1.3310 HD2 :: 1.2900 HD3 :: 1.0540 HE2 :: 2.6300 HE3 :: 2.9700 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 :: 118.7130 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.5 F 0.49 C Shift Assignments>> C :: 178.1410 CA :: 62.4730 CB :: 38.3030 CD1 :: 132.0000 CD2 :: 132.0000 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 :: 8.0260 HA :: 4.0870 HB2 :: 3.2070 HB3 :: 2.9660 HD1 :: 7.0160 HD2 :: 7.0160 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 :: 113.7000 Ave N Shift Values>> N :: 120.45(4.18) 1.T160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> 1.T42 1.T42 C Shift Assignments>> C :: 178.1240 CA :: 65.5030 CB :: 68.8030 CG2 :: 19.8800 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 :: 7.9170 HB :: 4.0030 HG21 :: 0.9830 HG22 :: 0.9830 HG23 :: 0.9830 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.3780 Ave N Shift Values>> N :: 115.42(4.75) 1.V161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.A63 1.L102 1.A63 1.L102 C Shift Assignments>> C :: 177.7710 CA :: 66.3610 CB :: 31.3600 CG1 :: 20.6000 CG2 :: 23.5500 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 :: 8.4300 HA :: 3.6590 HB :: 1.7630 HG11 :: 0.9720 HG12 :: 0.9720 HG13 :: 0.9720 HG21 :: 0.7080 HG22 :: 0.7080 HG23 :: 0.7080 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.6920 Ave N Shift Values>> N :: 121.14(4.54) 1.F162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.54 F 0.45 C Shift Assignments>> C :: 176.9890 CA :: 62.7050 CB :: 39.3270 CD1 :: 132.2210 CD2 :: 132.2210 CZ :: 130.2340 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 :: 8.6510 HA :: 3.7990 HB2 :: 3.2600 HB3 :: 3.2600 HD1 :: 7.0570 HD2 :: 7.0570 HZ :: 6.5940 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 :: 119.8470 Ave N Shift Values>> N :: 120.45(4.18) 1.E163 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.3 V 0.25 P 0.16 E 0.07 R 0.06 H 0.05 K 0.03 Q 0.03 M 0.01 C Shift Assignments>> C :: 177.8940 CA :: 61.8770 CB :: 30.0620 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 :: 8.6500 HA :: 3.8630 HB2 :: 2.4120 HB3 :: 2.2570 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.1440 Ave N Shift Values>> N :: 120.67(3.48) 1.A164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.56 A 0.39 I 0.03 HN Overlap>> 1.A77 1.A77 C Shift Assignments>> C :: 180.2380 CA :: 55.1180 CB :: 18.0200 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.7590 HA :: 4.2130 HB1 :: 1.4900 HB2 :: 1.4900 HB3 :: 1.4900 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.1300 Ave N Shift Values>> N :: 123.23(3.54) 1.A165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.64 M 0.32 I 0.01 HN Overlap>> 1.A27 1.A27 C Shift Assignments>> C :: 180.4990 CA :: 54.5300 CB :: 18.8900 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4750 HA :: 4.1460 HB1 :: 1.2900 HB2 :: 1.2900 HB3 :: 1.2900 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.4190 Ave N Shift Values>> N :: 123.23(3.54) 1.F166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.49 Y 0.49 HN Overlap>> 1.E8 1.E8 C Shift Assignments>> C :: 177.4270 CA :: 58.8320 CB :: 39.7400 CE1 :: 131.1000 CE2 :: 131.1000 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 :: 9.0260 HA :: 4.1960 HB2 :: 2.8840 HB3 :: 2.4590 HE1 :: 7.0350 HE2 :: 7.0350 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 :: 120.7540 Ave N Shift Values>> N :: 120.45(4.18) 1.N167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.29 F 0.22 N 0.15 E 0.11 D 0.07 I 0.05 M 0.03 L 0.03 HN Overlap>> 1.S65 1.F51 1.S65 1.F51 C Shift Assignments>> CA :: 56.2300 CB :: 37.9950 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 :: 8.4850 HA :: 4.3900 HB2 :: 2.8750 HB3 :: 3.0290 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 116.9410 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D168 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.31 Y 0.27 L 0.13 D 0.1 K 0.07 I 0.07 N 0.01 C Shift Assignments>> C :: 178.8320 CA :: 57.6970 CB :: 40.5370 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 :: 8.2830 HA :: 4.3660 HB2 :: 2.7660 HB3 :: 2.5640 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 119.4930 Ave N Shift Values>> N :: 120.65(3.86) 1.A169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.49 A 0.47 I 0.02 HN Overlap>> 1.L81 1.L81 C Shift Assignments>> CA :: 54.8920 CB :: 18.2510 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1750 HA :: 4.1380 HB1 :: 1.5360 HB2 :: 1.5360 HB3 :: 1.5360 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.2010 Ave N Shift Values>> N :: 123.23(3.54) 1.I170 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.A22 1.A22 C Shift Assignments>> C :: 178.0300 CA :: 65.3200 CB :: 38.1500 CG1 :: 29.7990 CG2 :: 16.7500 CD1 :: 12.3700 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 :: 8.5250 HA :: 3.3960 HB :: 1.6320 HG12 :: 0.4180 HG13 :: 1.3320 HG21 :: 0.5500 HG22 :: 0.5500 HG23 :: 0.5500 HD11 :: 0.0200 HD12 :: 0.0200 HD13 :: 0.0200 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 122.9600 Ave N Shift Values>> N :: 121.46(4.28) 1.K171 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.23 M 0.16 R 0.14 V 0.12 H 0.11 Q 0.1 E 0.09 C Shift Assignments>> C :: 179.1900 CA :: 58.5940 CB :: 32.4890 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 :: 8.4570 HA :: 4.1300 HB2 :: 1.8980 HB3 :: 1.8980 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 124.1500 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A172 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.48 M 0.47 I 0.03 C Shift Assignments>> C :: 181.8430 CA :: 55.0120 CB :: 18.4730 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1910 HA :: 4.1280 HB1 :: 1.4750 HB2 :: 1.4750 HB3 :: 1.4750 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.8040 Ave N Shift Values>> N :: 123.23(3.54) 1.S173 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.0710 CA :: 61.2590 CB :: 63.4140 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.5680 HA :: 4.3500 HB2 :: 3.9880 HB3 :: 3.9880 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.4020 Ave N Shift Values>> N :: 116.28(3.52) 1.T174 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 61.4530 CB :: 69.7320 CG2 :: 20.9240 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.8040 HA :: 4.6050 HB :: 4.7350 HG21 :: 1.3350 HG22 :: 1.3350 HG23 :: 1.3350 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 :: 109.1700 Ave N Shift Values>> N :: 115.42(4.75) 1.G175 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.91 L 0.05 A 0.01 C Shift Assignments>> C :: 178.1320 CA :: 47.1490 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.9880 HA2 :: 3.8910 HA3 :: 3.8910 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.4510 Ave N Shift Values>> N :: 109.67(3.87) 1.G176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.53 L 0.25 R 0.13 F 0.03 D 0.02 Y 0.01 C Shift Assignments>> C :: 173.8560 CA :: 44.4920 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.7920 HA2 :: 4.1300 HA3 :: 3.2040 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.2980 Ave N Shift Values>> N :: 109.67(3.87) 1.A177 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.66 M 0.3 I 0.01 C Shift Assignments>> C :: 177.0410 CA :: 54.5130 CB :: 18.9980 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.4670 HA :: 3.7770 HB1 :: 1.1570 HB2 :: 1.1570 HB3 :: 1.1570 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.8930 Ave N Shift Values>> N :: 123.23(3.54) 1.Y178 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 174.6590 CA :: 55.9320 CB :: 39.8480 CD1 :: 133.0500 CD2 :: 133.0500 CE1 :: 117.8000 CE2 :: 117.8000 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.3320 HA :: 4.3960 HB2 :: 2.5000 HB3 :: 2.5000 HD1 :: 6.8950 HD2 :: 6.8950 HE1 :: 6.7800 HE2 :: 6.7800 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 :: 112.6290 Ave N Shift Values>> N :: 120.52(4.2) 1.E179 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.65 M 0.19 Q 0.04 K 0.04 I 0.04 C Shift Assignments>> C :: 174.3480 CA :: 57.0640 CB :: 30.7340 CG :: 36.5400 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 :: 7.9950 HA :: 3.7900 HB2 :: 2.0750 HB3 :: 1.8200 HG2 :: 1.9330 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 117.6840 Ave N Shift Values>> N :: 120.67(3.48) 1.S180 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.1410 CA :: 55.8720 CB :: 64.9880 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.3180 HA :: 4.4950 HB2 :: 3.7600 HB3 :: 3.4020 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 :: 107.0990 Ave N Shift Values>> N :: 116.28(3.52) 1.Y181 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 HN Overlap>> 1.Q31 1.Q31 C Shift Assignments>> C :: 175.3050 CA :: 59.6940 CB :: 37.6500 CD1 :: 133.7370 CD2 :: 133.7370 CE1 :: 117.9220 CE2 :: 117.9220 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 :: 8.6290 HA :: 4.0930 HB2 :: 3.0450 HB3 :: 2.4930 HD1 :: 7.1390 HD2 :: 7.1390 HE1 :: 7.0660 HE2 :: 7.0660 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.1620 Ave N Shift Values>> N :: 120.52(4.2) 1.K182 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.73 R 0.25 C Shift Assignments>> C :: 176.4270 CA :: 58.0000 CB :: 31.5200 CG :: 25.7500 CD :: 28.9440 CE :: 41.7200 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 :: 7.3840 HA :: 3.5730 HB2 :: 1.3870 HB3 :: 1.0780 HG2 :: 0.4950(S) HG3 :: 0.8120 HD2 :: 1.3370 HE2 :: 2.7200 HE3 :: 2.7200 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 :: 118.1630 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F183 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 174.1140 CA :: 57.8520 CB :: 39.7450 CD1 :: 131.2270 CD2 :: 131.2270 CE1 :: 133.0500 CE2 :: 133.0500 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 :: 7.2580 HA :: 4.4330 HB2 :: 2.9010 HB3 :: 3.6660 HD1 :: 7.2750 HD2 :: 7.2750 HE1 :: 6.9090 HE2 :: 6.9090 HZ :: 7.1000 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 :: 115.3770 Ave N Shift Values>> N :: 120.45(4.18) 1.I184 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.97 A 0.02 HN Overlap>> 1.A147 1.A147 C Shift Assignments>> CA :: 58.3000 CB :: 38.6000 CG1 :: 27.1660 CG2 :: 17.1900 CD1 :: 12.6850 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.3890 HA :: 4.4090 HB :: 1.8000 HG12 :: 1.4710 HG13 :: 1.1200 HG21 :: 0.8930 HG22 :: 0.8930 HG23 :: 0.8930 HD11 :: 0.7940 HD12 :: 0.7940 HD13 :: 0.7940 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.7640 Ave N Shift Values>> N :: 121.46(4.28) 1.P185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 178.9500 CA :: 66.6700 CB :: 32.1900 CG :: 27.3600 CD :: 51.0000 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.3060 HB2 :: 2.3780 HB3 :: 1.9800 HG2 :: 2.0400 HG3 :: 2.0400 HD2 :: 3.6400 HD3 :: 3.8500 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.A186 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 M 0.41 I 0.02 C Shift Assignments>> CA :: 55.0310 CB :: 18.8410 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.1010 HA :: 4.1340 HB1 :: 1.3870 HB2 :: 1.3870 HB3 :: 1.3870 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.8540 Ave N Shift Values>> N :: 123.23(3.54) 1.L187 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.62 R 0.33 G 0.02 A 0.01 HN Overlap>> 1.K215 1.K215 1.K138 1.K216 1.K138 1.K216 C Shift Assignments>> C :: 177.4070 CA :: 56.3330 CB :: 42.3900 CG :: 27.6160 CD1 :: 26.6350 CD2 :: 23.3710 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 :: 7.7310 HA :: 4.2500 HB2 :: 1.8500 HG :: 1.7510 HD11 :: 1.0170 HD12 :: 1.0170 HD13 :: 1.0170 HD21 :: 1.0020 HD22 :: 1.0020 HD23 :: 1.0020 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 :: 118.8460 Ave N Shift Values>> N :: 121.86(3.9) 1.E188 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.57 E 0.33 K 0.06 Q 0.02 C Shift Assignments>> C :: 178.4650 CA :: 60.8200 CB :: 28.8860 CG :: 36.3500 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 :: 8.7050 HA :: 3.9610 HB2 :: 2.2000 HB3 :: 2.0600 HG2 :: 2.2930 HG3 :: 2.2930 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 :: 122.0480 Ave N Shift Values>> N :: 120.67(3.48) 1.A189 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.58 A 0.37 I 0.03 C Shift Assignments>> C :: 179.8410 CA :: 54.9300 CB :: 17.7000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1050 HA :: 4.0380 HB1 :: 1.3990 HB2 :: 1.3990 HB3 :: 1.3990 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 118.8800 Ave N Shift Values>> N :: 123.23(3.54) 1.A190 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.14 M 0.11 D 0.11 H 0.09 Q 0.09 R 0.08 K 0.07 E 0.05 N 0.05 F 0.04 Y 0.04 A 0.03 S 0.01 C Shift Assignments>> C :: 179.8390 CA :: 55.4180 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.4910 HA :: 4.0370 HB1 :: 1.3610 HB2 :: 1.3610 HB3 :: 1.3610 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.3990 Ave N Shift Values>> N :: 123.23(3.54) 1.V191 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.I218 1.I218 C Shift Assignments>> C :: 177.9090 CA :: 67.1630 CB :: 31.7900 CG1 :: 22.8270 CG2 :: 21.8970 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 :: 8.6120 HA :: 3.3820 HB :: 2.1180 HG11 :: 0.6220 HG12 :: 0.6220 HG13 :: 0.6220 HG21 :: 1.0330 HG22 :: 1.0330 HG23 :: 1.0330 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 :: 120.2390 Ave N Shift Values>> N :: 121.14(4.54) 1.K192 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.74 R 0.24 G 0.01 C Shift Assignments>> C :: 180.6030 CA :: 60.5530 CB :: 31.8280 CG :: 25.9340 CD :: 29.2850 CE :: 41.9100 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 :: 8.3660 HA :: 4.1650 HB2 :: 1.9480 HB3 :: 1.9480 HG2 :: 1.7260 HG3 :: 1.4770 HD2 :: 1.6730 HD3 :: 1.6730 HE2 :: 2.9100 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 :: 119.2700 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Q193 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.38 K 0.35 R 0.1 E 0.09 I 0.03 M 0.02 C Shift Assignments>> C :: 178.2550 CA :: 58.5240 CB :: 28.2340 CG :: 33.9310 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 :: 8.3020 HA :: 4.0550 HB2 :: 2.0710 HB3 :: 2.0710 HG2 :: 2.3000 HG3 :: 2.4100 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 120.0850 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A194 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.47 A 0.47 I 0.03 C Shift Assignments>> C :: 179.7000 CA :: 55.2530 CB :: 18.6580 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1940 HA :: 3.8770 HB1 :: 1.0100 HB2 :: 1.0100 HB3 :: 1.0100 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.4630 Ave N Shift Values>> N :: 123.23(3.54) 1.Y195 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 180.9930 CA :: 63.3610 CB :: 38.0680 CD1 :: 132.4000 CD2 :: 132.4000 CE1 :: 118.2000 CE2 :: 118.2000 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 :: 8.6860 HA :: 4.3000 HB2 :: 2.9540 HB3 :: 2.9540 HD1 :: 6.8600 HD2 :: 6.8600 HE1 :: 6.1300 HE2 :: 6.1300 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 :: 116.3810 Ave N Shift Values>> N :: 120.52(4.2) 1.A196 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.65 A 0.3 I 0.04 HN Overlap>> 1.A23 1.A23 C Shift Assignments>> C :: 179.6210 CA :: 55.2200 CB :: 17.5000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4480 HA :: 4.1610 HB1 :: 1.5050 HB2 :: 1.5050 HB3 :: 1.5050 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.9560 Ave N Shift Values>> N :: 123.23(3.54) 1.A197 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.61 A 0.34 I 0.04 C Shift Assignments>> C :: 178.5880 CA :: 55.2060 CB :: 17.8040 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.6490 HA :: 4.1630 HB1 :: 1.4150 HB2 :: 1.4150 HB3 :: 1.4150 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.4090 Ave N Shift Values>> N :: 123.23(3.54) 1.T198 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.6790 CA :: 62.3760 CB :: 70.8380 CG2 :: 22.7400 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 :: 7.8060 HA :: 4.3920 HB :: 4.3200 HG21 :: 1.5600 HG22 :: 1.5600 HG23 :: 1.5600 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 :: 106.1940 Ave N Shift Values>> N :: 115.42(4.75) 1.V199 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 176.2130 CA :: 65.3390 CB :: 31.9710 CG1 :: 20.7300 CG2 :: 21.4400 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 :: 7.1730 HA :: 3.7540 HB :: 2.0910 HG11 :: 0.9640 HG12 :: 0.9640 HG13 :: 0.9640 HG21 :: 1.0330 HG22 :: 1.0330 HG23 :: 1.0330 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 :: 121.8050 Ave N Shift Values>> N :: 121.14(4.54) 1.A200 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.12 HN Overlap>> 1.A155 1.A155 1.H116 1.H116 C Shift Assignments>> C :: 177.0070 CA :: 51.8590 CB :: 18.4940 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5420 HA :: 4.4570 HB1 :: 1.3410 HB2 :: 1.3410 HB3 :: 1.3410 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.8340 Ave N Shift Values>> N :: 123.23(3.54) 1.T201 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.6870 CA :: 62.1380 CB :: 70.5840 CG2 :: 22.4890 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 :: 7.4690 HA :: 4.2220 HB :: 4.0120 HG21 :: 1.2630 HG22 :: 1.2630 HG23 :: 1.2630 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.2410 Ave N Shift Values>> N :: 115.42(4.75) 1.A202 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.84 M 0.15 C Shift Assignments>> C :: 176.7820 CA :: 51.1650 CB :: 17.5960 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.6250 HA :: 4.5150 HB1 :: 1.4880 HB2 :: 1.4880 HB3 :: 1.4880 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 128.2900 Ave N Shift Values>> N :: 123.23(3.54) 1.P203 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 178.6700 CA :: 66.2500 CB :: 32.4000 CG :: 27.7840 CD :: 50.4200 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 :: 4.0890 HB2 :: 2.4290 HB3 :: 2.0000 HG2 :: 2.0500 HG3 :: 2.2000 HD2 :: 3.8630 HD3 :: 3.8630 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.E204 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.47 I 0.38 K 0.09 Q 0.03 C Shift Assignments>> C :: 177.4840 CA :: 59.4890 CB :: 28.8960 CG :: 36.5150 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 :: 9.7110 HA :: 4.2050 HB2 :: 2.0730 HB3 :: 2.0730 HG2 :: 2.3600 HG3 :: 2.3600 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 :: 115.5380 Ave N Shift Values>> N :: 120.67(3.48) 1.V205 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 175.5360 CA :: 61.0650 CB :: 32.6520 CG1 :: 21.9700 CG2 :: 20.3970 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 :: 7.7650 HA :: 4.6410 HB :: 2.4010 HG11 :: 0.9520 HG12 :: 0.9520 HG13 :: 0.9520 HG21 :: 0.9120 HG22 :: 0.9120 HG23 :: 0.9120 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 :: 113.0430 Ave N Shift Values>> N :: 121.14(4.54) 1.K206 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.58 R 0.37 G 0.03 C Shift Assignments>> C :: 177.7500 CA :: 61.5070 CB :: 34.1890 CG :: 26.3930 CD :: 29.4900 CE :: 42.0000 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 :: 7.4150 HA :: 3.7690 HB2 :: 2.0360 HB3 :: 1.8500 HG2 :: 1.7530 HG3 :: 1.4840 HD2 :: 1.6800 HD3 :: 1.6800 HE2 :: 2.9300 HE3 :: 2.9300 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 :: 121.8490 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Y207 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 176.0200 CA :: 62.7610 CB :: 36.9820 CD1 :: 131.1300 CD2 :: 131.1300 CE1 :: 127.7430(S) CE2 :: 127.7430(S) 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 :: 8.9420 HA :: 3.8030 HB2 :: 2.3860 HB3 :: 2.6380 HD1 :: 6.7250 HD2 :: 6.7250 HE1 :: 6.7960 HE2 :: 6.7960 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 :: 117.2220 Ave N Shift Values>> N :: 120.52(4.2) 1.T208 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 177.1360 CA :: 68.8550 CB :: 66.8180 CG2 :: 21.8780 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 :: 7.8220 HA :: 4.1360 HB :: 3.6140 HG21 :: 1.2380 HG22 :: 1.2380 HG23 :: 1.2380 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.8690 Ave N Shift Values>> N :: 115.42(4.75) 1.V209 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.A93 1.A93 C Shift Assignments>> C :: 178.0200 CA :: 67.0000 CB :: 31.6990 CG1 :: 21.0450 CG2 :: 23.2640 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 :: 8.0510 HA :: 3.5070 HB :: 2.0660 HG11 :: 0.8050 HG12 :: 0.8050 HG13 :: 0.8050 HG21 :: 1.0440 HG22 :: 1.0440 HG23 :: 1.0440 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 :: 123.4710 Ave N Shift Values>> N :: 121.14(4.54) 1.F210 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> F 0.55 Y 0.44 C Shift Assignments>> C :: 175.2170 CA :: 60.7200 CB :: 39.6370 CD1 :: 131.6780 CD2 :: 131.6780 CE1 :: 130.4000 CE2 :: 130.4000 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 :: 8.0470 HA :: 3.8120 HB2 :: 2.9100 HB3 :: 3.0880 HD1 :: 6.2380 HD2 :: 6.2380 HE1 :: 5.9970(S) HE2 :: 5.9970(S) 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 :: 123.1780 Ave N Shift Values>> N :: 120.45(4.18) 1.E211 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.49 E 0.45 M 0.03 K 0.01 C Shift Assignments>> C :: 178.3000 CA :: 59.8540 CB :: 30.3180 CG :: 37.7000 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 :: 8.8300 HA :: 2.9590 HB2 :: 1.3990 HB3 :: 1.6600 HG2 :: 2.0210 HG3 :: 2.0210 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 :: 120.5240 Ave N Shift Values>> N :: 120.67(3.48) 1.T212 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.0200 CA :: 66.6450 CB :: 68.7040 CG2 :: 21.2450 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 :: 7.9780 HA :: 3.6940 HB :: 4.0810 HG21 :: 1.1370 HG22 :: 1.1370 HG23 :: 1.1370 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.3710 Ave N Shift Values>> N :: 115.42(4.75) 1.A213 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.59 A 0.36 I 0.03 C Shift Assignments>> C :: 180.6150 CA :: 54.9500 CB :: 17.6680 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9080 HA :: 3.8990 HB1 :: 1.2570 HB2 :: 1.2570 HB3 :: 1.2570 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.0700 Ave N Shift Values>> N :: 123.23(3.54) 1.L214 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.64 L 0.3 V 0.04 HN Overlap>> 1.A110 1.K60 1.A110 1.K60 C Shift Assignments>> C :: 177.4030 CA :: 57.0950 CB :: 35.7150(S) CG :: 26.5800 CD1 :: 23.4060 CD2 :: 27.4560 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 :: 8.4990 HA :: 3.7160 HB2 :: 1.0440 HG :: 1.1310 HD11 :: 0.4400 HD12 :: 0.4400 HD13 :: 0.4400 HD21 :: 0.8800 HD22 :: 0.8800 HD23 :: 0.8800 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.4940 Ave N Shift Values>> N :: 121.86(3.9) 1.K215 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.82 R 0.16 HN Overlap>> 1.L187 1.K216 1.L187 1.K216 C Shift Assignments>> C :: 179.4400 CA :: 59.5000 CB :: 31.8800 CG :: 24.4400 CD :: 29.0300 CE :: 41.8600 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 :: 7.6780 HA :: 2.9460 HB2 :: 1.7380 HB3 :: 1.7380 HG2 :: 1.1290 HG3 :: 1.1290 HD2 :: 1.5170 HD3 :: 1.5170 HE2 :: 2.9200 HE3 :: 2.9200 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 :: 118.9000 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K216 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.84 R 0.14 HN Overlap>> 1.K215 1.L187 1.K215 1.L187 C Shift Assignments>> C :: 178.9600 CA :: 59.7700 CB :: 32.3300 CG :: 25.4270 CD :: 29.2210 CE :: 41.8520 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 :: 7.6780 HA :: 3.8140 HB2 :: 1.7530 HB3 :: 1.7530 HG2 :: 1.3520 HG3 :: 1.5000 HD2 :: 1.5590 HD3 :: 1.5590 HE2 :: 2.8760 HE3 :: 2.8760 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 :: 118.9000 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A217 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 M 0.4 I 0.02 C Shift Assignments>> C :: 180.7070 CA :: 54.8350 CB :: 18.6940 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.6990 HA :: 4.0780 HB1 :: 1.3910 HB2 :: 1.3910 HB3 :: 1.3910 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.6280 Ave N Shift Values>> N :: 123.23(3.54) 1.I218 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 HN Overlap>> 1.V191 1.V191 C Shift Assignments>> C :: 178.4580 CA :: 65.2960 CB :: 37.7240 CG1 :: 29.3410 CG2 :: 16.8390 CD1 :: 14.2780 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 :: 8.5190 HA :: 3.6160 HB :: 1.5430 HG12 :: 1.5200 HG13 :: 0.6940 HG21 :: 0.7640 HG22 :: 0.7640 HG23 :: 0.7640 HD11 :: 0.5040 HD12 :: 0.5040 HD13 :: 0.5040 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.1900 Ave N Shift Values>> N :: 121.46(4.28) 1.T219 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.1220 CA :: 68.6860 CB :: 67.0310 CG2 :: 21.3500 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 :: 8.3290 HA :: 4.2270 HB :: 3.8770 HG21 :: 1.1400 HG22 :: 1.1400 HG23 :: 1.1400 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.7480 Ave N Shift Values>> N :: 115.42(4.75) 1.A220 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.58 A 0.37 I 0.03 HN Overlap>> 1.K74 1.K74 C Shift Assignments>> C :: 180.5800 CA :: 55.0130 CB :: 17.7700 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8410 HA :: 4.1200 HB1 :: 1.2510 HB2 :: 1.2510 HB3 :: 1.2510 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.8290 Ave N Shift Values>> N :: 123.23(3.54) 1.M221 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.98 I 0.01 HN Overlap>> 1.K144 1.K144 1.Q10 1.Q10 C Shift Assignments>> C :: 178.2260 CA :: 59.2400 CB :: 33.6240 CG :: 32.0900 CE :: 17.0800 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 :: 7.8860 HA :: 4.0820 HB2 :: 2.2460 HB3 :: 2.0040 HG2 :: 2.7270 HG3 :: 2.5330 HE1 :: 1.8450 HE2 :: 1.8450 HE3 :: 1.8450 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 :: 118.3520 Ave N Shift Values>> N :: 120.09(3.57) 1.S222 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.N151 1.N151 C Shift Assignments>> C :: 176.6870 CA :: 60.9200 CB :: 62.7630 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.1540 HA :: 4.1000 HB2 :: 3.9380 HB3 :: 3.9380 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 :: 115.2420 Ave N Shift Values>> N :: 116.28(3.52) 1.E223 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.59 I 0.18 K 0.11 Q 0.05 M 0.03 HN Overlap>> 1.L24 1.K80 1.L24 1.K80 C Shift Assignments>> C :: 178.5620 CA :: 58.4260 CB :: 29.5100 CG :: 36.4000 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 :: 8.3360 HA :: 3.9900 HB2 :: 1.9950 HB3 :: 1.9950 HG2 :: 2.2900 HG3 :: 2.1720 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.9500 Ave N Shift Values>> N :: 120.67(3.48) 1.A224 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.59 M 0.38 I 0.01 HN Overlap>> 1.A41 1.A41 C Shift Assignments>> C :: 179.4120 CA :: 54.1630 CB :: 18.2340 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9430 HA :: 4.1370 HB1 :: 1.4110 HB2 :: 1.4110 HB3 :: 1.4110 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.6550 Ave N Shift Values>> N :: 123.23(3.54) 1.Q225 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.39 K 0.37 R 0.09 E 0.08 M 0.04 I 0.01 C Shift Assignments>> C :: 177.1640 CA :: 56.9870 CB :: 28.6020 CG :: 33.7540 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.7910 HA :: 4.1380 HB2 :: 1.9800 HB3 :: 2.1800 HG2 :: 2.3660 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 116.9510 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K226 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.82 R 0.16 HN Overlap>> 1.A141 1.A141 C Shift Assignments>> C :: 176.9090 CA :: 57.7000 CB :: 32.8600 CG :: 25.0500 CD :: 29.2300 CE :: 41.9500 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 :: 7.8630 HA :: 4.0890 HB2 :: 1.7810 HB3 :: 1.7810 HG2 :: 1.5950 HG3 :: 1.5950 HE2 :: 2.8800 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 :: 119.9930 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A227 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 M 0.1 HN Overlap>> 1.A228 1.A228 C Shift Assignments>> C :: 177.3750 CA :: 52.4740 CB :: 19.1400 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8410 HA :: 4.2060 HB1 :: 1.3610 HB2 :: 1.3610 HB3 :: 1.3610 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.3670 Ave N Shift Values>> N :: 123.23(3.54) 1.A228 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 M 0.11 HN Overlap>> 1.A227 1.A227 C Shift Assignments>> C :: 177.3330 CA :: 52.4130 CB :: 19.0160 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8910 HA :: 4.2110 HB1 :: 1.3260 HB2 :: 1.3260 HB3 :: 1.3260 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.4650 Ave N Shift Values>> N :: 123.23(3.54) 1.K229 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.92 R 0.05 A 0.01 G 0.01 C Shift Assignments>> C :: 181.1410 CA :: 54.0690 CB :: 32.6440 CG :: 24.5200 CE :: 41.8460 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 :: 8.1400 HA :: 4.5600 HB2 :: 1.7680 HB3 :: 1.9150 HG2 :: 1.4100 HG3 :: 1.4100 HE2 :: 2.9080 HE3 :: 2.9080 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 :: 121.9340 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P230 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 172.2500 CA :: 63.5000 CB :: 32.1600 CG :: 27.3400 CD :: 50.6100 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 :: 4.3310 HB2 :: 2.2250 HG2 :: 1.9000 HD2 :: 3.5770 HD3 :: 3.7590 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.A231 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.81 M 0.12 L 0.04 C Shift Assignments>> C :: 172.2370 CA :: 54.0000 CB :: 19.9280 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0260 HA :: 4.5030 HB1 :: 1.1860 HB2 :: 1.1860 HB3 :: 1.1860 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 130.0590 Ave N Shift Values>> N :: 123.23(3.54) ########################################################################### Overall Results: #Consistent: 218 #Clerical: 0 #Suspicious: 11 #Anomalous: 0 #Mistyped: 2 #Indeterminable: 0 Typing Results: #Consistent: 223 #Suspicious: 4 #Mistyped: 2 #Indeterminable: 2 Shift Relative Order (SRO) Results: #Consistent: 231 #Suspicious: 0 C Shift Results: #Consistent: 924 #Duplicate: 0 #Unknown: 0 #Suspicious: 11 #Anomalous: 1 H Shift Results: #Consistent:1429 #Duplicate: 0 #Unknown: 0 #Suspicious: 7 #Anomalous: 0 N Shift Results: #Consistent: 216 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 0 Error Summary: 1.K4 Typing: Suspicious 1.K4 CG = 28.8600(S), Expected = 24.89, Std = 1.1300, ChiSquare = 4.4262e-04 1.K4 CD = 24.2110(S), Expected = 28.96, Std = 1.0800, ChiSquare = 1.0965e-05 1.G29 N = 128.2650(S), Expected = 109.67, Std = 3.8700, ChiSquare = 1.5482e-06 1.S47 Typing: Mistyped 1.S47 CA = 68.5000(A), Expected = 58.72, Std = 2.0700, ChiSquare = 2.3053e-06 1.K49 Typing: Suspicious 1.K49 CG = 29.2280(S), Expected = 24.89, Std = 1.1300, ChiSquare = 1.2357e-04 1.K49 CD = 24.4870(S), Expected = 28.96, Std = 1.0800, ChiSquare = 3.4479e-05 1.K60 Typing: Suspicious 1.K60 CG = 28.8550(S), Expected = 24.89, Std = 1.1300, ChiSquare = 4.5005e-04 1.K60 CD = 24.7400(S), Expected = 28.96, Std = 1.0800, ChiSquare = 9.3292e-05 1.V99 HG11 = -0.3240(S), Expected = 0.83, Std = 0.2600, ChiSquare = 9.0604e-06 1.V99 HG12 = -0.3240(S), Expected = 0.83, Std = 0.2600, ChiSquare = 9.0604e-06 1.V99 HG13 = -0.3240(S), Expected = 0.83, Std = 0.2600, ChiSquare = 9.0604e-06 1.I108 CG2 = 12.7080(S), Expected = 17.53, Std = 1.3600, ChiSquare = 3.9174e-04 1.T148 Typing: Mistyped 1.T148 CB = 62.0700(S), Expected = 69.73, Std = 1.6300, ChiSquare = 2.6094e-06 1.K158 HB2 = 0.5440(S), Expected = 1.78, Std = 0.2500, ChiSquare = 7.6536e-07 1.K182 HG2 = 0.4950(S), Expected = 1.37, Std = 0.2600, ChiSquare = 7.6437e-04 1.Y207 Typing: Suspicious 1.Y207 CE1 = 127.7430(S), Expected = 117.93, Std = 1.1900, ChiSquare = 1.6349e-16 1.Y207 CE2 = 127.7430(S), Expected = 117.90, Std = 1.1800, ChiSquare = 7.3338e-17 1.F210 HE1 = 5.9970(S), Expected = 7.08, Std = 0.3100, ChiSquare = 4.7665e-04 1.F210 HE2 = 5.9970(S), Expected = 7.08, Std = 0.3200, ChiSquare = 7.1340e-04 1.L214 CB = 35.7150(S), Expected = 42.31, Std = 1.8800, ChiSquare = 4.5153e-04