Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.M4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> M 0.2 K 0.18 C 0.15 Q 0.12 R 0.1 H 0.09 W 0.06 E 0.04 V 0.01 C Shift Assignments>> C :: 176.0760 CA :: 55.7120 CB :: 32.7460 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) 1.S5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.1830 CA :: 58.3390 CB :: 63.9040 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.3170 HB2 :: 3.7760 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 :: 117.7080 Ave N Shift Values>> N :: 116.28(3.52) 1.D6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 L 0.21 F 0.1 N 0.1 K 0.09 Y 0.08 C 0.06 HN Overlap>> 1.E23 1.V82 1.E23 1.V82 C Shift Assignments>> C :: 175.8710 CA :: 54.5690 CB :: 41.0030 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 :: 8.3220 HB3 :: 2.5970 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 123.2050 Ave N Shift Values>> N :: 120.65(3.86) 1.N7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.46 D 0.21 C 0.08 F 0.08 Y 0.07 L 0.06 C Shift Assignments>> C :: 175.1670 CA :: 53.3970 CB :: 39.0900 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 :: 8.2300 HB2 :: 2.6650 HB3 :: 2.7630 HD21 :: 7.5180 HD22 :: 6.8410 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.2410 ND2 :: 114.2040 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.38 C 0.32 M 0.09 K 0.07 Q 0.07 I 0.02 HN Overlap>> 1.D18 1.D18 1.E85 1.E85 C Shift Assignments>> C :: 176.0810 CA :: 56.8100 CB :: 30.1520 CG :: 36.0670 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 :: 8.2900 HB2 :: 1.8580 HB3 :: 1.9850 HG3 :: 2.1930 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 :: 121.9670 Ave N Shift Values>> N :: 120.67(3.48) 1.D9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 L 0.22 K 0.1 N 0.1 F 0.1 Y 0.07 C 0.05 R 0.01 HN Overlap>> 1.Q36 1.Q36 2.L102 2.L102 C Shift Assignments>> C :: 175.6190 CA :: 54.4020 CB :: 41.1120 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 :: 8.2340 HB2 :: 2.4780 HB3 :: 2.5170 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 :: 121.7210 Ave N Shift Values>> N :: 120.65(3.86) 1.N10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.5 D 0.2 C 0.08 F 0.07 Y 0.06 L 0.05 HN Overlap>> 1.L93 1.L93 C Shift Assignments>> C :: 174.8270 CA :: 53.0580 CB :: 39.0320 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 :: 8.1050 HB2 :: 2.5720 HB3 :: 2.6640 HD21 :: 7.4630 HD22 :: 6.8120 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.6760 ND2 :: 114.0150 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.F11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.39 F 0.39 C 0.21 C Shift Assignments>> C :: 175.3900 CA :: 57.8740 CB :: 39.3150 CD1 :: 132.1960 CE1 :: 131.6220 CZ :: 129.9390 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 :: 8.1950 HB2 :: 2.9530 HB3 :: 3.0650 HD1 :: 7.1540 HE1 :: 7.2180 HZ :: 7.1610 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 :: 122.2010 Ave N Shift Values>> N :: 120.45(4.18) 1.D12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 L 0.23 K 0.11 N 0.09 F 0.09 Y 0.06 C 0.05 R 0.01 C Shift Assignments>> C :: 176.3070 CA :: 54.2580 CB :: 41.2730 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 :: 8.2310 HB3 :: 2.5510 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 123.5640 Ave N Shift Values>> N :: 120.65(3.86) 1.G13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 R 0.01 C Shift Assignments>> C :: 173.6680 CA :: 45.3680 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.6680 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.5550 Ave N Shift Values>> N :: 109.67(3.87) 1.D14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 L 0.24 K 0.13 F 0.08 N 0.07 Y 0.06 C 0.05 R 0.02 HN Overlap>> 1.Q36 1.Q36 C Shift Assignments>> C :: 175.6050 CA :: 54.2460 CB :: 41.4820 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 :: 8.1460 HB3 :: 2.5290 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 :: 121.5790 Ave N Shift Values>> N :: 120.65(3.86) 1.D15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 L 0.22 N 0.1 K 0.1 F 0.08 Y 0.06 C 0.05 R 0.01 C Shift Assignments>> C :: 175.3430 CA :: 54.1290 CB :: 41.1930 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 :: 8.0710 HB3 :: 2.4700 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 :: 121.3230 Ave N Shift Values>> N :: 120.65(3.86) 1.F16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.44 Y 0.38 C 0.17 HN Overlap>> 1.V39 1.E64 1.V39 1.E64 C Shift Assignments>> C :: 174.9490 CA :: 57.8860 CB :: 40.8710 CD1 :: 132.0620 CE1 :: 131.3400 CZ :: 129.4390 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 :: 8.0680 HA :: 4.4140 HB2 :: 2.7560 HB3 :: 2.9070 HD1 :: 6.9670 HE1 :: 7.0430 HZ :: 6.9530 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 :: 120.3270 Ave N Shift Values>> N :: 120.45(4.18) 1.D17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 L 0.26 K 0.13 N 0.07 F 0.06 C 0.04 R 0.04 Y 0.04 HN Overlap>> 1.E33 1.E33 C Shift Assignments>> C :: 175.7420 CA :: 53.8120 CB :: 41.7490 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 :: 8.4960 HB2 :: 2.4890 HB3 :: 2.5970 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 :: 122.8910 Ave N Shift Values>> N :: 120.65(3.86) 1.D18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 L 0.24 K 0.14 F 0.09 N 0.07 Y 0.06 C 0.05 R 0.02 HN Overlap>> 1.E8 1.E85 1.E8 1.E85 C Shift Assignments>> C :: 176.0560 CA :: 54.4700 CB :: 41.4590 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 :: 8.2880 HB2 :: 2.4740 HB3 :: 2.5970 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 :: 121.9180 Ave N Shift Values>> N :: 120.65(3.86) 1.V19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.67 C 0.32 HN Overlap>> 2.S83 2.S83 C Shift Assignments>> C :: 175.9200 CA :: 62.3640 CB :: 32.6400 CG1 :: 21.1510 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 :: 8.0200 HB :: 1.9820 HG11 :: 0.8250 HG12 :: 0.8250 HG13 :: 0.8250 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 :: 121.1890 Ave N Shift Values>> N :: 121.14(4.54) 1.E20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.4 C 0.32 M 0.11 Q 0.07 K 0.06 I 0.02 HN Overlap>> 1.A77 2.V11 1.A77 2.V11 C Shift Assignments>> C :: 176.2680 CA :: 56.3260 CB :: 30.2790 CG :: 36.1580 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 :: 8.4340 HB2 :: 1.8630 HB3 :: 1.9990 HG3 :: 2.1980 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 125.9430 Ave N Shift Values>> N :: 120.67(3.48) 1.E21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.4 C 0.33 M 0.11 Q 0.06 K 0.05 I 0.02 C Shift Assignments>> C :: 175.9850 CA :: 56.5050 CB :: 30.3920 CG :: 36.1680 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.4150 HB2 :: 1.8630 HB3 :: 1.9990 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 :: 123.5930 Ave N Shift Values>> N :: 120.67(3.48) 1.D22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 L 0.24 K 0.13 F 0.08 N 0.08 Y 0.06 C 0.05 R 0.02 HN Overlap>> 1.I95 1.E89 2.V18 1.I95 1.E89 2.V18 C Shift Assignments>> C :: 176.4420 CA :: 54.2200 CB :: 41.4390 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 :: 8.3210 HB3 :: 2.5940 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 :: 122.6950 Ave N Shift Values>> N :: 120.65(3.86) 1.E23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.39 C 0.33 M 0.1 Q 0.06 K 0.06 I 0.02 HN Overlap>> 1.V82 1.D6 1.V82 1.D6 C Shift Assignments>> C :: 176.9060 CA :: 56.7980 CB :: 30.3480 CG :: 36.1640 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 :: 8.3330 HB2 :: 1.8940 HB3 :: 2.0300 HG3 :: 2.2180 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 123.2050 Ave N Shift Values>> N :: 120.67(3.48) 1.G24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.07 C 0.03 C Shift Assignments>> C :: 174.3060 CA :: 45.8340 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.4450 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.5750 Ave N Shift Values>> N :: 109.67(3.87) 1.L25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.29 D 0.18 R 0.17 K 0.15 F 0.07 C 0.04 Y 0.04 N 0.01 G 0.01 C Shift Assignments>> C :: 176.8460 CA :: 54.9510 CB :: 42.5340 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 :: 7.9250 HB3 :: 1.5060 HD11 :: 0.6690 HD12 :: 0.6690 HD13 :: 0.6690 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 :: 121.7660 Ave N Shift Values>> N :: 121.86(3.9) 1.D26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 L 0.24 K 0.14 F 0.09 N 0.07 Y 0.06 C 0.05 R 0.02 HN Overlap>> 1.T129 1.E32 1.T129 1.E32 C Shift Assignments>> C :: 175.8580 CA :: 54.5080 CB :: 41.4490 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 :: 8.4180 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.5220 Ave N Shift Values>> N :: 120.65(3.86) 1.D27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 L 0.22 N 0.11 K 0.1 F 0.09 Y 0.07 C 0.05 R 0.01 C Shift Assignments>> C :: 176.1390 CA :: 54.2950 CB :: 41.1050 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 :: 8.1000 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.7610 Ave N Shift Values>> N :: 120.65(3.86) 1.L28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.25 K 0.19 R 0.18 D 0.12 F 0.09 Y 0.06 C 0.05 C Shift Assignments>> C :: 177.3940 CA :: 56.1670 CB :: 42.4630 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 :: 8.0020 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 :: 122.6630 Ave N Shift Values>> N :: 121.86(3.9) 1.E29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> R 0.15 H 0.15 W 0.12 C 0.12 E 0.12 Q 0.11 M 0.1 K 0.08 C Shift Assignments>> C :: 176.1820 CA :: 56.1180 CB :: 30.7680 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) 1.N30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 D 0.19 C 0.09 F 0.08 Y 0.08 L 0.05 HN Overlap>> 1.E99 2.D97 1.E99 2.D97 C Shift Assignments>> C :: 175.0200 CA :: 53.3890 CB :: 38.9350 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 :: 8.5150 HB2 :: 2.6590 HB3 :: 2.7720 HD21 :: 7.6100 HD22 :: 6.8130 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 :: 121.1570 ND2 :: 113.8740 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.A31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 M 0.07 C 0.01 C Shift Assignments>> C :: 177.4070 CA :: 52.2800 CB :: 19.3980 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1730 HB1 :: 1.2880 HB2 :: 1.2880 HB3 :: 1.2880 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.8890 Ave N Shift Values>> N :: 123.23(3.54) 1.E32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.15 R 0.14 E 0.14 W 0.13 Q 0.13 C 0.12 K 0.07 M 0.06 HN Overlap>> 1.T129 1.T129 1.D26 1.D26 C Shift Assignments>> C :: 176.5840 CA :: 56.6220 CB :: 30.2120 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 :: 8.4300 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 :: 121.5760 Ave N Shift Values>> N :: 120.67(3.48) 1.E33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.15 R 0.14 E 0.14 W 0.14 Q 0.12 C 0.12 K 0.07 M 0.06 HN Overlap>> 1.D17 1.D17 C Shift Assignments>> C :: 176.4620 CA :: 56.7370 CB :: 30.2070 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 :: 8.4060 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 :: 122.8610 Ave N Shift Values>> N :: 120.67(3.48) 1.E34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> R 0.15 H 0.15 C 0.12 W 0.12 E 0.12 Q 0.1 M 0.1 K 0.08 C Shift Assignments>> C :: 176.6910 CA :: 56.2360 CB :: 30.8510 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) 1.G35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 173.9740 CA :: 45.4080 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3630 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.7290 Ave N Shift Values>> N :: 109.67(3.87) 1.Q36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.11 L 0.11 H 0.09 Q 0.09 R 0.08 K 0.07 D 0.06 E 0.06 W 0.06 C 0.05 F 0.04 Y 0.04 N 0.02 S 0.02 A 0.02 HN Overlap>> 1.D14 1.D9 1.D14 1.D9 C Shift Assignments>> CA :: 55.9010 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 :: 8.1930 HE21 :: 7.5550 HE22 :: 6.8470 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 121.6670 NE2 :: 113.8770 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> M 0.15 R 0.14 C 0.13 H 0.13 K 0.12 W 0.1 E 0.09 Q 0.07 V 0.01 C Shift Assignments>> C :: 175.4230 CA :: 56.3000 CB :: 31.5520 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) 1.N38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.56 D 0.14 C 0.09 Y 0.06 F 0.06 L 0.03 M 0.01 HN Overlap>> 2.H81 2.H81 C Shift Assignments>> C :: 173.4070 CA :: 52.9590 CB :: 38.5230 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 :: 8.9630 HA :: 4.9620 HB2 :: 2.9920 HB3 :: 2.7320 HD21 :: 7.3890 HD22 :: 6.5930 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 123.9150 ND2 :: 112.8010 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.75 V 0.24 HN Overlap>> 1.F16 1.F16 1.E64 1.E64 C Shift Assignments>> C :: 174.8750 CA :: 59.0590 CB :: 36.1360 CG1 :: 21.7240 CG2 :: 20.5770 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 :: 8.1030 HA :: 5.7140 HB :: 2.1080 HG11 :: 1.0710 HG12 :: 1.0710 HG13 :: 1.0710 HG21 :: 0.9400 HG22 :: 0.9400 HG23 :: 0.9400 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 :: 120.3260 Ave N Shift Values>> N :: 121.14(4.54) 1.E40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 M 0.13 E 0.07 C Shift Assignments>> C :: 173.4390 CA :: 54.9350 CB :: 34.2950 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 :: 9.3560 HA :: 4.6530 HB3 :: 1.9930 HG2 :: 2.2170 HG3 :: 2.3260 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 125.3650 Ave N Shift Values>> N :: 120.67(3.48) 1.I41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 I 0.19 A 0.01 C Shift Assignments>> C :: 175.2990 CA :: 58.7260 CB :: 36.0020 CG1 :: 27.4610 CG2 :: 19.4300 CD1 :: 10.8240 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 :: 8.6250 HA :: 4.5500 HB :: 2.0390 HG12 :: 1.1270 HG13 :: 1.3900 HG21 :: 0.7750 HG22 :: 0.7750 HG23 :: 0.7750 HD11 :: 0.5640 HD12 :: 0.5640 HD13 :: 0.5640 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.9250 Ave N Shift Values>> N :: 121.46(4.28) 1.L42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.69 C 0.12 G 0.1 A 0.04 R 0.02 C Shift Assignments>> C :: 174.2900 CA :: 52.3700 CB :: 43.1910 CG :: 26.8870 CD1 :: 25.1660 CD2 :: 23.4450 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 :: 8.9040 HA :: 4.8600 HB2 :: 1.5060 HB3 :: 1.3990 HG :: 1.3980 HD11 :: 0.6280 HD12 :: 0.6280 HD13 :: 0.6280 HD21 :: 0.7160 HD22 :: 0.7160 HD23 :: 0.7160 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 :: 130.2580 Ave N Shift Values>> N :: 121.86(3.9) 1.P43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.7 C 0.29 C Shift Assignments>> C :: 176.5160 CA :: 62.7550 CB :: 31.8650 CG :: 27.4610 CD :: 50.4090 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 :: 4.5820 HB2 :: 1.9170 HB3 :: 2.2230 HG2 :: 1.8750 HG3 :: 2.0380 HD2 :: 3.8030 HD3 :: 3.5970 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.S44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.5290 CA :: 58.4680 CB :: 63.7400 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.7050 HA :: 4.2080 HB2 :: 3.7480 HB3 :: 3.5160 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 :: 116.1660 Ave N Shift Values>> N :: 116.28(3.52) 1.G45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 L 0.1 C 0.03 R 0.01 F 0.01 HN Overlap>> 2.T77 2.T77 C Shift Assignments>> C :: 173.5740 CA :: 45.2200 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.1610 HA2 :: 3.7730 HA3 :: 3.9510 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.0200 Ave N Shift Values>> N :: 109.67(3.87) 1.E46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.39 C 0.31 M 0.11 Q 0.08 K 0.07 I 0.01 C Shift Assignments>> C :: 175.8960 CA :: 56.0230 CB :: 30.2620 CG :: 36.0670 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 :: 8.0370 HA :: 4.1890 HB2 :: 1.7990 HB3 :: 1.8950 HG3 :: 2.1910 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 :: 122.2760 Ave N Shift Values>> N :: 120.67(3.48) 1.R47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.49 C 0.27 K 0.14 G 0.05 L 0.02 HN Overlap>> 1.A96 1.A96 C Shift Assignments>> C :: 174.1660 CA :: 53.8200 CB :: 29.9790 CG :: 26.3140 CD :: 42.9510 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 :: 8.3260 HA :: 4.4430 HB3 :: 1.7560 HG3 :: 1.6250 HD3 :: 3.1090 HE :: 7.2460 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 124.2130 NE :: 85.3960 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.P48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.69 C 0.3 C Shift Assignments>> C :: 176.5760 CA :: 62.6340 CB :: 32.2250 CG :: 27.4610 CD :: 50.4090 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 :: 4.3620 HB2 :: 1.7890 HB3 :: 2.1550 HG2 :: 1.8140 HG3 :: 1.9350 HD2 :: 3.5340 HD3 :: 3.6570 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.Q49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.31 K 0.28 C 0.23 E 0.06 M 0.06 R 0.03 HN Overlap>> 1.I127 1.I127 C Shift Assignments>> C :: 175.8540 CA :: 55.8590 CB :: 29.3030 CG :: 33.7720 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 :: 8.6620 HA :: 4.1220 HB2 :: 1.9010 HB3 :: 2.0050 HG3 :: 2.3220 HE21 :: 7.5010 HE22 :: 6.7730 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 :: 122.8070 NE2 :: 113.9650 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 M 0.09 C 0.01 HN Overlap>> 2.A110 2.A110 C Shift Assignments>> C :: 177.2820 CA :: 52.4240 CB :: 19.2550 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3200 HA :: 4.2030 HB1 :: 1.2810 HB2 :: 1.2810 HB3 :: 1.2810 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 127.1680 Ave N Shift Values>> N :: 123.23(3.54) 1.N51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.55 C 0.11 D 0.11 Y 0.07 F 0.06 L 0.02 E 0.02 M 0.01 C Shift Assignments>> C :: 174.8750 CA :: 53.2620 CB :: 38.1610 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 :: 8.4000 HA :: 4.4950 HB3 :: 2.7050 HD21 :: 7.5000 HD22 :: 6.8080 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 118.3510 ND2 :: 113.7070 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.Q52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.3 C 0.24 M 0.21 K 0.16 E 0.06 HN Overlap>> 2.V95 2.V95 C Shift Assignments>> C :: 175.3940 CA :: 55.5530 CB :: 30.4270 CG :: 33.7720 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 :: 7.9510 HA :: 4.2090 HB2 :: 1.7990 HB3 :: 1.9320 HG2 :: 2.1500 HG3 :: 2.2210 HE21 :: 7.4930 HE22 :: 6.9700 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 :: 120.7240 NE2 :: 113.5870 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.K53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.45 C 0.36 R 0.16 C Shift Assignments>> C :: 175.6080 CA :: 56.0740 CB :: 32.0150 CG :: 24.5930 CD :: 28.6090 CE :: 41.8040 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 :: 8.4590 HA :: 4.2090 HB2 :: 1.6410 HB3 :: 1.6930 HG2 :: 1.2260 HG3 :: 1.3320 HD3 :: 1.5930 HE3 :: 2.8900 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 125.5540 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R54 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.5 K 0.34 R 0.15 C Shift Assignments>> C :: 177.4150 CA :: 56.3770 CB :: 31.9650 CG :: 27.4610 CD :: 41.2300 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 :: 8.1670 HA :: 4.3780 HB2 :: 1.5190 HB3 :: 1.9480 HG2 :: 1.0900 HG3 :: 1.2460 HD2 :: 1.2940(S) HD3 :: 2.4540 HE :: 5.7810 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 :: 126.4980 NE :: 83.1580 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) SRO Rule Breaks>> (HD2 > HB2 : 0.9950) (HD2 > HB3 : 0.9951) 1.I55 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> I 0.68 C 0.31 C Shift Assignments>> C :: 177.9870 CA :: 61.3070 CB :: 40.1490 CG1 :: 26.3140 CG2 :: 18.2820 CD1 :: 14.2660 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 :: 11.1200(S) HA :: 4.6170 HB :: 2.0910 HG12 :: 1.2690 HG13 :: 1.3020 HG21 :: 0.8310 HG22 :: 0.8310 HG23 :: 0.8310 HD11 :: 0.8110 HD12 :: 0.8110 HD13 :: 0.8110 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 :: 122.2310 Ave N Shift Values>> N :: 121.46(4.28) 1.T56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.83 C 0.16 HN Overlap>> 2.K17 2.K17 C Shift Assignments>> C :: 173.3760 CA :: 62.1710 CB :: 70.0320 CG2 :: 22.8720 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 :: 8.7060 HA :: 4.5100 HB :: 4.4200 HG21 :: 1.2690 HG22 :: 1.2690 HG23 :: 1.2690 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.2810 Ave N Shift Values>> N :: 115.42(4.75) 1.T57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.77 C 0.21 A 0.01 C Shift Assignments>> C :: 173.4520 CA :: 58.8150 CB :: 69.4890 CG2 :: 21.1510 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 :: 7.9790 HA :: 4.5480 HB :: 4.3050 HG21 :: 1.2980 HG22 :: 1.2980 HG23 :: 1.2980 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 :: 112.1070 Ave N Shift Values>> N :: 115.42(4.75) 1.P58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.68 C 0.31 C Shift Assignments>> C :: 174.6380 CA :: 63.5650 CB :: 30.0430 CG :: 27.4610 CD :: 50.9820 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 :: 3.7820 HB2 :: 2.0600 HB3 :: 2.1330 HG2 :: 1.5040 HG3 :: 2.0330 HD3 :: 3.7290 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.Y59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.66 C 0.33 C Shift Assignments>> C :: 175.3320 CA :: 56.8780 CB :: 39.1560 CD1 :: 133.2530 CE1 :: 118.2290 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 :: 7.2740 HA :: 4.5800 HB2 :: 2.5010 HB3 :: 2.7640 HD1 :: 6.8920 HE1 :: 6.7150 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 120.4090 Ave N Shift Values>> N :: 120.52(4.2) 1.M60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.43 C 0.35 A 0.2 C Shift Assignments>> C :: 176.8640 CA :: 55.5940 CB :: 34.4980 CG :: 32.0510 CE :: 18.2820 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.2450 HA :: 4.3580 HB2 :: 1.7500 HB3 :: 1.8880 HG2 :: 2.3830 HG3 :: 2.9490 HE1 :: 1.9090 HE2 :: 1.9090 HE3 :: 1.9090 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 :: 125.2050 Ave N Shift Values>> N :: 120.09(3.57) 1.T61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.9 C 0.09 C Shift Assignments>> C :: 175.2550 CA :: 61.5470 CB :: 70.1520 CG2 :: 21.1510 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.3980 HA :: 4.4200 HB :: 4.7630 HG21 :: 1.1330 HG22 :: 1.1330 HG23 :: 1.1330 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 124.8370 Ave N Shift Values>> N :: 115.42(4.75) 1.K62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 K 0.42 R 0.07 HN Overlap>> 1.L100 1.L100 C Shift Assignments>> C :: 179.4800 CA :: 59.9650 CB :: 31.2810 CG :: 25.1660 CD :: 29.1830 CE :: 41.8040 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 :: 8.7070 HA :: 3.9400 HB2 :: 1.7900 HB3 :: 1.8670 HG2 :: 1.3960 HG3 :: 1.5280 HD3 :: 1.6720 HE3 :: 2.9410 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 :: 122.4840 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.Y63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.59 C 0.4 HN Overlap>> 2.M30 2.M30 C Shift Assignments>> C :: 176.9010 CA :: 61.0000 CB :: 38.0520 CD1 :: 133.4810 CE1 :: 118.5110 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 :: 8.9340 HA :: 4.0240 HB2 :: 2.8590 HB3 :: 3.1360 HD1 :: 7.0410 HE1 :: 6.6880 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 123.7340 Ave N Shift Values>> N :: 120.52(4.2) 1.E64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 I 0.33 E 0.11 HN Overlap>> 1.F16 1.V39 1.F16 1.V39 C Shift Assignments>> C :: 178.1660 CA :: 59.8350 CB :: 30.0030 CG :: 38.3610 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 :: 8.0700 HA :: 3.1900 HB2 :: 2.3190 HB3 :: 1.4450 HG2 :: 2.0160 HG3 :: 2.4580 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 :: 120.3340 Ave N Shift Values>> N :: 120.67(3.48) 1.R65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 R 0.4 G 0.1 K 0.02 HN Overlap>> 1.L69 1.L69 C Shift Assignments>> C :: 177.2960 CA :: 59.9830 CB :: 30.1520 CG :: 27.4610 CD :: 43.5250 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 :: 8.3640 HA :: 3.8220 HB2 :: 1.6550 HB3 :: 1.8880 HG2 :: 1.4040 HG3 :: 1.4290 HD3 :: 3.1190 HE :: 7.4010 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 119.3100 NE :: 85.8350 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.A66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.57 A 0.34 I 0.04 C 0.03 C Shift Assignments>> CA :: 55.4510 CB :: 18.1610 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.5400 HA :: 3.9250 HB1 :: 1.4570 HB2 :: 1.4570 HB3 :: 1.4570 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.0840 Ave N Shift Values>> N :: 123.23(3.54) 1.R67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.59 L 0.31 K 0.06 R 0.02 C Shift Assignments>> C :: 180.0320 CA :: 56.3980 CB :: 27.7140 CG :: 27.4610 CD :: 40.6560 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> HA :: 4.1090 HB3 :: 1.6390 HG3 :: 1.0920 HD2 :: 2.8620 HD3 :: 2.9770 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) 1.V68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.78 C 0.21 C Shift Assignments>> C :: 177.1420 CA :: 67.4590 CB :: 31.2490 CG1 :: 21.7240 CG2 :: 24.5930 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.0650 HA :: 3.3030 HB :: 2.2210 HG11 :: 0.7630 HG12 :: 0.7630 HG13 :: 0.7630 HG21 :: 0.8870 HG22 :: 0.8870 HG23 :: 0.8870 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.0550 Ave N Shift Values>> N :: 121.14(4.54) 1.L69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.48 C 0.4 R 0.09 HN Overlap>> 1.R65 1.R65 C Shift Assignments>> C :: 178.8760 CA :: 58.1450 CB :: 42.0820 CG :: 26.8870 CD1 :: 26.3140 CD2 :: 23.4450 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 :: 8.3530 HA :: 3.7710 HB2 :: 1.8690 HB3 :: 1.1680 HG :: 1.8550 HD11 :: 0.7620 HD12 :: 0.7620 HD13 :: 0.7620 HD21 :: 0.7150 HD22 :: 0.7150 HD23 :: 0.7150 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.3060 Ave N Shift Values>> N :: 121.86(3.9) 1.G70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 C 0.09 P 0.05 A 0.04 L 0.03 N 0.01 C Shift Assignments>> C :: 176.6800 CA :: 47.6500 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3540 HA2 :: 3.7390 HA3 :: 4.1220 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.6400 Ave N Shift Values>> N :: 109.67(3.87) 1.T71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.97 C 0.02 HN Overlap>> 1.S117 1.S117 C Shift Assignments>> C :: 176.6410 CA :: 67.1420 CB :: 68.7960 CG2 :: 20.5770 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 :: 8.0420 HA :: 3.9570 HB :: 4.0240 HG21 :: 1.1010 HG22 :: 1.1010 HG23 :: 1.1010 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 :: 118.7290 Ave N Shift Values>> N :: 115.42(4.75) 1.R72 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.4 C 0.34 R 0.14 L 0.09 G 0.01 C Shift Assignments>> C :: 177.5100 CA :: 57.3530 CB :: 29.2430 CG :: 25.1660 CD :: 42.3770 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 :: 8.5160 HA :: 3.9580 HB2 :: 2.0890 HB3 :: 1.7230 HG3 :: 1.8690 HD2 :: 2.5600 HD3 :: 3.7250 HE :: 11.361(S) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.5570 NE :: 88.0440 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.A73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.64 A 0.27 I 0.05 C 0.02 HN Overlap>> 2.F80 2.F80 C Shift Assignments>> C :: 179.8420 CA :: 55.4370 CB :: 17.6540 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.8830 HA :: 3.8630 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 :: 122.7160 Ave N Shift Values>> N :: 123.23(3.54) 1.L74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.45 C 0.34 K 0.19 C Shift Assignments>> C :: 178.9880 CA :: 57.9190 CB :: 41.3230 CG :: 26.8870 CD1 :: 24.5930 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 :: 7.3250 HA :: 4.0060 HB2 :: 1.7000 HB3 :: 1.8080 HG :: 1.7490 HD11 :: 0.8250 HD12 :: 0.8250 HD13 :: 0.8250 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.7370 Ave N Shift Values>> N :: 121.86(3.9) 1.Q75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 K 0.22 R 0.19 Q 0.16 M 0.02 C Shift Assignments>> C :: 179.8520 CA :: 58.8260 CB :: 27.8470 CG :: 32.6250 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 :: 7.4980 HA :: 3.9630 HB2 :: 2.4590 HB3 :: 1.7880 HG2 :: 2.3630 HG3 :: 2.7690 HE21 :: 7.6020 HE22 :: 6.0200 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 :: 118.5230 NE2 :: 108.5110 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.88 C 0.11 HN Overlap>> 2.E91 2.E91 C Shift Assignments>> C :: 180.2450 CA :: 65.2920 CB :: 38.3280 CG1 :: 28.6090 CG2 :: 16.5610 CD1 :: 14.2660 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 :: 8.4170 HA :: 3.5510 HB :: 1.8480 HG13 :: 1.6400 HG21 :: 0.8550 HG22 :: 0.8550 HG23 :: 0.8550 HD11 :: 0.8320 HD12 :: 0.8320 HD13 :: 0.8320 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 :: 122.1160 Ave N Shift Values>> N :: 121.46(4.28) 1.A77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 A 0.46 I 0.02 C 0.02 HN Overlap>> 1.E20 1.E20 2.V11 2.V11 C Shift Assignments>> C :: 178.5790 CA :: 54.7390 CB :: 18.1170 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.4730 HA :: 4.2090 HB1 :: 1.5480 HB2 :: 1.5480 HB3 :: 1.5480 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.9500 Ave N Shift Values>> N :: 123.23(3.54) 1.M78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.5 C 0.32 A 0.16 C Shift Assignments>> C :: 175.4730 CA :: 54.8200 CB :: 31.1840 CG :: 32.0510 CE :: 16.5610 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 :: 7.4510 HA :: 4.6460 HB2 :: 2.0660 HB3 :: 2.3560 HG2 :: 2.5830 HG3 :: 2.7450 HE1 :: 2.0270 HE2 :: 2.0270 HE3 :: 2.0270 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 :: 117.3330 Ave N Shift Values>> N :: 120.09(3.57) 1.C79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 K 0.22 I 0.15 V 0.12 L 0.05 T 0.03 R 0.01 P 0.01 W 0.01 C Shift Assignments>> C :: 174.4590 CA :: 60.8210 CB :: 24.3970 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8770 HA :: 4.0420 HB2 :: 3.1770 HB3 :: 3.2670 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 111.5880 Ave N Shift Values>> N :: 120.17(4.64) 1.A80 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 :: 175.0960 CA :: 51.3240 CB :: 18.1650 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.9740 HA :: 4.4100 HB1 :: 1.1260 HB2 :: 1.1260 HB3 :: 1.1260 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.7640 Ave N Shift Values>> N :: 123.23(3.54) 1.P81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.66 C 0.33 C Shift Assignments>> C :: 176.8660 CA :: 62.8940 CB :: 31.9150 CG :: 28.6090 CD :: 50.4090 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 :: 4.3250 HB2 :: 1.7520 HB3 :: 2.2230 HG2 :: 1.9700 HG3 :: 2.0080 HD2 :: 3.5870 HD3 :: 3.7710 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.V82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.64 C 0.35 HN Overlap>> 1.E23 1.E23 1.D6 1.D6 C Shift Assignments>> C :: 177.6420 CA :: 62.0200 CB :: 33.3360 CG1 :: 22.2980 CG2 :: 21.7240 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 :: 8.2690 HA :: 3.8950 HB :: 1.9980 HG11 :: 1.0670 HG12 :: 1.0670 HG13 :: 1.0670 HG21 :: 1.0120 HG22 :: 1.0120 HG23 :: 1.0120 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 :: 123.1500 Ave N Shift Values>> N :: 121.14(4.54) 1.M83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.45 C 0.27 A 0.27 C Shift Assignments>> C :: 175.8160 CA :: 54.7320 CB :: 33.4200 CG :: 32.6250 CE :: 17.7090 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.8260 HA :: 4.6410 HB2 :: 1.8160 HB3 :: 2.1880 HG2 :: 2.3510 HG3 :: 2.7690 HE1 :: 1.9500 HE2 :: 1.9500 HE3 :: 1.9500 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.3610 Ave N Shift Values>> N :: 120.09(3.57) 1.V84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.92 A 0.03 V 0.03 C Shift Assignments>> C :: 174.2620 CA :: 58.1590 CB :: 35.7850 CG1 :: 22.2980 CG2 :: 17.7090 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 :: 6.9500 HA :: 4.5260 HB :: 2.1130 HG11 :: 0.7010 HG12 :: 0.7010 HG13 :: 0.7010 HG21 :: 0.5760 HG22 :: 0.5760 HG23 :: 0.5760 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 :: 110.9350 Ave N Shift Values>> N :: 121.14(4.54) 1.E85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.38 C 0.31 K 0.11 Q 0.08 M 0.04 I 0.04 HN Overlap>> 1.D18 1.E8 1.D18 1.E8 C Shift Assignments>> C :: 176.8840 CA :: 56.7610 CB :: 29.5260 CG :: 36.0670 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 :: 8.3210 HA :: 4.1550 HB2 :: 1.8340 HB3 :: 1.9330 HG2 :: 2.2160 HG3 :: 2.2570 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.9440 Ave N Shift Values>> N :: 120.67(3.48) 1.L86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.57 C 0.31 R 0.08 G 0.01 C Shift Assignments>> C :: 177.6760 CA :: 55.6680 CB :: 42.4720 CG :: 27.4610 CD1 :: 24.0190 CD2 :: 25.1660 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 :: 8.5290 HA :: 4.1590 HB2 :: 1.7850 HB3 :: 1.5980 HG :: 1.6820 HD11 :: 0.7770 HD12 :: 0.7770 HD13 :: 0.7770 HD21 :: 0.9380 HD22 :: 0.9380 HD23 :: 0.9380 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 125.2570 Ave N Shift Values>> N :: 121.86(3.9) 1.E87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.44 C 0.35 K 0.08 M 0.04 Q 0.04 I 0.03 C Shift Assignments>> C :: 176.4170 CA :: 55.4120 CB :: 29.4900 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 :: 9.4670 HA :: 4.1360 HB2 :: 1.8480 HB3 :: 2.0960 HG2 :: 1.9500 HG3 :: 2.0690 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 :: 121.6780 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 0.76 L 0.13 C 0.03 R 0.03 F 0.01 C Shift Assignments>> C :: 174.3700 CA :: 45.0370 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.0710 HA2 :: 3.5370 HA3 :: 4.1280 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.6820 Ave N Shift Values>> N :: 109.67(3.87) 1.E89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 E 0.39 I 0.09 M 0.04 K 0.03 Q 0.02 HN Overlap>> 1.D22 1.I95 1.D22 1.I95 2.V18 2.V18 C Shift Assignments>> C :: 176.2020 CA :: 58.5900 CB :: 30.2140 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 :: 8.4250 HA :: 4.1310 HB2 :: 2.0180 HB3 :: 1.7280 HG3 :: 2.1820 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 :: 122.7030 Ave N Shift Values>> N :: 120.67(3.48) 1.T90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.88 C 0.11 C Shift Assignments>> C :: 174.5890 CA :: 61.4940 CB :: 71.0780 CG2 :: 21.1510 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 :: 8.4060 HA :: 4.4190 HB :: 4.2260 HG21 :: 1.0860 HG22 :: 1.0860 HG23 :: 1.0860 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 :: 112.1100 Ave N Shift Values>> N :: 115.42(4.75) 1.D91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 D 0.27 R 0.14 K 0.06 G 0.05 N 0.04 C 0.04 F 0.03 Y 0.02 C Shift Assignments>> C :: 174.8210 CA :: 52.3320 CB :: 42.7220 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 :: 8.4880 HA :: 4.8620 HB2 :: 2.6230 HB3 :: 2.8140 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 :: 128.4220 Ave N Shift Values>> N :: 120.65(3.86) 1.P92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.78 C 0.21 C Shift Assignments>> C :: 177.4400 CA :: 65.9000 CB :: 33.1990 CG :: 27.4610 CD :: 50.9820 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 :: 4.0430 HB2 :: 2.1810 HB3 :: 2.4890 HG2 :: 1.9120 HG3 :: 2.1100 HD2 :: 3.8090 HD3 :: 4.2430 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.L93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.51 C 0.46 R 0.01 HN Overlap>> 1.N10 1.N10 C Shift Assignments>> C :: 178.5800 CA :: 57.9270 CB :: 41.1910 CG :: 27.4610 CD1 :: 24.0190 CD2 :: 25.1660 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 :: 8.1000 HA :: 4.0260 HB2 :: 1.5530 HB3 :: 1.7390 HG :: 1.5450 HD11 :: 0.8870 HD12 :: 0.8870 HD13 :: 0.8870 HD21 :: 0.8220 HD22 :: 0.8220 HD23 :: 0.8220 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.6540 Ave N Shift Values>> N :: 121.86(3.9) 1.L94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 C 0.41 C Shift Assignments>> C :: 181.0830 CA :: 57.5220 CB :: 40.8800 CG :: 26.8870 CD1 :: 25.1660 CD2 :: 22.8720 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 :: 7.4860 HA :: 4.1320 HB2 :: 1.8740 HB3 :: 1.5880 HG :: 1.7070 HD11 :: 0.9470 HD12 :: 0.9470 HD13 :: 0.9470 HD21 :: 0.8790 HD22 :: 0.8790 HD23 :: 0.8790 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 :: 120.7080 Ave N Shift Values>> N :: 121.86(3.9) 1.I95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.86 C 0.13 HN Overlap>> 1.D22 1.D22 1.E89 2.V18 1.E89 2.V18 C Shift Assignments>> C :: 177.2700 CA :: 66.3440 CB :: 37.6590 CG1 :: 29.1830 CG2 :: 19.4300 CD1 :: 13.6930 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 :: 8.3350 HA :: 3.3170 HB :: 1.7130 HG13 :: 0.5580 HG21 :: 0.7750 HG22 :: 0.7750 HG23 :: 0.7750 HD11 :: 0.5580 HD12 :: 0.5580 HD13 :: 0.5580 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 :: 122.6980 Ave N Shift Values>> N :: 121.46(4.28) 1.A96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.55 A 0.37 I 0.03 C 0.02 HN Overlap>> 1.R47 1.R47 C Shift Assignments>> C :: 179.5660 CA :: 55.1890 CB :: 18.0250 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2630 HA :: 4.1230 HB1 :: 1.4410 HB2 :: 1.4410 HB3 :: 1.4410 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.2770 Ave N Shift Values>> N :: 123.23(3.54) 1.M97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.73 M 0.25 C Shift Assignments>> C :: 178.3920 CA :: 59.7630 CB :: 32.3870 CG :: 33.7720 CE :: 17.1350 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.2600 HA :: 3.8910 HB3 :: 2.2280 HG2 :: 2.5000 HG3 :: 2.8340 HE1 :: 1.9380 HE2 :: 1.9380 HE3 :: 1.9380 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 :: 117.4260 Ave N Shift Values>> N :: 120.09(3.57) 1.K98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 K 0.43 R 0.06 HN Overlap>> 2.A94 2.A94 C Shift Assignments>> C :: 180.1710 CA :: 59.8120 CB :: 33.0870 CG :: 25.1660 CD :: 29.7560 CE :: 41.8040 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 :: 7.7880 HA :: 3.9660 HB3 :: 1.9640 HG2 :: 1.3240 HG3 :: 1.6000 HD2 :: 1.4890 HD3 :: 1.5560 HE3 :: 2.9360 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 :: 124.3320 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.68 I 0.16 E 0.12 M 0.02 HN Overlap>> 1.N30 1.N30 2.D97 2.D97 C Shift Assignments>> C :: 179.2830 CA :: 59.7020 CB :: 31.0440 CG :: 38.3610 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 :: 8.4950 HA :: 3.6460 HB2 :: 1.5560 HB3 :: 2.5190 HG2 :: 1.6640 HG3 :: 2.4550 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 :: 121.1090 Ave N Shift Values>> N :: 120.67(3.48) 1.L100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 L 0.47 R 0.04 HN Overlap>> 1.K62 1.K62 C Shift Assignments>> C :: 180.0110 CA :: 58.4280 CB :: 41.7920 CG :: 26.3140 CD1 :: 24.5930 CD2 :: 26.3140 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 :: 8.6730 HA :: 3.8530 HB2 :: 1.4940 HB3 :: 2.0870 HG :: 1.5570 HD11 :: 0.8390 HD12 :: 0.8390 HD13 :: 0.8390 HD21 :: 0.8740 HD22 :: 0.8740 HD23 :: 0.8740 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 :: 122.4180 Ave N Shift Values>> N :: 121.86(3.9) 1.K101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 K 0.45 R 0.07 C Shift Assignments>> C :: 177.4330 CA :: 59.0830 CB :: 32.0760 CG :: 25.1660 CD :: 29.1830 CE :: 41.8040 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 :: 7.9880 HA :: 3.9230 HB3 :: 1.8800 HG2 :: 1.4320 HG3 :: 1.5110 HD3 :: 1.6690 HE3 :: 2.9360 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 :: 121.5730 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.A102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 M 0.08 C 0.01 C Shift Assignments>> C :: 175.7230 CA :: 52.0420 CB :: 19.1000 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.3160 HA :: 4.2660 HB1 :: 1.3490 HB2 :: 1.3490 HB3 :: 1.3490 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.1580 Ave N Shift Values>> N :: 123.23(3.54) 1.R103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.35 L 0.33 R 0.18 K 0.08 G 0.04 C Shift Assignments>> C :: 175.9880 CA :: 57.0090 CB :: 26.8510 CG :: 27.4610 CD :: 42.9510 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 :: 7.9160 HA :: 3.7940 HB2 :: 2.2370 HB3 :: 1.8920 HG3 :: 1.6290 HD2 :: 3.2500 HD3 :: 3.2890 HE :: 7.2090 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 115.1120 NE :: 86.4120 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.K104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.56 C 0.36 R 0.05 A 0.01 C Shift Assignments>> C :: 175.2540 CA :: 54.2440 CB :: 34.3450 CG :: 24.0190 CD :: 28.6090 CE :: 41.8040 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 :: 7.9250 HA :: 4.4540 HB2 :: 1.1610 HB3 :: 1.9900 HG2 :: 1.2500 HG3 :: 1.3590 HD2 :: 1.5230 HD3 :: 1.6400 HE3 :: 2.9830 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 :: 116.9500 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 I 0.4 A 0.06 C Shift Assignments>> C :: 175.0980 CA :: 56.9960 CB :: 39.5120 CG1 :: 28.6090 CG2 :: 17.1350 CD1 :: 14.2660 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 :: 7.2540 HA :: 4.2590 HB :: 1.4890 HG13 :: 0.9750 HG21 :: 0.8390 HG22 :: 0.8390 HG23 :: 0.8390 HD11 :: 0.8060 HD12 :: 0.8060 HD13 :: 0.8060 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 :: 120.6100 Ave N Shift Values>> N :: 121.46(4.28) 1.P106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.88 P 0.1 C Shift Assignments>> C :: 175.0540 CA :: 62.7360 CB :: 28.2320 CG :: 27.4610 CD :: 50.9820 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 :: 4.8240 HB2 :: 1.7280 HB3 :: 2.3490 HG2 :: 1.8780 HG3 :: 2.1070 HD2 :: 3.4010 HD3 :: 3.8110 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.I107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.81 I 0.1 G 0.06 A 0.01 C Shift Assignments>> C :: 173.8620 CA :: 58.9570 CB :: 42.8940 CG1 :: 28.6090 CG2 :: 20.0030 CD1 :: 12.5450 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 :: 7.7300 HA :: 4.6910 HB :: 1.4800 HG12 :: 1.0440 HG13 :: 1.3110 HG21 :: 0.7770 HG22 :: 0.7770 HG23 :: 0.7770 HD11 :: 0.6700 HD12 :: 0.6700 HD13 :: 0.6700 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.1690 Ave N Shift Values>> N :: 121.46(4.28) 1.I108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.53 C 0.45 C Shift Assignments>> C :: 174.1190 CA :: 59.0990 CB :: 40.7410 CG1 :: 27.4610 CG2 :: 17.7090 CD1 :: 12.5450 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 :: 8.8520 HA :: 4.6130 HB :: 1.6090 HG12 :: 0.9690 HG13 :: 1.3180 HG21 :: 0.6860 HG22 :: 0.6860 HG23 :: 0.6860 HD11 :: 0.6800 HD12 :: 0.6800 HD13 :: 0.6800 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 126.7870 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: Consistent PRTL>> I 0.57 C 0.42 HN Overlap>> 2.N84 2.N84 C Shift Assignments>> C :: 173.2760 CA :: 60.6730 CB :: 40.0210 CG1 :: 28.6090 CG2 :: 18.2820 CD1 :: 14.8400 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.1250 HA :: 4.3700 HB :: 1.7090 HG13 :: 1.3930 HG21 :: 0.7520 HG22 :: 0.7520 HG23 :: 0.7520 HD11 :: 0.6280 HD12 :: 0.6280 HD13 :: 0.6280 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.3990 Ave N Shift Values>> N :: 121.46(4.28) 1.R110 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.39 C 0.31 R 0.27 G 0.01 C Shift Assignments>> C :: 175.0380 CA :: 54.7770 CB :: 31.8300 CG :: 25.7400 CD :: 42.3770 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.0600 HA :: 5.2530 HB2 :: 1.5000 HB3 :: 1.5870 HG2 :: 0.6290(S) HG3 :: 1.0010 HD2 :: 2.1720(S) HD3 :: 2.3910 HE :: 10.0150(S) Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 130.6380 NE :: 90.0530 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.R111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 G 0.36 R 0.22 C Shift Assignments>> C :: 175.8080 CA :: 55.3700 CB :: 32.4230 CG :: 26.8870 CD :: 44.6720 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.2290 HA :: 4.7030 HB2 :: 1.7960 HB3 :: 2.0440 HG2 :: 1.6090 HG3 :: 1.7180 HD2 :: 2.8520 HD3 :: 2.9210 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 127.7450 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.Y112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.65 C 0.34 C Shift Assignments>> C :: 176.4610 CA :: 58.6980 CB :: 39.3930 CD1 :: 133.6150 CE1 :: 117.7490 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 :: 8.3280 HA :: 4.8830 HB2 :: 2.7340 HB3 :: 2.9810 HD1 :: 6.9870 HE1 :: 6.5810 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.6330 Ave N Shift Values>> N :: 120.52(4.2) 1.L113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.57 C 0.34 A 0.07 C Shift Assignments>> C :: 177.9410 CA :: 53.2690 CB :: 40.6380 CG :: 28.6090 CD1 :: 24.5930 CD2 :: 23.4450 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.0170 HA :: 4.7620 HB2 :: 1.7370 HB3 :: 1.6420 HG :: 1.6430 HD11 :: 0.8420 HD12 :: 0.8420 HD13 :: 0.8420 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 :: 127.2110 Ave N Shift Values>> N :: 121.86(3.9) 1.P114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.86 C 0.13 C Shift Assignments>> C :: 176.7020 CA :: 65.3970 CB :: 31.7920 CG :: 27.4610 CD :: 50.9820 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 :: 1.9080 HB3 :: 2.3900 HG2 :: 2.0400 HG3 :: 2.0730 HD2 :: 3.7410 HD3 :: 3.8170 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.D115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 D 0.28 L 0.1 F 0.08 Y 0.07 C 0.07 C Shift Assignments>> C :: 177.2330 CA :: 53.3930 CB :: 39.7370 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.5280 HA :: 4.5070 HB2 :: 3.0580 HB3 :: 2.5700 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 :: 114.7280 Ave N Shift Values>> N :: 120.65(3.86) 1.G116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.08 C 0.02 C Shift Assignments>> C :: 174.8300 CA :: 45.3980 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.3640 HA2 :: 3.8100 HA3 :: 4.4280 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.4580 Ave N Shift Values>> N :: 109.67(3.87) 1.S117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.T71 1.T71 C Shift Assignments>> C :: 171.3740 CA :: 58.5380 CB :: 64.2650 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.1000 HA :: 4.4470 HB2 :: 3.9330 HB3 :: 3.8240 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 :: 118.6610 Ave N Shift Values>> N :: 116.28(3.52) 1.Y118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.7 C 0.29 C Shift Assignments>> C :: 174.6210 CA :: 55.6300 CB :: 41.1430 CD1 :: 133.9010 CE1 :: 118.2430 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 :: 7.5770 HA :: 5.6950 HB2 :: 2.2260 HB3 :: 2.2620 HD1 :: 6.6870 HE1 :: 6.7130 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 :: 113.6490 Ave N Shift Values>> N :: 120.52(4.2) 1.E119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 M 0.15 E 0.05 C Shift Assignments>> C :: 173.6740 CA :: 54.3180 CB :: 34.4480 CG :: 36.0670 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 :: 9.0070 HA :: 4.5380 HB2 :: 1.8460 HB3 :: 1.8870 HG2 :: 2.2750 HG3 :: 2.3280 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 :: 118.6770 Ave N Shift Values>> N :: 120.67(3.48) 1.D120 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.31 D 0.24 R 0.16 K 0.1 F 0.04 C 0.04 N 0.03 Y 0.03 G 0.02 C Shift Assignments>> C :: 176.4900 CA :: 53.6060 CB :: 42.6330 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 :: 8.5220 HA :: 5.7520(S) HB2 :: 2.1750 HB3 :: 2.3890 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.0760 Ave N Shift Values>> N :: 120.65(3.86) 1.W121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 W 0.42 C Shift Assignments>> C :: 175.8380 CA :: 56.1150 CB :: 31.4460 CD1 :: 124.1870 CE3 :: 120.4560 CZ2 :: 115.8980 CZ3 :: 121.3970 CH2 :: 123.6050 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 9.5850 HA :: 4.3610 HB2 :: 2.8310 HB3 :: 2.9460 HD1 :: 6.8520 HE1 :: 9.7980 HE3 :: 7.1540 HZ2 :: 7.0840 HZ3 :: 6.8910 HH2 :: 6.8720 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 125.1140 NE1 :: 129.3640 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.G122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 L 0.11 C 0.03 R 0.02 F 0.01 C Shift Assignments>> C :: 176.2960 CA :: 45.1540 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 9.9770 HA2 :: 3.8050 HA3 :: 4.4840 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 112.7400 Ave N Shift Values>> N :: 109.67(3.87) 1.V123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.81 C 0.18 C Shift Assignments>> C :: 176.2480 CA :: 66.7340 CB :: 31.2650 CG1 :: 22.2980 CG2 :: 24.0190 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 :: 8.4090 HA :: 3.5500 HB :: 2.0990 HG11 :: 0.8780 HG12 :: 0.8780 HG13 :: 0.8780 HG21 :: 0.9370 HG22 :: 0.9370 HG23 :: 0.9370 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.5790 Ave N Shift Values>> N :: 121.14(4.54) 1.D124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.23 N 0.21 F 0.15 Y 0.14 L 0.1 C 0.1 I 0.01 C Shift Assignments>> C :: 176.3420 CA :: 54.9590 CB :: 39.5650 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 :: 8.6880 HA :: 4.2950 HB2 :: 2.8060 HB3 :: 2.6800 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 115.0160 Ave N Shift Values>> N :: 120.65(3.86) 1.E125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 M 0.08 E 0.07 C Shift Assignments>> C :: 176.1560 CA :: 56.7130 CB :: 33.0740 CG :: 38.3610 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 :: 7.7510 HA :: 4.4090 HB2 :: 2.7000 HB3 :: 2.3860 HG2 :: 2.1140 HG3 :: 2.3580 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 :: 118.7760 Ave N Shift Values>> N :: 120.67(3.48) 1.L126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.6 C 0.19 L 0.12 A 0.04 R 0.03 C Shift Assignments>> C :: 176.0680 CA :: 53.4990 CB :: 44.9730 CG :: 26.3140 CD1 :: 23.4450 CD2 :: 27.4610 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 :: 7.0680 HA :: 4.4060 HB2 :: 1.6570 HB3 :: 1.0210 HG :: 1.7030 HD21 :: 0.5440 HD22 :: 0.5440 HD23 :: 0.5440 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.9950 Ave N Shift Values>> N :: 121.86(3.9) 1.I127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.71 C 0.28 HN Overlap>> 1.Q49 1.Q49 C Shift Assignments>> C :: 176.3190 CA :: 61.8420 CB :: 37.9500 CG1 :: 27.4610 CG2 :: 17.7090 CD1 :: 12.5450 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 :: 8.6320 HA :: 3.9480 HB :: 1.1680 HG12 :: 0.8350 HG13 :: 1.3770 HG21 :: 0.7570 HG22 :: 0.7570 HG23 :: 0.7570 HD11 :: 0.3610 HD12 :: 0.3610 HD13 :: 0.3610 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 :: 122.8140 Ave N Shift Values>> N :: 121.46(4.28) 1.I128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.64 C 0.35 C Shift Assignments>> C :: 175.8650 CA :: 60.6730 CB :: 39.5720 CG1 :: 27.4610 CG2 :: 17.7090 CD1 :: 13.6930 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 :: 8.4510 HA :: 4.3210 HB :: 1.7510 HG12 :: 1.0760 HG13 :: 1.4850 HG21 :: 0.8410 HG22 :: 0.8410 HG23 :: 0.8410 HD11 :: 0.8060 HD12 :: 0.8060 HD13 :: 0.8060 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 :: 130.6180 Ave N Shift Values>> N :: 121.46(4.28) 1.T129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.9 C 0.09 HN Overlap>> 1.E32 1.D26 1.E32 1.D26 C Shift Assignments>> C :: 173.4830 CA :: 61.4600 CB :: 69.9020 CG2 :: 21.1510 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 :: 8.4280 HA :: 4.3700 HB :: 4.2070 HG21 :: 1.1890 HG22 :: 1.1890 HG23 :: 1.1890 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 121.5220 Ave N Shift Values>> N :: 115.42(4.75) 1.D130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.24 K 0.21 R 0.14 D 0.12 F 0.11 Y 0.07 C 0.05 C Shift Assignments>> C :: 180.7330 CA :: 56.3070 CB :: 42.2570 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 :: 8.0290 HA :: 4.3000 HB2 :: 2.4250 HB3 :: 2.5890 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 129.6140 Ave N Shift Values>> N :: 120.65(3.86) 2.G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.H3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.M4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> M 0.45 C 0.32 Q 0.15 K 0.04 C Shift Assignments>> C :: 175.9170 CA :: 55.4440 CB :: 32.4080 CG :: 31.5300 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> HA :: 4.3760 HB2 :: 1.7570 HB3 :: 1.7710 HG2 :: 2.2120 HG3 :: 2.2330 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) 2.A5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.85 M 0.12 C 0.01 C Shift Assignments>> C :: 177.7360 CA :: 52.5270 CB :: 18.9560 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2360 HA :: 4.3560 HB1 :: 1.2980 HB2 :: 1.2980 HB3 :: 1.2980 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.0040 Ave N Shift Values>> N :: 123.23(3.54) 2.T6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.88 C 0.11 C Shift Assignments>> C :: 174.7440 CA :: 61.4510 CB :: 69.7010 CG2 :: 21.7500 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 :: 8.1100 HA :: 4.3520 HB :: 4.2830 HG21 :: 1.1040 HG22 :: 1.1040 HG23 :: 1.1040 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 113.6640 Ave N Shift Values>> N :: 115.42(4.75) 2.S7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.6480 CA :: 58.5570 CB :: 63.7520 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.2740 HA :: 4.5100 HB2 :: 3.7740 HB3 :: 3.8120 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 :: 118.2900 Ave N Shift Values>> N :: 116.28(3.52) 2.S8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 2.Q100 2.Q100 C Shift Assignments>> C :: 173.8090 CA :: 58.4030 CB :: 63.6480 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.3190 HA :: 4.4840 HB2 :: 3.8350 HB3 :: 3.9150 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 :: 118.1860 Ave N Shift Values>> N :: 116.28(3.52) 2.E9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.37 M 0.19 Q 0.03 K 0.01 C Shift Assignments>> C :: 175.2200 CA :: 56.3430 CB :: 31.3000 CG :: 36.4200 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 :: 8.0410 HA :: 4.3010 HB2 :: 1.8610 HB3 :: 1.9320 HG3 :: 2.2370 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 124.9750 Ave N Shift Values>> N :: 120.67(3.48) 2.E10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.36 C 0.33 M 0.13 Q 0.09 K 0.06 I 0.02 C Shift Assignments>> C :: 174.7920 CA :: 57.2530 CB :: 30.5480 CG :: 35.8080 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 :: 8.5690 HA :: 4.2080 HB3 :: 1.9600 HG2 :: 2.0550 HG3 :: 2.2380 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 :: 127.0600 Ave N Shift Values>> N :: 120.67(3.48) 2.V11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.67 C 0.32 HN Overlap>> 1.E20 1.A77 1.E20 1.A77 C Shift Assignments>> C :: 175.5600 CA :: 62.4380 CB :: 33.2050 CG1 :: 22.3610 CG2 :: 21.7500 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 :: 8.4120 HA :: 4.2690 HB :: 2.0270 HG11 :: 0.9070 HG12 :: 0.9070 HG13 :: 0.9070 HG21 :: 1.0850 HG22 :: 1.0850 HG23 :: 1.0850 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 126.0190 Ave N Shift Values>> N :: 121.14(4.54) 2.L12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 C 0.31 R 0.28 A 0.03 G 0.02 C Shift Assignments>> C :: 177.1540 CA :: 55.8750 CB :: 42.5770 CG :: 27.8630 CD1 :: 26.6400 CD2 :: 22.3610 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.5220 HA :: 4.4040 HB2 :: 1.5080 HB3 :: 1.3900 HG :: 1.4030 HD11 :: 0.8310 HD12 :: 0.8310 HD13 :: 0.8310 HD21 :: 0.7400 HD22 :: 0.7400 HD23 :: 0.7400 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 :: 129.1490 Ave N Shift Values>> N :: 121.86(3.9) 2.L13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.54 C 0.31 L 0.09 A 0.02 R 0.01 C Shift Assignments>> C :: 172.9870 CA :: 55.6040 CB :: 45.6210 CG :: 27.2510 CD1 :: 22.9730 CD2 :: 27.2510 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 :: 7.6690 HA :: 4.4500 HB2 :: 1.4270 HB3 :: 1.5320 HG :: 1.3600 HD11 :: 0.9090 HD12 :: 0.9090 HD13 :: 0.9090 HD21 :: 0.7020 HD22 :: 0.7020 HD23 :: 0.7020 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 :: 120.4320 Ave N Shift Values>> N :: 121.86(3.9) 2.I14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.57 C 0.42 C Shift Assignments>> C :: 175.5720 CA :: 60.2760 CB :: 40.6700 CG1 :: 26.6400 CG2 :: 16.2490 CD1 :: 14.4160 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 :: 8.0570 HA :: 4.7880 HB :: 1.2530 HG12 :: 0.1220 HG13 :: 1.2000 HG21 :: 0.1650 HG22 :: 0.1650 HG23 :: 0.1650 HD11 :: 0.6540 HD12 :: 0.6540 HD13 :: 0.6540 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 126.3590 Ave N Shift Values>> N :: 121.46(4.28) 2.V15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.88 L 0.11 C Shift Assignments>> CG1 :: 22.9730 CG2 :: 20.5280 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 9.2310 HA :: 4.3390 HB :: 1.8140 HG11 :: 1.0880 HG12 :: 1.0880 HG13 :: 1.0880 HG21 :: 0.7800 HG22 :: 0.7800 HG23 :: 0.7800 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 129.1970 Ave N Shift Values>> N :: 121.14(4.54) 2.K16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.49 C 0.37 R 0.12 C Shift Assignments>> C :: 176.0460 CA :: 55.7220 CB :: 33.4080 CG :: 25.4180 CD :: 28.4740 CE :: 41.9210 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 :: 8.6060 HA :: 4.4470 HB2 :: 1.8160 HB3 :: 1.8600 HG2 :: 1.2890 HG3 :: 1.5060 HD3 :: 1.6050 HE2 :: 2.8740 HE3 :: 2.8840 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 :: 126.5770 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.K17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 K 0.28 R 0.19 L 0.02 HN Overlap>> 1.T56 1.T56 C Shift Assignments>> C :: 176.3400 CA :: 56.5230 CB :: 28.9210 CG :: 24.8070 CD :: 29.0850 CE :: 41.9210 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 :: 8.6470 HA :: 4.2090 HB2 :: 2.0750 HB3 :: 1.7500 HG2 :: 1.3000 HG3 :: 1.3340 HD2 :: 1.5890 HD3 :: 1.6440 HE3 :: 2.9460 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 :: 117.2410 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.V18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.52 C 0.47 HN Overlap>> 1.D22 1.I95 1.E89 1.D22 1.I95 1.E89 C Shift Assignments>> C :: 176.5170 CA :: 61.1600 CB :: 32.5370 CG1 :: 22.3610 CG2 :: 22.9730 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 :: 8.4010 HA :: 4.5830 HB :: 1.5890 HG11 :: 0.3570 HG12 :: 0.3570 HG13 :: 0.3570 HG21 :: 0.4070 HG22 :: 0.4070 HG23 :: 0.4070 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 :: 122.6340 Ave N Shift Values>> N :: 121.14(4.54) 2.R19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 R 0.26 G 0.16 K 0.12 C Shift Assignments>> C :: 175.9110 CA :: 54.9670 CB :: 33.3290 CG :: 28.4740 CD :: 43.7540 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.8710 HA :: 5.6820 HB2 :: 1.8400 HB3 :: 1.6050 HG2 :: 1.4480 HG3 :: 1.5130 HD2 :: 2.9670 HD3 :: 3.2020 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 :: 131.4970 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 2.Q20 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> Q 0.31 K 0.27 C 0.23 E 0.07 R 0.05 M 0.03 C Shift Assignments>> C :: 174.6900 CA :: 55.9530 CB :: 28.7770 CG :: 33.9750 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 :: 8.2430 HA :: 4.2510 HB2 :: 0.2470(S) HB3 :: 0.4060(S) HG2 :: 1.1060(S) HG3 :: 1.6160 HE21 :: 6.6930 HE22 :: 5.6820 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 :: 124.4200 NE2 :: 111.4360 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.K21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.97 G 0.01 L 0.01 C Shift Assignments>> C :: 175.4240 CB :: 30.0330 CG :: 25.4180 CD :: 28.4740 CE :: 41.9210 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.4530 HA :: 3.7630 HB2 :: 1.6240 HB3 :: 1.8360 HG2 :: 1.1950 HG3 :: 1.3180 HD3 :: 1.6070 HE3 :: 2.9270 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 :: 127.7900 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.K22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 K 0.37 R 0.16 C Shift Assignments>> C :: 174.8940 CA :: 57.9500 CB :: 30.2410 CG :: 25.4180 CD :: 29.0850 CE :: 41.9210 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 :: 8.7690 HA :: 3.7050 HB2 :: 2.0570 HB3 :: 1.9930 HG2 :: 1.2500 HG3 :: 1.2810 HD3 :: 1.6340 HE3 :: 2.8910 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 :: 111.9830 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.Q23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 C 0.3 Q 0.15 E 0.04 C Shift Assignments>> C :: 175.2250 CA :: 54.5760 CB :: 32.3220 CG :: 33.9750 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 :: 7.7480 HA :: 4.7450 HB2 :: 2.3510 HB3 :: 2.4530 HG3 :: 2.5540 HE21 :: 7.6280 HE22 :: 6.9280 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 :: 120.2080 NE2 :: 113.2760 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.D24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.26 K 0.2 D 0.16 R 0.13 F 0.09 Y 0.06 C 0.05 N 0.01 C Shift Assignments>> C :: 176.9910 CA :: 55.7130 CB :: 42.2580 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 :: 8.8020 HA :: 4.6630 HB2 :: 2.5670 HB3 :: 2.6260 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 124.6900 Ave N Shift Values>> N :: 120.65(3.86) 2.G25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 C 0.05 L 0.05 C Shift Assignments>> C :: 170.2780 CA :: 46.8690 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.8640 HA2 :: 4.0050 HA3 :: 4.1180 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 113.0890 Ave N Shift Values>> N :: 109.67(3.87) 2.A26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 L 0.28 C 0.13 K 0.01 C Shift Assignments>> C :: 173.5060 CA :: 50.3850 CB :: 22.4620 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.8630 HA :: 5.1500 HB1 :: 1.1890 HB2 :: 1.1890 HB3 :: 1.1890 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.1330 Ave N Shift Values>> N :: 123.23(3.54) 2.L27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 G 0.3 L 0.12 A 0.05 C Shift Assignments>> C :: 173.6720 CA :: 53.1380 CB :: 47.4880 CG :: 26.6400 CD1 :: 24.1950 CD2 :: 26.6400 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.0270 HA :: 4.9410 HB2 :: 0.8800 HB3 :: 1.8110 HG :: 1.2390 HD11 :: 0.1730 HD12 :: 0.1730 HD13 :: 0.1730 HD21 :: 0.4950 HD22 :: 0.4950 HD23 :: 0.4950 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.8290 Ave N Shift Values>> N :: 121.86(3.9) 2.Y28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.71 C 0.28 C Shift Assignments>> C :: 174.2100 CA :: 56.5230 CB :: 40.6200 CD1 :: 133.4300 CE1 :: 118.2770 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 :: 9.6180 HA :: 5.0060 HB2 :: 2.7250 HB3 :: 2.6360 HD1 :: 7.0560 HE1 :: 6.6640 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 :: 126.6520 Ave N Shift Values>> N :: 120.52(4.2) 2.L29 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 K 0.33 R 0.16 C Shift Assignments>> C :: 175.2250 CA :: 56.8200 CB :: 41.2360 CG :: 31.5300(S) CD1 :: 27.2510 CD2 :: 24.8070 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.2790 HA :: 4.8320 HB3 :: 1.7430 HG :: 1.8640 HD11 :: 1.0120 HD12 :: 1.0120 HD13 :: 1.0120 HD21 :: 0.9700 HD22 :: 0.9700 HD23 :: 0.9700 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 126.0960 Ave N Shift Values>> N :: 121.86(3.9) 2.M30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.51 C 0.24 M 0.23 HN Overlap>> 1.Y63 1.Y63 C Shift Assignments>> C :: 176.1860 CA :: 53.8740 CB :: 34.0750 CG :: 33.9750 CE :: 18.0830 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.8660 HA :: 5.3390 HB2 :: 2.0500 HB3 :: 2.5030 HG2 :: 2.2990 HG3 :: 2.5220 HE1 :: 1.6080 HE2 :: 1.6080 HE3 :: 1.6080 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.6460 Ave N Shift Values>> N :: 120.09(3.57) 2.A31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.42 A 0.31 C 0.09 I 0.07 V 0.05 L 0.02 T 0.01 HN Overlap>> 2.S59 2.S59 C Shift Assignments>> C :: 178.8030 CA :: 56.3520 CB :: 19.3480 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0230 HA :: 4.2330 HB1 :: 1.6530 HB2 :: 1.6530 HB3 :: 1.6530 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.5170 Ave N Shift Values>> N :: 123.23(3.54) 2.E32 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Suspicious PRTL>> C 0.38 E 0.31 M 0.27 Q 0.02 C Shift Assignments>> C :: 175.4690 CA :: 55.4370 CB :: 31.9070 CG :: 36.4200 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 :: 8.6320 HA :: 4.3300 HB2 :: 1.6660 HB3 :: 1.8590 HG2 :: 2.0870 HG3 :: 2.2470 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 :: 109.0840(S) Ave N Shift Values>> N :: 120.67(3.48) 2.R33 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 G 0.31 K 0.13 R 0.09 C Shift Assignments>> C :: 184.2900(S) CA :: 53.4170 CB :: 33.3340 CG :: 24.8070 CD :: 43.7540 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 :: 6.5940 HA :: 3.8830 HB2 :: 0.9690 HB3 :: 1.8780 HG2 :: 0.7500 HG3 :: 1.3020 HD2 :: 2.5870 HD3 :: 2.7440 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.1790 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 2.I34 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.7 I 0.26 A 0.02 C Shift Assignments>> C :: 185.3480(A) CA :: 57.4730 CB :: 41.3000 CG1 :: 28.4740 CG2 :: 16.2490 CD1 :: 15.0270 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 :: 8.2630 HA :: 5.1810 HB :: 1.9440 HG12 :: 0.8870 HG13 :: 1.8570 HG21 :: 1.0660 HG22 :: 1.0660 HG23 :: 1.0660 HD11 :: 0.9300 HD12 :: 0.9300 HD13 :: 0.9300 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 :: 118.9040 Ave N Shift Values>> N :: 121.46(4.28) 2.A35 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.73 L 0.16 C 0.09 C Shift Assignments>> C :: 173.8510 CA :: 50.3100 CB :: 21.9810 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.2340 HA :: 5.0290 HB1 :: 0.2370(S) HB2 :: 0.2370(S) HB3 :: 0.2370(S) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 130.0270 Ave N Shift Values>> N :: 123.23(3.54) 2.W36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 W 0.34 C Shift Assignments>> C :: 174.2330 CA :: 56.5830 CB :: 33.8340 CD1 :: 126.3210 CE3 :: 120.7590 CZ2 :: 115.3930 CZ3 :: 122.2560 CH2 :: 124.8790 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 8.7580 HA :: 5.7440 HB2 :: 2.9560 HB3 :: 3.1560 HD1 :: 6.3810 HE1 :: 9.9210 HE3 :: 7.4950 HZ2 :: 7.7760 HZ3 :: 7.0530 HH2 :: 7.1350 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 121.4800 NE1 :: 129.7160 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 2.A37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.7 A 0.16 L 0.08 C 0.04 C Shift Assignments>> C :: 173.2360 CA :: 48.1360 CB :: 22.2540 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0880 HA :: 5.0770 HB1 :: 1.0250 HB2 :: 1.0250 HB3 :: 1.0250 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 131.3360 Ave N Shift Values>> N :: 123.23(3.54) 2.P38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.56 C 0.43 C Shift Assignments>> C :: 176.3770 CA :: 61.7760 CB :: 31.5790 CG :: 26.6400 CD :: 51.0890 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 :: 4.0830 HB2 :: 1.7460 HB3 :: 2.3150 HG2 :: 1.9420 HG3 :: 2.1520 HD2 :: 3.5140 HD3 :: 3.9160 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 2.E39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.35 C 0.3 K 0.13 Q 0.11 I 0.05 M 0.03 C Shift Assignments>> C :: 177.4220 CA :: 57.4830 CB :: 29.4810 CG :: 35.8080 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 :: 8.4240 HA :: 4.0170 HB2 :: 1.7700 HB3 :: 1.8290 HG2 :: 2.1110 HG3 :: 2.1930 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 :: 123.7910 Ave N Shift Values>> N :: 120.67(3.48) 2.G40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.82 L 0.1 C 0.03 R 0.01 F 0.01 C Shift Assignments>> C :: 173.9300 CA :: 45.2350 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.6560 HA2 :: 3.6960 HA3 :: 4.2000 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 114.1800 Ave N Shift Values>> N :: 109.67(3.87) 2.K41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.51 C 0.36 R 0.11 C Shift Assignments>> C :: 175.6780 CA :: 54.3430 CB :: 34.0480 CG :: 25.4180 CD :: 27.8630 CE :: 41.9210 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 :: 7.6600 HA :: 4.6060 HB2 :: 1.7600 HB3 :: 1.8210 HG2 :: 1.2960 HG3 :: 1.3690 HD2 :: 1.5450 HD3 :: 1.6100 HE3 :: 2.9270 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 :: 120.2980 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.D42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 N 0.26 L 0.15 F 0.08 Y 0.06 C 0.06 K 0.02 C Shift Assignments>> C :: 174.7450 CA :: 53.3490 CB :: 40.4410 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 :: 8.1930 HA :: 4.4010 HB2 :: 2.4650 HB3 :: 2.6150 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.4260 Ave N Shift Values>> N :: 120.65(3.86) 2.R43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 C 0.33 K 0.2 G 0.07 C Shift Assignments>> C :: 174.3980 CA :: 54.0250 CB :: 32.4330 CG :: 26.0290 CD :: 43.1430 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 :: 6.8560 HA :: 4.2280 HB2 :: 1.5160 HB3 :: 1.6180 HG3 :: 1.3620 HD3 :: 3.0520 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 117.0790 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 2.F44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.4 Y 0.33 C 0.25 C Shift Assignments>> C :: 177.4390 CA :: 57.6330 CB :: 38.3830 CD1 :: 131.4290 CE1 :: 131.4950 CZ :: 129.7070 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 :: 7.8730 HA :: 4.7040 HB2 :: 2.6910 HB3 :: 3.1360 HD1 :: 6.8610 HE1 :: 6.4650 HZ :: 6.3060 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 :: 120.4180 Ave N Shift Values>> N :: 120.45(4.18) 2.T45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.8 C 0.19 C Shift Assignments>> C :: 174.6990 CA :: 62.4400 CB :: 68.6200 CG2 :: 22.9730 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 :: 8.6770 HA :: 4.5910 HB :: 4.4540 HG21 :: 1.2210 HG22 :: 1.2210 HG23 :: 1.2210 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 :: 114.7470 Ave N Shift Values>> N :: 115.42(4.75) 2.I46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.5 C 0.49 C Shift Assignments>> C :: 174.6230 CA :: 59.4690 CB :: 41.5470 CG1 :: 27.2510 CG2 :: 16.8600 CD1 :: 12.5820 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 :: 7.8780 HA :: 4.2990 HB :: 1.9370 HG12 :: 1.2640 HG13 :: 1.4600 HG21 :: 0.6070 HG22 :: 0.6070 HG23 :: 0.6070 HD11 :: 0.6190 HD12 :: 0.6190 HD13 :: 0.6190 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 :: 123.9040 Ave N Shift Values>> N :: 121.46(4.28) 2.S47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.7030 CA :: 57.2940 CB :: 63.1680 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.0600 HA :: 4.7120 HB2 :: 3.2590 HB3 :: 3.4880 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.5610 Ave N Shift Values>> N :: 116.28(3.52) 2.H48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.39 H 0.3 C 0.29 HN Overlap>> 2.L68 2.L68 C Shift Assignments>> C :: 174.9800 CA :: 53.1010 CB :: 31.9130 CD2 :: 124.1480 CE1 :: 139.6200 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 9.0400 HA :: 5.2680 HB2 :: 2.7940 HB3 :: 2.5780 HD2 :: 6.3440 HE1 :: 7.6130 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 :: 125.7190 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 2.M49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.39 C 0.39 A 0.2 C Shift Assignments>> C :: 178.9650 CA :: 54.4080 CB :: 29.4970 CG :: 32.1410 CE :: 16.2490 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.2160 HA :: 4.3380 HB2 :: 1.9220 HB3 :: 2.4020 HG2 :: 2.5280 HG3 :: 2.7250 HE1 :: 1.9610 HE2 :: 1.9610 HE3 :: 1.9610 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 124.9280 Ave N Shift Values>> N :: 120.09(3.57) 2.Y50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.89 Y 0.07 H 0.01 W 0.01 C Shift Assignments>> C :: 179.2520 CA :: 60.4250 CB :: 36.7370 CD1 :: 130.5670 CE1 :: 120.1770 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 :: 7.8100 HA :: 4.3330 HB2 :: 2.3410 HB3 :: 2.9240 HD1 :: 6.5690 HE1 :: 6.5650 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 125.5920 Ave N Shift Values>> N :: 120.52(4.2) 2.A51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.75 M 0.18 C 0.03 L 0.01 C Shift Assignments>> C :: 178.2640 CA :: 54.0560 CB :: 19.4590 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 :: 4.4090 HB1 :: 1.4760 HB2 :: 1.4760 HB3 :: 1.4760 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.8630 Ave N Shift Values>> N :: 123.23(3.54) 2.D52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.24 D 0.24 K 0.18 F 0.1 Y 0.07 C 0.05 N 0.04 R 0.04 C Shift Assignments>> C :: 175.7590 CA :: 55.1580 CB :: 41.5720 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.8590 HA :: 5.0210 HB2 :: 2.8910 HB3 :: 3.0160 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 115.9190 Ave N Shift Values>> N :: 120.65(3.86) 2.I53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.67 C 0.32 C Shift Assignments>> C :: 172.7130 CA :: 62.0200 CB :: 39.1310 CG1 :: 27.2510 CG2 :: 18.6940 CD1 :: 15.6380 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 :: 7.6950 HA :: 3.8190 HB :: 2.0090 HG12 :: 0.4400 HG13 :: 1.8300 HG21 :: 0.7110 HG22 :: 0.7110 HG23 :: 0.7110 HD11 :: 0.9190 HD12 :: 0.9190 HD13 :: 0.9190 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.3130 Ave N Shift Values>> N :: 121.46(4.28) 2.K54 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.44 K 0.41 R 0.13 C Shift Assignments>> C :: 176.7330 CA :: 58.1720 CB :: 34.0180 CG :: 25.4180 CD :: 29.6960 CE :: 41.9210 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.1220 HA :: 3.6480 HB2 :: 0.7350(S) HB3 :: 1.2580 HG2 :: 1.0440 HG3 :: 1.2850 HD2 :: 1.4980 HD3 :: 1.6360 HE3 :: 2.8910 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 :: 129.1440 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.C55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.16 Q 0.15 R 0.13 W 0.12 E 0.12 C 0.11 K 0.1 M 0.06 C Shift Assignments>> C :: 170.0990 CA :: 55.4980 CB :: 29.7900 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.8650 HA :: 4.7490 HB3 :: 3.1250 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 111.1620 Ave N Shift Values>> N :: 120.17(4.64) 2.Q56 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Suspicious PRTL>> M 0.22 C 0.18 H 0.16 R 0.14 K 0.09 W 0.09 E 0.04 P 0.03 Q 0.01 C Shift Assignments>> C :: 174.3000 CA :: 52.7100 CG :: 31.5300 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 :: 8.3300 HA :: 5.7690(S) HB2 :: 2.1980 HB3 :: 1.5280 HG2 :: 2.0630 HG3 :: 2.1940 HE21 :: 7.1110 HE22 :: 6.4090 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.2650 NE2 :: 105.1610(S) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.K57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 R 0.25 K 0.16 G 0.01 C Shift Assignments>> C :: 175.3650 CA :: 55.0740 CB :: 37.5200 CG :: 25.4180 CD :: 29.0850 CE :: 41.9210 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.2540 HA :: 5.2790 HB2 :: 1.4030 HB3 :: 1.7020 HG2 :: 1.1970 HG3 :: 1.3030 HD2 :: 1.4160 HD3 :: 1.5710 HE3 :: 2.6990 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 :: 121.9530 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.I58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 I 0.41 A 0.01 C Shift Assignments>> C :: 175.2180 CA :: 59.0680 CB :: 41.3440 CG1 :: 24.8070 CG2 :: 18.0830 CD1 :: 13.8040 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 :: 8.5740 HA :: 5.2810 HB :: 1.9440 HG12 :: 0.9680 HG13 :: 1.3610 HG21 :: 0.8480 HG22 :: 0.8480 HG23 :: 0.8480 HD11 :: 0.7450 HD12 :: 0.7450 HD13 :: 0.7450 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 121.3720 Ave N Shift Values>> N :: 121.46(4.28) 2.S59 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Consistent HN Overlap>> 2.A31 2.A31 H Shift Assignments>> H :: 8.0260 HA :: 4.1120 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 :: 122.5360 Ave N Shift Values>> N :: 116.28(3.52) 2.P60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.64 C 0.35 C Shift Assignments>> C :: 177.4490 CA :: 62.4800 CB :: 32.7220 CG :: 27.2510 CD :: 51.0890 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 :: 4.5460 HB2 :: 1.9540 HB3 :: 2.3460 HG2 :: 1.8280 HG3 :: 2.0270 HD2 :: 3.4110 HD3 :: 3.6910 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 2.E61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.35 C 0.32 K 0.11 Q 0.09 I 0.06 M 0.03 C Shift Assignments>> C :: 177.2420 CA :: 58.1040 CB :: 29.5610 CG :: 35.8080 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 :: 8.6070 HA :: 4.1060 HB2 :: 1.9190 HB3 :: 1.9680 HG3 :: 2.2330 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 123.2560 Ave N Shift Values>> N :: 120.67(3.48) 2.G62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.78 L 0.12 C 0.03 R 0.02 F 0.01 C Shift Assignments>> C :: 174.4690 CA :: 45.0980 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5170 HA2 :: 3.7080 HA3 :: 4.2040 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.9440 Ave N Shift Values>> N :: 109.67(3.87) 2.K63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.44 C 0.29 R 0.24 C Shift Assignments>> C :: 176.7920 CA :: 54.4540 CB :: 32.0130 CG :: 24.8070 CD :: 27.8630 CE :: 41.9210 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 :: 7.7140 HA :: 4.4930 HB2 :: 1.7880 HB3 :: 1.8880 HG3 :: 1.4320 HD2 :: 1.5770 HD3 :: 1.6390 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 :: 121.0230 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.A64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.68 M 0.25 C 0.03 I 0.01 C Shift Assignments>> C :: 177.9000 CA :: 54.2930 CB :: 19.1070 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HA :: 4.0450 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) 2.K65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.53 C 0.41 R 0.04 C Shift Assignments>> C :: 174.8470 CA :: 55.8230 CB :: 32.7500 CG :: 24.8070 CD :: 29.0850 CE :: 41.3090 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 :: 7.6970 HA :: 4.2600 HB2 :: 1.1630 HB3 :: 1.4820 HG2 :: 0.7320 HG3 :: 0.8840 HD2 :: 1.0890 HD3 :: 1.1670 HE2 :: 2.4100 HE3 :: 2.4510 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 :: 118.5560 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.I66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 I 0.16 C Shift Assignments>> C :: 176.2400 CA :: 60.1670 CB :: 34.6350 CG1 :: 26.0290 CG2 :: 18.0830 CD1 :: 10.7480 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 :: 8.9970 HA :: 3.9510 HB :: 2.5060 HG12 :: 1.3600 HG13 :: 1.7040 HG21 :: 0.6690 HG22 :: 0.6690 HG23 :: 0.6690 HD11 :: 0.7230 HD12 :: 0.7230 HD13 :: 0.7230 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 126.8970 Ave N Shift Values>> N :: 121.46(4.28) 2.Q67 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 175.4680 CA :: 54.5510 CB :: 37.4380(S) CG :: 36.4200 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 :: 8.5790 HA :: 6.3410(A) HB2 :: 1.9050 HB3 :: 2.0960 HG2 :: 1.8230 HG3 :: 2.2340 HE21 :: 7.5660 HE22 :: 7.0090 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 :: 127.4310 NE2 :: 112.8530 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.L68 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 HN Overlap>> 2.H48 2.H48 C Shift Assignments>> C :: 172.7350 CA :: 55.4420 CB :: 49.7410(S) CG :: 27.8630 CD1 :: 26.0290 CD2 :: 25.4180 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.0640 HA :: 5.2030 HB2 :: 1.6470 HB3 :: 2.0060 HG :: 1.8560 HD11 :: 1.0720 HD12 :: 1.0720 HD13 :: 1.0720 HD21 :: 0.9710 HD22 :: 0.9710 HD23 :: 0.9710 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 125.6420 Ave N Shift Values>> N :: 121.86(3.9) 2.Q69 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.81 M 0.13 E 0.03 C Shift Assignments>> C :: 174.3690 CA :: 53.9240 CB :: 34.6670 CG :: 35.8080 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.2790 HA :: 5.3550 HB2 :: 0.9770(S) HB3 :: 1.3750 HG2 :: 1.4050(S) HG3 :: 2.0320 HE22 :: 6.2420 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 :: 127.1820 NE2 :: 110.9710 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.L70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.44 C 0.18 R 0.15 G 0.11 A 0.1 C Shift Assignments>> C :: 174.8130 CA :: 52.7270 CB :: 43.1710 CG :: 26.6400 CD1 :: 27.2510 CD2 :: 22.9730 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.1110 HA :: 4.8920 HB2 :: 1.6870 HB3 :: 1.0620 HG :: 1.8060 HD11 :: 1.1040 HD12 :: 1.1040 HD13 :: 1.1040 HD21 :: 0.9420 HD22 :: 0.9420 HD23 :: 0.9420 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.5590 Ave N Shift Values>> N :: 121.86(3.9) 2.V71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.57 C 0.42 C Shift Assignments>> C :: 175.6190 CA :: 61.2230 CB :: 32.0240 CG1 :: 20.5280 CG2 :: 21.1390 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 :: 8.4750 HA :: 4.2790 HB :: 2.1690 HG11 :: 0.7260 HG12 :: 0.7260 HG13 :: 0.7260 HG21 :: 0.6160 HG22 :: 0.6160 HG23 :: 0.6160 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 124.3700 Ave N Shift Values>> N :: 121.14(4.54) 2.L72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.35 A 0.15 C Shift Assignments>> C :: 179.0110 CA :: 54.3030 CB :: 39.7760 CG :: 27.8630 CD1 :: 24.1950 CD2 :: 22.3610 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 :: 8.7850 HA :: 4.6510 HB2 :: 1.7690 HB3 :: 1.8280 HG :: 1.3970 HD11 :: 0.4200 HD12 :: 0.4200 HD13 :: 0.4200 HD21 :: 0.1220 HD22 :: 0.1220 HD23 :: 0.1220 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 :: 129.2630 Ave N Shift Values>> N :: 121.86(3.9) 2.H73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 W 0.36 H 0.2 C Shift Assignments>> C :: 177.5140 CA :: 60.9160 CB :: 30.7700 CD2 :: 118.6200 CE1 :: 139.2070 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.1500 HA :: 4.2430 HB2 :: 2.9310 HB3 :: 3.0300 HD2 :: 6.9280 HE1 :: 7.8380 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 :: 122.9870 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 2.A74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 M 0.18 C 0.02 C Shift Assignments>> C :: 178.0520 CA :: 53.3760 CB :: 18.8990 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.5240 HA :: 4.3160 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 :: 119.1840 Ave N Shift Values>> N :: 123.23(3.54) 2.G75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.66 L 0.18 R 0.06 C 0.03 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.6540 CA :: 44.8010 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.6420 HA2 :: 3.5600 HA3 :: 4.4700 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.9920 Ave N Shift Values>> N :: 109.67(3.87) 2.D76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 L 0.23 N 0.12 K 0.1 F 0.07 C 0.05 Y 0.05 R 0.01 C Shift Assignments>> C :: 173.7330 CA :: 53.5360 CB :: 41.3520 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.8000 HA :: 4.6340 HB2 :: 2.4430 HB3 :: 2.6490 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 :: 119.9270 Ave N Shift Values>> N :: 120.65(3.86) 2.T77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 T 0.44 HN Overlap>> 1.G45 1.G45 C Shift Assignments>> C :: 174.3440 CA :: 59.4560 CB :: 72.6300 CG2 :: 22.3610 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 :: 8.1810 HA :: 5.2860 HB :: 3.7850 HG21 :: 0.9930 HG22 :: 0.9930 HG23 :: 0.9930 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 :: 112.0520 Ave N Shift Values>> N :: 115.42(4.75) 2.T78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.72 T 0.27 C Shift Assignments>> C :: 171.8740 CA :: 61.5470 CB :: 71.1550 CG2 :: 24.1950 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 :: 8.5560 HA :: 4.2010 HB :: 3.4490 HG21 :: 0.4380 HG22 :: 0.4380 HG23 :: 0.4380 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 121.9530 Ave N Shift Values>> N :: 115.42(4.75) 2.N79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.38 D 0.33 L 0.11 C 0.06 F 0.05 Y 0.04 C Shift Assignments>> C :: 173.6060 CA :: 52.2050 CB :: 40.2490 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 :: 8.7150 HA :: 5.1500 HB2 :: 2.5410 HB3 :: 2.4030 HD21 :: 7.1050 HD22 :: 6.6900 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 :: 127.0100 ND2 :: 112.0690 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.F80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.56 Y 0.26 C 0.16 HN Overlap>> 1.A73 1.A73 C Shift Assignments>> C :: 173.9000 CA :: 56.4700 CB :: 41.5470 CD1 :: 131.5810 CE1 :: 130.8410 CZ :: 128.9990 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 :: 8.9230 HA :: 5.0510 HB2 :: 2.7990 HB3 :: 2.5390 HD1 :: 6.7340 HE1 :: 6.6220 HZ :: 6.7110 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 :: 122.7350 Ave N Shift Values>> N :: 120.45(4.18) 2.H81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 H 0.36 W 0.06 Y 0.01 HN Overlap>> 1.N38 1.N38 C Shift Assignments>> C :: 174.2690 CA :: 52.6410 CB :: 33.6740 CD2 :: 116.8390 CE1 :: 138.1230 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 :: 8.9840 HA :: 5.5240 HB2 :: 3.0030 HB3 :: 3.0950 HD2 :: 7.1050 HE1 :: 7.6760 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 :: 123.9190 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 2.F82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 Y 0.33 F 0.28 C Shift Assignments>> C :: 173.0060 CA :: 58.9420 CB :: 37.8690 CD1 :: 133.1640 CE1 :: 130.5170 CZ :: 127.5580 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 :: 9.1220 HA :: 4.3330 HB2 :: 2.9510 HB3 :: 3.2400 HD1 :: 7.4430 HE1 :: 7.1320 HZ :: 6.8390 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 :: 132.0120 Ave N Shift Values>> N :: 120.45(4.18) 2.S83 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.97 T 0.02 HN Overlap>> 1.V19 1.V19 C Shift Assignments>> C :: 174.6140 CA :: 59.3470 CB :: 65.3740 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.9590 HA :: 4.0430 HB2 :: 3.8470 HB3 :: 2.7940(S) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 121.2390 Ave N Shift Values>> N :: 116.28(3.52) 2.N84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 D 0.16 C 0.1 Y 0.09 F 0.09 L 0.05 HN Overlap>> 1.I109 1.I109 C Shift Assignments>> C :: 175.1970 CA :: 53.7450 CB :: 38.7190 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 :: 9.1870 HA :: 4.7680 HB2 :: 2.6480 HB3 :: 3.2000 HD21 :: 8.3680 HD22 :: 6.8200 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 :: 125.4470 ND2 :: 117.5000 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 2.E85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 E 0.3 I 0.2 K 0.03 Q 0.01 M 0.01 C Shift Assignments>> C :: 178.1660 CA :: 60.1890 CB :: 29.8190 CG :: 36.4200 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 :: 8.7030 HA :: 4.0260 HB3 :: 2.1090 HG2 :: 2.3520 HG3 :: 2.4240 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 :: 127.4430 Ave N Shift Values>> N :: 120.67(3.48) 2.S86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.2330 CA :: 61.1200 CB :: 63.5280 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.6360 HA :: 4.4260 HB3 :: 3.9440 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 :: 113.2560 Ave N Shift Values>> N :: 116.28(3.52) 2.T87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.86 C 0.13 C Shift Assignments>> C :: 175.0020 CA :: 61.8420 CB :: 69.3990 CG2 :: 22.3610 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 :: 7.3330 HA :: 4.6690 HB :: 4.4440 HG21 :: 1.0790 HG22 :: 1.0790 HG23 :: 1.0790 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 :: 109.8030 Ave N Shift Values>> N :: 115.42(4.75) 2.A88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.34 M 0.24 C 0.14 V 0.1 L 0.08 T 0.04 I 0.03 C Shift Assignments>> C :: 178.8300 CA :: 56.2890 CB :: 20.0360 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.6970 HA :: 4.2230 HB1 :: 1.4650 HB2 :: 1.4650 HB3 :: 1.4650 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 126.5060 Ave N Shift Values>> N :: 123.23(3.54) 2.V89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.89 C 0.1 C Shift Assignments>> C :: 177.4730 CA :: 67.2340 CB :: 31.5520 CG1 :: 21.1390 CG2 :: 23.5840 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 :: 8.2500 HA :: 3.4180 HB :: 1.9190 HG11 :: 0.8520 HG12 :: 0.8520 HG13 :: 0.8520 HG21 :: 1.0080 HG22 :: 1.0080 HG23 :: 1.0080 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 :: 116.6880 Ave N Shift Values>> N :: 121.14(4.54) 2.K90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 K 0.45 R 0.06 C Shift Assignments>> C :: 180.4100 CA :: 58.8000 CB :: 32.0810 CG :: 24.8070 CD :: 29.6960 CE :: 41.9210 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 :: 7.5740 HA :: 4.1010 HB3 :: 1.9290 HG2 :: 1.4350 HG3 :: 1.5160 HD3 :: 1.7400 HE3 :: 3.0160 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 :: 120.7820 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.E91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 Y 0.19 E 0.18 I 0.17 F 0.12 M 0.02 K 0.01 V 0.01 HN Overlap>> 1.I76 1.I76 C Shift Assignments>> C :: 177.3190 CA :: 59.1670 CG :: 37.0310 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 :: 3.9840 HB2 :: 2.4450 HB3 :: 1.9420 HG2 :: 2.4500 HG3 :: 2.4920 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 :: 122.1830 Ave N Shift Values>> N :: 120.67(3.48) 2.R92 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.59 L 0.15 R 0.14 K 0.09 C Shift Assignments>> C :: 178.9380 CA :: 59.5450 CB :: 27.4630 CG :: 27.2510 CD :: 41.9210 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 :: 8.2860 HA :: 2.7430(S) HB2 :: 0.6920(S) HB3 :: 1.5580 HG2 :: 1.1280 HG3 :: 1.3180 HD2 :: 2.8090 HD3 :: 3.1480 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 :: 121.1820 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) SRO Rule Breaks>> (HA > HD2 : 0.9912) 2.D93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.29 F 0.28 C 0.15 I 0.08 D 0.07 L 0.05 N 0.03 C Shift Assignments>> C :: 176.8550 CA :: 57.4560 CB :: 39.2920 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 :: 8.2840 HA :: 4.3210 HB2 :: 2.6770 HB3 :: 2.5590 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.7950 Ave N Shift Values>> N :: 120.65(3.86) 2.A94 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Consistent HN Overlap>> 1.K98 1.K98 H Shift Assignments>> H :: 7.8240 HA :: 4.1950 HB1 :: 1.4270 HB2 :: 1.4270 HB3 :: 1.4270 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.3590 Ave N Shift Values>> N :: 123.23(3.54) 2.V95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.81 C 0.18 HN Overlap>> 1.Q52 1.Q52 C Shift Assignments>> C :: 176.8310 CA :: 66.9830 CB :: 31.6850 CG1 :: 22.3610 CG2 :: 24.1950 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 :: 7.9690 HA :: 3.4370 HB :: 2.2280 HG11 :: 0.9810 HG12 :: 0.9810 HG13 :: 0.9810 HG21 :: 1.1120 HG22 :: 1.1120 HG23 :: 1.1120 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 :: 120.6550 Ave N Shift Values>> N :: 121.14(4.54) 2.K96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 K 0.4 R 0.12 C Shift Assignments>> C :: 179.5860 CA :: 58.0940 CB :: 31.7980 CG :: 23.5840 CD :: 29.0850 CE :: 41.9210 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 :: 8.7350 HA :: 4.8700 HB2 :: 1.6890 HB3 :: 1.8930 HG3 :: 1.3900 HD2 :: 1.4500 HD3 :: 1.5900 HE2 :: 2.8100 HE3 :: 2.8830 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 :: 122.2970 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.D97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.27 Y 0.24 D 0.12 C 0.11 L 0.11 I 0.05 K 0.03 N 0.02 HN Overlap>> 1.N30 1.E99 1.N30 1.E99 C Shift Assignments>> C :: 179.5210 CA :: 57.2140 CB :: 40.2350 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 :: 8.5480 HA :: 4.4400 HB3 :: 2.7450 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 :: 121.1350 Ave N Shift Values>> N :: 120.65(3.86) 2.L98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 L 0.28 R 0.13 K 0.01 C Shift Assignments>> C :: 179.7810 CA :: 58.1440 CB :: 41.7660 CG :: 27.2510 CD1 :: 27.2510 CD2 :: 26.0290 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 :: 7.6330 HA :: 4.2120 HB3 :: 1.3750 HG :: 1.8140 HD11 :: 1.0120 HD12 :: 1.0120 HD13 :: 1.0120 HD21 :: 0.6020 HD22 :: 0.6020 HD23 :: 0.6020 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 :: 122.6520 Ave N Shift Values>> N :: 121.86(3.9) 2.L99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.58 L 0.35 R 0.05 C Shift Assignments>> C :: 178.3760 CA :: 58.7780 CB :: 41.3030 CG :: 26.6400 CD1 :: 27.2510 CD2 :: 24.1950 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 :: 8.9090 HA :: 3.8110 HB2 :: 2.1490 HB3 :: 1.0250 HG :: 1.8020 HD11 :: 0.7870 HD12 :: 0.7870 HD13 :: 0.7870 HD21 :: 0.7220 HD22 :: 0.7220 HD23 :: 0.7220 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 :: 120.7530 Ave N Shift Values>> N :: 121.86(3.9) 2.Q100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 Q 0.26 K 0.25 E 0.08 R 0.04 I 0.02 M 0.02 HN Overlap>> 2.S8 2.S8 C Shift Assignments>> C :: 177.4000 CA :: 58.6160 CB :: 28.7970 CG :: 33.9750 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 :: 8.3500 HA :: 4.1710 HB2 :: 2.0410 HB3 :: 2.1860 HG2 :: 2.3080 HG3 :: 2.4990 HE21 :: 7.5320 HE22 :: 6.8600 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 :: 118.1440 NE2 :: 113.1550 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.Q101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.15 H 0.14 K 0.13 E 0.13 W 0.13 R 0.12 C 0.11 M 0.04 I 0.01 C Shift Assignments>> C :: 177.8370 CA :: 56.4260 CB :: 29.4530 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 :: 7.2650 HA :: 4.2970 HE22 :: 6.8330 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 :: 116.1250 NE2 :: 113.6360 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 2.L102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 C 0.39 R 0.1 G 0.02 HN Overlap>> 1.D9 1.D9 C Shift Assignments>> C :: 178.0740 CA :: 57.8290 CB :: 42.6830 CG :: 26.6400 CD1 :: 26.0290 CD2 :: 22.3610 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 :: 8.1620 HA :: 4.1560 HB2 :: 1.0550 HB3 :: 0.6560 HG :: 1.6370 HD11 :: 0.6040 HD12 :: 0.6040 HD13 :: 0.6040 HD21 :: 0.9180 HD22 :: 0.9180 HD23 :: 0.9180 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 :: 121.8050 Ave N Shift Values>> N :: 121.86(3.9) 2.L103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.99 C Shift Assignments>> C :: 177.7540 CG :: 26.6400 CD1 :: 24.8070 CD2 :: 23.5840 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 :: 8.6890 HA :: 4.0710 HB2 :: 2.0090 HB3 :: 1.4360 HG :: 1.9070 HD11 :: 0.7230 HD12 :: 0.7230 HD13 :: 0.7230 HD21 :: 0.8570 HD22 :: 0.8570 HD23 :: 0.8570 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 :: 118.4570 Ave N Shift Values>> N :: 121.86(3.9) 2.P104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.82 C 0.17 C Shift Assignments>> C :: 178.6370 CA :: 65.4730 CB :: 30.9020 CG :: 27.8630 CD :: 51.0890 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 :: 4.3150 HB2 :: 1.7580 HB3 :: 2.2750 HG2 :: 1.9810 HG3 :: 2.0810 HD2 :: 3.3620 HD3 :: 3.5260 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 2.K105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 K 0.44 R 0.09 C Shift Assignments>> C :: 177.2960 CA :: 58.5710 CB :: 32.2630 CG :: 24.8070 CD :: 29.0850 CE :: 41.9210 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 :: 7.1590 HA :: 3.9310 HB2 :: 1.6490 HB3 :: 1.7890 HG2 :: 0.8570 HG3 :: 1.2470 HD2 :: 1.5050 HD3 :: 1.5510 HE3 :: 2.8120 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 :: 117.0860 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.F106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.48 F 0.3 C 0.2 C Shift Assignments>> C :: 174.4160 CA :: 58.1720 CB :: 40.4720 CD1 :: 133.2070 CE1 :: 131.7870 CZ :: 130.6680 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 :: 7.3940 HA :: 4.6290 HB2 :: 2.4310 HB3 :: 3.4440 HD1 :: 7.5910 HE1 :: 7.5120 HZ :: 7.5270 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 :: 116.5800 Ave N Shift Values>> N :: 120.45(4.18) 2.K107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.47 C 0.44 R 0.08 C Shift Assignments>> C :: 176.7500 CA :: 57.0760 CB :: 33.1950 CG :: 24.8070 CD :: 29.6960 CE :: 41.9210 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 :: 7.1310 HA :: 4.4230 HB2 :: 1.8080 HB3 :: 1.8290 HG3 :: 1.5180 HD3 :: 1.7420 HE3 :: 3.0170 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 :: 121.9510 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.R108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.47 C 0.38 K 0.09 G 0.04 C Shift Assignments>> C :: 176.3490 CA :: 56.3390 CB :: 30.8440 CG :: 27.2510 CD :: 43.1430 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 :: 8.6570 HA :: 4.3550 HB2 :: 1.7080 HB3 :: 1.7650 HG2 :: 1.6270 HG3 :: 1.7070 HD2 :: 2.9560 HD3 :: 3.0800 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 :: 126.1270 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 2.K109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.47 C 0.38 R 0.13 C Shift Assignments>> C :: 175.9720 CA :: 56.1310 CB :: 33.1790 CG :: 24.8070 CD :: 28.4740 CE :: 41.9210 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 :: 8.4480 HA :: 4.3290 HB2 :: 1.7220 HB3 :: 1.8140 HG3 :: 1.4370 HD3 :: 1.6500 HE3 :: 2.9630 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 :: 124.7530 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 2.A110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 M 0.07 C 0.01 HN Overlap>> 1.A50 1.A50 C Shift Assignments>> C :: 176.3510 CA :: 52.3290 CB :: 19.4650 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.3310 HA :: 4.3430 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 :: 127.1810 Ave N Shift Values>> N :: 123.23(3.54) 2.N111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 N 0.17 L 0.15 F 0.13 Y 0.11 C 0.07 K 0.02 C Shift Assignments>> C :: 179.4140 CA :: 54.7220 CB :: 40.2010 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 7.9380 HA :: 4.4390 HB3 :: 2.7050 HD21 :: 7.4500 HD22 :: 6.7380 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 :: 124.4230 ND2 :: 113.8350 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) ########################################################################### Overall Results: #Consistent: 223 #Clerical: 0 #Suspicious: 16 #Anomalous: 1 #Mistyped: 1 #Indeterminable: 0 Typing Results: #Consistent: 231 #Suspicious: 1 #Mistyped: 1 #Indeterminable: 8 Shift Relative Order (SRO) Results: #Consistent: 239 #Suspicious: 2 C Shift Results: #Consistent:1003 #Duplicate: 0 #Unknown: 0 #Suspicious: 4 #Anomalous: 1 H Shift Results: #Consistent:1488 #Duplicate: 0 #Unknown: 0 #Suspicious: 20 #Anomalous: 1 N Shift Results: #Consistent: 243 #Duplicate: 0 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 Error Summary: 1.R54 HD2 = 1.2940(S), Expected = 3.12, Std = 0.2400, ChiSquare = 2.7765e-14 1.R54 SRO Rule Break>> HD2 > HB2 : 0.994969040247678 1.R54 SRO Rule Break>> HD2 > HB3 : 0.995112016293279 1.I55 H = 11.1200(S), Expected = 8.28, Std = 0.6800, ChiSquare = 2.9607e-05 1.R72 HE = 11.361(S), Expected = 7.40, Std = 0.6300, ChiSquare = 3.2303e-10 1.R110 HG2 = 0.6290(S), Expected = 1.57, Std = 0.2700, ChiSquare = 4.9180e-04 1.R110 HD2 = 2.1720(S), Expected = 3.12, Std = 0.2400, ChiSquare = 7.8151e-05 1.R110 HE = 10.0150(S), Expected = 7.40, Std = 0.6300, ChiSquare = 3.3132e-05 1.D120 HA = 5.7520(S), Expected = 4.59, Std = 0.3200, ChiSquare = 2.8205e-04 2.Q20 HB2 = 0.2470(S), Expected = 2.05, Std = 0.2500, ChiSquare = 5.5136e-13 2.Q20 HB3 = 0.4060(S), Expected = 2.02, Std = 0.2800, ChiSquare = 8.2004e-09 2.Q20 HG2 = 1.1060(S), Expected = 2.32, Std = 0.2700, ChiSquare = 6.9147e-06 2.L29 Typing: Suspicious 2.L29 CG = 31.5300(S), Expected = 26.78, Std = 1.1000, ChiSquare = 1.5732e-05 2.E32 N = 109.0840(S), Expected = 120.67, Std = 3.4800, ChiSquare = 8.7061e-04 2.R33 C = 184.2900(S), Expected = 176.41, Std = 2.0300, ChiSquare = 1.0370e-04 2.I34 C = 185.3480(A), Expected = 175.85, Std = 1.9200, ChiSquare = 7.5414e-07 2.A35 HB1 = 0.2370(S), Expected = 1.35, Std = 0.2600, ChiSquare = 1.8625e-05 2.A35 HB2 = 0.2370(S), Expected = 1.35, Std = 0.2600, ChiSquare = 1.8625e-05 2.A35 HB3 = 0.2370(S), Expected = 1.35, Std = 0.2600, ChiSquare = 1.8625e-05 2.K54 HB2 = 0.7350(S), Expected = 1.78, Std = 0.2500, ChiSquare = 2.9151e-05 2.Q56 HA = 5.7690(S), Expected = 4.27, Std = 0.4400, ChiSquare = 6.5725e-04 2.Q56 NE2 = 105.1610(S), Expected = 111.87, Std = 1.7200, ChiSquare = 9.5962e-05 2.Q67 Typing: Mistyped 2.Q67 CB = 37.4380(S), Expected = 29.19, Std = 1.8200, ChiSquare = 5.8464e-06 2.Q67 HA = 6.3410(A), Expected = 4.27, Std = 0.4400, ChiSquare = 2.5161e-06 2.L68 CB = 49.7410(S), Expected = 42.31, Std = 1.8800, ChiSquare = 7.7287e-05 2.Q69 HB2 = 0.9770(S), Expected = 2.05, Std = 0.2500, ChiSquare = 1.7707e-05 2.Q69 HG2 = 1.4050(S), Expected = 2.32, Std = 0.2700, ChiSquare = 7.0176e-04 2.S83 HB3 = 2.7940(S), Expected = 3.85, Std = 0.2700, ChiSquare = 9.1872e-05 2.R92 HA = 2.7430(S), Expected = 4.30, Std = 0.4600, ChiSquare = 7.1235e-04 2.R92 HB2 = 0.6920(S), Expected = 1.79, Std = 0.2700, ChiSquare = 4.7690e-05 2.R92 SRO Rule Break>> HA > HD2 : 0.991153846153846