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.A2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> A 0.91 M 0.07 L 0.01 C Shift Assignments>> C :: 177.8501 CA :: 52.4084 CB :: 19.5787 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> HA :: 4.3720 HB1 :: 1.4000 HB2 :: 1.4000 HB3 :: 1.4000 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) 1.M3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.71 Q 0.23 K 0.03 E 0.01 HN Overlap>> 1.L21 1.L21 C Shift Assignments>> C :: 176.7555 CA :: 56.0697 CB :: 32.6500 CG :: 31.9720 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 :: 8.5719 HA :: 4.4210 HB2 :: 2.0710 HB3 :: 2.0710 HG2 :: 2.5860 HG3 :: 2.5860 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 120.0490 Ave N Shift Values>> N :: 120.09(3.57) 1.G4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.87 L 0.09 R 0.01 C Shift Assignments>> C :: 173.8540 CA :: 45.3310 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5153 HA2 :: 3.9200 HA3 :: 4.0410 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.3472 Ave N Shift Values>> N :: 109.67(3.87) 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 :: 174.4107 CA :: 58.1885 CB :: 64.7515 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.9798 HA :: 4.7410 HB2 :: 3.8250 HB3 :: 3.8960 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 :: 116.0881 Ave N Shift Values>> N :: 116.28(3.52) 1.T6 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 171.6845 CA :: 61.5256 CB :: 69.9178 CG2 :: 20.1500 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 :: 10.5439(S) HA :: 4.5940 HB :: 3.7660 HG21 :: 0.6900 HG22 :: 0.6900 HG23 :: 0.6900 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 :: 123.8174 Ave N Shift Values>> N :: 115.42(4.75) 1.N7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.73 D 0.15 F 0.03 Y 0.03 L 0.03 C Shift Assignments>> C :: 174.9358 CA :: 51.1495 CB :: 38.7500 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 :: 8.8381 HA :: 5.1290 HB2 :: 2.5250 HB3 :: 2.6380 HD21 :: 6.7897 HD22 :: 8.0383 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 :: 121.5218 ND2 :: 113.2665 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.V8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 175.9300 CA :: 62.1858 CB :: 34.6620 CG1 :: 21.7750 CG2 :: 22.8590 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 :: 9.0084 HA :: 4.6000 HB :: 2.0400 HG11 :: 0.6730 HG12 :: 0.6730 HG13 :: 0.6730 HG21 :: 0.7440 HG22 :: 0.7440 HG23 :: 0.7440 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 :: 124.1985 Ave N Shift Values>> N :: 121.14(4.54) 1.L9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.57 A 0.17 R 0.16 L 0.08 C Shift Assignments>> C :: 173.5730 CA :: 53.5053 CB :: 44.4998 CG :: 27.4810 CD1 :: 22.5000 CD2 :: 27.8990 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 :: 4.9510 HB2 :: 1.2740 HB3 :: 1.7800 HG :: 1.3260 HD11 :: 0.6120 HD12 :: 0.6120 HD13 :: 0.6120 HD21 :: 0.8210 HD22 :: 0.8210 HD23 :: 0.8210 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 :: 131.3055 Ave N Shift Values>> N :: 121.86(3.9) 1.I10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 174.2283 CA :: 61.1093 CB :: 40.2430 CG1 :: 28.4440 CG2 :: 18.0070 CD1 :: 14.7290 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 :: 8.1981 HA :: 4.4970 HB :: 1.8600 HG12 :: 0.8130 HG13 :: 1.6230 HG21 :: 0.9390 HG22 :: 0.9390 HG23 :: 0.9390 HD11 :: 0.7820 HD12 :: 0.7820 HD13 :: 0.7820 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.6234 Ave N Shift Values>> N :: 121.46(4.28) 1.I11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 174.6720 CA :: 59.8216 CB :: 38.3090 CG1 :: 26.9990 CG2 :: 18.5570 CD1 :: 14.5670 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 :: 9.3752 HA :: 4.9570 HB :: 2.0470 HG12 :: 1.5870 HG13 :: 1.5810 HG21 :: 0.6950 HG22 :: 0.6950 HG23 :: 0.6950 HD11 :: 0.6330 HD12 :: 0.6330 HD13 :: 0.6330 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 :: 128.9193 Ave N Shift Values>> N :: 121.46(4.28) 1.E12 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> E 0.67 I 0.16 M 0.14 K 0.01 C Shift Assignments>> C :: 173.4743 CA :: 57.7197 CB :: 30.8570 CG :: 37.7990 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 :: 8.3965 HA :: 4.1960 HB2 :: 2.8330(S) HB3 :: 1.3560 HG2 :: 2.0470 HG3 :: 2.1780 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 126.2605 Ave N Shift Values>> N :: 120.67(3.48) 1.D13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.29 D 0.25 K 0.17 R 0.1 F 0.07 Y 0.05 N 0.03 C Shift Assignments>> C :: 175.7048 CA :: 54.4493 CB :: 42.1117 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 :: 8.9826 HA :: 4.6980 HB2 :: 3.0640 HB3 :: 3.0640 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 :: 124.6272 Ave N Shift Values>> N :: 120.65(3.86) 1.E14 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> E 0.74 I 0.08 K 0.07 M 0.07 Q 0.01 C Shift Assignments>> CA :: 54.8200 CB :: 29.5530 CG :: 37.4960 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 :: 10.3770(S) HA :: 4.8050 HB2 :: 2.1520 HB3 :: 2.1520 HG2 :: 2.2870 HG3 :: 2.3940 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 :: 127.2479 Ave N Shift Values>> N :: 120.67(3.48) 1.P15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 178.6724 CA :: 65.0906 CB :: 32.5960 CG :: 27.5210 CD :: 51.8480 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 :: 4.4380 HB2 :: 1.9660 HB3 :: 2.3990 HG2 :: 2.0600 HG3 :: 2.1230 HD2 :: 4.3710 HD3 :: 4.0140 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.L16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.92 R 0.06 HN Overlap>> 1.T40 1.T40 C Shift Assignments>> C :: 180.2164 CA :: 58.3539 CB :: 41.7172 CG :: 27.5200 CD1 :: 25.0760 CD2 :: 23.8740 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 :: 8.8955 HA :: 4.1630 HB2 :: 1.5070 HB3 :: 1.7960 HG :: 1.7050 HD11 :: 0.9280 HD12 :: 0.9280 HD13 :: 0.9280 HD21 :: 0.8880 HD22 :: 0.8880 HD23 :: 0.8880 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 116.5643 Ave N Shift Values>> N :: 121.86(3.9) 1.I17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.9003 CA :: 62.8736 CB :: 36.8000 CG1 :: 27.9040 CG2 :: 17.5090 CD1 :: 11.9825 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 :: 7.1096 HA :: 4.0780 HB :: 1.9890 HG12 :: 1.2530 HG13 :: 1.5350 HG21 :: 1.0420 HG22 :: 1.0420 HG23 :: 1.0420 HD11 :: 0.7821 HD12 :: 0.7821 HD13 :: 0.7821 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.7527 Ave N Shift Values>> N :: 121.46(4.28) 1.S18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.8898 CA :: 62.6620 CB :: 62.2180 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.6475 HA :: 3.8170 HB2 :: 3.6970 HB3 :: 3.8190 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.9482 Ave N Shift Values>> N :: 116.28(3.52) 1.M19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.98 HN Overlap>> 1.R113 1.R113 C Shift Assignments>> C :: 177.9990 CA :: 59.1390 CB :: 33.1310 CG :: 32.3960 CE :: 17.1450 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 :: 8.5106 HA :: 4.2180 HB2 :: 2.1630 HB3 :: 2.1630 HG2 :: 2.5830 HG3 :: 2.7410 HE1 :: 2.0820 HE2 :: 2.0820 HE3 :: 2.0820 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 118.4026 Ave N Shift Values>> N :: 120.09(3.57) 1.Q20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.38 Q 0.36 R 0.1 E 0.07 I 0.03 M 0.02 C Shift Assignments>> C :: 179.8320 CA :: 59.0961 CB :: 28.5000 CG :: 33.6870 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 :: 7.4284 HA :: 4.2140 HB2 :: 2.4640 HB3 :: 2.2810 HG2 :: 2.2300 HG3 :: 2.7100 HE21 :: 6.6700 HE22 :: 8.0105 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 :: 120.1254 NE2 :: 109.2003 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.68 R 0.28 G 0.02 HN Overlap>> 1.M3 1.M3 C Shift Assignments>> C :: 178.1835 CA :: 57.9491 CB :: 42.1550 CG :: 27.0250 CD1 :: 27.0600 CD2 :: 22.8730 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 :: 8.6052 HA :: 4.0100 HB2 :: 1.0600 HB3 :: 2.1250 HG :: 1.9180 HD11 :: 0.8540 HD12 :: 0.8540 HD13 :: 0.8540 HD21 :: 0.5080 HD22 :: 0.5080 HD23 :: 0.5080 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 :: 119.9478 Ave N Shift Values>> N :: 121.86(3.9) 1.E22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.54 E 0.4 K 0.02 M 0.01 C Shift Assignments>> C :: 178.2625 CA :: 60.3684 CB :: 29.9030 CG :: 37.2940 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 :: 8.9584 HA :: 3.6490 HB2 :: 2.0850 HB3 :: 2.1750 HG2 :: 2.0310 HG3 :: 2.3880 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 :: 121.3381 Ave N Shift Values>> N :: 120.67(3.48) 1.D23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.3 Y 0.26 L 0.14 D 0.12 K 0.08 I 0.06 N 0.01 C Shift Assignments>> C :: 179.4435 CA :: 57.4595 CB :: 40.5500 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 :: 8.1411 HA :: 4.3450 HB2 :: 2.6620 HB3 :: 2.7900 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.2941 Ave N Shift Values>> N :: 120.65(3.86) 1.L24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 R 0.34 G 0.04 C Shift Assignments>> C :: 180.2412 CA :: 58.5948 CB :: 42.6300 CG :: 27.5730 CD1 :: 26.2000 CD2 :: 25.2050 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 :: 8.1033 HA :: 4.1210 HB2 :: 1.6840 HB3 :: 1.9230 HG :: 1.7400 HD11 :: 0.9090 HD12 :: 0.9090 HD13 :: 0.9090 HD21 :: 0.7870 HD22 :: 0.7870 HD23 :: 0.7870 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 :: 122.3593 Ave N Shift Values>> N :: 121.86(3.9) 1.V25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 178.6710 CA :: 67.7315 CB :: 31.8070 CG1 :: 24.0470 CG2 :: 24.0980 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 :: 8.8321 HA :: 3.4500 HB :: 2.2310 HG11 :: 0.9170 HG12 :: 0.9170 HG13 :: 0.9170 HG21 :: 0.8170 HG22 :: 0.8170 HG23 :: 0.8170 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 :: 120.4947 Ave N Shift Values>> N :: 121.14(4.54) 1.R26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.55 G 0.25 K 0.18 C Shift Assignments>> C :: 181.8487 CA :: 59.7660 CB :: 30.0680 CG :: 29.2110 CD :: 43.4240 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 :: 8.5400 HA :: 4.5250 HB2 :: 1.8070 HB3 :: 1.9580 HG2 :: 1.7130 HG3 :: 1.9520 HD2 :: 3.2350 HD3 :: 3.2940 HE :: 7.6585 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 :: 119.1832 NE :: 85.0955 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.S27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.6288 CA :: 61.5332 CB :: 62.5685 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.3699 HA :: 4.3270 HB2 :: 4.1330 HB3 :: 4.0660 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 :: 118.2414 Ave N Shift Values>> N :: 116.28(3.52) 1.L28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.59 R 0.19 G 0.15 A 0.05 C Shift Assignments>> C :: 176.5111 CA :: 54.7617 CB :: 43.5780 CG :: 26.7230 CD1 :: 26.8910 CD2 :: 22.9690 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 :: 7.2840 HA :: 4.2920 HB2 :: 1.6050 HB3 :: 1.9790 HG :: 1.8580 HD11 :: 0.9220 HD12 :: 0.9220 HD13 :: 0.9220 HD21 :: 0.8600 HD22 :: 0.8600 HD23 :: 0.8600 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.4878 Ave N Shift Values>> N :: 121.86(3.9) 1.G29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.67 L 0.19 R 0.07 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.6626 CA :: 44.7591 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.8937 HA2 :: 3.6250 HA3 :: 4.0070 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.0045 Ave N Shift Values>> N :: 109.67(3.87) 1.H30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.99 C Shift Assignments>> C :: 174.0716 CA :: 55.2586 CB :: 32.6220 CD2 :: 116.0020 CE1 :: 138.7370 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.0230 HA :: 5.0350 HB2 :: 2.6760 HB3 :: 3.3580 HD2 :: 6.5130 HE1 :: 7.6680 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 :: 119.0940 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.D31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.4 L 0.29 R 0.14 D 0.1 F 0.01 C Shift Assignments>> C :: 175.1563 CA :: 52.5540 CB :: 44.0323 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 :: 8.5072 HA :: 5.0310 HB2 :: 2.4030 HB3 :: 2.7320 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.7514 Ave N Shift Values>> N :: 120.65(3.86) 1.I32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.94 A 0.04 C Shift Assignments>> C :: 176.4351 CA :: 58.2230 CB :: 37.2540 CG1 :: 27.4220 CG2 :: 17.8220 CD1 :: 11.2520 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 :: 8.9074 HA :: 4.6340 HB :: 2.0530 HG12 :: 1.4080 HG13 :: 1.3650 HG21 :: 0.8350 HG22 :: 0.8350 HG23 :: 0.8350 HD11 :: 0.8000 HD12 :: 0.8000 HD13 :: 0.8000 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 :: 120.6942 Ave N Shift Values>> N :: 121.46(4.28) 1.A33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.9 M 0.07 L 0.01 C Shift Assignments>> C :: 177.2310 CA :: 52.6658 CB :: 19.7130 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.1231 HA :: 4.2320 HB1 :: 1.0000 HB2 :: 1.0000 HB3 :: 1.0000 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 131.9028 Ave N Shift Values>> N :: 123.23(3.54) 1.G34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.66 L 0.2 R 0.07 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 170.5640 CA :: 44.7393 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.1474 HA2 :: 3.9950 HA3 :: 3.9950 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 102.8791 Ave N Shift Values>> N :: 109.67(3.87) 1.T35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.4036 CA :: 59.7771 CB :: 70.5480 CG2 :: 21.9070 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 :: 8.1916 HA :: 5.3650 HB :: 4.1750 HG21 :: 1.0950 HG22 :: 1.0950 HG23 :: 1.0950 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 :: 112.3859 Ave N Shift Values>> N :: 115.42(4.75) 1.A36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.63 L 0.34 K 0.01 C Shift Assignments>> C :: 174.8207 CA :: 50.7416 CB :: 22.4140 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.9782 HA :: 4.7420 HB1 :: 1.2920 HB2 :: 1.2920 HB3 :: 1.2920 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.8985 Ave N Shift Values>> N :: 123.23(3.54) 1.A37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.84 L 0.14 C Shift Assignments>> C :: 175.0312 CA :: 51.3894 CB :: 21.5260 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.6958 HA :: 4.3110 HB1 :: 1.5710 HB2 :: 1.5710 HB3 :: 1.5710 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.7422 Ave N Shift Values>> N :: 123.23(3.54) 1.T38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 A 0.01 C Shift Assignments>> C :: 173.5871 CA :: 59.3169 CB :: 73.4241 CG2 :: 22.6990 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 :: 7.1688 HA :: 4.4400 HB :: 4.5890 HG1 :: 5.7523 HG21 :: 1.1290 HG22 :: 1.1290 HG23 :: 1.1290 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 103.0747 Ave N Shift Values>> N :: 115.42(4.75) 1.R39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.74 R 0.24 C Shift Assignments>> C :: 177.8300 CA :: 59.8522 CB :: 31.6140 CG :: 26.4110 CD :: 44.7550 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 :: 8.7902 HA :: 3.7970 HB2 :: 2.0800 HB3 :: 1.7110 HG2 :: 1.4730 HG3 :: 1.6450 HD2 :: 3.1650 HD3 :: 3.2900 HE :: 9.0094 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 :: 124.6706 NE :: 84.6005 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.T40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> 1.L16 1.L16 C Shift Assignments>> C :: 176.7107 CA :: 66.7175 CB :: 68.8400 CG2 :: 22.1300 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.8552 HA :: 3.9310 HB :: 4.0610 HG21 :: 1.2510 HG22 :: 1.2510 HG23 :: 1.2510 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.5526 Ave N Shift Values>> N :: 115.42(4.75) 1.Q41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.34 K 0.33 E 0.19 I 0.05 R 0.03 M 0.02 C Shift Assignments>> C :: 179.3489 CA :: 58.8443 CB :: 28.9247 CG :: 34.3970 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 :: 7.9774 HA :: 4.1840 HB2 :: 2.0430 HB3 :: 2.2420 HG2 :: 2.5890 HG3 :: 2.5890 HE21 :: 7.0723 HE22 :: 7.5135 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.5345 NE2 :: 111.5083 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.66 A 0.26 I 0.06 C Shift Assignments>> C :: 177.8749 CA :: 55.6357 CB :: 17.7380 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0589 HA :: 3.8440 HB1 :: 1.4280 HB2 :: 1.4280 HB3 :: 1.4280 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.3802 Ave N Shift Values>> N :: 123.23(3.54) 1.Q43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.35 Q 0.35 R 0.19 E 0.03 M 0.02 I 0.02 C Shift Assignments>> C :: 179.8676 CA :: 58.7991 CB :: 27.9690 CG :: 33.3680 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 :: 7.9060 HA :: 3.9670 HB2 :: 2.4910 HB3 :: 2.0150 HG2 :: 2.4180 HG3 :: 2.6720 HE21 :: 7.6334 HE22 :: 6.7169 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 :: 117.6797 NE2 :: 110.3930 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.6 I 0.21 K 0.09 Q 0.04 M 0.04 C Shift Assignments>> C :: 179.1279 CA :: 58.9514 CB :: 29.7065 CG :: 36.4290 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 :: 8.0001 HA :: 4.0170 HB2 :: 2.1184 HB3 :: 2.0174 HG2 :: 2.2260 HG3 :: 2.5110 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.0725 Ave N Shift Values>> N :: 120.67(3.48) 1.A45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.5 A 0.43 I 0.03 C Shift Assignments>> C :: 181.0799 CA :: 55.3043 CB :: 18.5190 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1291 HA :: 4.1780 HB1 :: 1.5000 HB2 :: 1.5000 HB3 :: 1.5000 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.5235 Ave N Shift Values>> N :: 123.23(3.54) 1.V46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 176.2116 CA :: 63.8372 CB :: 31.6230 CG1 :: 22.7010 CG2 :: 22.7010 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 :: 7.8782 HA :: 4.3380 HB :: 2.3010 HG11 :: 1.1250 HG12 :: 1.1250 HG13 :: 1.1250 HG21 :: 1.1250 HG22 :: 1.1250 HG23 :: 1.1250 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 :: 115.1205 Ave N Shift Values>> N :: 121.14(4.54) 1.A47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.68 M 0.3 HN Overlap>> 1.K105 1.K105 C Shift Assignments>> C :: 179.2320 CA :: 53.8833 CB :: 18.5190 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.3898 HA :: 4.1920 HB1 :: 1.4700 HB2 :: 1.4700 HB3 :: 1.4700 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.8938 Ave N Shift Values>> N :: 123.23(3.54) 1.K48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.68 R 0.3 G 0.01 C Shift Assignments>> C :: 176.7370 CA :: 57.9877 CB :: 33.7790 CG :: 25.3740 CD :: 29.5480 CE :: 42.3090 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 :: 7.2632 HA :: 4.2280 HB2 :: 1.9490 HB3 :: 1.8970 HG2 :: 1.4410 HG3 :: 1.5960 HD2 :: 1.7210 HD3 :: 1.7210 HE2 :: 3.0120 HE3 :: 3.0120 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 :: 116.5512 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.59 E 0.34 Q 0.05 C Shift Assignments>> C :: 173.0068 CA :: 55.5515 CB :: 32.8280 CG :: 35.8100 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.7978 HA :: 4.2980 HB2 :: 1.7740 HB3 :: 1.8920 HG2 :: 1.8960 HG3 :: 2.0590 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.1671 Ave N Shift Values>> N :: 120.67(3.48) 1.K50 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.85 R 0.1 A 0.03 G 0.01 C Shift Assignments>> CA :: 54.0331 CB :: 32.4950 CG :: 23.8400 CD :: 29.5310 CE :: 41.9070 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 :: 8.3743 HA :: 4.1070 HB2 :: 1.3360 HB3 :: 1.4250 HG2 :: 0.4940(S) HG3 :: 0.8520 HD2 :: 1.2140 HD3 :: 1.2140 HE2 :: 2.5890 HE3 :: 2.5890 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 :: 126.7584 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 175.0109 CA :: 62.0468 CB :: 32.8940 CG :: 26.3570 CD :: 49.8970 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 :: 4.5130 HB2 :: 1.8850 HB3 :: 1.8850 HG2 :: 1.8230 HG3 :: 1.8230 HD2 :: 4.0230 HD3 :: 3.4060 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.G52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.58 L 0.23 R 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 172.9662 CA :: 44.5844 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.8050 HA2 :: 3.8610 HA3 :: 4.2220 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.4102 Ave N Shift Values>> N :: 109.67(3.87) 1.L53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.55 L 0.28 R 0.11 A 0.04 C Shift Assignments>> C :: 173.6385 CA :: 54.9287 CB :: 44.7016 CG :: 27.4021 CD1 :: 23.2180 CD2 :: 26.9150 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 :: 7.1978 HA :: 4.4510 HB2 :: 1.2110 HB3 :: 1.6000 HG :: 1.2061 HD11 :: 0.6350 HD12 :: 0.6350 HD13 :: 0.6350 HD21 :: 0.5290 HD22 :: 0.5290 HD23 :: 0.5290 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.5545 Ave N Shift Values>> N :: 121.86(3.9) 1.V54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 173.1499 CA :: 60.7796 CB :: 35.0130 CG1 :: 21.6650 CG2 :: 22.1050 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 :: 8.2188 HA :: 4.8930 HB :: 1.9396 HG11 :: 0.6870 HG12 :: 0.6870 HG13 :: 0.6870 HG21 :: 0.8330 HG22 :: 0.8330 HG23 :: 0.8330 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 :: 126.2623 Ave N Shift Values>> N :: 121.14(4.54) 1.L55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.93 R 0.05 C Shift Assignments>> C :: 175.0793 CA :: 53.2293 CB :: 41.6590 CG :: 27.4020 CD1 :: 24.9710 CD2 :: 25.7930 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 :: 8.7636 HA :: 5.1090 HB2 :: 1.7410 HB3 :: 1.5590 HG :: 1.3610 HD11 :: 0.5690 HD12 :: 0.5690 HD13 :: 0.5690 HD21 :: 0.5720 HD22 :: 0.5720 HD23 :: 0.5720 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 128.1147 Ave N Shift Values>> N :: 121.86(3.9) 1.A56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.59 L 0.38 K 0.01 C Shift Assignments>> C :: 174.9211 CA :: 51.8867 CB :: 22.1810 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.9305 HA :: 5.1280 HB1 :: 0.7300 HB2 :: 0.7300 HB3 :: 0.7300 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.6278 Ave N Shift Values>> N :: 123.23(3.54) 1.D57 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.5 L 0.24 R 0.11 D 0.09 F 0.01 C Shift Assignments>> C :: 173.6708 CA :: 52.0408 CB :: 44.0398 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 :: 8.5051 HA :: 5.3870 HB2 :: 2.5770 HB3 :: 3.7070(S) 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 :: 124.0838 Ave N Shift Values>> N :: 120.65(3.86) 1.I58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 176.7450 CA :: 65.5529 CB :: 39.1090 CG1 :: 29.2120 CG2 :: 17.7400 CD1 :: 15.0730 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 :: 9.3532 HA :: 4.0680 HB :: 2.1390 HG12 :: 1.8040 HG13 :: 1.8040 HG21 :: 0.9070 HG22 :: 0.9070 HG23 :: 0.9070 HD11 :: 0.7990 HD12 :: 0.7990 HD13 :: 0.7990 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 117.1469 Ave N Shift Values>> N :: 121.46(4.28) 1.Q59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.4 K 0.35 R 0.1 E 0.08 M 0.03 C Shift Assignments>> C :: 174.4359 CA :: 56.0695 CB :: 28.3710 CG :: 33.8880 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 :: 8.4537 HA :: 4.5530 HB2 :: 2.7280 HB3 :: 1.8210 HG2 :: 2.1950 HG3 :: 2.3500 HE21 :: 7.3024 HE22 :: 6.7759 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 :: 121.3759 NE2 :: 111.7077 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.7 L 0.29 C Shift Assignments>> C :: 180.1722 CA :: 54.9276 CB :: 38.2360 CG :: 27.0210 CD1 :: 24.7970 CD2 :: 21.0110 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 :: 7.7509 HA :: 4.6550 HB2 :: 1.9670 HB3 :: 1.9670 HG :: 1.6010 HD11 :: 0.3730 HD12 :: 0.3730 HD13 :: 0.3730 HD21 :: 0.4840 HD22 :: 0.4840 HD23 :: 0.4840 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 :: 127.6370 Ave N Shift Values>> N :: 121.86(3.9) 1.A61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.27 M 0.21 V 0.2 L 0.14 T 0.11 I 0.04 C Shift Assignments>> C :: 178.2749 CA :: 56.7502 CB :: 20.3330 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.7526 HA :: 4.1120 HB1 :: 1.5610 HB2 :: 1.5610 HB3 :: 1.5610 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.0334 Ave N Shift Values>> N :: 123.23(3.54) 1.D62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.4 D 0.35 L 0.12 F 0.05 Y 0.04 K 0.01 C Shift Assignments>> C :: 177.0736 CA :: 52.2469 CB :: 40.2580 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 :: 8.5901 HA :: 4.7460 HB2 :: 2.6650 HB3 :: 3.1460 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 :: 113.7945 Ave N Shift Values>> N :: 120.65(3.86) 1.G63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 L 0.1 R 0.01 F 0.01 C Shift Assignments>> C :: 174.3751 CA :: 45.2529 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.7553 HA2 :: 3.6560 HA3 :: 4.3380 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 107.7057 Ave N Shift Values>> N :: 109.67(3.87) 1.S64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.1986 CA :: 58.9619 CB :: 64.0081 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.8367 HA :: 4.3330 HB2 :: 4.0320 HB3 :: 4.0320 HG :: 8.2589 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.3967 Ave N Shift Values>> N :: 116.28(3.52) 1.S65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 177.9906 CA :: 54.3800 CB :: 64.9859 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.8446 HA :: 5.5300 HB2 :: 3.9080 HB3 :: 3.9080 HG :: 6.1778 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 :: 111.6177 Ave N Shift Values>> N :: 116.28(3.52) 1.G66 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.92 L 0.06 C Shift Assignments>> C :: 176.1290 CA :: 46.2114 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 11.0297(S) HA2 :: 3.8090 HA3 :: 5.1780(S) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 118.5677 Ave N Shift Values>> N :: 109.67(3.87) 1.I67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.9851 CA :: 66.1163 CB :: 38.2160 CG1 :: 29.7710 CG2 :: 17.6280 CD1 :: 14.6640 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 :: 8.0565 HA :: 3.7490 HB :: 1.5930 HG12 :: 1.5540 HG13 :: 0.6611 HG21 :: 0.8600 HG22 :: 0.8600 HG23 :: 0.8600 HD11 :: 0.6770 HD12 :: 0.6770 HD13 :: 0.6770 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 :: 119.8959 Ave N Shift Values>> N :: 121.46(4.28) 1.D68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.31 Y 0.31 D 0.12 L 0.1 I 0.07 N 0.04 C Shift Assignments>> C :: 177.6773 CA :: 57.1365 CB :: 39.6720 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 :: 6.7430 HA :: 4.3860 HB2 :: 2.4860 HB3 :: 2.8480 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 :: 119.1871 Ave N Shift Values>> N :: 120.65(3.86) 1.A69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.6 M 0.37 I 0.01 C Shift Assignments>> C :: 179.1592 CA :: 54.3997 CB :: 18.5300 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.0457 HA :: 4.3900 HB1 :: 1.4020 HB2 :: 1.4020 HB3 :: 1.4020 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 119.2026 Ave N Shift Values>> N :: 123.23(3.54) 1.V70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 177.5611 CA :: 67.5807 CB :: 31.7010 CG1 :: 23.0250 CG2 :: 25.2050 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 :: 8.1435 HA :: 3.4480 HB :: 2.4070 HG11 :: 1.0010 HG12 :: 1.0010 HG13 :: 1.0010 HG21 :: 0.7900 HG22 :: 0.7900 HG23 :: 0.7900 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 117.4387 Ave N Shift Values>> N :: 121.14(4.54) 1.E71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.55 E 0.38 K 0.04 Q 0.01 C Shift Assignments>> C :: 180.2526 CA :: 60.1415 CB :: 28.9840 CG :: 36.9010 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 :: 8.2686 HA :: 3.9600 HB2 :: 2.1490 HB3 :: 2.2300 HG2 :: 2.3240 HG3 :: 2.5140 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 :: 121.2675 Ave N Shift Values>> N :: 120.67(3.48) 1.D72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.29 Y 0.26 L 0.14 D 0.13 K 0.06 I 0.05 N 0.02 C Shift Assignments>> C :: 179.7199 CA :: 57.2545 CB :: 40.4340 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 :: 8.4060 HA :: 4.2250 HB2 :: 2.6390 HB3 :: 3.2870 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 :: 120.4520 Ave N Shift Values>> N :: 120.65(3.86) 1.I73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 177.6003 CA :: 66.0713 CB :: 38.7590 CG1 :: 29.6530 CG2 :: 17.7340 CD1 :: 15.0980 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 :: 7.6915 HA :: 3.4840 HB :: 1.9970 HG12 :: 0.8790 HG13 :: 2.0610 HG21 :: 0.7340 HG22 :: 0.7340 HG23 :: 0.7340 HD11 :: 0.6870 HD12 :: 0.6870 HD13 :: 0.6870 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 :: 122.1436 Ave N Shift Values>> N :: 121.46(4.28) 1.L74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.85 R 0.09 A 0.04 C Shift Assignments>> C :: 174.4372 CA :: 56.1480 CB :: 41.3000 CG :: 27.4800 CD1 :: 26.3320 CD2 :: 22.7180 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.9209 HA :: 4.9120 HB2 :: 1.5100 HB3 :: 1.7600 HG :: 1.8640 HD11 :: 0.9040 HD12 :: 0.9040 HD13 :: 0.9040 HD21 :: 1.1680 HD22 :: 1.1680 HD23 :: 1.1680 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 :: 119.4584 Ave N Shift Values>> N :: 121.86(3.9) 1.G75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 L 0.07 C Shift Assignments>> C :: 174.1835 CA :: 45.8826 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.7277 HA2 :: 3.8030 HA3 :: 3.9700 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 104.2693 Ave N Shift Values>> N :: 109.67(3.87) 1.Q76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.49 Q 0.28 E 0.18 K 0.03 C Shift Assignments>> C :: 175.4433 CA :: 56.7353 CB :: 31.7360 CG :: 34.3450 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 :: 7.8294 HA :: 4.2620 HB2 :: 1.6720 HB3 :: 1.6000 HG2 :: 1.9390 HG3 :: 2.1810 HE21 :: 6.6858 HE22 :: 7.1070 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 :: 118.2832 NE2 :: 110.9671 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.F77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 172.3790 CA :: 55.6370 CB :: 41.1100 CD1 :: 132.3200 CD2 :: 132.3200 CE1 :: 129.9100 CE2 :: 129.9100 CZ :: 129.9100 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 :: 8.3326 HA :: 4.7840 HB2 :: 2.8040 HB3 :: 3.2520 HD1 :: 7.1050 HD2 :: 7.1050 HE1 :: 7.1500 HE2 :: 7.1500 HZ :: 7.1500 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 :: 117.3477 Ave N Shift Values>> N :: 120.45(4.18) 1.D78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.33 L 0.25 K 0.12 N 0.1 F 0.09 Y 0.06 R 0.02 C Shift Assignments>> C :: 175.5947 CA :: 54.1440 CB :: 41.3470 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 :: 8.2774 HA :: 4.7440 HB2 :: 2.5870 HB3 :: 2.7070 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.4165 Ave N Shift Values>> N :: 120.65(3.86) 1.V79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.84 A 0.15 C Shift Assignments>> CA :: 57.7103 CB :: 34.9080 CG1 :: 20.3300 CG2 :: 21.2827 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 :: 6.9519 HA :: 4.7240 HB :: 2.0350 HG11 :: 0.7720 HG12 :: 0.7720 HG13 :: 0.7720 HG21 :: 0.7805 HG22 :: 0.7805 HG23 :: 0.7805 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 :: 121.2402 Ave N Shift Values>> N :: 121.14(4.54) 1.P80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 175.0905 CA :: 62.8256 CB :: 31.9180 CG :: 28.1550 CD :: 50.9880 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 :: 4.5730 HB2 :: 1.6490 HB3 :: 2.3290 HG2 :: 2.0750 HG3 :: 1.9430 HD2 :: 3.8750 HD3 :: 3.7120 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.V81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 174.8778 CA :: 59.8602 CB :: 35.9500 CG1 :: 21.3050 CG2 :: 21.3510 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 :: 8.1065 HA :: 4.8170 HB :: 1.7520 HG11 :: 0.2520 HG12 :: 0.2520 HG13 :: 0.2520 HG21 :: 0.8050 HG22 :: 0.8050 HG23 :: 0.8050 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 :: 120.5815 Ave N Shift Values>> N :: 121.14(4.54) 1.I82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 175.6897 CA :: 59.5065 CB :: 40.4800 CG1 :: 25.8020 CG2 :: 16.8830 CD1 :: 15.5180 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 :: 8.8453 HA :: 4.4400 HB :: 1.6190 HG12 :: 0.5680 HG13 :: 1.2350 HG21 :: 0.5970 HG22 :: 0.5970 HG23 :: 0.5970 HD11 :: 0.4120 HD12 :: 0.4120 HD13 :: 0.4120 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 :: 125.8222 Ave N Shift Values>> N :: 121.46(4.28) 1.F83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.98 G 0.01 C Shift Assignments>> C :: 175.2604 CA :: 58.4379 CB :: 41.9833 CD1 :: 131.7300 CD2 :: 131.7300 CE1 :: 130.4330 CE2 :: 130.4330 CZ :: 128.7887 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 :: 8.1031 HA :: 5.3200 HB2 :: 2.7710 HB3 :: 2.9120 HD1 :: 7.2060 HD2 :: 7.2060 HE1 :: 7.0720 HE2 :: 7.0720 HZ :: 7.1640 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 126.1264 Ave N Shift Values>> N :: 120.45(4.18) 1.I84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 175.4640 CA :: 60.7507 CB :: 37.9660 CG1 :: 27.3710 CG2 :: 18.3970 CD1 :: 15.6990 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 :: 8.4200 HA :: 5.3610 HB :: 1.7780 HG12 :: 1.4504 HG13 :: 0.5538 HG21 :: 0.4380 HG22 :: 0.4380 HG23 :: 0.4380 HD11 :: 0.5180 HD12 :: 0.5180 HD13 :: 0.5180 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 :: 124.8403 Ave N Shift Values>> N :: 121.46(4.28) 1.T85 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Anomalous N Shifts: Consistent PRTL>> A 0.84 T 0.13 S 0.01 C Shift Assignments>> C :: 172.5874 CA :: 58.8854 CB :: 69.9082 CG2 :: 17.4810(S) 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 :: 8.0054 HA :: 5.7220 HB :: 4.2290 HG1 :: 9.0130(A) HG21 :: 0.9300 HG22 :: 0.9300 HG23 :: 0.9300 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.8430 Ave N Shift Values>> N :: 115.42(4.75) 1.A86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.93 M 0.05 L 0.01 C Shift Assignments>> C :: 176.0592 CA :: 52.0327 CB :: 19.6800 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.4952 HA :: 4.4980 HB1 :: 1.0350 HB2 :: 1.0350 HB3 :: 1.0350 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 131.8359 Ave N Shift Values>> N :: 123.23(3.54) 1.Y87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> CA :: 55.3004 CB :: 38.8300 CD1 :: 133.6910 CD2 :: 133.6910 CE1 :: 117.9400 CE2 :: 117.9400 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 :: 9.7068 HA :: 5.2500 HB2 :: 2.6510 HB3 :: 3.0820 HD1 :: 7.5060 HD2 :: 7.5060 HE1 :: 6.9690 HE2 :: 6.9690 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 119.8981 Ave N Shift Values>> N :: 120.52(4.2) 1.P88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 177.7718 CA :: 65.1605 CB :: 32.0140 CG :: 27.7540 CD :: 50.8460 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 :: 3.8800 HB2 :: 1.9070 HB3 :: 2.0990 HG2 :: 2.0800 HG3 :: 2.0800 HD2 :: 3.1640 HD3 :: 3.8990 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.E89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.31 I 0.3 Q 0.18 K 0.14 R 0.04 C Shift Assignments>> C :: 178.6370 CA :: 59.1491 CB :: 27.4400 CG :: 35.4010 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 :: 10.1456 HA :: 4.1020 HB2 :: 2.1940 HB3 :: 1.9830 HG2 :: 2.1910 HG3 :: 2.4840 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.7714 Ave N Shift Values>> N :: 120.67(3.48) 1.R90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.68 G 0.15 K 0.15 C Shift Assignments>> C :: 176.8042 CA :: 58.1181 CB :: 30.0620 CG :: 28.6770 CD :: 43.4920 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 :: 7.9523 HA :: 4.0960 HB2 :: 1.8850 HB3 :: 1.8850 HG2 :: 1.8670 HG3 :: 1.7510 HD2 :: 3.1280 HD3 :: 3.0150 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 :: 119.6776 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.L91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.58 R 0.26 G 0.08 A 0.06 C Shift Assignments>> C :: 177.1978 CA :: 55.2090 CB :: 43.1420 CG :: 26.7650 CD1 :: 26.9800 CD2 :: 22.6520 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 :: 4.1330 HB2 :: 1.3650 HB3 :: 1.7120 HG :: 1.1590 HD11 :: 0.4180 HD12 :: 0.4180 HD13 :: 0.4180 HD21 :: 0.0270 HD22 :: 0.0270 HD23 :: 0.0270 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 116.6820 Ave N Shift Values>> N :: 121.86(3.9) 1.L92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.88 A 0.11 C Shift Assignments>> C :: 176.8612 CA :: 54.0650 CB :: 41.0613 CG :: 26.6480 CD1 :: 25.5670 CD2 :: 22.7640 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 :: 7.2987 HA :: 4.5520 HB2 :: 1.6320 HB3 :: 1.6320 HG :: 1.5670 HD11 :: 0.8200 HD12 :: 0.8200 HD13 :: 0.8200 HD21 :: 0.7530 HD22 :: 0.7530 HD23 :: 0.7530 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 :: 120.4318 Ave N Shift Values>> N :: 121.86(3.9) 1.T93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.5642 CA :: 61.8655 CB :: 69.8880 CG2 :: 21.9900 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 :: 7.4745 HA :: 4.3200 HB :: 4.2980 HG21 :: 1.1500 HG22 :: 1.1500 HG23 :: 1.1500 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 111.0615 Ave N Shift Values>> N :: 115.42(4.75) 1.G94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 L 0.07 C Shift Assignments>> C :: 174.1230 CA :: 45.7310 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.5946 HA2 :: 3.8340 HA3 :: 4.0880 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.2564 Ave N Shift Values>> N :: 109.67(3.87) 1.D95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 L 0.21 N 0.15 F 0.11 Y 0.09 K 0.06 C Shift Assignments>> C :: 175.1247 CA :: 54.3300 CB :: 40.7640 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 :: 8.2369 HA :: 4.5570 HB2 :: 2.6530 HB3 :: 2.6530 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.9073 Ave N Shift Values>> N :: 120.65(3.86) 1.R96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.8 G 0.15 K 0.04 C Shift Assignments>> CA :: 53.8392 CB :: 30.9310 CG :: 26.9370 CD :: 43.4100 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 :: 7.5307 HA :: 4.6650 HB2 :: 1.8260 HB3 :: 1.7020 HG2 :: 1.5900 HG3 :: 1.5900 HD2 :: 3.1820 HD3 :: 3.1820 HE :: 7.3945 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 118.9569 NE :: 84.4401 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.P97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 176.4806 CA :: 62.7300 CB :: 32.0920 CG :: 27.7570 CD :: 50.5240 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 :: 4.3900 HB2 :: 1.8160 HB3 :: 2.2820 HG2 :: 1.9440 HG3 :: 2.0060 HD2 :: 3.5550 HD3 :: 3.7700 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.E98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.64 K 0.16 Q 0.08 I 0.06 M 0.02 C Shift Assignments>> CA :: 55.4050 CB :: 28.9100 CG :: 36.5130 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 :: 8.6400 HA :: 4.2200 HB2 :: 1.9230 HB3 :: 1.8670 HG2 :: 2.2810 HG3 :: 2.2810 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 :: 123.1880 Ave N Shift Values>> N :: 120.67(3.48) 1.P99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 176.3134 CA :: 62.5148 CB :: 31.8700 CG :: 28.1640 CD :: 49.9240 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 :: 4.5730 HB2 :: 2.3110 HB3 :: 1.9920 HG2 :: 2.0030 HG3 :: 1.9020 HD2 :: 3.7330 HD3 :: 3.5470 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.T100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.1550 CA :: 65.2411 CB :: 69.3790 CG2 :: 22.1880 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 :: 8.0940 HA :: 3.8080 HB :: 3.6320 HG21 :: 0.5990 HG22 :: 0.5990 HG23 :: 0.5990 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 :: 118.4105 Ave N Shift Values>> N :: 115.42(4.75) 1.Y101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 173.7453 CA :: 56.6025 CB :: 41.1280 CD1 :: 133.3150 CD2 :: 133.3150 CE1 :: 117.5300 CE2 :: 117.5300 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 :: 8.3966 HA :: 4.9780 HB2 :: 2.7280 HB3 :: 3.3700 HD1 :: 7.2170 HD2 :: 7.2170 HE1 :: 6.7810 HE2 :: 6.7810 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 118.0197 Ave N Shift Values>> N :: 120.52(4.2) 1.L102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 L 0.22 R 0.04 C Shift Assignments>> C :: 174.4524 CA :: 54.3948 CB :: 45.2580 CG :: 28.3280 CD1 :: 24.7640 CD2 :: 26.0480 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 :: 8.6648 HA :: 5.2200 HB2 :: 1.2740 HB3 :: 1.8090 HG :: 1.4070 HD11 :: 0.7700 HD12 :: 0.7700 HD13 :: 0.7700 HD21 :: 0.8120 HD22 :: 0.8120 HD23 :: 0.8120 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 127.0379 Ave N Shift Values>> N :: 121.86(3.9) 1.V103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 174.4254 CA :: 61.1765 CB :: 34.2950 CG1 :: 21.9330 CG2 :: 20.9170 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 :: 9.6917 HA :: 4.3350 HB :: 2.0080 HG11 :: 0.8260 HG12 :: 0.8260 HG13 :: 0.8260 HG21 :: 0.7400 HG22 :: 0.7400 HG23 :: 0.7400 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 :: 129.9379 Ave N Shift Values>> N :: 121.14(4.54) 1.T104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.0852 CA :: 60.6802 CB :: 69.4809 CG2 :: 22.3450 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 :: 8.1158 HA :: 5.0400 HB :: 4.2940 HG21 :: 1.2170 HG22 :: 1.2170 HG23 :: 1.2170 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.8805 Ave N Shift Values>> N :: 115.42(4.75) 1.K105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.46 K 0.4 G 0.12 HN Overlap>> 1.A47 1.A47 C Shift Assignments>> CA :: 53.9100 CB :: 34.8000 CD :: 26.9056 CE :: 42.5420 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 :: 7.3876 HA :: 4.4190 HB2 :: 1.9040 HB3 :: 1.1679 HD2 :: 1.4497 HD3 :: 1.2820 HE2 :: 2.7989 HE3 :: 3.0324 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 :: 120.8684 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.98 A 0.01 C Shift Assignments>> C :: 175.8856 CA :: 62.1622 CB :: 34.3220 CG :: 25.2040 CD :: 50.4610 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 :: 4.4350 HB2 :: 1.9420 HB3 :: 2.2410 HG2 :: 1.9060 HG3 :: 1.9060 HD2 :: 3.6170 HD3 :: 3.4120 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.F107 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.59 G 0.4 C Shift Assignments>> C :: 175.3563 CA :: 54.4260 CB :: 41.9310 CD1 :: 132.3170 CD2 :: 132.3170 CE1 :: 129.4630 CE2 :: 129.4530 CZ :: 124.4513(S) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.9165 HA :: 5.2860 HB2 :: 2.9500 HB3 :: 2.9500 HD1 :: 6.6760 HD2 :: 6.6760 HE1 :: 6.9660 HE2 :: 6.9660 HZ :: 6.6776 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.9825 Ave N Shift Values>> N :: 120.45(4.18) 1.Q108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.43 M 0.23 K 0.21 E 0.1 C Shift Assignments>> C :: 177.7947 CA :: 53.7350 CB :: 30.1300 CG :: 34.1270 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 :: 8.8749 HA :: 4.7200 HB2 :: 2.0750 HB3 :: 2.3750 HG2 :: 2.4940 HG3 :: 2.4940 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.3269 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.84 E 0.14 C Shift Assignments>> C :: 178.5758 CA :: 61.2356 CB :: 29.5000 CG :: 37.8740 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 :: 9.5008 HA :: 3.8250 HB2 :: 2.0880 HB3 :: 2.2100 HG2 :: 2.2600 HG3 :: 2.6280 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 :: 125.5526 Ave N Shift Values>> N :: 120.67(3.48) 1.S110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.7092 CA :: 61.7100 CB :: 61.4420 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.8728 HA :: 4.0500 HB2 :: 3.9640 HB3 :: 4.0500 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 :: 113.4062 Ave N Shift Values>> N :: 116.28(3.52) 1.T111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 177.3702 CA :: 65.5904 CB :: 68.5819 CG2 :: 23.3720 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 :: 7.3524 HA :: 4.0900 HB :: 4.4200 HG21 :: 1.3670 HG22 :: 1.3670 HG23 :: 1.3670 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.3194 Ave N Shift Values>> N :: 115.42(4.75) 1.V112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 176.8660 CA :: 67.6413 CB :: 31.2900 CG1 :: 22.0350 CG2 :: 23.7630 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 :: 7.4692 HA :: 3.2660 HB :: 1.9720 HG11 :: 0.5770 HG12 :: 0.5770 HG13 :: 0.5770 HG21 :: 0.3590 HG22 :: 0.3590 HG23 :: 0.3590 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 :: 123.1667 Ave N Shift Values>> N :: 121.14(4.54) 1.R113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.39 R 0.36 K 0.23 HN Overlap>> 1.M19 1.M19 C Shift Assignments>> C :: 178.6073 CA :: 61.1750 CB :: 30.7530 CG :: 29.4680 CD :: 43.3480 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 :: 8.4457 HA :: 3.7590 HB2 :: 1.9550 HB3 :: 1.9550 HG2 :: 1.4170 HG3 :: 1.8040 HD2 :: 3.2180 HD3 :: 3.2180 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 118.3741 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.T114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.3393 CA :: 66.2345 CB :: 68.9296 CG2 :: 22.1160 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 :: 8.3403 HA :: 3.9500 HB :: 4.2600 HG21 :: 1.2720 HG22 :: 1.2720 HG23 :: 1.2720 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 :: 114.3545 Ave N Shift Values>> N :: 115.42(4.75) 1.T115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.3326 CA :: 67.7440 CB :: 67.8909 CG2 :: 22.5700 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 :: 7.9353 HA :: 3.9400 HB :: 3.9500 HG1 :: 5.1865 HG21 :: 1.1320 HG22 :: 1.1320 HG23 :: 1.1320 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.2511 Ave N Shift Values>> N :: 115.42(4.75) 1.I116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 176.4779 CA :: 66.6950 CB :: 37.6960 CG1 :: 29.8130 CG2 :: 16.8240 CD1 :: 15.0930 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 :: 8.2623 HA :: 3.2110 HB :: 1.7130 HG12 :: 0.5130 HG13 :: 1.7020 HG21 :: 0.6130 HG22 :: 0.6130 HG23 :: 0.6130 HD11 :: 0.5240 HD12 :: 0.5240 HD13 :: 0.5240 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 :: 121.4281 Ave N Shift Values>> N :: 121.46(4.28) 1.S117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.8815 CA :: 62.7290 CB :: 62.2240 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.5406 HA :: 4.0040 HB2 :: 4.1230 HB3 :: 4.1230 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.2681 Ave N Shift Values>> N :: 116.28(3.52) 1.Q118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.35 K 0.34 E 0.17 I 0.05 R 0.04 M 0.01 C Shift Assignments>> C :: 177.8399 CA :: 58.9067 CB :: 28.8390 CG :: 34.2970 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 :: 8.0057 HA :: 4.0320 HB2 :: 2.1890 HB3 :: 2.2550 HG2 :: 2.4510 HG3 :: 2.5940 HE21 :: 6.7893 HE22 :: 7.3657 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 :: 120.8230 NE2 :: 110.7495 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.59 M 0.38 I 0.01 C Shift Assignments>> C :: 179.6117 CA :: 54.3350 CB :: 18.3750 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.1342 HA :: 3.9770 HB1 :: 0.7050 HB2 :: 0.7050 HB3 :: 0.7050 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.0720 Ave N Shift Values>> N :: 123.23(3.54) 1.L120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.87 A 0.06 R 0.05 C Shift Assignments>> C :: 177.9691 CA :: 55.2440 CB :: 41.7652 CG :: 26.3330 CD1 :: 26.1810 CD2 :: 22.8340 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 :: 7.5433 HA :: 4.2380 HB2 :: 1.4090 HB3 :: 1.6180 HG :: 1.6290 HD11 :: 0.4840 HD12 :: 0.4840 HD13 :: 0.4840 HD21 :: 0.6830 HD22 :: 0.6830 HD23 :: 0.6830 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 :: 113.6040 Ave N Shift Values>> N :: 121.86(3.9) 1.F121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 176.6742 CA :: 59.9712 CB :: 39.4060 CD1 :: 131.0410 CD2 :: 131.0410 CE1 :: 130.7600 CE2 :: 130.7600 CZ :: 130.7600 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 :: 7.8111 HA :: 4.3530 HB2 :: 3.0450 HB3 :: 3.2240 HD1 :: 6.9680 HD2 :: 6.9680 HE1 :: 7.2700 HE2 :: 7.2700 HZ :: 7.2700 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 :: 120.9760 Ave N Shift Values>> N :: 120.45(4.18) 1.F122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> C :: 175.9218 CA :: 58.7410 CB :: 39.0510 CD1 :: 131.4150 CD2 :: 131.4150 CE1 :: 131.4140 CE2 :: 131.4140 CZ :: 131.4140 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 :: 8.0630 HA :: 4.4470 HB2 :: 3.1080 HB3 :: 3.2240 HD1 :: 7.3870 HD2 :: 7.3870 HE1 :: 7.3850 HE2 :: 7.3850 HZ :: 7.3850 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.9726 Ave N Shift Values>> N :: 120.45(4.18) 1.Q123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.4 K 0.36 E 0.1 M 0.09 R 0.03 C Shift Assignments>> C :: 175.5969 CA :: 56.4080 CB :: 29.4600 CG :: 33.7990 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 :: 7.7794 HA :: 4.2000 HB2 :: 2.0390 HB3 :: 2.0390 HG2 :: 2.2850 HG3 :: 2.2850 HE21 :: 7.5206 HE22 :: 6.8785 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 :: 120.2804 NE2 :: 111.7069 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.N124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.47 D 0.26 F 0.08 L 0.08 Y 0.08 C Shift Assignments>> C :: 174.8209 CA :: 53.2852 CB :: 39.3750 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 :: 8.1453 HA :: 4.7100 HB2 :: 2.6760 HB3 :: 2.7920 HD21 :: 7.5569 HD22 :: 6.9307 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 :: 118.7427 ND2 :: 113.0233 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.S125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 56.5041 CB :: 63.3516 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.1147 HA :: 4.7000 HB2 :: 3.7460 HB3 :: 3.7460 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 :: 117.0801 Ave N Shift Values>> N :: 116.28(3.52) 1.P126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> C :: 177.1137 CA :: 63.4350 CB :: 32.3260 CG :: 27.5670 CD :: 50.7310 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 :: 4.4860 HB2 :: 2.2900 HB3 :: 2.2900 HG2 :: 1.9350 HG3 :: 2.0080 HD2 :: 3.7510 HD3 :: 3.7510 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.T127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.1371 CA :: 61.8551 CB :: 69.8659 CG2 :: 21.8060 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 :: 8.1329 HA :: 4.3080 HB :: 4.2110 HG21 :: 1.2220 HG22 :: 1.2220 HG23 :: 1.2220 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 :: 113.9920 Ave N Shift Values>> N :: 115.42(4.75) 1.A128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.9 M 0.08 C Shift Assignments>> C :: 176.5793 CA :: 52.5714 CB :: 19.4521 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.2214 HA :: 4.4110 HB1 :: 1.3850 HB2 :: 1.3850 HB3 :: 1.3850 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 127.5006 Ave N Shift Values>> N :: 123.23(3.54) 1.V129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 63.5396 CB :: 33.3371 CG1 :: 22.2000 CG2 :: 22.2000 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.6880 HA :: 4.0330 HB :: 2.0780 HG11 :: 0.8940 HG12 :: 0.8940 HG13 :: 0.8940 HG21 :: 0.8790 HG22 :: 0.8790 HG23 :: 0.8790 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 :: 123.4314 Ave N Shift Values>> N :: 121.14(4.54) ########################################################################### Overall Results: #Consistent: 121 #Clerical: 0 #Suspicious: 7 #Anomalous: 1 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 128 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 1 Shift Relative Order (SRO) Results: #Consistent: 129 #Suspicious: 0 C Shift Results: #Consistent: 555 #Duplicate: 0 #Unknown: 0 #Suspicious: 2 #Anomalous: 0 H Shift Results: #Consistent: 905 #Duplicate: 0 #Unknown: 0 #Suspicious: 7 #Anomalous: 1 N Shift Results: #Consistent: 131 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.T6 H = 10.5439(S), Expected = 8.24, Std = 0.6200, ChiSquare = 2.0243e-04 1.E12 HB2 = 2.8330(S), Expected = 2.02, Std = 0.2100, ChiSquare = 1.0820e-04 1.E14 H = 10.3770(S), Expected = 8.33, Std = 0.5900, ChiSquare = 5.2144e-04 1.K50 HG2 = 0.4940(S), Expected = 1.37, Std = 0.2600, ChiSquare = 7.5378e-04 1.D57 HB3 = 3.7070(S), Expected = 2.66, Std = 0.2800, ChiSquare = 1.8454e-04 1.G66 H = 11.0297(S), Expected = 8.33, Std = 0.6500, ChiSquare = 3.2759e-05 1.G66 HA3 = 5.1780(S), Expected = 3.90, Std = 0.3700, ChiSquare = 5.5223e-04 1.T85 CG2 = 17.4810(S), Expected = 21.55, Std = 1.1100, ChiSquare = 2.4660e-04 1.T85 HG1 = 9.0130(A), Expected = 4.92, Std = 1.5800, ChiSquare = 9.5835e-03 1.F107 CZ = 124.4513(S), Expected = 129.21, Std = 1.4300, ChiSquare = 8.7547e-04