Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.77 L 0.09 C 0.07 R 0.03 C Shift Assignments>> C :: 173.950 CA :: 45.289 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> HA2 :: 3.882 HA3 :: 3.882 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) 1.I2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 C 0.33 I 0.1 HN Overlap>> 1.D12 1.D12 C Shift Assignments>> CA :: 54.315 CB :: 41.381 CG1 :: 27.041 CG2 :: 17.391 CD1 :: 13.038 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.026 HA :: 4.518 HB :: 1.720 HG12 :: 1.076 HG13 :: 1.344 HG21 :: 0.816 HG22 :: 0.816 HG23 :: 0.816 HD11 :: 0.776 HD12 :: 0.776 HD13 :: 0.776 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 120.237 Ave N Shift Values>> N :: 121.6(4.72) 1.D3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.22 F 0.16 L 0.14 K 0.14 Y 0.1 C 0.08 I 0.06 N 0.04 R 0.02 C Shift Assignments>> CB :: 41.116 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.212 HB2 :: 2.628 HB3 :: 2.554 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 126.816 Ave N Shift Values>> N :: 120.73(4.2) 1.P4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.23 P 0.23 V 0.19 T 0.15 I 0.12 C 0.01 F 0.01 C Shift Assignments>> C :: 176.930 CA :: 63.589 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 3.818 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.F5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 F 0.24 C 0.21 I 0.12 E 0.04 D 0.03 L 0.02 N 0.01 C Shift Assignments>> C :: 176.204 CA :: 58.089 CB :: 38.893 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.214 HA :: 4.534 HB3 :: 1.754 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 118.317 Ave N Shift Values>> N :: 120.69(4.18) 1.T6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.93 C 0.06 HN Overlap>> 1.T79 1.T79 C Shift Assignments>> C :: 174.096 CA :: 62.228 CB :: 69.842 CG2 :: 21.468 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.789 HA :: 4.268 HB :: 4.174 HG21 :: 1.127 HG22 :: 1.127 HG23 :: 1.127 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 114.242 Ave N Shift Values>> N :: 115.7(5.05) 1.M7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.11 M 0.1 H 0.09 Q 0.08 K 0.07 R 0.07 C 0.07 D 0.06 W 0.05 E 0.05 Y 0.04 F 0.04 N 0.02 S 0.02 A 0.02 HN Overlap>> 1.K78 1.K78 C Shift Assignments>> CA :: 55.836 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.077 HA :: 4.721 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 121.684 Ave N Shift Values>> N :: 120.1(3.88) 1.L8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.67 C 0.26 A 0.03 K 0.01 C Shift Assignments>> CA :: 55.142 CD1 :: 23.274 CD2 :: 24.953 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.043 HA :: 4.322 HD11 :: 0.779 HD12 :: 0.779 HD13 :: 0.779 HD21 :: 0.840 HD22 :: 0.840 HD23 :: 0.840 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.622 Ave N Shift Values>> N :: 121.98(4.07) 1.S9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.256 CB :: 63.851 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.263 HA :: 4.318 HB2 :: 3.788 HB3 :: 3.788 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.455 Ave N Shift Values>> N :: 116.3(3.95) 1.S10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.142 CA :: 58.684 CB :: 63.935 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.268 HA :: 4.418 HB2 :: 3.815 HB3 :: 3.815 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 117.758 Ave N Shift Values>> N :: 116.3(3.95) 1.G11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.78 L 0.08 C 0.07 R 0.03 C Shift Assignments>> C :: 176.844 CA :: 45.340 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.300 HA2 :: 3.888 HA3 :: 3.888 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.621 Ave N Shift Values>> N :: 109.91(4.29) 1.D12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.27 L 0.19 K 0.12 C 0.11 N 0.1 F 0.08 Y 0.07 R 0.03 HN Overlap>> 1.I2 1.I2 C Shift Assignments>> C :: 176.422 CA :: 54.331 CB :: 41.101 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.095 HA :: 4.520 HB2 :: 2.633 HB3 :: 2.550 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.276 Ave N Shift Values>> N :: 120.73(4.2) 1.L13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 C 0.29 R 0.05 A 0.02 G 0.01 C Shift Assignments>> C :: 177.829 CA :: 55.426 CB :: 42.043 CG :: 26.855 CD1 :: 23.278 CD2 :: 24.973 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.259 HA :: 4.326 HB2 :: 1.614 HB3 :: 1.562 HG :: 1.567 HD11 :: 0.776 HD12 :: 0.776 HD13 :: 0.776 HD21 :: 0.837 HD22 :: 0.837 HD23 :: 0.837 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.645 Ave N Shift Values>> N :: 121.98(4.07) 1.T14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.93 C 0.06 HN Overlap>> 1.N28 1.N28 C Shift Assignments>> C :: 174.821 CA :: 62.228 CB :: 69.762 CG2 :: 21.516 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.134 HA :: 4.265 HB :: 4.178 HG21 :: 1.129 HG22 :: 1.129 HG23 :: 1.129 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 114.338 Ave N Shift Values>> N :: 115.7(5.05) 1.S15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.213 CA :: 58.321 CB :: 63.826 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.181 HA :: 4.429 HB2 :: 3.843 HB3 :: 3.843 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 117.846 Ave N Shift Values>> N :: 116.3(3.95) 1.A16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 M 0.2 C 0.02 C Shift Assignments>> C :: 177.160 CA :: 52.623 CB :: 19.390 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.284 HA :: 4.395 HB1 :: 1.442 HB2 :: 1.442 HB3 :: 1.442 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.207 Ave N Shift Values>> N :: 123.23(3.7) 1.S17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.97 T 0.02 C Shift Assignments>> C :: 173.472 CA :: 57.547 CB :: 65.420 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.035 HA :: 4.891 HB2 :: 3.637 HB3 :: 3.637 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 114.521 Ave N Shift Values>> N :: 116.3(3.95) 1.W18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 H 0.18 W 0.17 C Shift Assignments>> C :: 173.910 CA :: 55.331 CB :: 30.044 CD1 :: 129.289 CE3 :: 121.191 CZ2 :: 114.113 CZ3 :: 124.635 CH2 :: 122.038 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.523 HA :: 4.787 HB2 :: 3.230 HB3 :: 3.371 HD1 :: 6.930 HE1 :: 9.481 HE3 :: 7.214 HZ2 :: 6.999 HZ3 :: 6.609 HH2 :: 6.592 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 120.348 NE1 :: 128.270 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.E19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 E 0.31 M 0.14 I 0.03 C Shift Assignments>> C :: 175.089 CA :: 55.735 CB :: 31.683 CG :: 37.400 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.542 HA :: 4.957 HB2 :: 1.885 HB3 :: 1.625 HG2 :: 2.132 HG3 :: 1.854 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 117.964 Ave N Shift Values>> N :: 120.68(3.68) 1.L20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.5 C 0.23 L 0.22 A 0.02 C Shift Assignments>> C :: 174.656 CA :: 53.195 CB :: 46.182 CG :: 26.756 CD1 :: 23.783 CD2 :: 25.904 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.813 HA :: 4.794 HB2 :: 1.155 HB3 :: 1.452 HG :: 1.298 HD11 :: 0.811 HD12 :: 0.811 HD13 :: 0.811 HD21 :: 0.573 HD22 :: 0.573 HD23 :: 0.573 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.925 Ave N Shift Values>> N :: 121.98(4.07) 1.V21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.74 C 0.25 C Shift Assignments>> C :: 176.157 CA :: 62.260 CB :: 31.627 CG1 :: 20.888 CG2 :: 21.142 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.827 HA :: 4.499 HB :: 2.010 HG11 :: 0.915 HG12 :: 0.915 HG13 :: 0.915 HG21 :: 0.690 HG22 :: 0.690 HG23 :: 0.690 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 127.297 Ave N Shift Values>> N :: 121.02(4.96) 1.V22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.59 C 0.39 C Shift Assignments>> C :: 175.253 CA :: 60.925 CB :: 34.352 CG1 :: 21.874 CG2 :: 21.218 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.178 HA :: 4.348 HB :: 1.700 HG11 :: 0.691 HG12 :: 0.691 HG13 :: 0.691 HG21 :: 0.612 HG22 :: 0.612 HG23 :: 0.612 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 129.937 Ave N Shift Values>> N :: 121.02(4.96) 1.R23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 R 0.34 K 0.24 G 0.06 C Shift Assignments>> C :: 174.950 CA :: 55.516 CB :: 31.988 CG :: 28.676 CD :: 43.299 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.104 HA :: 4.933 HB2 :: 1.831 HB3 :: 1.567 HG2 :: 1.733 HG3 :: 1.526 HD2 :: 3.218 HD3 :: 3.218 HE :: 7.337 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 125.848 NE :: 84.922 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.V24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.67 C 0.32 C Shift Assignments>> C :: 175.449 CA :: 61.634 CB :: 33.928 CG1 :: 21.164 CG2 :: 21.157 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.325 HA :: 5.011 HB :: 2.136 HG11 :: 1.021 HG12 :: 1.021 HG13 :: 1.021 HG21 :: 1.024 HG22 :: 1.024 HG23 :: 1.024 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 124.136 Ave N Shift Values>> N :: 121.02(4.96) 1.D25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 R 0.18 G 0.14 D 0.14 C 0.12 K 0.03 F 0.02 N 0.01 Y 0.01 C Shift Assignments>> C :: 176.671 CA :: 52.956 CB :: 43.473 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.414 HA :: 5.220 HB2 :: 2.803 HB3 :: 2.495 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 126.172 Ave N Shift Values>> N :: 120.73(4.2) 1.H26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.35 H 0.35 C 0.29 C Shift Assignments>> C :: 174.917 CA :: 56.700 CB :: 30.185 CD2 :: 120.456 CE1 :: 137.494 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 9.152 HA :: 4.542 HB2 :: 2.946 HB3 :: 3.199 HD2 :: 7.116 HE1 :: 7.663 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 124.402 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.A27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.56 M 0.4 C 0.01 C Shift Assignments>> C :: 176.927 CA :: 53.240 CB :: 17.122 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.121 HA :: 3.984 HB1 :: 1.212 HB2 :: 1.212 HB3 :: 1.212 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.895 Ave N Shift Values>> N :: 123.23(3.7) 1.N28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.51 D 0.16 C 0.16 Y 0.06 F 0.04 L 0.02 E 0.01 HN Overlap>> 1.T14 1.T14 C Shift Assignments>> C :: 176.389 CA :: 52.466 CB :: 38.624 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.140 HA :: 4.628 HB2 :: 2.646 HB3 :: 3.008 HD21 :: 6.880 HD22 :: 7.430 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 114.287 ND2 :: 111.111 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.G29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.78 L 0.08 C 0.07 R 0.03 C Shift Assignments>> C :: 174.848 CA :: 45.354 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.254 HA2 :: 4.165 HA3 :: 3.637 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.650 Ave N Shift Values>> N :: 109.91(4.29) 1.E30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.38 C 0.37 M 0.1 K 0.05 I 0.04 Q 0.02 C Shift Assignments>> C :: 176.802 CA :: 56.348 CB :: 30.460 CG :: 36.616 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.860 HA :: 4.267 HB2 :: 2.091 HB3 :: 2.016 HG2 :: 2.223 HG3 :: 2.112 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 119.375 Ave N Shift Values>> N :: 120.68(3.68) 1.Q31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.25 C 0.24 K 0.2 M 0.14 E 0.11 R 0.03 C Shift Assignments>> C :: 175.995 CA :: 55.917 CB :: 30.002 CG :: 33.687 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.280 HA :: 4.222 HB2 :: 1.850 HB3 :: 1.730 HG2 :: 2.331 HG3 :: 2.285 HE21 :: 7.515 HE22 :: 6.809 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 120.036 NE2 :: 112.437 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.Q32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 M 0.21 Q 0.21 E 0.18 K 0.11 C Shift Assignments>> C :: 176.112 CA :: 56.211 CB :: 30.863 CG :: 34.385 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.520 HA :: 4.905 HB2 :: 1.987 HB3 :: 1.852 HG2 :: 2.491 HG3 :: 2.264 HE21 :: 8.153 HE22 :: 6.739 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 123.146 NE2 :: 112.393 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.T33 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 :: 173.112 CA :: 61.506 CB :: 71.605 CG2 :: 21.801 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.533 HA :: 4.621 HB :: 4.011 HG21 :: 1.210 HG22 :: 1.210 HG23 :: 1.210 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.233 Ave N Shift Values>> N :: 115.7(5.05) 1.E34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 E 0.29 M 0.16 I 0.02 C Shift Assignments>> C :: 175.108 CA :: 55.553 CB :: 31.950 CG :: 37.284 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.711 HA :: 4.939 HB2 :: 1.807 HB3 :: 1.807 HG2 :: 2.064 HG3 :: 1.908 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 124.692 Ave N Shift Values>> N :: 120.68(3.68) 1.I35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.58 C 0.4 C Shift Assignments>> C :: 174.282 CA :: 59.057 CB :: 40.296 CG1 :: 27.368 CG2 :: 17.742 CD1 :: 12.263 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.115 HA :: 4.306 HB :: 1.535 HG12 :: 1.237 HG13 :: 1.130 HG21 :: 0.617 HG22 :: 0.617 HG23 :: 0.617 HD11 :: 0.696 HD12 :: 0.696 HD13 :: 0.696 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 127.113 Ave N Shift Values>> N :: 121.6(4.72) 1.T36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.94 C 0.05 C Shift Assignments>> C :: 174.054 CA :: 62.257 CB :: 68.948 CG2 :: 21.345 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.545 HA :: 4.772 HB :: 3.876 HG21 :: 0.924 HG22 :: 0.924 HG23 :: 0.924 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 123.057 Ave N Shift Values>> N :: 115.7(5.05) 1.L37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.6 L 0.19 C 0.18 A 0.01 C Shift Assignments>> C :: 175.047 CA :: 52.646 CB :: 45.951 CG :: 26.334 CD1 :: 26.801 CD2 :: 24.134 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.161 HA :: 4.503 HB2 :: 1.416 HB3 :: 1.049 HG :: 1.328 HD11 :: 0.500 HD12 :: 0.500 HD13 :: 0.500 HD21 :: 0.506 HD22 :: 0.506 HD23 :: 0.506 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 128.195 Ave N Shift Values>> N :: 121.98(4.07) 1.R38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.45 C 0.33 K 0.12 L 0.04 G 0.03 C Shift Assignments>> C :: 175.726 CA :: 55.701 CB :: 29.601 CG :: 27.439 CD :: 42.861 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.258 HA :: 4.556 HB2 :: 1.551 HB3 :: 1.551 HG2 :: 1.356 HG3 :: 1.323 HD2 :: 3.032 HD3 :: 2.994 HE :: 7.233 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 122.992 NE :: 83.894 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.V39 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.9 V 0.03 I 0.03 A 0.02 C Shift Assignments>> C :: 172.241 CA :: 58.334 CB :: 35.214 CG1 :: 21.956 CG2 :: 16.922 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.635 HA :: 4.358 HB :: 1.392 HG11 :: 0.304 HG12 :: 0.304 HG13 :: 0.304 HG21 :: -0.886(S) HG22 :: -0.886(S) HG23 :: -0.886(S) Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 118.388 Ave N Shift Values>> N :: 121.02(4.96) 1.S40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.97 T 0.02 C Shift Assignments>> C :: 175.046 CA :: 56.216 CB :: 65.650 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 6.388 HA :: 4.325 HB2 :: 3.864 HB3 :: 3.585 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 108.799 Ave N Shift Values>> N :: 116.3(3.95) 1.G41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.68 C 0.22 L 0.03 P 0.02 A 0.02 C Shift Assignments>> C :: 173.137 CA :: 47.346 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.085 HA2 :: 3.850 HA3 :: 4.321 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.767 Ave N Shift Values>> N :: 109.91(4.29) 1.D42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 N 0.25 C 0.12 L 0.11 F 0.07 Y 0.06 K 0.03 C Shift Assignments>> C :: 175.609 CA :: 53.241 CB :: 40.331 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.994 HA :: 4.498 HB2 :: 2.691 HB3 :: 2.593 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 112.956 Ave N Shift Values>> N :: 120.73(4.2) 1.L43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.44 C 0.35 R 0.14 G 0.03 A 0.02 C Shift Assignments>> C :: 175.552 CA :: 55.199 CB :: 42.398 CG :: 25.794 CD1 :: 23.341 CD2 :: 26.925 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.431 HA :: 4.210 HB2 :: 1.413 HB3 :: 1.703 HG :: 1.817 HD11 :: 0.880 HD12 :: 0.880 HD13 :: 0.880 HD21 :: 0.617 HD22 :: 0.617 HD23 :: 0.617 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 123.293 Ave N Shift Values>> N :: 121.98(4.07) 1.H44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.4 C 0.33 W 0.26 C Shift Assignments>> C :: 177.511 CA :: 54.692 CB :: 30.868 CD2 :: 118.675 CE1 :: 139.743 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.405 HA :: 5.154 HB2 :: 3.055 HB3 :: 3.278 HD2 :: 7.125 HE1 :: 7.802 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 121.975 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.I45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 I 0.47 C Shift Assignments>> C :: 179.116 CA :: 62.585 CB :: 35.492 CG1 :: 27.587 CG2 :: 17.488 CD1 :: 9.636 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.628 HA :: 3.445 HB :: 2.239 HG12 :: 1.662 HG13 :: 1.300 HG21 :: 0.798 HG22 :: 0.798 HG23 :: 0.798 HD11 :: 0.627 HD12 :: 0.627 HD13 :: 0.627 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 124.304 Ave N Shift Values>> N :: 121.6(4.72) 1.G46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.77 C 0.16 L 0.04 C Shift Assignments>> C :: 175.742 CA :: 46.812 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.792 HA2 :: 3.916 HA3 :: 3.901 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.610 Ave N Shift Values>> N :: 109.91(4.29) 1.G47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.77 C 0.16 L 0.04 C Shift Assignments>> C :: 176.182 CA :: 46.819 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 6.761 HA2 :: 3.739 HA3 :: 3.294 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.580 Ave N Shift Values>> N :: 109.91(4.29) 1.V48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.95 C 0.04 C Shift Assignments>> C :: 176.849 CA :: 66.775 CB :: 30.944 CG1 :: 20.955 CG2 :: 23.120 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.669 HA :: 3.083 HB :: 2.198 HG11 :: 0.422 HG12 :: 0.422 HG13 :: 0.422 HG21 :: 0.687 HG22 :: 0.687 HG23 :: 0.687 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 123.461 Ave N Shift Values>> N :: 121.02(4.96) 1.M49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 M 0.39 I 0.03 C Shift Assignments>> C :: 176.774 CA :: 59.972 CB :: 33.142 CG :: 31.099 CE :: 15.989 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.632 HA :: 3.143 HB2 :: 2.184 HB3 :: 2.114 HG2 :: 2.641 HG3 :: 2.168 HE1 :: 2.350 HE2 :: 2.350 HE3 :: 2.350 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 115.691 Ave N Shift Values>> N :: 120.1(3.88) 1.L50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 C 0.35 R 0.03 C Shift Assignments>> C :: 179.001 CA :: 57.910 CB :: 41.821 CG :: 26.647 CD1 :: 23.839 CD2 :: 24.488 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.535 HA :: 3.821 HB2 :: 1.611 HB3 :: 1.507 HG :: 1.601 HD11 :: 0.790 HD12 :: 0.790 HD13 :: 0.790 HD21 :: 0.811 HD22 :: 0.811 HD23 :: 0.811 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 117.445 Ave N Shift Values>> N :: 121.98(4.07) 1.K51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.41 C 0.38 R 0.18 M 0.01 C Shift Assignments>> C :: 178.975 CA :: 59.003 CB :: 32.890 CG :: 25.524 CD :: 29.089 CE :: 41.911 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.447 HA :: 3.880 HB2 :: 1.619 HB3 :: 1.691 HG2 :: 1.393 HG3 :: 1.474 HD2 :: 1.388 HD3 :: 1.485 HE2 :: 2.903 HE3 :: 2.795 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 118.306 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.L52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 L 0.46 R 0.06 C Shift Assignments>> C :: 177.676 CA :: 58.038 CB :: 41.660 CG :: 25.732 CD1 :: 23.600 CD2 :: 26.422 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.547 HA :: 3.523 HB2 :: 1.335 HB3 :: 0.637 HG :: 1.385 HD11 :: 0.286 HD12 :: 0.286 HD13 :: 0.286 HD21 :: -0.038 HD22 :: -0.038 HD23 :: -0.038 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 119.198 Ave N Shift Values>> N :: 121.98(4.07) 1.V53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.95 C 0.04 C Shift Assignments>> C :: 179.189 CA :: 66.706 CB :: 31.343 CG1 :: 20.124 CG2 :: 21.270 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.368 HA :: 2.469 HB :: 1.649 HG11 :: 0.249 HG12 :: 0.249 HG13 :: 0.249 HG21 :: 0.219 HG22 :: 0.219 HG23 :: 0.219 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 117.879 Ave N Shift Values>> N :: 121.02(4.96) 1.E54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.35 C 0.34 I 0.16 K 0.07 M 0.03 Q 0.02 C Shift Assignments>> C :: 178.593 CA :: 58.935 CB :: 29.772 CG :: 36.375 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.966 HA :: 3.865 HB2 :: 2.009 HB3 :: 1.909 HG2 :: 2.062 HG3 :: 2.293 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 119.295 Ave N Shift Values>> N :: 120.68(3.68) 1.Q55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.25 Q 0.24 K 0.22 E 0.16 R 0.04 M 0.03 I 0.02 C Shift Assignments>> C :: 177.512 CA :: 57.362 CB :: 28.938 CG :: 34.307 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.651 HA :: 4.005 HB2 :: 2.062 HB3 :: 1.942 HG2 :: 2.356 HG3 :: 2.291 HE21 :: 7.414 HE22 :: 6.698 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 116.036 NE2 :: 111.821 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.M56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 C 0.45 A 0.05 C Shift Assignments>> C :: 176.572 CA :: 56.492 CB :: 32.901 CG :: 32.495 CE :: 16.585 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.691 HA :: 4.316 HB2 :: 2.119 HB3 :: 1.977 HG2 :: 2.514 HG3 :: 2.489 HE1 :: 1.741 HE2 :: 1.741 HE3 :: 1.741 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 117.664 Ave N Shift Values>> N :: 120.1(3.88) 1.N57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.39 C 0.22 Y 0.1 D 0.08 F 0.06 E 0.06 M 0.02 L 0.01 C Shift Assignments>> C :: 174.613 CA :: 53.813 CB :: 37.713 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.816 HA :: 4.495 HB2 :: 3.077 HB3 :: 2.465 HD21 :: 7.515 HD22 :: 6.702 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 115.864 ND2 :: 111.399 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.I58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.69 C 0.3 C Shift Assignments>> C :: 175.277 CA :: 60.631 CB :: 41.470 CG1 :: 26.803 CG2 :: 17.543 CD1 :: 13.693 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.391 HA :: 4.284 HB :: 1.706 HG12 :: 0.973 HG13 :: 1.497 HG21 :: 0.707 HG22 :: 0.707 HG23 :: 0.707 HD11 :: 0.700 HD12 :: 0.700 HD13 :: 0.700 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 117.760 Ave N Shift Values>> N :: 121.6(4.72) 1.A59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.75 M 0.22 C 0.01 C Shift Assignments>> C :: 175.554 CA :: 51.604 CB :: 17.256 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.438 HA :: 4.535 HB1 :: 1.242 HB2 :: 1.242 HB3 :: 1.242 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 129.371 Ave N Shift Values>> N :: 123.23(3.7) 1.Q60 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.41 M 0.27 K 0.16 R 0.13 Q 0.01 C Shift Assignments>> C :: 172.908 CA :: 53.492 CB :: 30.340 CG :: 30.591 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.498 HA :: 4.291 HB2 :: 1.367 HB3 :: 1.455 HG2 :: 0.365(S) HG3 :: 1.131(S) HE21 :: 5.766 HE22 :: 4.212(A) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 120.550 NE2 :: 107.435 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) SRO Rule Breaks>> (HE22 > HA : 0.9976) 1.D61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.31 N 0.21 L 0.13 C 0.12 F 0.07 Y 0.07 K 0.05 C Shift Assignments>> C :: 177.529 CA :: 53.520 CB :: 40.493 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.086 HA :: 4.622 HB2 :: 2.729 HB3 :: 2.531 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.225 Ave N Shift Values>> N :: 120.73(4.2) 1.W62 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 W 0.27 H 0.14 C Shift Assignments>> C :: 178.609 CA :: 57.200 CB :: 29.155 CD1 :: 130.513(A) CE3 :: 120.461 CZ2 :: 114.511 CZ3 :: 121.785 CH2 :: 123.407 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.999 HA :: 4.578 HB2 :: 3.315 HB3 :: 2.891 HD1 :: 7.319 HE1 :: 10.057 HE3 :: 5.740 HZ2 :: 7.338 HZ3 :: 6.266 HH2 :: 6.872 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 129.134 NE1 :: 129.579 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.S63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.119 CA :: 62.933 CB :: 63.120 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.756 HA :: 4.127 HB2 :: 3.922 HB3 :: 4.018 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 119.231 Ave N Shift Values>> N :: 116.3(3.95) 1.D64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 R 0.21 D 0.14 C 0.11 K 0.08 G 0.05 F 0.04 Y 0.02 N 0.01 C Shift Assignments>> C :: 177.267 CA :: 54.157 CB :: 43.116 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 9.095 HA :: 4.876 HB2 :: 2.516 HB3 :: 2.408 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.137 Ave N Shift Values>> N :: 120.73(4.2) 1.Y65 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.85 Y 0.12 F 0.01 C Shift Assignments>> C :: 175.746 CA :: 59.053 CB :: 38.836 CD1 :: 130.482 CD2 :: 130.482 CE1 :: 122.899 CE2 :: 122.899 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.991 HA :: 4.151 HB2 :: 2.941 HB3 :: 1.204(S) HD1 :: 7.026 HD2 :: 7.026 HE1 :: 7.013 HE2 :: 7.013 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 121.458 Ave N Shift Values>> N :: 120.79(4.69) 1.A66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 C 0.21 K 0.1 A 0.07 M 0.06 P 0.04 R 0.02 HN Overlap>> 1.L94 1.L94 C Shift Assignments>> C :: 175.126 CA :: 51.166 CB :: 23.771 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.698 HA :: 4.794 HB1 :: 1.425 HB2 :: 1.425 HB3 :: 1.425 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.944 Ave N Shift Values>> N :: 123.23(3.7) 1.L67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 G 0.23 C 0.21 R 0.07 A 0.01 C Shift Assignments>> C :: 174.489 CA :: 53.987 CB :: 44.080 CG :: 26.996 CD1 :: 24.144 CD2 :: 25.982 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.131 HA :: 5.498 HB2 :: 2.137 HB3 :: 1.146 HG :: 1.719 HD11 :: 0.691 HD12 :: 0.691 HD13 :: 0.691 HD21 :: 0.763 HD22 :: 0.763 HD23 :: 0.763 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.646 Ave N Shift Values>> N :: 121.98(4.07) 1.W68 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> W 0.53 C 0.41 H 0.04 C Shift Assignments>> C :: 174.148 CA :: 55.276 CB :: 30.222 CD1 :: 127.067 CE3 :: 121.397 CZ2 :: 113.132 CZ3 :: 120.851 CH2 :: 124.124 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 9.934 HA :: 4.680 HB2 :: 2.005(S) HB3 :: 2.770 HD1 :: 6.617 HE1 :: 9.933 HE3 :: 5.068 HZ2 :: 6.973 HZ3 :: 6.260 HH2 :: 6.675 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 126.978 NE1 :: 128.740 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.W69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 H 0.03 W 0.01 C Shift Assignments>> C :: 175.837 CA :: 52.520 CB :: 30.500 CD1 :: 121.901 CE3 :: 120.916 CZ2 :: 114.420 CZ3 :: 126.605 CH2 :: 122.909 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.507 HA :: 5.060 HB2 :: 2.395 HB3 :: 3.387 HD1 :: 7.343 HE1 :: 9.870 HE3 :: 7.056 HZ2 :: 7.327 HZ3 :: 6.989 HH2 :: 7.003 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 129.756 NE1 :: 126.776 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.E70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.29 I 0.15 K 0.08 Q 0.06 M 0.04 C Shift Assignments>> C :: 179.449 CA :: 60.208 CB :: 29.937 CG :: 35.468 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.917 HA :: 3.817 HB2 :: 2.139 HB3 :: 2.071 HG2 :: 2.285 HG3 :: 2.285 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 126.517 Ave N Shift Values>> N :: 120.68(3.68) 1.Q71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 I 0.29 E 0.11 K 0.07 Q 0.05 P 0.05 R 0.01 C Shift Assignments>> C :: 177.266 CA :: 61.006 CB :: 27.451 CG :: 35.193 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.515 HA :: 3.782 HB2 :: 1.756 HB3 :: 1.674 HG2 :: 2.742 HG3 :: 2.464 HE21 :: 7.603 HE22 :: 7.050 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 114.822 NE2 :: 112.453 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.K72 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.36 K 0.35 R 0.2 A 0.02 M 0.01 G 0.01 C Shift Assignments>> C :: 174.268 CA :: 53.864 CB :: 33.242 CG :: 23.439 CD :: 27.526 CE :: 42.070 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 5.086(A) HA :: 3.719 HB2 :: 1.148 HB3 :: 0.104(S) HG2 :: -0.305(S) HG3 :: -0.404(S) HD2 :: 0.751(S) HD3 :: 0.661(S) HE2 :: 2.448 HE3 :: 2.394 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 112.499 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.R73 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.39 C 0.28 R 0.12 K 0.1 G 0.09 C Shift Assignments>> C :: 173.935 CA :: 56.187 CB :: 26.602 CG :: 27.217 CD :: 43.464 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.402 HA :: 2.800(S) HB2 :: 1.774 HB3 :: 1.710 HG2 :: 1.490 HG3 :: 1.563 HD2 :: 3.164 HD3 :: 3.201 HE :: 7.202 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 118.477 NE :: 84.911 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) SRO Rule Breaks>> (HA > HD2 : 0.9912) 1.C74 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> M 0.18 C 0.16 H 0.14 R 0.13 K 0.11 W 0.09 E 0.07 Q 0.07 C Shift Assignments>> C :: 171.332 CA :: 54.443 CB :: 31.599 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 6.242(S) HA :: 4.671 HB2 :: 3.032 HB3 :: 2.500 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 110.705 Ave N Shift Values>> N :: 119.95(4.79) 1.W75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 W 0.3 H 0.1 C Shift Assignments>> C :: 177.638 CA :: 55.720 CB :: 30.966 CD1 :: 128.421 CE3 :: 121.241 CZ2 :: 114.935 CZ3 :: 123.775 CH2 :: 125.546 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.567 HA :: 5.414 HB2 :: 3.148 HB3 :: 3.059 HD1 :: 7.529 HE1 :: 10.132 HE3 :: 7.552 HZ2 :: 7.165 HZ3 :: 7.135 HH2 :: 6.785 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 120.876 NE1 :: 130.222 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.L76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.57 C 0.35 A 0.03 R 0.02 C Shift Assignments>> C :: 175.745 CA :: 53.729 CB :: 40.810 CG :: 26.707 CD1 :: 23.600 CD2 :: 26.670 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.181 HA :: 4.737 HB2 :: 1.938 HB3 :: 1.451 HG :: 1.614 HD11 :: 1.035 HD12 :: 1.035 HD13 :: 1.035 HD21 :: 0.642 HD22 :: 0.642 HD23 :: 0.642 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.488 Ave N Shift Values>> N :: 121.98(4.07) 1.L77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 C 0.24 A 0.09 R 0.07 G 0.03 C Shift Assignments>> C :: 178.257 CA :: 54.539 CB :: 42.566 CG :: 26.900 CD1 :: 25.178 CD2 :: 22.232 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.711 HA :: 4.416 HB2 :: 1.646 HB3 :: 1.591 HG :: 1.570 HD11 :: 0.813 HD12 :: 0.813 HD13 :: 0.813 HD21 :: 0.700 HD22 :: 0.700 HD23 :: 0.700 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 119.493 Ave N Shift Values>> N :: 121.98(4.07) 1.K78 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.34 C 0.33 L 0.13 K 0.12 A 0.03 G 0.02 HN Overlap>> 1.M7 1.M7 C Shift Assignments>> C :: 177.029 CA :: 54.048 CB :: 28.755 CG :: 23.406 CD :: 28.341 CE :: 42.195 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.173 HA :: 4.380 HB2 :: 1.012 HB3 :: 0.277(S) HG2 :: 0.355(S) HG3 :: 0.737 HD2 :: 0.843 HD3 :: 0.474(S) HE2 :: 2.552 HE3 :: 2.552 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 121.730 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.T79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.96 C 0.03 HN Overlap>> 1.T6 1.T6 C Shift Assignments>> C :: 175.193 CA :: 64.890 CB :: 68.447 CG2 :: 22.455 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.812 HA :: 3.677 HB :: 4.113 HG21 :: 1.247 HG22 :: 1.247 HG23 :: 1.247 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 114.142 Ave N Shift Values>> N :: 115.7(5.05) 1.H80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.15 Q 0.13 R 0.13 E 0.12 W 0.12 C 0.11 K 0.1 M 0.06 I 0.01 HN Overlap>> 1.H100 1.H100 C Shift Assignments>> C :: 175.622 CA :: 56.078 CB :: 29.927 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.929 HA :: 4.759 HB2 :: 3.254 HB3 :: 3.077 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 117.372 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.W81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.58 W 0.4 C Shift Assignments>> C :: 175.952 CA :: 56.009 CB :: 30.999 CD1 :: 123.417 CE3 :: 122.116 CZ2 :: 114.914 CZ3 :: 122.300 CH2 :: 125.256 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 8.544 HA :: 4.906 HB2 :: 3.122 HB3 :: 3.058 HD1 :: 6.263 HE1 :: 10.185 HE3 :: 7.800 HZ2 :: 7.521 HZ3 :: 7.163 HH2 :: 7.249 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 122.512 NE1 :: 127.971 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.T82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.82 C 0.17 C Shift Assignments>> C :: 176.305 CA :: 60.250 CB :: 70.601 CG2 :: 22.387 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.587 HA :: 4.725 HB :: 5.030 HG21 :: 1.203 HG22 :: 1.203 HG23 :: 1.203 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 109.728 Ave N Shift Values>> N :: 115.7(5.05) 1.L83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.7 L 0.21 K 0.05 I 0.02 C Shift Assignments>> C :: 179.461 CA :: 59.442 CB :: 40.758 CD1 :: 22.465 CD2 :: 26.004 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.354 HA :: 3.798 HB2 :: 2.041 HB3 :: 1.595 HD11 :: 0.510 HD12 :: 0.510 HD13 :: 0.510 HD21 :: 0.577 HD22 :: 0.577 HD23 :: 0.577 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.120 Ave N Shift Values>> N :: 121.98(4.07) 1.D84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.24 Y 0.22 C 0.17 L 0.09 D 0.09 K 0.07 I 0.06 N 0.02 C Shift Assignments>> C :: 179.464 CA :: 57.459 CB :: 40.243 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.985 HA :: 4.427 HB2 :: 2.433 HB3 :: 2.433 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.020 Ave N Shift Values>> N :: 120.73(4.2) 1.K85 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.43 C 0.39 R 0.14 M 0.01 C Shift Assignments>> C :: 178.824 CA :: 59.103 CB :: 32.229 CG :: 24.817 CD :: 28.729 CE :: 41.379 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.134 HA :: 3.820 HB2 :: 1.670 HB3 :: 1.742 HG2 :: 0.851 HG3 :: 0.595 HD2 :: 1.147 HD3 :: 0.676(S) HE2 :: 1.722(S) HE3 :: 1.710(S) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 123.380 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) SRO Rule Breaks>> (HE2 > HB3 : 0.9957) (HE3 > HB3 : 0.9974) 1.C86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.39 C 0.13 P 0.12 W 0.1 V 0.05 E 0.04 R 0.04 K 0.03 H 0.02 Q 0.02 C Shift Assignments>> C :: 174.621 CA :: 61.800 CB :: 28.700 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.083 HA :: 4.439 HB2 :: 3.105 HB3 :: 2.921 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 113.734 Ave N Shift Values>> N :: 119.95(4.79) 1.G87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.79 L 0.08 C 0.08 R 0.02 C Shift Assignments>> C :: 174.471 CA :: 45.434 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.904 HA2 :: 4.254 HA3 :: 3.818 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.243 Ave N Shift Values>> N :: 109.91(4.29) 1.V88 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.81 C 0.18 C Shift Assignments>> C :: 173.926 CA :: 63.281 CB :: 31.892 CG1 :: 20.977 CG2 :: 22.042 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.635 HA :: 3.165 HB :: 1.629 HG11 :: -0.187(S) HG12 :: -0.187(S) HG13 :: -0.187(S) HG21 :: 0.451 HG22 :: 0.451 HG23 :: 0.451 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 122.351 Ave N Shift Values>> N :: 121.02(4.96) 1.Q89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.29 C 0.27 Q 0.21 E 0.1 K 0.09 C Shift Assignments>> C :: 175.629 CA :: 53.861 CB :: 31.010 CG :: 34.077 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.651 HA :: 3.946 HB2 :: 1.799 HB3 :: 1.799 HG2 :: 2.045 HG3 :: 2.000 HE21 :: 7.388 HE22 :: 6.604 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 125.820 NE2 :: 112.339 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.A90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.47 A 0.44 C 0.03 I 0.02 C Shift Assignments>> C :: 177.042 CA :: 54.869 CB :: 18.818 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.025 HA :: 3.873 HB1 :: 1.169 HB2 :: 1.169 HB3 :: 1.169 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.713 Ave N Shift Values>> N :: 123.23(3.7) 1.D91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 D 0.27 C 0.13 L 0.07 Y 0.07 F 0.07 K 0.01 C Shift Assignments>> C :: 176.371 CA :: 53.133 CB :: 39.673 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.310 HA :: 4.415 HB2 :: 2.745 HB3 :: 2.473 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 113.050 Ave N Shift Values>> N :: 120.73(4.2) 1.A92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.6 M 0.3 C 0.04 L 0.02 C Shift Assignments>> C :: 176.536 CA :: 53.721 CB :: 19.774 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.831 HA :: 4.237 HB1 :: 1.122 HB2 :: 1.122 HB3 :: 1.122 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.114 Ave N Shift Values>> N :: 123.23(3.7) 1.N93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 C 0.16 D 0.15 Y 0.06 F 0.04 L 0.02 E 0.01 C Shift Assignments>> C :: 173.906 CA :: 52.433 CB :: 38.547 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 9.478 HA :: 5.141 HB2 :: 2.800 HB3 :: 3.014 HD21 :: 7.573 HD22 :: 6.812 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 123.235 ND2 :: 110.889 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.L94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.48 L 0.26 C 0.16 A 0.05 R 0.02 HN Overlap>> 1.A66 1.A66 C Shift Assignments>> C :: 175.486 CA :: 53.003 CB :: 44.739 CG :: 26.742 CD1 :: 23.019 CD2 :: 26.111 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.675 HA :: 5.429 HB2 :: 1.863 HB3 :: 1.137 HG :: 1.404 HD11 :: 0.322 HD12 :: 0.322 HD13 :: 0.322 HD21 :: 0.522 HD22 :: 0.522 HD23 :: 0.522 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.901 Ave N Shift Values>> N :: 121.98(4.07) 1.L95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.49 C 0.34 L 0.11 A 0.04 C Shift Assignments>> C :: 174.403 CA :: 53.155 CB :: 46.432 CG :: 28.146 CD1 :: 23.606 CD2 :: 26.312 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 9.412 HA :: 5.388 HB2 :: 1.987 HB3 :: 1.628 HG :: 1.405 HD11 :: 0.860 HD12 :: 0.860 HD13 :: 0.860 HD21 :: 0.820 HD22 :: 0.820 HD23 :: 0.820 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 126.034 Ave N Shift Values>> N :: 121.98(4.07) 1.F96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.46 C 0.34 Y 0.18 C Shift Assignments>> C :: 173.713 CA :: 54.660 CB :: 40.823 CD1 :: 131.865 CD2 :: 131.865 CE1 :: 132.091 CE2 :: 132.091 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.785 HA :: 5.817 HB2 :: 2.641 HB3 :: 3.393 HD1 :: 7.025 HD2 :: 7.025 HE1 :: 6.834 HE2 :: 6.834 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 129.551 Ave N Shift Values>> N :: 120.69(4.18) 1.T97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 T 0.36 A 0.15 C Shift Assignments>> CA :: 58.788 CB :: 72.428 CG2 :: 18.889 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.795 HA :: 5.060 HB :: 3.938 HG21 :: 1.168 HG22 :: 1.168 HG23 :: 1.168 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 123.835 Ave N Shift Values>> N :: 115.7(5.05) 1.P98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.66 C 0.32 C Shift Assignments>> C :: 176.927 CA :: 62.711 CB :: 31.840 CG :: 27.323 CD :: 51.977 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 3.590 HB2 :: 1.354 HB3 :: 1.907 HG2 :: 0.884 HG3 :: 1.562 HD2 :: 2.969 HD3 :: 3.430 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.Q99 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.26 E 0.21 Q 0.2 K 0.14 M 0.13 I 0.01 R 0.01 C Shift Assignments>> C :: 176.698 CA :: 57.413 CB :: 30.283 CG :: 34.543 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.928 HA :: 3.543 HB2 :: 1.128(S) HB3 :: 1.343 HG2 :: 1.376 HG3 :: 0.407(S) HE21 :: 6.261 HE22 :: 6.204 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 123.460 NE2 :: 108.906 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.H100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.39 W 0.32 C 0.28 HN Overlap>> 1.H80 1.H80 C Shift Assignments>> C :: 173.955 CA :: 55.866 CB :: 28.054 CD2 :: 120.459 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.910 HA :: 4.465 HB2 :: 3.116 HB3 :: 3.011 HD2 :: 7.111 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 117.472 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.K101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.4 C 0.37 R 0.17 M 0.03 C Shift Assignments>> C :: 175.547 CA :: 56.253 CB :: 33.032 CG :: 24.627 CD :: 28.981 CE :: 42.080 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.909 HA :: 4.169 HB2 :: 1.550 HB3 :: 1.702 HG2 :: 1.232 HG3 :: 1.232 HD2 :: 1.495 HD3 :: 1.495 HE2 :: 2.832 HE3 :: 2.832 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 121.366 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.M102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 M 0.47 A 0.04 C Shift Assignments>> CA :: 57.003 CB :: 33.767 CG :: 32.269 CE :: 16.680 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.877 HA :: 4.129 HB2 :: 1.905 HB3 :: 1.779 HG2 :: 2.310 HG3 :: 2.261 HE1 :: 2.046 HE2 :: 2.046 HE3 :: 2.046 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 127.420 Ave N Shift Values>> N :: 120.1(3.88) ########################################################################### Overall Results: #Consistent: 90 #Clerical: 0 #Suspicious: 9 #Anomalous: 3 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 102 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 99 #Suspicious: 3 C Shift Results: #Consistent: 441 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 1 H Shift Results: #Consistent: 692 #Duplicate: 0 #Unknown: 0 #Suspicious: 25 #Anomalous: 2 N Shift Results: #Consistent: 118 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.V39 HG21 = -0.886(S), Expected = 0.83, Std = 0.2900, ChiSquare = 3.2739e-09 1.V39 HG22 = -0.886(S), Expected = 0.83, Std = 0.2900, ChiSquare = 3.2739e-09 1.V39 HG23 = -0.886(S), Expected = 0.83, Std = 0.2900, ChiSquare = 3.2739e-09 1.Q60 HG2 = 0.365(S), Expected = 2.32, Std = 0.2900, ChiSquare = 1.5689e-11 1.Q60 HG3 = 1.131(S), Expected = 2.32, Std = 0.2900, ChiSquare = 4.1315e-05 1.Q60 HE22 = 4.212(A), Expected = 7.07, Std = 0.4900, ChiSquare = 5.4553e-09 1.Q60 SRO Rule Break>> HE22 > HA : 0.997619047619048 1.W62 CD1 = 130.513(A), Expected = 126.16, Std = 1.7600, ChiSquare = 1.3387e-02 1.Y65 HB3 = 1.204(S), Expected = 2.91, Std = 0.3700, ChiSquare = 4.0110e-06 1.W68 HB2 = 2.005(S), Expected = 3.22, Std = 0.3600, ChiSquare = 7.3816e-04 1.K72 H = 5.086(A), Expected = 8.22, Std = 0.6400, ChiSquare = 9.7373e-07 1.K72 HB3 = 0.104(S), Expected = 1.78, Std = 0.2600, ChiSquare = 1.1472e-10 1.K72 HG2 = -0.305(S), Expected = 1.38, Std = 0.2700, ChiSquare = 4.3550e-10 1.K72 HG3 = -0.404(S), Expected = 1.37, Std = 0.2900, ChiSquare = 9.5209e-10 1.K72 HD2 = 0.751(S), Expected = 1.61, Std = 0.2500, ChiSquare = 5.9037e-04 1.K72 HD3 = 0.661(S), Expected = 1.61, Std = 0.2500, ChiSquare = 1.4705e-04 1.R73 HA = 2.800(S), Expected = 4.27, Std = 0.4400, ChiSquare = 8.3505e-04 1.R73 SRO Rule Break>> HA > HD2 : 0.991153846153846 1.C74 H = 6.242(S), Expected = 8.42, Std = 0.6600, ChiSquare = 9.6685e-04 1.K78 HB3 = 0.277(S), Expected = 1.78, Std = 0.2600, ChiSquare = 7.4360e-09 1.K78 HG2 = 0.355(S), Expected = 1.38, Std = 0.2700, ChiSquare = 1.4687e-04 1.K78 HD3 = 0.474(S), Expected = 1.61, Std = 0.2500, ChiSquare = 5.5197e-06 1.K85 HD3 = 0.676(S), Expected = 1.61, Std = 0.2500, ChiSquare = 1.8697e-04 1.K85 HE2 = 1.722(S), Expected = 2.93, Std = 0.2000, ChiSquare = 1.5411e-09 1.K85 HE3 = 1.710(S), Expected = 2.93, Std = 0.2000, ChiSquare = 1.0607e-09 1.K85 SRO Rule Break>> HE2 > HB3 : 0.995656220912194 1.K85 SRO Rule Break>> HE3 > HB3 : 0.997380484610347 1.V88 HG11 = -0.187(S), Expected = 0.84, Std = 0.2700, ChiSquare = 1.4255e-04 1.V88 HG12 = -0.187(S), Expected = 0.84, Std = 0.2700, ChiSquare = 1.4255e-04 1.V88 HG13 = -0.187(S), Expected = 0.84, Std = 0.2700, ChiSquare = 1.4255e-04 1.Q99 HB2 = 1.128(S), Expected = 2.05, Std = 0.2800, ChiSquare = 9.9175e-04 1.Q99 HG3 = 0.407(S), Expected = 2.32, Std = 0.2900, ChiSquare = 4.2083e-11