G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable S2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 174.614 CA :: 57.795 CB :: 64.138 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> HA :: 4.614 HB2 :: 3.827 HB3 :: 3.827 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) L3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.59 C 0.33 G 0.02 A 0.02 R 0.01 C Shift Assignments>> C :: 176.367 CA :: 55.834 CB :: 42.486 CG :: 27.006 CD1 :: 22.918 CD2 :: 22.947 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 :: 8.492 HA :: 4.213 HB2 :: 1.550 HB3 :: 1.404 HG :: 1.580 HD1 :: 0.727 HD2 :: 0.727 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 :: 124.425 Ave N Shift Values>> N :: 121.98(4.07) N4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.49 D 0.25 C 0.24 C Shift Assignments>> C :: 174.075 CA :: 53.579 CB :: 38.185 CG :: 177.660 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 :: 8.173 HA :: 4.295 HB2 :: 2.831 HB3 :: 2.562 HD21 :: 7.390 HD22 :: 6.685 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 :: 117.396 ND2 :: 111.920 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) M5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 M 0.36 E 0.11 Q 0.11 K 0.03 HN Overlap>> S53 C Shift Assignments>> CA :: 52.665 CB :: 34.910 CG :: 31.572 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 :: 7.973 HA :: 5.020 HB2 :: 2.071 HB3 :: 1.839 HG2 :: 2.554 HG3 :: 2.489 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 :: 120.327 Ave N Shift Values>> N :: 120.1(3.88) P6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.76 C 0.23 C Shift Assignments>> C :: 175.984 CA :: 62.732 CB :: 32.740 CG :: 27.483 CD :: 50.802 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 :: 5.030 HB2 :: 1.804 HB3 :: 2.087 HG2 :: 2.192 HG3 :: 1.975 HD2 :: 3.986 HD3 :: 3.836 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) A7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.5 L 0.22 M 0.12 C 0.12 K 0.01 C Shift Assignments>> C :: 174.633 CA :: 51.202 CB :: 22.025 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.962 HA :: 4.811 HB :: 1.254 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.515 Ave N Shift Values>> N :: 123.23(3.7) Y8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.59 C 0.4 C Shift Assignments>> C :: 175.957 CA :: 57.236 CB :: 40.331 CD1 :: 133.280 CD2 :: 133.279 CE1 :: 117.900 CE2 :: 117.901 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 :: 8.720 HA :: 4.963 HB2 :: 2.823 HB3 :: 2.823 HD1 :: 6.884 HD2 :: 6.884 HE1 :: 6.712 HE2 :: 6.712 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 :: 120.352 Ave N Shift Values>> N :: 120.79(4.69) V9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.55 C 0.44 C Shift Assignments>> C :: 176.821 CA :: 63.701 CB :: 32.129 CG1 :: 24.866 CG2 :: 22.250 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 :: 8.536 HA :: 3.847 HB :: 1.910 HG1 :: 0.645 HG2 :: 0.604 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 :: 124.068 Ave N Shift Values>> N :: 121.02(4.96) K10 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.43 C 0.43 R 0.1 M 0.01 C Shift Assignments>> C :: 175.091 CA :: 57.839 CB :: 33.742 CG :: 24.739 CD :: 28.934 CE :: 41.571 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 :: 8.967 HA :: 3.938 HB2 :: 0.967(S) HB3 :: 0.994 HG2 :: 1.057 HG3 :: 0.992 HD2 :: 1.383 HD3 :: 1.383 HE2 :: 2.688 HE3 :: 2.628 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 :: 129.334 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) F11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.37 C 0.32 F 0.24 G 0.06 C Shift Assignments>> C :: 173.043 CA :: 54.487 CB :: 42.672 CD1 :: 132.750 CD2 :: 132.749 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 :: 7.041 HA :: 4.840 HB2 :: 3.226 HB3 :: 2.599 HD1 :: 6.920 HD2 :: 6.920 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 :: 113.819 Ave N Shift Values>> N :: 120.69(4.18) N12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 D 0.23 C 0.15 Y 0.09 F 0.08 L 0.06 C Shift Assignments>> C :: 175.343 CA :: 53.757 CB :: 39.218 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 :: 8.423 HA :: 4.606 HB2 :: 2.789 HB3 :: 2.649 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 :: 116.457 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Y13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.61 C 0.37 G 0.01 C Shift Assignments>> C :: 174.193 CA :: 57.775 CB :: 42.124 CD1 :: 133.150 CD2 :: 133.149 CE1 :: 118.180 CE2 :: 118.179 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 :: 8.681 HA :: 4.726 HB2 :: 2.774 HB3 :: 2.431 HD1 :: 7.047 HD2 :: 7.047 HE1 :: 6.879 HE2 :: 6.879 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 :: 120.929 Ave N Shift Values>> N :: 120.79(4.69) M14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.49 C 0.35 Q 0.07 K 0.05 R 0.01 C Shift Assignments>> C :: 173.211 CA :: 53.108 CB :: 32.075 CG :: 31.694 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 :: 7.767 HA :: 4.503 HB2 :: 1.783 HB3 :: 1.731 HG2 :: 2.453 HG3 :: 2.385 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 :: 128.379 Ave N Shift Values>> N :: 120.1(3.88) A15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.62 M 0.26 C 0.04 L 0.04 C Shift Assignments>> C :: 178.675 CA :: 53.279 CB :: 20.288 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.098 HA :: 4.107 HB :: 1.371 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.765 Ave N Shift Values>> N :: 123.23(3.7) E16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 E 0.33 M 0.2 Q 0.03 K 0.02 I 0.02 C Shift Assignments>> C :: 176.031 CA :: 56.290 CB :: 31.608 CG :: 36.263 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 :: 8.861 HA :: 4.368 HB2 :: 2.200 HB3 :: 2.120 HG2 :: 2.497 HG3 :: 2.241 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 :: 121.086 Ave N Shift Values>> N :: 120.68(3.68) R17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 K 0.17 R 0.15 G 0.11 C Shift Assignments>> C :: 177.291 CA :: 54.402 CB :: 34.605 CG :: 27.020 CD :: 43.223 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 :: 7.310 HA :: 4.621 HB2 :: 2.059 HB3 :: 1.667 HG2 :: 1.657 HG3 :: 1.521 HD2 :: 3.137 HD3 :: 3.137 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 :: 115.708 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) E18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.34 C 0.33 I 0.17 K 0.07 Q 0.03 M 0.03 C Shift Assignments>> C :: 176.229 CA :: 59.121 CB :: 29.596 CG :: 36.247 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 :: 8.958 HA :: 4.167 HB2 :: 2.104 HB3 :: 2.104 HG2 :: 2.363 HG3 :: 2.363 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 :: 120.435 Ave N Shift Values>> N :: 120.68(3.68) D19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.3 N 0.23 C 0.12 L 0.11 F 0.08 Y 0.08 K 0.03 C Shift Assignments>> C :: 176.279 CA :: 53.800 CB :: 40.165 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 :: 8.362 HA :: 4.884 HB2 :: 3.037 HB3 :: 2.872 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 :: 114.666 Ave N Shift Values>> N :: 120.73(4.2) E20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.64 M 0.17 E 0.16 C Shift Assignments>> C :: 175.590 CA :: 55.346 CB :: 33.298 CG :: 37.108 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 :: 7.546 HA :: 5.509 HB2 :: 2.615 HB3 :: 2.337 HG2 :: 2.534 HG3 :: 2.324 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 :: 117.784 Ave N Shift Values>> N :: 120.68(3.68) L21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.46 L 0.3 C 0.22 C Shift Assignments>> C :: 175.387 CA :: 53.324 CB :: 46.193 CG :: 26.587 CD1 :: 24.928 CD2 :: 24.690 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 :: 8.826 HA :: 4.616 HB2 :: 1.715 HB3 :: 1.041 HG :: 1.585 HD1 :: 0.736 HD2 :: 0.907 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 :: 124.142 Ave N Shift Values>> N :: 121.98(4.07) S22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.707 CA :: 59.350 CB :: 63.550 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.893 HA :: 4.836 HB2 :: 4.003 HB3 :: 3.877 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 :: 118.178 Ave N Shift Values>> N :: 116.3(3.95) L23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.58 A 0.16 L 0.13 C 0.1 C Shift Assignments>> C :: 177.348 CA :: 52.832 CB :: 45.361 CG :: 25.694 CD1 :: 25.645 CD2 :: 21.816 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 :: 9.051 HA :: 4.561 HB2 :: 1.318 HB3 :: 1.706 HG :: 1.668 HD1 :: 0.429 HD2 :: 0.023 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 :: 121.478 Ave N Shift Values>> N :: 121.98(4.07) I24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.57 C 0.41 C Shift Assignments>> C :: 175.616 CA :: 59.114 CB :: 38.899 CG1 :: 27.212 CG2 :: 16.984 CD1 :: 12.486 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 :: 8.523 HA :: 4.343 HB :: 1.484 HG2 :: 0.874 HG12 :: 1.349 HG13 :: 1.035 HD1 :: 0.810 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 :: 123.637 Ave N Shift Values>> N :: 121.6(4.72) K25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.4 C 0.39 R 0.14 M 0.05 C Shift Assignments>> C :: 176.295 CA :: 58.580 CB :: 32.513 CG :: 24.115 CD :: 29.617 CE :: 41.921 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 :: 8.668 HA :: 3.291 HB2 :: 1.588 HB3 :: 1.472 HG2 :: 1.166 HG3 :: 1.166 HD2 :: 1.676 HD3 :: 1.647 HE2 :: 2.997 HE3 :: 2.997 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 :: 129.247 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) G26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.66 L 0.13 C 0.09 R 0.07 F 0.01 C Shift Assignments>> C :: 174.532 CA :: 44.962 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.677 HA2 :: 4.273 HA3 :: 3.725 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 112.648 Ave N Shift Values>> N :: 109.91(4.29) T27 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 :: 171.869 CA :: 60.880 CB :: 71.965 CG2 :: 21.887 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 :: 7.306 HA :: 4.598 HB :: 4.317 HG2 :: 1.101 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 :: 109.830 Ave N Shift Values>> N :: 115.7(5.05) K28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.43 C 0.38 R 0.13 M 0.03 C Shift Assignments>> C :: 175.852 CA :: 54.924 CB :: 34.730 CG :: 24.686 CD :: 29.501 CE :: 41.732 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 :: 8.070 HA :: 5.153 HB2 :: 1.658 HB3 :: 1.640 HG2 :: 1.262 HG3 :: 1.113 HD2 :: 1.628 HD3 :: 1.628 HE2 :: 2.883 HE3 :: 2.883 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 :: 117.752 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) V29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.61 V 0.36 A 0.01 C Shift Assignments>> C :: 174.088 CA :: 58.898 CB :: 34.785 CG1 :: 21.090 CG2 :: 20.120 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 :: 8.772 HA :: 4.747 HB :: 1.686 HG1 :: 0.499 HG2 :: 0.466 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 :: 119.844 Ave N Shift Values>> N :: 121.02(4.96) I30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 I 0.39 C Shift Assignments>> C :: 175.967 CA :: 59.132 CB :: 37.048 CG1 :: 26.671 CG2 :: 17.390 CD1 :: 10.305 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 :: 8.285 HA :: 4.359 HB :: 2.073 HG2 :: 0.660 HG12 :: 1.356 HG13 :: 1.425 HD1 :: 0.675 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 :: 122.376 Ave N Shift Values>> N :: 121.6(4.72) V31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.87 C 0.12 C Shift Assignments>> C :: 175.311 CA :: 64.619 CB :: 31.987 CG1 :: 22.130 CG2 :: 23.169 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 :: 9.372 HA :: 3.973 HB :: 2.231 HG1 :: 0.578 HG2 :: 1.250 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 :: 128.775 Ave N Shift Values>> N :: 121.02(4.96) M32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 M 0.34 I 0.07 A 0.07 C Shift Assignments>> C :: 176.347 CA :: 56.588 CB :: 36.234 CG :: 31.191 CE :: 16.826 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 :: 9.366 HA :: 4.659 HB2 :: 2.269 HB3 :: 1.455 HG2 :: 2.526 HG3 :: 2.407 HE :: 1.988 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 :: 124.999 Ave N Shift Values>> N :: 120.1(3.88) E33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.64 M 0.21 E 0.13 C Shift Assignments>> C :: 173.618 CA :: 55.907 CB :: 33.900 CG :: 36.105 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 :: 7.785 HA :: 4.402 HB2 :: 1.836 HB3 :: 1.836 HG2 :: 2.155 HG3 :: 2.155 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 :: 118.248 Ave N Shift Values>> N :: 120.68(3.68) K34 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.49 K 0.34 M 0.09 R 0.04 A 0.01 C Shift Assignments>> CA :: 55.250 CB :: 35.010 CG :: 23.814 CD :: 30.136 CE :: 41.095 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 :: 8.609 HA :: 4.256 HB2 :: 1.356 HB3 :: 1.247 HG2 :: 0.311(S) HG3 :: -1.110(M) HD2 :: 1.108 HD3 :: 0.949 HE2 :: 2.053(S) HE3 :: 1.265(M) 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 :: 123.925 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) SRO Rule Breaks>> (HE3 > HB2 : 0.9970) C35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> W 0.17 E 0.16 C 0.14 R 0.13 Q 0.12 K 0.11 I 0.06 M 0.04 V 0.02 C Shift Assignments>> CA :: 58.463 CB :: 29.808 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> HA :: 4.921 HB2 :: 3.540 HB3 :: 3.540 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) S36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 174.170 CA :: 60.376 CB :: 63.336 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> HA :: 4.041 HB2 :: 3.817 HB3 :: 3.817 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) D37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.29 N 0.19 L 0.13 C 0.12 F 0.09 Y 0.09 K 0.04 C Shift Assignments>> C :: 176.849 CA :: 54.119 CB :: 40.309 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 :: 8.168 HA :: 4.622 HB2 :: 3.036 HB3 :: 2.666 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 :: 120.448 Ave N Shift Values>> N :: 120.73(4.2) G38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.68 L 0.12 C 0.08 R 0.06 F 0.01 C Shift Assignments>> C :: 174.020 CA :: 45.025 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.021 HA2 :: 4.174 HA3 :: 3.599 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.920 Ave N Shift Values>> N :: 109.91(4.29) W39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.54 C 0.45 C Shift Assignments>> C :: 174.652 CA :: 57.505 CB :: 29.881 CD1 :: 126.980 CE3 :: 119.700 CZ2 :: 114.540 CZ3 :: 120.840 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 :: 7.986 HA :: 4.815 HB2 :: 3.214 HB3 :: 3.161 HD1 :: 6.925 HE1 :: 9.875 HE3 :: 7.338 HZ2 :: 7.421 HZ3 :: 6.758 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 :: 122.876 NE1 :: 128.990 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) W40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 W 0.16 C Shift Assignments>> C :: 172.808 CA :: 52.958 CB :: 33.653 CD1 :: 122.660 CE3 :: 121.330 CZ2 :: 114.380 CZ3 :: 121.420 CH2 :: 125.360 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 :: 8.990 HA :: 5.524 HB2 :: 2.275 HB3 :: 2.888 HD1 :: 7.387 HE3 :: 7.383 HZ2 :: 7.533 HZ3 :: 6.835 HH2 :: 7.288 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 :: 124.070 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) R41 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> R 0.36 C 0.35 K 0.17 G 0.09 C Shift Assignments>> C :: 176.684 CA :: 53.740 CB :: 32.642 CG :: 27.441 CD :: 43.277 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 :: 8.644 HA :: 4.655 HB2 :: 1.052 HB3 :: -0.308(M) HG2 :: 0.870 HG3 :: 0.239(S) HD2 :: 2.391 HD3 :: 2.391(S) 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 :: 121.145 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) G42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.12 L 0.05 C Shift Assignments>> C :: 169.709 CA :: 46.355 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.128 HA2 :: 4.910 HA3 :: 4.165 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 114.080 Ave N Shift Values>> N :: 109.91(4.29) S43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.89 T 0.1 C Shift Assignments>> C :: 174.215 CA :: 55.349 CB :: 66.526 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.112 HA :: 5.816 HB2 :: 3.721 HB3 :: 3.646 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 :: 111.505 Ave N Shift Values>> N :: 116.3(3.95) Y44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.58 C 0.4 C Shift Assignments>> C :: 175.151 CA :: 57.888 CB :: 41.609 CD1 :: 133.680 CD2 :: 133.679 CE1 :: 118.490 CE2 :: 118.489 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 :: 8.895 HA :: 4.817 HB2 :: 3.087 HB3 :: 2.792 HD1 :: 7.293 HD2 :: 7.293 HE1 :: 6.884 HE2 :: 6.884 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 :: 123.955 Ave N Shift Values>> N :: 120.79(4.69) N45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.55 C 0.31 D 0.12 E 0.01 C Shift Assignments>> C :: 174.862 CA :: 53.369 CB :: 37.215 CG :: 177.452 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 :: 8.928 HA :: 4.104 HB2 :: 2.868 HB3 :: 1.787 HD21 :: 7.233 HD22 :: 6.531 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 :: 128.267 ND2 :: 110.380 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) G46 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 :: 173.684 CA :: 45.378 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.508 HA2 :: 4.138 HA3 :: 3.515 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 103.761 Ave N Shift Values>> N :: 109.91(4.29) Q47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.23 M 0.23 Q 0.2 K 0.16 E 0.05 W 0.03 R 0.03 C Shift Assignments>> C :: 174.353 CA :: 54.495 CG :: 33.989 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 :: 7.844 HA :: 4.615 HB2 :: 2.131 HB3 :: 2.064 HG2 :: 2.442 HG3 :: 2.350 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 :: 121.201 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) V48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 V 0.48 HN Overlap>> E59 C Shift Assignments>> C :: 176.591 CA :: 59.993 CB :: 34.816 CG1 :: 20.865 CG2 :: 20.851 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 :: 8.406 HA :: 5.298 HB :: 1.821 HG1 :: 0.762 HG2 :: 0.817 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 :: 121.830 Ave N Shift Values>> N :: 121.02(4.96) G49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.09 L 0.07 R 0.01 C Shift Assignments>> C :: 171.140 CA :: 45.746 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.755 HA2 :: 4.138 HA3 :: 3.939 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 111.420 Ave N Shift Values>> N :: 109.91(4.29) W50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 W 0.43 C Shift Assignments>> C :: 176.833 CA :: 56.979 CB :: 32.106 CD1 :: 128.220 CE3 :: 120.700 CZ2 :: 114.840 CZ3 :: 122.410 CH2 :: 124.860 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 :: 8.959 HA :: 5.660 HB2 :: 2.983 HB3 :: 3.421 HD1 :: 7.384 HE3 :: 7.488 HZ2 :: 7.443 HZ3 :: 7.126 HH2 :: 7.152 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 :: 120.558 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) F51 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 F 0.04 C Shift Assignments>> CA :: 55.765 CB :: 38.634 CD1 :: 134.650(M) CD2 :: 134.649 CE1 :: 129.541 CE2 :: 129.540 CZ :: 130.950 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 :: 9.620 HA :: 5.203 HB2 :: 3.334 HB3 :: 2.619 HD1 :: 6.972 HD2 :: 6.972 HE1 :: 6.880 HE2 :: 6.880 HZ :: 7.131 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 :: 117.580 Ave N Shift Values>> N :: 120.69(4.18) P52 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> P 0.61 C 0.38 C Shift Assignments>> C :: 178.796 CA :: 61.480 CB :: 30.318 CG :: 27.487 CD :: 49.898 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 :: 3.639 HB2 :: 1.531 HB3 :: 1.239 HG2 :: 0.899 HG3 :: 0.421(S) HD2 :: 2.597 HD3 :: 2.260(S) 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) S53 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> M5 C Shift Assignments>> C :: 174.909 CA :: 60.777 CB :: 60.897 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.997 HA :: 2.812(S) HB2 :: 1.835(S) HB3 :: 1.633(S) 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 :: 120.294 Ave N Shift Values>> N :: 116.3(3.95) N54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 N 0.21 E 0.16 Y 0.09 M 0.08 F 0.04 K 0.03 D 0.02 I 0.01 C Shift Assignments>> C :: 175.243 CA :: 54.393 CB :: 36.609 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 :: 8.052 HA :: 4.485 HB2 :: 2.754 HB3 :: 2.578 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 :: 115.637 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Y55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.46 C 0.34 F 0.19 C Shift Assignments>> C :: 175.053 CA :: 59.633 CB :: 38.289 CD1 :: 133.190 CD2 :: 133.189 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 :: 7.743 HA :: 4.346 HB2 :: 3.301 HB3 :: 2.911 HD1 :: 7.120 HD2 :: 7.120 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 :: 118.479 Ave N Shift Values>> N :: 120.79(4.69) V56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.73 V 0.22 A 0.03 I 0.01 C Shift Assignments>> C :: 174.229 CA :: 58.329 CB :: 35.347 CG1 :: 21.816 CG2 :: 19.518 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 :: 7.500 HA :: 5.457 HB :: 2.006 HG1 :: 0.550 HG2 :: 0.869 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 :: 109.861 Ave N Shift Values>> N :: 121.02(4.96) T57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.86 C 0.13 C Shift Assignments>> C :: 174.019 CA :: 60.040 CB :: 70.857 CG2 :: 20.994 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 :: 9.098 HA :: 4.813 HB :: 4.052 HG2 :: 1.274 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 :: 113.952 Ave N Shift Values>> N :: 115.7(5.05) E58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 E 0.35 I 0.1 M 0.07 K 0.01 C Shift Assignments>> C :: 176.206 CA :: 57.449 CB :: 31.021 CG :: 37.567 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 :: 9.091 HA :: 4.540 HB2 :: 2.299 HB3 :: 2.135 HG2 :: 2.466 HG3 :: 2.358 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 :: 126.127 Ave N Shift Values>> N :: 120.68(3.68) E59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 M 0.11 K 0.07 I 0.04 Q 0.04 HN Overlap>> V48 C Shift Assignments>> C :: 176.077 CA :: 56.688 CB :: 30.377 CG :: 36.282 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 :: 8.423 HA :: 4.392 HB2 :: 2.071 HB3 :: 1.942 HG2 :: 2.258 HG3 :: 2.258 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 :: 121.917 Ave N Shift Values>> N :: 120.68(3.68) G60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.69 L 0.12 C 0.08 R 0.06 F 0.01 C Shift Assignments>> C :: 172.665 CA :: 45.042 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.197 HA2 :: 3.814 HA3 :: 3.800 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.428 Ave N Shift Values>> N :: 109.91(4.29) D61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.24 K 0.18 R 0.16 D 0.12 C 0.1 F 0.08 Y 0.06 N 0.01 C Shift Assignments>> CA :: 55.773 CB :: 42.279 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 :: 7.767 HA :: 4.373 HB2 :: 2.619 HB3 :: 2.534 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 :: 125.532 Ave N Shift Values>> N :: 120.73(4.2) ########################################################################### Overall Results: #Consistent: 55 #Clerical: 0 #Suspicious: 3 #Anomalous: 3 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 60 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 1 Shift Relative Order (SRO) Results: #Consistent: 60 #Suspicious: 1 C Shift Results: #Consistent: 262 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 1 H Shift Results: #Consistent: 335 #Duplicate: 0 #Unknown: 0 #Suspicious: 10 #Anomalous: 3 N Shift Results: #Consistent: 58 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: K10 HB2 = 0.967(S), Expected = 1.79, Std = 0.2500, ChiSquare = 9.9478e-04 K34 HG2 = 0.311(S), Expected = 1.38, Std = 0.2700, ChiSquare = 7.5183e-05 K34 HG3 = -1.110(M), Expected = 1.37, Std = 0.2900, ChiSquare = 1.2126e-17 K34 HE2 = 2.053(S), Expected = 2.93, Std = 0.2000, ChiSquare = 1.1599e-05 K34 HE3 = 1.265(M), Expected = 2.93, Std = 0.2000, ChiSquare = 8.4329e-17 K34 SRO Rule Break>> HE3 > HB2 : 0.99703557312253 R41 HB3 = -0.308(M), Expected = 1.78, Std = 0.2800, ChiSquare = 8.8419e-14 R41 HG3 = 0.239(S), Expected = 1.58, Std = 0.2700, ChiSquare = 6.8114e-07 R41 HD3 = 2.391(S), Expected = 3.13, Std = 0.2200, ChiSquare = 7.8199e-04 F51 CD1 = 134.650(M), Expected = 131.38, Std = 1.3800, ChiSquare = 1.7809e-02 P52 HG3 = 0.421(S), Expected = 1.92, Std = 0.3700, ChiSquare = 5.0923e-05 P52 HD3 = 2.260(S), Expected = 3.63, Std = 0.4000, ChiSquare = 6.1480e-04 S53 HA = 2.812(S), Expected = 4.51, Std = 0.4300, ChiSquare = 7.8532e-05 S53 HB2 = 1.835(S), Expected = 3.88, Std = 0.2900, ChiSquare = 1.7671e-12 S53 HB3 = 1.633(S), Expected = 3.87, Std = 0.3100, ChiSquare = 5.3488e-13