M1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> M 0.72 A 0.27 C Shift Assignments>> C :: 171.2656 CA :: 54.2962 CB :: 32.6490 CG :: 30.7644 CE :: 16.2845 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>> HA :: 4.2370 HB2 :: 2.1287 HB3 :: 1.9390 HG2 :: 2.3280 HG3 :: 1.8292 HE :: 1.9824 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) Q2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.52 Q 0.44 N 0.02 D 0.01 C Shift Assignments>> C :: 173.2708 CA :: 54.7227 CB :: 30.8559 CG :: 35.3467 CD :: 179.8387 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 :: 8.6404 HA :: 5.1219 HB2 :: 2.3321 HB3 :: 1.9220 HG2 :: 2.1007 HG3 :: 2.3654 HE21 :: 7.1300 HE22 :: 6.7472 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 :: 124.2000 NE2 :: 111.5800 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) Y3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.97 G 0.02 C Shift Assignments>> C :: 175.7216 CA :: 58.0184 CB :: 41.9769 CD1 :: 132.9436 CE1 :: 117.2441 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 :: 9.3340 HA :: 5.5898 HB2 :: 3.1324 HB3 :: 2.9153 HD1 :: 6.4594 HE1 :: 6.1716 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 :: 121.3300 Ave N Shift Values>> N :: 120.79(4.69) K4 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.93 M 0.05 C Shift Assignments>> C :: 174.9171 CA :: 55.0146 CB :: 36.0172 CG :: 25.1071 CD :: 29.4683 CE :: 41.3744 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 :: 9.6768 HA :: 5.9562(S) HB2 :: 2.0278 HB3 :: 1.7586 HG2 :: 1.5390 HG3 :: 1.3495 HD2 :: 1.7834 HD3 :: 1.7214 HE2 :: 2.9084 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 :: 123.5200 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) V5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.98 I 0.01 C Shift Assignments>> C :: 174.2014 CA :: 61.6554 CB :: 36.0363 CG1 :: 21.3985 CG2 :: 22.1397 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 :: 9.2817 HA :: 4.5252 HB :: 1.9178 HG1 :: 0.5691 HG2 :: 1.1848 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 :: 124.6200 Ave N Shift Values>> N :: 121.02(4.96) I6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> C :: 175.1902 CA :: 61.3636 CB :: 39.4721 CG1 :: 28.2416 CG2 :: 18.1866 CD1 :: 13.9764 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 :: 9.1732 HA :: 4.6284 HB :: 1.8710 HG2 :: 0.8685 HG12 :: 1.5292 HG13 :: 1.1320 HD1 :: 0.9110 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 :: 128.3900 Ave N Shift Values>> N :: 121.6(4.72) L7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.74 G 0.24 A 0.01 C Shift Assignments>> C :: 175.8443 CA :: 53.9970 CB :: 43.8103 CG :: 27.3515 CD1 :: 26.0063 CD2 :: 24.3380 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 :: 8.5122 HA :: 4.7307 HB2 :: 1.6317 HG :: 1.4358 HD1 :: 0.5717 HD2 :: 0.7259 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 :: 127.4500 Ave N Shift Values>> N :: 121.98(4.07) N8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.6 D 0.39 C Shift Assignments>> C :: 175.4771 CA :: 53.3482 CB :: 39.3234 CG :: 176.8386 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 :: 8.7053 HA :: 4.7727 HB2 :: 2.8645 HD21 :: 7.5697 HD22 :: 6.9351 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 :: 121.6400 ND2 :: 112.3400 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) G9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 L 0.08 C Shift Assignments>> C :: 174.1502 CA :: 45.7560 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.5154 HA2 :: 3.8804 HA3 :: 4.0507 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.3500 Ave N Shift Values>> N :: 109.91(4.29) K10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.89 M 0.06 G 0.04 C Shift Assignments>> C :: 176.9539 CA :: 56.6704 CB :: 33.5210 CG :: 24.9854 CD :: 29.3906 CE :: 42.5273 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 :: 8.2160 HA :: 4.4714 HB2 :: 1.8015 HB3 :: 1.8245 HG2 :: 1.4222 HD2 :: 1.6736 HE2 :: 3.0000 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 :: 120.3400 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) T11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> T49 C Shift Assignments>> C :: 175.0583 CA :: 62.1661 CB :: 70.4672 CG2 :: 22.0130 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 :: 8.2109 HA :: 4.4026 HB :: 4.2796 HG2 :: 1.2008 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 :: 114.7900 Ave N Shift Values>> N :: 115.7(5.05) L12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.93 G 0.04 A 0.01 C Shift Assignments>> C :: 177.2249 CA :: 55.7414 CB :: 42.5068 CG :: 27.1080 CD1 :: 25.1895 CD2 :: 23.7771 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 :: 8.2782 HA :: 4.3728 HB2 :: 1.6247 HG :: 1.6385 HD1 :: 0.8970 HD2 :: 0.8463 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 :: 123.4500 Ave N Shift Values>> N :: 121.98(4.07) K13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.87 M 0.08 G 0.04 HN Overlap>> E15 C Shift Assignments>> C :: 176.8510 CA :: 56.7296 CB :: 32.9221 CG :: 24.9547 CD :: 29.3730 CE :: 42.4857 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 :: 8.1555 HA :: 4.2934 HB2 :: 1.7561 HB3 :: 1.8449 HG2 :: 1.4115 HD2 :: 1.6878 HE2 :: 2.9871 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 :: 120.2200 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) G14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.9 L 0.08 C Shift Assignments>> C :: 174.1499 CA :: 45.6997 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.2479 HA2 :: 4.0572 HA3 :: 3.8526 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.8000 Ave N Shift Values>> N :: 109.91(4.29) E15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.55 M 0.18 K 0.11 Q 0.07 I 0.07 HN Overlap>> K13 C Shift Assignments>> C :: 176.7245 CA :: 56.8758 CB :: 30.4577 CG :: 36.1872 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 :: 8.1000 HA :: 4.3998 HB2 :: 2.1248 HB3 :: 1.9874 HG2 :: 2.2710 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 :: 120.1881 Ave N Shift Values>> N :: 120.68(3.68) T16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.7546 CA :: 62.2132 CB :: 70.1243 CG2 :: 21.8097 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 :: 8.2058 HA :: 4.4928 HB :: 4.3114 HG2 :: 1.2186 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 :: 113.8700 Ave N Shift Values>> N :: 115.7(5.05) T17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.7450 CA :: 62.1266 CB :: 70.0576 CG2 :: 21.8370 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 :: 8.1307 HA :: 4.4738 HB :: 4.2851 HG2 :: 1.2015 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 :: 115.8400 Ave N Shift Values>> N :: 115.7(5.05) T18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.5051 CA :: 62.2229 CB :: 70.0360 CG2 :: 21.9022 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 :: 8.1010 HA :: 4.3692 HB :: 4.3446 HG2 :: 1.2119 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 :: 114.9900 Ave N Shift Values>> N :: 115.7(5.05) E19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.53 M 0.15 K 0.13 Q 0.09 I 0.07 C Shift Assignments>> C :: 176.0424 CA :: 57.0042 CB :: 30.2497 CG :: 36.0892 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 :: 8.3049 HA :: 4.3080 HB2 :: 2.0701 HB3 :: 1.9791 HG2 :: 2.3028 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 :: 122.8300 Ave N Shift Values>> N :: 120.68(3.68) A20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.68 M 0.27 L 0.02 C Shift Assignments>> C :: 177.5489 CA :: 53.3124 CB :: 19.8140 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.2687 HA :: 4.2976 HB :: 1.3977 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.1900 Ave N Shift Values>> N :: 123.23(3.7) V21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 174.8144 CA :: 62.1007 CB :: 33.0759 CG1 :: 21.6457 CG2 :: 21.3520 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 :: 7.7646 HA :: 3.9555 HB :: 1.9559 HG1 :: 0.7282 HG2 :: 0.7740 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 :: 116.6300 Ave N Shift Values>> N :: 121.02(4.96) D22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.37 D 0.25 K 0.17 F 0.07 Y 0.05 N 0.04 G 0.02 C Shift Assignments>> C :: 176.4006 CA :: 54.1846 CB :: 42.4994 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 :: 8.3315 HA :: 4.6479 HB2 :: 2.7747 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 :: 124.7600 Ave N Shift Values>> N :: 120.73(4.2) A23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.31 I 0.05 V 0.01 C Shift Assignments>> C :: 178.5241 CA :: 55.7005 CB :: 18.6357 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.6267 HA :: 3.8576 HB :: 1.5738 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 129.5400 Ave N Shift Values>> N :: 123.23(3.7) A24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.61 A 0.32 I 0.05 C Shift Assignments>> C :: 181.0998 CA :: 55.4000 CB :: 17.9687 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.1560 HA :: 3.8950 HB :: 1.4563 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.6000 Ave N Shift Values>> N :: 123.23(3.7) T25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.5254 CA :: 67.1047 CB :: 68.3932 CG2 :: 22.4986 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 :: 7.8421 HA :: 3.8868 HB :: 4.4107 HG2 :: 1.3872 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 :: 115.6900 Ave N Shift Values>> N :: 115.7(5.05) F26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.61 Y 0.38 C Shift Assignments>> C :: 175.7664 CA :: 61.6926 CB :: 38.3482 CD1 :: 131.3970 CE1 :: 130.3851 CZ :: 128.1667 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 :: 7.7403 HA :: 3.0083 HB2 :: 2.6679 HB3 :: 2.5300 HD2 :: 5.9274 HE2 :: 6.5862 HZ :: 6.8941 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 :: 122.9100 Ave N Shift Values>> N :: 120.69(4.18) E27 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> E 0.49 I 0.33 K 0.08 M 0.04 Q 0.03 C Shift Assignments>> C :: 180.2632 CA :: 60.0689 CB :: 29.9267 CG :: 36.1875 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 :: 8.0812 HA :: 3.1903 HB2 :: 1.8858 HB3 :: 1.8498 HG2 :: 2.1500 HG3 :: 0.7184(M) 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 :: 115.9900 Ave N Shift Values>> N :: 120.68(3.68) K28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.9 M 0.05 G 0.04 C Shift Assignments>> C :: 178.4648 CA :: 59.6494 CB :: 32.8476 CG :: 25.0418 CD :: 29.7289 CE :: 42.3745 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 :: 7.3791 HA :: 4.1007 HB2 :: 1.9818 HG2 :: 1.4528 HG3 :: 1.6316 HD2 :: 1.6990 HE2 :: 2.9905 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 :: 118.9400 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>> V 0.99 C Shift Assignments>> C :: 179.0742 CA :: 66.4397 CB :: 31.3592 CG1 :: 19.7865 CG2 :: 22.8318 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 :: 8.1733 HA :: 3.5602 HB :: 1.5857 HG1 :: 0.4509 HG2 :: 0.7231 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 :: 122.0700 Ave N Shift Values>> N :: 121.02(4.96) V30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 176.8404 CA :: 67.3359 CB :: 31.9514 CG1 :: 23.2778 CG2 :: 22.0940 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 :: 7.4681 HA :: 3.3024 HB :: 1.7968 HG1 :: 0.2739 HG2 :: 0.5719 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 :: 119.5000 Ave N Shift Values>> N :: 121.02(4.96) K31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.84 G 0.09 M 0.05 C Shift Assignments>> C :: 178.2777 CA :: 60.8333 CB :: 33.4376 CG :: 25.3631 CD :: 30.3898 CE :: 42.4646 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 :: 7.7771 HA :: 3.7728 HB2 :: 2.1459 HB3 :: 1.9616 HG2 :: 1.6160 HD2 :: 1.9594 HD3 :: 1.9195 HE2 :: 3.3418 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 :: 119.5500 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Q32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.59 E 0.4 C Shift Assignments>> C :: 177.0287 CA :: 59.0317 CB :: 28.5303 CG :: 33.9422 CD :: 180.7474 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 :: 8.6584 HA :: 3.9099 HB2 :: 2.1679 HB3 :: 2.1094 HG2 :: 2.4167 HE21 :: 7.8574 HE22 :: 6.8132 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 :: 118.5900 NE2 :: 114.9100 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) F33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.55 Y 0.44 C Shift Assignments>> C :: 177.9353 CA :: 61.2934 CB :: 38.1421 CD1 :: 132.0672 CE1 :: 130.3460 CZ :: 128.2402 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 :: 7.7721 HA :: 4.3011 HB2 :: 3.1136 HD2 :: 6.7196 HE2 :: 6.7480 HZ :: 6.6396 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 :: 120.2000 Ave N Shift Values>> N :: 120.69(4.18) F34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.51 F 0.48 C Shift Assignments>> C :: 178.9589 CA :: 64.4010 CB :: 37.2459 CD1 :: 131.7026 CZ :: 128.9200 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 :: 7.9191 HA :: 3.5893 HB2 :: 3.0591 HB3 :: 2.7138 HD2 :: 6.7830 HZ :: 6.9493 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 :: 119.0800 Ave N Shift Values>> N :: 120.69(4.18) N35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.5 N 0.49 C Shift Assignments>> C :: 179.3107 CA :: 57.3281 CB :: 39.1015 CG :: 176.2165 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 :: 8.9244 HA :: 4.4802 HB2 :: 2.8978 HD21 :: 7.9346 HD22 :: 7.3275 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 :: 120.9700 ND2 :: 111.3500 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) D36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.89 N 0.07 E 0.03 C Shift Assignments>> C :: 176.8722 CA :: 57.1156 CB :: 40.0736 CG :: 179.1425 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 :: 9.0338 HA :: 4.3946 HB2 :: 2.7652 HB3 :: 2.5805 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 :: 122.4700 Ave N Shift Values>> N :: 120.73(4.2) N37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.61 N 0.38 C Shift Assignments>> C :: 174.0342 CA :: 53.8262 CB :: 40.8051 CG :: 177.4472 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 :: 7.3255 HA :: 4.6553 HB2 :: 2.7808 HB3 :: 2.1019 HD21 :: 6.5577 HD22 :: 6.1617 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 :: 116.9200 ND2 :: 115.3200 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) G38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.06 C Shift Assignments>> C :: 173.8938 CA :: 46.4820 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.8461 HA2 :: 4.0884 HA3 :: 3.8035 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.4800 Ave N Shift Values>> N :: 109.91(4.29) V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> C :: 173.8272 CA :: 61.6306 CB :: 34.2609 CG1 :: 22.4871 CG2 :: 21.0026 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 :: 8.1132 HA :: 4.2508 HB :: 2.0069 HG1 :: 0.9174 HG2 :: 0.8808 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 :: 121.4000 Ave N Shift Values>> N :: 121.02(4.96) D40 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.79 D 0.2 C Shift Assignments>> C :: 174.7600 CA :: 52.8629 CB :: 43.2921 CG :: 182.6612(M) 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 :: 8.5873 HA :: 4.8305 HB2 :: 2.5644 HB3 :: 2.6086 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 :: 126.3200 Ave N Shift Values>> N :: 120.73(4.2) G41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.92 L 0.06 C Shift Assignments>> C :: 170.6566 CA :: 46.3458 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.7806 HA2 :: 3.9966 HA3 :: 3.1515 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.5400 Ave N Shift Values>> N :: 109.91(4.29) E42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.78 E 0.13 Q 0.07 C Shift Assignments>> C :: 174.7708 CA :: 53.6400 CB :: 33.8347 CG :: 35.0096 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 :: 7.2551 HA :: 4.4590 HB2 :: 1.8458 HB3 :: 1.6289 HG2 :: 2.1449 HG3 :: 2.0654 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 :: 114.2500 Ave N Shift Values>> N :: 120.68(3.68) W43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.99 C Shift Assignments>> C :: 176.8271 CA :: 57.0217 CB :: 30.3088 CD1 :: 127.7107 CE3 :: 120.8830 CZ2 :: 113.5111 CZ3 :: 124.5355 CH2 :: 123.9529 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 :: 8.9390 HA :: 5.0074 HB2 :: 3.2164 HB3 :: 2.9574 HD1 :: 7.5518 HE1 :: 9.9073 HE3 :: 7.4772 HZ2 :: 6.9309 HZ3 :: 7.7171 HH2 :: 7.0410 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 :: 123.0900 NE1 :: 127.2900 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) T44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.9744 CA :: 60.2072 CB :: 71.7727 CG2 :: 21.5510 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 :: 9.2451 HA :: 4.7572 HB :: 4.2249 HG2 :: 1.1438 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 :: 117.6100 Ave N Shift Values>> N :: 115.7(5.05) Y45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.99 C Shift Assignments>> C :: 176.8427 CA :: 60.3941 CB :: 39.0593 CD1 :: 133.6183 CE1 :: 118.2056 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 :: 8.7686 HA :: 4.8084 HB2 :: 3.1013 HB3 :: 2.9050 HD1 :: 7.2736 HE1 :: 6.7873 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 :: 121.5100 Ave N Shift Values>> N :: 120.79(4.69) D46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.91 N 0.05 G 0.03 HN Overlap>> K50 C Shift Assignments>> C :: 177.0029 CA :: 53.4527 CB :: 42.1461 CG :: 179.3883 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 :: 8.6859 HA :: 4.6490 HB2 :: 2.7005 HB3 :: 2.5088 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 :: 125.0800 Ave N Shift Values>> N :: 120.73(4.2) D47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.9 N 0.08 C Shift Assignments>> C :: 175.8414 CA :: 54.6962 CB :: 41.3473 CG :: 179.1938 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 :: 8.4976 HA :: 4.4970 HB2 :: 2.7077 HB3 :: 2.5303 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 :: 120.8000 Ave N Shift Values>> N :: 120.73(4.2) A48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.69 M 0.27 L 0.02 HN Overlap>> V54 C Shift Assignments>> C :: 175.6009 CA :: 53.2802 CB :: 19.7765 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.1246 HA :: 4.2379 HB :: 1.5275 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 127.0100 Ave N Shift Values>> N :: 123.23(3.7) T49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 HN Overlap>> T11 C Shift Assignments>> C :: 173.8148 CA :: 61.2576 CB :: 72.3810 CG2 :: 21.8216 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 :: 8.1358 HA :: 5.1858 HB :: 3.8490 HG2 :: 1.0342 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 :: 114.8500 Ave N Shift Values>> N :: 115.7(5.05) K50 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.77 M 0.12 G 0.09 HN Overlap>> D46 C Shift Assignments>> C :: 175.1365 CA :: 55.4187 CB :: 36.7303 CG :: 26.0601 CD :: 30.6566 CE :: 42.1353 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 :: 8.6800 HA :: 5.1767 HB2 :: 1.6769 HB3 :: 1.4539 HG2 :: 0.4697(S) HG3 :: 1.1520 HD2 :: 1.1520 HD3 :: 1.2624 HE2 :: 2.3385 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 :: 125.1300 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) T51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.1142 CA :: 60.9450 CB :: 71.3691 CG2 :: 21.9841 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 :: 9.2719 HA :: 5.8155 HB :: 3.8333 HG2 :: 1.0482 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 :: 119.4500 Ave N Shift Values>> N :: 115.7(5.05) F52 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> F 0.68 Y 0.31 C Shift Assignments>> CA :: 59.2456 CB :: 37.7582 CD1 :: 131.0118 CE1 :: 129.5939 CZ :: 127.6495 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 :: 8.3661 HA :: 3.7822 HB2 :: 2.4474 HB3 :: 1.0458(S) HD2 :: 5.2481 HE2 :: 6.0492 HZ :: 6.6572 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 :: 130.2100 Ave N Shift Values>> N :: 120.69(4.18) T53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.3540 CA :: 61.9079 CB :: 69.8400 CG2 :: 21.1935 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 :: 8.1887 HA :: 4.1427 HB :: 3.8355 HG2 :: 1.0100 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 :: 127.3960 Ave N Shift Values>> N :: 115.7(5.05) V54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> A48 C Shift Assignments>> C :: 176.1476 CA :: 62.6931 CB :: 32.6688 CG1 :: 21.4114 CG2 :: 21.2899 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 :: 8.1845 HA :: 3.9396 HB :: 1.9118 HG1 :: 0.8468 HG2 :: 0.7049 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 :: 127.0700 Ave N Shift Values>> N :: 121.02(4.96) T55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.3910 CA :: 62.2612 CB :: 69.8796 CG2 :: 21.8865 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 :: 8.3653 HA :: 4.1939 HB :: 4.0019 HG2 :: 1.0830 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 :: 121.8900 Ave N Shift Values>> N :: 115.7(5.05) E56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.52 M 0.26 Q 0.08 I 0.06 K 0.05 C Shift Assignments>> C :: 180.5595 CA :: 58.0295 CB :: 31.3303 CG :: 35.8290 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 :: 7.9131 HA :: 4.1543 HB2 :: 2.0357 HB3 :: 1.8795 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 :: 129.0400 Ave N Shift Values>> N :: 120.68(3.68) ########################################################################### Overall Results: #Consistent: 51 #Clerical: 0 #Suspicious: 3 #Anomalous: 2 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 56 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 56 #Suspicious: 0 C Shift Results: #Consistent: 249 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 1 H Shift Results: #Consistent: 286 #Duplicate: 0 #Unknown: 0 #Suspicious: 3 #Anomalous: 1 N Shift Results: #Consistent: 61 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: K4 HA = 5.9562(S), Expected = 4.28, Std = 0.4500, ChiSquare = 1.9540e-04 E27 HG3 = 0.7184(M), Expected = 2.31, Std = 0.2100, ChiSquare = 3.4810e-14 D40 CG = 182.6612(M), Expected = 178.41, Std = 1.8400, ChiSquare = 2.0864e-02 K50 HG2 = 0.4697(S), Expected = 1.38, Std = 0.2700, ChiSquare = 7.4765e-04 F52 HB3 = 1.0458(S), Expected = 2.97, Std = 0.3800, ChiSquare = 4.1123e-07