M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable G2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable P3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable V4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.88 L 0.1 C Shift Assignments>> C :: 172.708 CA :: 59.780 CB :: 38.285 CG1 :: 24.761 CG2 :: 24.152 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 :: 8.229 HA :: 4.392 HB :: 1.215 HG1 :: 0.416 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 :: 110.210 Ave N Shift Values>> N :: 121.02(4.96) W5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.35 C 0.18 K 0.15 R 0.13 Q 0.04 H 0.04 P 0.04 W 0.02 M 0.01 C Shift Assignments>> C :: 172.235 CA :: 52.628 CB :: 25.732 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 :: 7.929 HA :: 4.982 HE1 :: 9.288 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 :: 122.976 NE1 :: 125.655 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) R6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.4 C 0.15 L 0.15 H 0.08 Q 0.06 K 0.05 W 0.04 R 0.02 E 0.01 M 0.01 C Shift Assignments>> C :: 177.138 CA :: 51.629 CB :: 27.705 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 :: 7.458 HA :: 4.423 HB2 :: 1.837 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 :: 115.526 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) K7 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable H8 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable Y9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 M 0.17 E 0.13 N 0.1 K 0.08 Q 0.07 Y 0.04 F 0.01 H 0.01 W 0.01 C Shift Assignments>> C :: 171.180 CA :: 53.836 CB :: 35.460 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 :: 6.867 HA :: 4.715 HB2 :: 2.748 HB3 :: 2.608 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 :: 119.899 Ave N Shift Values>> N :: 120.79(4.69) I10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 I 0.04 A 0.01 C Shift Assignments>> C :: 172.521 CA :: 56.317 CB :: 37.489 CG1 :: 25.467 CG2 :: 14.085 CD1 :: 10.099 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 :: 8.194 HA :: 4.040 HB :: 1.250 HG2 :: 0.276 HG12 :: 0.654 HG13 :: 0.100 HD1 :: 0.014 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 :: 128.394 Ave N Shift Values>> N :: 121.6(4.72) T11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 C 0.14 T 0.07 C Shift Assignments>> C :: 171.799 CA :: 55.860 CB :: 69.955 CG2 :: 19.124 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 :: 9.097 HA :: 5.240 HB :: 3.977 HG2 :: 0.968 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 :: 117.229 Ave N Shift Values>> N :: 115.7(5.05) Y12 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.33 N 0.3 C 0.12 L 0.1 F 0.05 Y 0.04 K 0.02 C Shift Assignments>> C :: 169.021(M) CA :: 52.174 CB :: 40.428 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 :: 8.546 HA :: 5.741 HB2 :: 2.861 HB3 :: 2.230 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 :: 117.274 Ave N Shift Values>> N :: 120.79(4.69) R13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 K 0.13 R 0.01 C Shift Assignments>> C :: 171.433 CA :: 51.743 CB :: 32.535 CG :: 26.116 CD :: 39.796 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 :: 8.291 HA :: 4.694 HB2 :: 1.496 HG2 :: 1.462 HD2 :: 2.890 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 :: 118.851 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) I14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 C Shift Assignments>> C :: 172.315 CA :: 58.600 CB :: 33.524 CG1 :: 25.155 CG2 :: 13.861 CD1 :: 10.326 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 :: 9.110 HA :: 4.217 HB :: 1.614 HG2 :: -0.016 HG12 :: 1.609 HG13 :: 0.661 HD1 :: 0.878 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 :: 127.164 Ave N Shift Values>> N :: 121.6(4.72) N15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.39 D 0.19 C 0.16 Y 0.09 F 0.07 L 0.04 E 0.01 C Shift Assignments>> C :: 171.058 CA :: 53.577 CB :: 38.873 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 :: 9.604 HA :: 4.207 HB2 :: 2.999 HB3 :: 2.411 HD21 :: 7.946 HD22 :: 7.021 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 :: 128.561 ND2 :: 112.162 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) N16 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 N 0.36 G 0.07 C Shift Assignments>> C :: 167.039(M) CA :: 49.167 CB :: 35.780 CG :: 175.137 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 :: 7.718 HA :: 4.580 HB2 :: 2.939 HB3 :: 2.796 HD21 :: 7.821 HD22 :: 6.887 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 :: 113.007 ND2 :: 114.847 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Y17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.26 M 0.11 Y 0.09 K 0.06 N 0.04 F 0.03 Q 0.03 I 0.02 C Shift Assignments>> C :: 172.355 CA :: 55.977 CB :: 36.071 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 :: 8.537 HA :: 3.981 HB2 :: 2.721 HB3 :: 2.482 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 :: 114.955 Ave N Shift Values>> N :: 120.79(4.69) T18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.1 M 0.1 H 0.1 Q 0.08 K 0.08 R 0.07 C 0.07 D 0.06 W 0.05 E 0.05 Y 0.05 F 0.04 S 0.02 N 0.02 A 0.02 C Shift Assignments>> C :: 170.997 CA :: 55.892 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 :: 8.090 HA :: 4.702 HB :: 3.739 HG2 :: 1.301 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 :: 115.752 Ave N Shift Values>> N :: 115.7(5.05) P19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.87 G 0.11 C Shift Assignments>> C :: 174.321 CA :: 60.248 CB :: 28.839 CG :: 24.249 CD :: 47.924 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 :: 4.256 HB2 :: 2.129 HB3 :: 1.970 HG2 :: 1.800 HG3 :: 1.716 HD2 :: 3.653 HD3 :: 3.488 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) N Shift Assignments>> N :: 139.641 Ave N Shift Values>> N :: 127.4(10.05) D20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.41 N 0.37 C 0.2 C Shift Assignments>> C :: 173.123 CA :: 53.310 CB :: 39.097 CG :: 178.210 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 :: 8.739 HA :: 3.987 HB2 :: 2.582 HB3 :: 2.403 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 :: 121.788 Ave N Shift Values>> N :: 120.73(4.2) M21 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.73 E 0.1 K 0.05 P 0.04 M 0.03 Q 0.01 C Shift Assignments>> C :: 172.078 CA :: 50.542 CB :: 36.413 CG :: 29.118 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 :: 6.811 HA :: 4.477 HB2 :: 2.157 HB3 :: 1.273 HG2 :: 2.208 HG3 :: 1.955 HE :: 0.306(S) 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 :: 113.047 Ave N Shift Values>> N :: 120.1(3.88) N22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 P 0.26 N 0.15 M 0.09 K 0.02 Q 0.02 E 0.01 Y 0.01 C Shift Assignments>> C :: 174.513 CA :: 50.426 CB :: 35.260 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 :: 8.820 HA :: 4.537 HB2 :: 2.728 HB3 :: 2.641 HD21 :: 7.551 HD22 :: 6.879 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 :: 118.643 ND2 :: 113.938 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) R23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.42 C 0.37 K 0.19 HN Overlap>> Y289 C Shift Assignments>> C :: 175.219 CA :: 57.689 CB :: 26.961 CG :: 23.803 CD :: 40.427 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 :: 8.902 HA :: 3.648 HB2 :: 1.345 HB3 :: 1.234 HG2 :: 0.917 HG3 :: 0.870 HD2 :: 2.550 HD3 :: 2.470 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 :: 125.970 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) E24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.35 K 0.32 Q 0.14 R 0.11 M 0.03 E 0.01 C Shift Assignments>> C :: 176.605 CA :: 56.726 CB :: 25.740 CG :: 33.519 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 :: 9.022 HA :: 4.023 HB2 :: 1.874 HG2 :: 2.201 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 :: 116.093 Ave N Shift Values>> N :: 120.68(3.68) D25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 C 0.22 Y 0.12 D 0.1 F 0.08 E 0.06 M 0.02 L 0.01 I 0.01 C Shift Assignments>> C :: 176.396 CA :: 54.232 CB :: 37.939 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 :: 7.409 HA :: 4.555 HB2 :: 2.757 HB3 :: 2.515 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 :: 119.843 Ave N Shift Values>> N :: 120.73(4.2) V26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.51 C 0.45 I 0.02 C Shift Assignments>> C :: 174.401 CA :: 64.009 CB :: 28.581 CG1 :: 21.225 CG2 :: 18.584 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 :: 7.683 HA :: 3.402 HB :: 2.478 HG1 :: 0.875 HG2 :: 0.784 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 :: 123.993 Ave N Shift Values>> N :: 121.02(4.96) D27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 N 0.19 Y 0.15 E 0.14 F 0.08 D 0.04 M 0.04 I 0.02 K 0.01 HN Overlap>> N238 C Shift Assignments>> C :: 176.864 CA :: 55.161 CB :: 37.356 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 :: 8.300 HA :: 4.249 HB2 :: 2.717 HB3 :: 2.585 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 :: 118.287 Ave N Shift Values>> N :: 120.73(4.2) Y28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.25 Y 0.1 I 0.09 M 0.06 K 0.05 F 0.04 V 0.03 Q 0.02 HN Overlap>> R31 F45 F243 C Shift Assignments>> C :: 173.490 CA :: 58.942 CB :: 35.942 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 :: 8.090 HA :: 4.088 HB2 :: 3.188 HB3 :: 2.985 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 :: 119.607 Ave N Shift Values>> N :: 120.79(4.69) A29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.37 C 0.01 HN Overlap>> D54 Q344 C Shift Assignments>> C :: 176.604 CA :: 52.892 CB :: 15.638 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.984 HA :: 3.799 HB :: 1.386 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.412 Ave N Shift Values>> N :: 123.23(3.7) I30 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 C Shift Assignments>> C :: 174.488 CA :: 59.172 CB :: 32.607 CG1 :: 24.430 CG2 :: 15.987 CD1 :: 5.650(S) 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 :: 7.983 HA :: 3.429 HB :: 2.035 HG2 :: 0.640 HG12 :: 1.547 HG13 :: 0.966 HD1 :: 0.180 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 :: 113.835 Ave N Shift Values>> N :: 121.6(4.72) R31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.38 K 0.33 C 0.26 R 0.01 HN Overlap>> Y28 F243 C Shift Assignments>> C :: 177.059 CA :: 57.446 CB :: 27.322 CG :: 24.141 CD :: 41.111 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 :: 8.200 HA :: 4.002 HB2 :: 1.958 HB3 :: 1.882 HG2 :: 1.650 HG3 :: 1.492 HD2 :: 3.178 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 :: 119.589 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) K32 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 L 0.22 A 0.17 HN Overlap>> L313 V328 S360 C Shift Assignments>> C :: 175.953 CA :: 55.402 CB :: 27.967 CG :: 21.550 CD :: 25.000 CE :: 38.848 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 :: 8.462 HA :: 3.802 HB2 :: 1.439 HG2 :: 1.481 HG3 :: 1.408 HD2 :: 0.861 HD3 :: 0.827 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 :: 118.961 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) A33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.5 A 0.46 C 0.01 HN Overlap>> R255 C Shift Assignments>> C :: 175.821 CA :: 52.703 CB :: 16.021 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.948 HA :: 3.827 HB :: 0.986 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.489 Ave N Shift Values>> N :: 123.23(3.7) F34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 I 0.23 E 0.13 V 0.11 Y 0.09 F 0.04 M 0.02 K 0.02 C Shift Assignments>> C :: 175.936 CA :: 61.080 CB :: 35.926 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 :: 7.649 HA :: 3.633 HB2 :: 2.477 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 :: 113.900 Ave N Shift Values>> N :: 120.69(4.18) Q35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 R 0.3 K 0.29 M 0.03 Q 0.01 C Shift Assignments>> C :: 175.057 CA :: 55.576 CB :: 25.719 CG :: 31.187 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 :: 8.040 HA :: 4.101 HB2 :: 2.158 HG2 :: 2.446 HG3 :: 2.330 HE21 :: 7.533 HE22 :: 6.887 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 :: 118.904 NE2 :: 112.879 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) V36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.58 V 0.33 I 0.07 HN Overlap>> A230 C Shift Assignments>> C :: 175.451 CA :: 63.266 CB :: 28.204 CG1 :: 20.036 CG2 :: 18.987 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 :: 7.579 HA :: 3.538 HB :: 1.972 HG1 :: 1.014 HG2 :: 0.401 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 :: 116.949 Ave N Shift Values>> N :: 121.02(4.96) W37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.17 L 0.16 Q 0.14 K 0.12 C 0.11 H 0.11 W 0.07 E 0.06 I 0.02 M 0.01 C Shift Assignments>> C :: 177.917 CA :: 55.625 CB :: 27.639 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 :: 6.641 HA :: 4.688 HB2 :: 3.059 HB3 :: 2.961 HE1 :: 10.027 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 :: 116.762 NE1 :: 128.128 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) S38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.046 CA :: 58.680 CB :: 60.893 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.963 HA :: 4.199 HB2 :: 4.258 HB3 :: 4.073 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 :: 117.922 Ave N Shift Values>> N :: 116.3(3.95) N39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 C 0.34 M 0.09 E 0.06 Y 0.04 K 0.02 F 0.01 D 0.01 Q 0.01 C Shift Assignments>> C :: 174.066 CA :: 52.229 CB :: 36.206 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 :: 8.012 HA :: 4.557 HB2 :: 2.905 HB3 :: 2.802 HD21 :: 7.524 HD22 :: 6.917 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 :: 114.792 ND2 :: 111.562 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) V40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 I 0.21 A 0.08 C Shift Assignments>> C :: 171.526 CA :: 57.522 CB :: 29.799 CG1 :: 18.555 CG2 :: 15.979 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 :: 7.025 HA :: 4.684 HB :: 2.576 HG1 :: 0.807 HG2 :: 1.051 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 :: 105.538 Ave N Shift Values>> N :: 121.02(4.96) T41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.57 C 0.34 A 0.08 C Shift Assignments>> C :: 169.788 CA :: 57.105 CB :: 69.444 CG2 :: 21.848 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 :: 7.459 HA :: 5.168 HB :: 3.983 HG2 :: 1.379 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 :: 109.982 Ave N Shift Values>> N :: 115.7(5.05) P42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 K 0.3 V 0.1 R 0.09 L 0.01 M 0.01 P 0.01 C Shift Assignments>> C :: 172.744 CA :: 60.612 CB :: 29.517 CG :: 24.247 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>> HB2 :: 1.559 HG2 :: 1.505 HD2 :: 2.880 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) N Shift Assignments>> N :: 128.123 Ave N Shift Values>> N :: 127.4(10.05) L43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 A 0.23 I 0.09 L 0.07 M 0.02 C Shift Assignments>> C :: 173.450 CA :: 56.586 CG :: 26.192 CD1 :: 20.207 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 :: 7.204 HA :: 4.334 HB2 :: 2.013 HG :: 1.571 HD1 :: 0.594 HD2 :: 0.540 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 :: 111.126 Ave N Shift Values>> N :: 121.98(4.07) K44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 C 0.18 D 0.12 Y 0.04 F 0.03 L 0.01 HN Overlap>> D96 V214 C Shift Assignments>> C :: 173.352 CA :: 51.438 CB :: 38.300 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 :: 8.119 HA :: 4.335 HG2 :: 1.297 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 :: 122.655 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) F45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.45 D 0.2 C 0.15 Y 0.06 F 0.06 L 0.04 HN Overlap>> Y28 C Shift Assignments>> C :: 173.785 CA :: 52.812 CB :: 39.011 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 :: 8.109 HA :: 5.582 HB2 :: 2.402 HB3 :: 2.104 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 :: 119.696 Ave N Shift Values>> N :: 120.69(4.18) S46 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.93 C 0.03 P 0.02 HN Overlap>> T135 C Shift Assignments>> C :: 168.253(S) CA :: 53.971 CB :: 63.031 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.975 HA :: 4.522 HB2 :: 3.422 HB3 :: 3.314 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 :: 116.544 Ave N Shift Values>> N :: 116.3(3.95) K47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.62 A 0.17 K 0.09 R 0.06 M 0.02 L 0.02 C Shift Assignments>> C :: 173.735 CA :: 52.434 CB :: 30.468 CG :: 22.990 CD :: 27.337 CE :: 40.160 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 :: 8.057 HA :: 3.314 HB2 :: 1.355 HB3 :: 0.994 HG2 :: 0.799 HD2 :: 1.650 HE2 :: 2.939 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 :: 127.558 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) I48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.96 A 0.02 I 0.01 C Shift Assignments>> C :: 172.186 CA :: 56.182 CB :: 37.688 CG1 :: 23.295 CG2 :: 14.284 CD1 :: 9.750 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 :: 8.683 HA :: 4.504 HB :: 1.810 HG2 :: 0.653 HG12 :: 0.989 HG13 :: 0.815 HD1 :: 0.541 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 :: 123.812 Ave N Shift Values>> N :: 121.6(4.72) N49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.71 C 0.22 D 0.05 HN Overlap>> F338 C Shift Assignments>> C :: 172.268 CA :: 50.628 CB :: 37.074 CG :: 176.922 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 :: 8.727 HA :: 4.740 HB2 :: 2.778 HD21 :: 6.672 HD22 :: 7.584 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 :: 119.411 ND2 :: 109.786 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) T50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.49 C 0.3 S 0.1 T 0.1 C Shift Assignments>> C :: 169.819 CA :: 57.521 CB :: 68.127 CG2 :: 17.974 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 :: 7.384 HG2 :: 0.996 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 :: 111.621 Ave N Shift Values>> N :: 115.7(5.05) G51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.19 K 0.19 L 0.16 F 0.14 Y 0.09 C 0.08 I 0.05 N 0.03 R 0.03 C Shift Assignments>> C :: 170.557 CA :: 41.364 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.207 HA2 :: 4.306 HA3 :: 3.998 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.896 Ave N Shift Values>> N :: 109.91(4.29) M52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.3 K 0.23 R 0.14 M 0.12 Q 0.09 P 0.08 C Shift Assignments>> C :: 172.201 CA :: 52.309 CB :: 29.079 CG :: 32.012 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 :: 8.181 HA :: 4.360 HB2 :: 2.406 HG2 :: 1.829 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 :: 119.106 Ave N Shift Values>> N :: 120.1(3.88) A53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.95 A 0.03 HN Overlap>> D66 C Shift Assignments>> C :: 173.643 CA :: 46.873 CB :: 19.466 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.904 HA :: 4.422 HB :: 0.836 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.941 Ave N Shift Values>> N :: 123.23(3.7) D54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.23 C 0.21 Y 0.17 F 0.12 D 0.12 E 0.05 L 0.03 I 0.02 M 0.01 HN Overlap>> A29 Q344 C Shift Assignments>> C :: 174.181 CA :: 55.075 CB :: 38.363 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 :: 7.962 HA :: 4.421 HB2 :: 2.869 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 :: 121.373 Ave N Shift Values>> N :: 120.73(4.2) I55 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 HN Overlap>> A279 C Shift Assignments>> C :: 170.451 CA :: 58.738 CB :: 37.326 CG1 :: 23.524 CG2 :: 12.079(S) CD1 :: 11.616 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 :: 8.785 HA :: 4.072 HB :: 1.759 HG2 :: 0.824 HG12 :: 1.379 HG13 :: 1.233 HD1 :: 0.996 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 :: 124.320 Ave N Shift Values>> N :: 121.6(4.72) L56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.69 C 0.27 L 0.03 C Shift Assignments>> C :: 172.963 CA :: 50.569 CB :: 40.780 CG :: 24.390 CD1 :: 21.751 CD2 :: 21.216 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 :: 7.552 HA :: 4.965 HB2 :: 1.566 HB3 :: 1.328 HG :: 1.519 HD1 :: 0.785 HD2 :: 1.012 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 :: 129.919 Ave N Shift Values>> N :: 121.98(4.07) V57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 I 0.19 A 0.01 V 0.01 C Shift Assignments>> C :: 172.353 CA :: 59.008 CB :: 29.830 CG1 :: 18.025 CG2 :: 17.393 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 :: 8.712 HA :: 5.070 HB :: 2.064 HG1 :: 0.605 HG2 :: 0.852 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 :: 125.516 Ave N Shift Values>> N :: 121.02(4.96) V58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.9 A 0.04 V 0.03 I 0.01 C Shift Assignments>> C :: 171.925 CA :: 58.098 CB :: 34.171 CG1 :: 18.293 CG2 :: 17.999 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 :: 8.713 HA :: 4.856 HB :: 1.601 HG1 :: 0.626 HG2 :: 0.791 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 :: 126.808 Ave N Shift Values>> N :: 121.02(4.96) F59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 C 0.21 Y 0.11 D 0.11 F 0.08 E 0.04 L 0.02 M 0.01 I 0.01 C Shift Assignments>> C :: 173.396 CA :: 54.085 CB :: 38.106 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 :: 8.296 HA :: 5.275 HB2 :: 2.981 HB3 :: 2.857 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 :: 125.471 Ave N Shift Values>> N :: 120.69(4.18) A60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.58 G 0.34 C 0.03 M 0.02 HN Overlap>> V206 C Shift Assignments>> C :: 172.015 CA :: 48.363 CB :: 20.011 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.049 HA :: 4.754 HB :: 0.816 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.759 Ave N Shift Values>> N :: 123.23(3.7) R61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.68 C 0.16 R 0.08 K 0.04 C Shift Assignments>> C :: 173.160 CA :: 51.021 CB :: 31.059 CG :: 25.953 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 :: 8.738 HA :: 5.156 HB2 :: 1.545 HG2 :: 1.294 HD2 :: 3.165 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 :: 118.113 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) G62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.33 L 0.27 G 0.15 C 0.09 D 0.04 F 0.03 K 0.02 Y 0.02 C Shift Assignments>> C :: 173.050 CA :: 43.728 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.407 HA2 :: 3.851 HA3 :: 3.657 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.004 Ave N Shift Values>> N :: 109.91(4.29) A63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.53 M 0.43 C 0.02 C Shift Assignments>> C :: 174.207 CA :: 50.239 CB :: 15.032 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.118 HA :: 4.239 HB :: 1.370 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 134.082 Ave N Shift Values>> N :: 123.23(3.7) H64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.15 L 0.1 N 0.08 M 0.08 A 0.07 H 0.07 C 0.06 Q 0.06 R 0.05 K 0.05 W 0.04 E 0.03 Y 0.03 F 0.03 S 0.01 C Shift Assignments>> C :: 173.480 CA :: 54.639 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 :: 7.794 HA :: 4.702 HB2 :: 4.095 HB3 :: 3.377 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 :: 124.847 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) G65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.31 L 0.29 K 0.1 C 0.07 D 0.07 F 0.05 Y 0.03 G 0.03 I 0.01 HN Overlap>> C178 C Shift Assignments>> C :: 172.207 CA :: 42.867 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.675 HA2 :: 3.713 HA3 :: 3.991 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.634 Ave N Shift Values>> N :: 109.91(4.29) D66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.12 F 0.11 Y 0.1 C 0.09 W 0.09 E 0.06 I 0.06 R 0.05 K 0.04 V 0.04 T 0.04 H 0.03 Q 0.03 M 0.03 L 0.01 HN Overlap>> A53 C Shift Assignments>> C :: 170.985 CA :: 59.227 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 :: 7.949 HA :: 4.946 HB2 :: 2.786 HB3 :: 2.936 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 :: 126.858 Ave N Shift Values>> N :: 120.73(4.2) D67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 C 0.24 Y 0.06 D 0.05 E 0.05 M 0.03 F 0.03 C Shift Assignments>> C :: 172.107 CA :: 52.652 CB :: 37.206 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 :: 7.980 HA :: 4.321 HB2 :: 2.952 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 :: 120.204 Ave N Shift Values>> N :: 120.73(4.2) H68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.62 C 0.1 L 0.08 R 0.04 H 0.04 Q 0.02 K 0.02 W 0.02 C Shift Assignments>> C :: 169.937 CA :: 51.106 CB :: 27.631 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 :: 7.446 HA :: 4.524 HB2 :: 2.020 HB3 :: 2.471 HD2 :: 6.444 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 :: 119.701 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) A69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 M 0.41 C 0.02 C Shift Assignments>> C :: 177.582 CA :: 50.835 CB :: 15.391 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.940 HA :: 4.511 HB :: 1.189 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.252 Ave N Shift Values>> N :: 123.23(3.7) F70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 E 0.16 N 0.15 M 0.13 Y 0.06 K 0.06 Q 0.03 F 0.02 C Shift Assignments>> C :: 173.477 CA :: 54.140 CB :: 36.000 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 :: 7.920 HA :: 4.829 HB2 :: 4.168 HB3 :: 3.105 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 :: 120.039 Ave N Shift Values>> N :: 120.69(4.18) D71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.56 D 0.17 C 0.16 Y 0.03 F 0.03 L 0.02 C Shift Assignments>> C :: 174.565 CA :: 50.975 CB :: 38.918 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 :: 8.218 HA :: 4.825 HB2 :: 3.009 HB3 :: 2.476 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 :: 116.247 Ave N Shift Values>> N :: 120.73(4.2) G72 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 F 0.17 Y 0.12 L 0.11 K 0.1 C 0.08 I 0.07 N 0.05 R 0.01 C Shift Assignments>> C :: 170.435 CA :: 40.898 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.792 HA2 :: 4.328 HA3 :: 4.169 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.150 Ave N Shift Values>> N :: 109.91(4.29) K73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.72 A 0.14 L 0.11 R 0.01 C Shift Assignments>> C :: 175.036 CA :: 55.642 CB :: 29.280 CG :: 21.871 CD :: 26.270 CE :: 39.307 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 :: 3.469 HB2 :: 1.502 HG2 :: 1.468 HG3 :: 1.194 HD2 :: 1.522 HE2 :: 2.444 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 :: 124.041 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) G74 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 D 0.18 Y 0.17 I 0.11 N 0.1 C 0.09 L 0.05 K 0.02 C Shift Assignments>> C :: 171.413 CA :: 40.107(S) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 10.689 HA2 :: 4.111 HA3 :: 3.382 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 121.103 Ave N Shift Values>> N :: 109.91(4.29) G75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.35 L 0.27 G 0.12 C 0.08 D 0.04 F 0.03 K 0.03 Y 0.02 C Shift Assignments>> C :: 171.758 CA :: 43.631 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.417 HA2 :: 3.920 HA3 :: 3.305 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.629 Ave N Shift Values>> N :: 109.91(4.29) I76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 I 0.13 C Shift Assignments>> C :: 174.175 CA :: 59.727 CB :: 35.314 CG1 :: 25.325 CG2 :: 15.732 CD1 :: 9.716 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 :: 10.567 HA :: 3.823 HB :: 2.011 HG2 :: 1.164 HG12 :: 1.628 HG13 :: 1.295 HD1 :: 0.903 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 :: 129.153 Ave N Shift Values>> N :: 121.6(4.72) L77 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.8 C 0.18 C Shift Assignments>> C :: 173.288 CA :: 52.773 CB :: 41.185 CG :: 23.227 CD1 :: 21.201 CD2 :: 18.824 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 :: 8.452 HA :: 4.374 HB2 :: 1.317 HG :: 1.599 HD1 :: -0.036 HD2 :: 0.181 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 :: 127.756 Ave N Shift Values>> N :: 121.98(4.07) A78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.71 G 0.2 C 0.03 M 0.03 C Shift Assignments>> C :: 173.574 CA :: 48.606 CB :: 19.999 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.398 HA :: 4.778 HB :: 1.003 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 114.363 Ave N Shift Values>> N :: 123.23(3.7) H79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.53 C 0.13 L 0.07 H 0.06 R 0.05 Q 0.04 K 0.03 W 0.03 M 0.01 E 0.01 C Shift Assignments>> C :: 168.551 CA :: 51.160 CB :: 28.092 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 :: 9.104 HA :: 4.757 HB2 :: 3.219 HB3 :: 3.023 HD2 :: 6.472 HE1 :: 8.032 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 :: 113.788 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) A80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 A 0.12 M 0.01 C Shift Assignments>> C :: 177.150 CA :: 47.825 CB :: 16.133 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.589 HA :: 4.134 HB :: 1.156 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.807 Ave N Shift Values>> N :: 123.23(3.7) F81 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> N 0.36 C 0.18 D 0.16 Y 0.11 F 0.08 L 0.03 E 0.02 C Shift Assignments>> C :: 172.848 CA :: 53.974 CB :: 38.590 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 :: 11.910(M) 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 :: 131.380 Ave N Shift Values>> N :: 120.69(4.18) G82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.24 L 0.19 D 0.16 F 0.11 C 0.07 Y 0.07 R 0.05 I 0.04 N 0.02 C Shift Assignments>> C :: 168.147 CA :: 41.621 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.163 HA2 :: 4.340 HA3 :: 4.215 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.239 Ave N Shift Values>> N :: 109.91(4.29) P83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 G 0.2 C Shift Assignments>> C :: 171.928 CA :: 61.327 CB :: 28.900 CG :: 24.248 CD :: 47.677 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 :: 4.258 HB2 :: 2.123 HB3 :: 1.711 HG2 :: 1.861 HD2 :: 3.673 HD3 :: 3.490 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) N Shift Assignments>> N :: 133.221 Ave N Shift Values>> N :: 127.4(10.05) G84 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> D 0.2 K 0.17 L 0.15 F 0.14 Y 0.09 C 0.08 I 0.05 N 0.04 R 0.02 C Shift Assignments>> C :: 168.950 CA :: 41.277 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 5.621(S) HA2 :: 4.040 HA3 :: 3.534 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.878 Ave N Shift Values>> N :: 109.91(4.29) S85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 C Shift Assignments>> C :: 173.297 CA :: 55.943 CB :: 61.644 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.293 HA :: 4.349 HB2 :: 4.006 HB3 :: 3.835 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 :: 114.470 Ave N Shift Values>> N :: 116.3(3.95) G86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.34 L 0.23 R 0.22 C 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 172.254 CA :: 44.259 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.902 HA2 :: 3.894 HA3 :: 3.627 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 112.395 Ave N Shift Values>> N :: 109.91(4.29) I87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 I 0.05 C Shift Assignments>> C :: 171.613 CA :: 59.100 CB :: 35.347 CG1 :: 25.333 CG2 :: 13.428 CD1 :: 11.492 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 :: 8.938 HA :: 4.130 HB :: 1.370 HG2 :: 0.359 HG12 :: 0.875 HG13 :: 0.429 HD1 :: 0.324 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 :: 134.118 Ave N Shift Values>> N :: 121.6(4.72) G88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.3 L 0.26 G 0.2 C 0.09 D 0.03 F 0.03 Y 0.02 K 0.02 C Shift Assignments>> C :: 171.663 CA :: 43.885 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.576 HA2 :: 3.665 HA3 :: 2.959 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.059 Ave N Shift Values>> N :: 109.91(4.29) G89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.32 L 0.27 G 0.16 C 0.09 D 0.03 F 0.03 K 0.02 Y 0.02 C Shift Assignments>> C :: 169.466 CA :: 43.776 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.783 HA2 :: 4.071 HA3 :: 3.665 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 119.477 Ave N Shift Values>> N :: 109.91(4.29) D90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.32 C 0.28 E 0.11 Y 0.08 M 0.06 F 0.04 D 0.03 K 0.02 C Shift Assignments>> C :: 170.711 CA :: 53.741 CB :: 36.867 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 :: 8.265 HA :: 4.085 HB2 :: 2.888 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 :: 122.517 Ave N Shift Values>> N :: 120.73(4.2) A91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.48 A 0.47 M 0.02 C 0.01 HN Overlap>> K332 C Shift Assignments>> C :: 171.694 CA :: 48.137 CB :: 18.087 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.581 HA :: 4.600 HB :: 0.905 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.865 Ave N Shift Values>> N :: 123.23(3.7) H92 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.5 G 0.34 C 0.11 H 0.01 M 0.01 C Shift Assignments>> C :: 169.965 CA :: 48.022(S) CB :: 31.092 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 :: 9.018 HA :: 5.695 HB2 :: 3.048 HB3 :: 2.356 HD2 :: 6.899 HE1 :: 9.175 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 :: 121.186 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) F93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.35 C 0.19 D 0.14 Y 0.12 F 0.09 E 0.03 L 0.03 M 0.01 I 0.01 HN Overlap>> F291 C Shift Assignments>> C :: 170.893 CA :: 54.121 CB :: 38.434 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 :: 8.971 HA :: 4.186 HB2 :: 2.053 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 :: 122.387 Ave N Shift Values>> N :: 120.69(4.18) D94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.12 M 0.1 H 0.09 Q 0.08 C 0.07 K 0.07 D 0.07 R 0.07 W 0.05 E 0.05 Y 0.04 F 0.04 N 0.03 A 0.02 S 0.02 C Shift Assignments>> C :: 173.832 CA :: 55.648 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 :: 7.912 HA :: 4.086 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 :: 120.718 Ave N Shift Values>> N :: 120.73(4.2) E95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.22 I 0.17 R 0.17 P 0.15 C 0.07 K 0.07 Q 0.05 H 0.02 W 0.02 E 0.01 C Shift Assignments>> C :: 173.234 CB :: 26.431 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 :: 8.007 HA :: 4.784 HB2 :: 1.986 HB3 :: 1.850 HG2 :: 2.208 HG3 :: 2.097 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 :: 120.958 Ave N Shift Values>> N :: 120.68(3.68) D96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.59 C 0.22 D 0.07 Y 0.03 F 0.02 M 0.01 E 0.01 HN Overlap>> K44 V214 K247 C Shift Assignments>> C :: 176.687 CA :: 51.205 CB :: 37.657 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 :: 8.161 HA :: 4.149 HB2 :: 2.702 HB3 :: 2.588 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 :: 122.597 Ave N Shift Values>> N :: 120.73(4.2) E97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 Q 0.46 E 0.04 C Shift Assignments>> C :: 173.785 CA :: 53.325 CB :: 28.562 CG :: 32.661 CD :: 180.485 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 :: 9.391 HA :: 4.349 HB2 :: 1.678 HG2 :: 2.505 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 :: 130.480 Ave N Shift Values>> N :: 120.68(3.68) F98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.3 N 0.23 E 0.15 M 0.1 Y 0.07 K 0.03 F 0.03 D 0.01 Q 0.01 C Shift Assignments>> C :: 174.583 CA :: 53.991 CB :: 36.429 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 :: 8.983 HA :: 4.688 HB2 :: 2.451 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 :: 119.210 Ave N Shift Values>> N :: 120.69(4.18) W99 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.4 A 0.22 C 0.2 M 0.09 K 0.05 C Shift Assignments>> C :: 172.106 CA :: 50.853 CB :: 23.024(M) 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 :: 7.319 HA :: 4.309 HB2 :: 2.477 HB3 :: 1.777(S) HE1 :: 10.109 HE3 :: 7.123 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 :: 116.741 NE1 :: 126.897 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) T100 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.7 M 0.27 C 0.01 C Shift Assignments>> C :: 172.185 CA :: 52.624(S) CG2 :: 17.802 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 :: 8.338 HA :: 4.807 HB :: 4.432 HG2 :: 0.939 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 :: 126.210 Ave N Shift Values>> N :: 115.7(5.05) T101 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent C Shift Assignments>> C :: 171.412 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 :: 7.908 HA :: 4.544 HB :: 4.262 HG2 :: 0.434 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 :: 122.666 Ave N Shift Values>> N :: 115.7(5.05) H102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.6 C 0.12 H 0.06 L 0.05 R 0.04 Q 0.03 K 0.03 W 0.02 C Shift Assignments>> C :: 173.225 CA :: 50.934 CB :: 28.205 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 :: 7.498 HA :: 4.712 HB2 :: 3.136 HB3 :: 2.697 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 :: 120.547 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) S103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.76 C 0.21 S 0.01 C Shift Assignments>> C :: 173.130 CA :: 52.091 CB :: 60.760 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 6.877 HA :: 4.026 HB2 :: 3.078 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 :: 115.418 Ave N Shift Values>> N :: 116.3(3.95) G104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.28 K 0.21 R 0.12 D 0.11 F 0.08 C 0.07 Y 0.05 I 0.02 N 0.01 C Shift Assignments>> C :: 170.841 CA :: 42.184 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.473 HA2 :: 4.005 HA3 :: 3.714 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 115.132 Ave N Shift Values>> N :: 109.91(4.29) G105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 L 0.27 C 0.07 K 0.06 D 0.05 G 0.04 F 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 170.977 CA :: 43.136 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.801 HA2 :: 3.914 HA3 :: 3.829 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.270 Ave N Shift Values>> N :: 109.91(4.29) T106 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.61 C 0.22 T 0.16 C Shift Assignments>> C :: 169.737 CA :: 59.841 CB :: 65.705 CG2 :: 21.791 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 :: 9.101 HA :: 3.581 HB :: 2.355(S) HG2 :: 0.203(S) 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 :: 124.763 Ave N Shift Values>> N :: 115.7(5.05) N107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.46 D 0.19 C 0.15 Y 0.06 F 0.05 L 0.03 C Shift Assignments>> C :: 173.528 CA :: 52.769 CB :: 38.909 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 :: 8.498 HA :: 4.715 HB2 :: 3.046 HB3 :: 3.006 HD21 :: 7.930 HD22 :: 6.255 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 :: 125.523 ND2 :: 111.286 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) L108 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.64 A 0.34 C Shift Assignments>> C :: 173.484 CA :: 55.908 CB :: 38.199 CG :: 25.050 CD1 :: 24.797 CD2 :: 19.105 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 :: 8.410 HA :: 4.315 HB2 :: 1.657 HB3 :: 1.403 HG :: 0.968 HD1 :: 0.650 HD2 :: -0.330(S) 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 :: 131.606 Ave N Shift Values>> N :: 121.98(4.07) F109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.18 K 0.1 M 0.1 Q 0.1 V 0.07 Y 0.04 I 0.03 W 0.02 F 0.01 R 0.01 H 0.01 HN Overlap>> F339 C Shift Assignments>> C :: 172.747 CA :: 58.876 CB :: 34.896 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 :: 9.128 HA :: 3.795 HB2 :: 3.315 HB3 :: 3.035 HD1 :: 6.555 HD2 :: 6.836 HE1 :: 7.171 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 :: 119.852 Ave N Shift Values>> N :: 120.69(4.18) L110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.58 A 0.39 L 0.01 HN Overlap>> S147 C Shift Assignments>> C :: 176.089 CA :: 55.112 CB :: 40.146 CG :: 23.361 CD1 :: 20.856 CD2 :: 22.983 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 :: 8.738 HA :: 3.035 HB2 :: 1.682 HB3 :: 1.448 HG :: 0.920 HD1 :: 0.421 HD2 :: 0.691 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 :: 117.948 Ave N Shift Values>> N :: 121.98(4.07) T111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.45 S 0.33 C 0.2 C Shift Assignments>> C :: 173.916 CA :: 63.870 CB :: 65.404 CG2 :: 19.492 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 :: 7.283 HA :: 4.021 HB :: 4.223 HG2 :: 1.254 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 :: 112.535 Ave N Shift Values>> N :: 115.7(5.05) A112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.76 A 0.19 C 0.01 I 0.01 C Shift Assignments>> C :: 175.911 CA :: 52.335 CB :: 14.414 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 9.132 HA :: 3.989 HB :: 0.953 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.596 Ave N Shift Values>> N :: 123.23(3.7) V113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.79 C 0.2 C Shift Assignments>> C :: 175.735 CA :: 65.574 CB :: 28.258 CG1 :: 21.065 CG2 :: 20.408 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 :: 8.248 HA :: 3.083 HB :: 1.602 HG1 :: 0.587 HG2 :: 0.012 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 :: 118.495 Ave N Shift Values>> N :: 121.02(4.96) H114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.24 R 0.21 K 0.13 C 0.12 Q 0.09 H 0.06 W 0.04 I 0.03 E 0.02 C Shift Assignments>> C :: 172.670 CA :: 56.080 CB :: 26.379 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 :: 6.874 HA :: 4.244 HB2 :: 3.788 HB3 :: 2.982 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 :: 117.899 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) A115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.66 A 0.3 C 0.01 C Shift Assignments>> C :: 176.179 CA :: 53.084 CB :: 15.398 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.639 HA :: 4.017 HB :: 1.060 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.337 Ave N Shift Values>> N :: 123.23(3.7) I116 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.86 I 0.12 C Shift Assignments>> C :: 174.612 CA :: 60.522 CB :: 34.496 CG1 :: 26.482 CG2 :: 16.179 CD1 :: 9.301 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 :: 8.806 HA :: 3.432 HB :: 1.284 HG2 :: 0.064 HG12 :: 0.943 HG13 :: 0.184 HD1 :: -0.609(S) 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 :: 115.625 Ave N Shift Values>> N :: 121.6(4.72) G117 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.79 L 0.08 C 0.08 R 0.02 C Shift Assignments>> C :: 174.779 CA :: 45.442 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.604 HA2 :: 3.768 HA3 :: 2.234(S) Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.980 Ave N Shift Values>> N :: 109.91(4.29) H118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 K 0.26 R 0.12 C 0.12 Q 0.04 H 0.03 M 0.02 W 0.01 I 0.01 C Shift Assignments>> C :: 178.098 CA :: 54.974 CB :: 25.289 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 :: 7.123 HA :: 4.677 HB2 :: 3.627 HB3 :: 2.353 HD2 :: 6.589 HE1 :: 8.373 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 :: 119.129 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) S119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.050 CA :: 60.246 CB :: 60.549 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.593 HA :: 4.165 HB2 :: 3.401 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 :: 122.583 Ave N Shift Values>> N :: 116.3(3.95) L120 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.8 C 0.19 C Shift Assignments>> C :: 175.220 CA :: 52.096 CB :: 39.402 CG :: 23.209 CD1 :: 22.000 CD2 :: 19.032 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 :: 7.639 HA :: 4.224 HB2 :: 1.264 HG :: 1.915 HD1 :: 0.206 HD2 :: 0.732 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 :: 113.750 Ave N Shift Values>> N :: 121.98(4.07) G121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.23 L 0.18 D 0.17 F 0.12 Y 0.08 C 0.07 R 0.04 I 0.04 N 0.02 C Shift Assignments>> C :: 171.493 CA :: 41.547 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.146 HA2 :: 4.063 HA3 :: 3.312 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.953 Ave N Shift Values>> N :: 109.91(4.29) L122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 C 0.25 C Shift Assignments>> C :: 174.906 CA :: 52.311 CB :: 39.562 CG :: 23.564 CD1 :: 22.163 CD2 :: 20.325 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 :: 8.289 HA :: 4.398 HB2 :: 1.402 HB3 :: 1.084 HG :: 1.250 HD1 :: 0.611 HD2 :: 0.584 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 :: 120.575 Ave N Shift Values>> N :: 121.98(4.07) G123 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 D 0.18 Y 0.17 I 0.11 N 0.1 C 0.09 L 0.05 K 0.02 C Shift Assignments>> C :: 170.905 CA :: 40.113(S) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.271 HA2 :: 4.316 HA3 :: 3.511 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.690 Ave N Shift Values>> N :: 109.91(4.29) H124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.31 C 0.17 R 0.14 P 0.09 H 0.07 Q 0.07 K 0.04 W 0.03 E 0.01 C Shift Assignments>> C :: 172.617 CA :: 52.444 CB :: 26.770 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 :: 8.353 HA :: 4.953 HB2 :: 2.951 HB3 :: 2.803 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 :: 115.595 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) S125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.84 S 0.09 C 0.06 HN Overlap>> F285 C Shift Assignments>> C :: 172.660 CA :: 52.441 CB :: 62.609 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 6.729 HA :: 4.709 HB2 :: 4.260 HB3 :: 3.362 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 :: 113.754 Ave N Shift Values>> N :: 116.3(3.95) S126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.97 C 0.02 C Shift Assignments>> C :: 170.638 CA :: 55.809 CB :: 61.315 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.764 HA :: 4.657 HB2 :: 4.093 HB3 :: 3.839 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 :: 120.056 Ave N Shift Values>> N :: 116.3(3.95) D127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.48 N 0.23 C 0.18 D 0.06 C Shift Assignments>> C :: 171.040 CA :: 48.143 CB :: 39.163 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 :: 8.848 HA :: 4.620 HB2 :: 2.911 HB3 :: 2.316 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 :: 126.571 Ave N Shift Values>> N :: 120.73(4.2) P128 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.88 G 0.1 C Shift Assignments>> C :: 175.042 CA :: 60.153 CB :: 29.100 CG :: 24.210 CD :: 47.953 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 :: 2.464(S) HB2 :: 1.713 HB3 :: 1.385 HG2 :: 1.609 HG3 :: 1.493 HD2 :: 3.932 HD3 :: 3.625 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) N Shift Assignments>> N :: 136.982 Ave N Shift Values>> N :: 127.4(10.05) K129 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.5 A 0.33 L 0.13 R 0.01 C Shift Assignments>> C :: 174.023 CA :: 53.460 CB :: 29.213 CG :: 21.943 CD :: 26.216 CE :: 39.711 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 :: 8.151 HA :: 4.002 HB2 :: 1.689 HG2 :: 1.384 HG3 :: 1.254 HD2 :: 2.465(S) HD3 :: 1.562 HE2 :: 2.882 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 :: 116.552 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) A130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.78 G 0.09 M 0.09 C 0.01 C Shift Assignments>> C :: 176.866 CA :: 48.997 CB :: 17.019 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.124 HA :: 4.459 HB :: 1.691 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.681 Ave N Shift Values>> N :: 123.23(3.7) V131 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.73 V 0.13 I 0.13 C Shift Assignments>> C :: 176.244 CA :: 61.992 CB :: 28.285 CG1 :: 20.531 CG2 :: 17.863 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 :: 11.387(M) HA :: 4.291 HB :: 2.381 HG1 :: 1.121 HG2 :: 0.934 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 :: 130.727 Ave N Shift Values>> N :: 121.02(4.96) M132 Overall: Anomalous Typing: Suspicious SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 P 0.26 C 0.21 K 0.09 R 0.03 A 0.02 C Shift Assignments>> C :: 174.389 CA :: 50.715 CB :: 24.407(M) 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 :: 7.541 HA :: 4.497 HB2 :: 2.565 HB3 :: 1.692 HE :: 0.364 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 :: 115.300 Ave N Shift Values>> N :: 120.1(3.88) F133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.38 C 0.23 Y 0.1 D 0.08 E 0.06 F 0.06 M 0.02 L 0.01 C Shift Assignments>> C :: 174.562 CA :: 53.846 CB :: 37.639 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 :: 7.992 HA :: 4.854 HB2 :: 3.537 HB3 :: 3.097 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 :: 128.151 Ave N Shift Values>> N :: 120.69(4.18) P134 Overall: Anomalous Typing: Suspicious SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.35 C 0.18 K 0.14 V 0.11 R 0.05 T 0.04 L 0.04 W 0.01 C Shift Assignments>> C :: 171.414 CA :: 60.989 CB :: 24.689(M) 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 :: 3.745 HB2 :: 1.924 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) N Shift Assignments>> N :: 139.453 Ave N Shift Values>> N :: 127.4(10.05) T135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.73 C 0.21 A 0.04 HN Overlap>> S46 D160 C Shift Assignments>> C :: 170.456 CA :: 59.162 CB :: 69.073 CG2 :: 19.149 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 :: 7.884 HA :: 4.538 HB :: 3.959 HG2 :: 1.130 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 :: 116.478 Ave N Shift Values>> N :: 115.7(5.05) Y136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.26 M 0.11 Y 0.09 K 0.06 N 0.04 F 0.03 Q 0.02 I 0.02 C Shift Assignments>> C :: 171.319 CA :: 56.066 CB :: 36.108 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 :: 8.973 HA :: 4.567 HB2 :: 2.640 HB3 :: 2.170 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 :: 127.452 Ave N Shift Values>> N :: 120.79(4.69) K137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 C 0.42 M 0.01 C Shift Assignments>> C :: 170.759 CA :: 52.617 CB :: 31.697 CG :: 21.203 CD :: 26.187 CE :: 39.436 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 :: 7.841 HA :: 3.900 HB2 :: 1.472 HB3 :: 1.545 HG2 :: 1.130 HD2 :: 1.491 HE2 :: 2.801 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 :: 129.709 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Y138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.25 M 0.09 K 0.08 Y 0.07 Q 0.05 I 0.05 V 0.03 F 0.02 W 0.01 HN Overlap>> L204 C Shift Assignments>> C :: 172.175 CA :: 58.346 CB :: 35.556 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 :: 8.500 HA :: 3.647 HB2 :: 2.923 HB3 :: 2.605 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 :: 123.949 Ave N Shift Values>> N :: 120.79(4.69) V139 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.76 A 0.2 I 0.02 C Shift Assignments>> C :: 169.317 CA :: 56.548 CB :: 32.316 CG1 :: 18.263 CG2 :: 16.492 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 :: 5.727(S) HA :: 3.789 HB :: 1.754 HG1 :: 0.729 HG2 :: 0.675 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 :: 124.190 Ave N Shift Values>> N :: 121.02(4.96) D140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.47 D 0.22 C 0.14 Y 0.05 F 0.04 L 0.04 C Shift Assignments>> C :: 176.195 CA :: 52.171 CB :: 39.220 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 :: 7.794 HA :: 4.139 HB2 :: 2.912 HB3 :: 2.627 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 :: 119.172 Ave N Shift Values>> N :: 120.73(4.2) I141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 I 0.15 C Shift Assignments>> C :: 174.349 CA :: 61.865 CB :: 34.827 CG1 :: 24.352 CG2 :: 14.761 CD1 :: 10.725 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 :: 7.777 HA :: 3.703 HB :: 1.768 HG2 :: 0.923 HG12 :: 1.051 HD1 :: 0.598 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 :: 124.692 Ave N Shift Values>> N :: 121.6(4.72) N142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.35 N 0.22 M 0.14 E 0.09 K 0.05 Q 0.03 Y 0.03 F 0.01 C Shift Assignments>> C :: 173.703 CA :: 52.678 CB :: 35.677 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 :: 8.452 HA :: 4.443 HB2 :: 2.819 HB3 :: 2.682 HD21 :: 6.956 HD22 :: 7.904 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 :: 118.248 ND2 :: 115.129 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) T143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.56 C 0.21 A 0.12 T 0.08 C Shift Assignments>> C :: 171.121 CA :: 58.367 CB :: 66.707 CG2 :: 18.570 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 :: 7.545 HA :: 4.281 HB :: 4.232 HG2 :: 0.999 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 :: 109.500 Ave N Shift Values>> N :: 115.7(5.05) F144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.27 Y 0.15 F 0.07 M 0.06 I 0.05 K 0.03 N 0.02 C Shift Assignments>> C :: 171.789 CA :: 57.134 CB :: 36.701 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 :: 7.162 HA :: 4.010 HB2 :: 2.962 HB3 :: 2.772 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 :: 123.197 Ave N Shift Values>> N :: 120.69(4.18) R145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 A 0.21 K 0.09 L 0.02 C Shift Assignments>> C :: 171.975 CA :: 51.352 CB :: 30.566 CG :: 22.997 CD :: 40.602 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 :: 7.112 HA :: 3.872 HB2 :: 1.542 HB3 :: 1.309 HG2 :: 1.360 HG3 :: 1.290 HD2 :: 3.032 HD3 :: 2.931 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 :: 126.185 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) L146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.61 L 0.13 K 0.12 R 0.06 A 0.04 C Shift Assignments>> C :: 174.323 CA :: 51.999 CB :: 40.376 CG :: 28.996 CD1 :: 28.215 CD2 :: 24.082 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 :: 8.071 HA :: 3.882 HB2 :: 1.368 HG :: 1.320 HD1 :: 1.166 HD2 :: 0.620 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 :: 121.116 Ave N Shift Values>> N :: 121.98(4.07) S147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 HN Overlap>> L110 C Shift Assignments>> C :: 172.270 CA :: 54.845 CB :: 63.168 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.822 HA :: 4.418 HB2 :: 4.099 HB3 :: 3.777 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 :: 117.994 Ave N Shift Values>> N :: 116.3(3.95) A148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.7 A 0.26 C 0.01 I 0.01 C Shift Assignments>> C :: 177.381 CA :: 52.787 CB :: 14.997 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.770 HA :: 3.957 HB :: 1.348 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.484 Ave N Shift Values>> N :: 123.23(3.7) D149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.21 L 0.18 K 0.14 F 0.12 C 0.12 Y 0.1 N 0.05 R 0.03 I 0.01 C Shift Assignments>> C :: 175.908 CA :: 55.509 CB :: 41.001 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 :: 8.180 HA :: 4.222 HB2 :: 2.719 HB3 :: 2.395 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 :: 117.544 Ave N Shift Values>> N :: 120.73(4.2) D150 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.21 L 0.21 K 0.17 C 0.1 F 0.08 Y 0.07 R 0.06 N 0.05 C Shift Assignments>> C :: 175.040 CA :: 54.950 CB :: 41.541 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 :: 7.384 HA :: 4.697 HB2 :: 2.976 HB3 :: 2.722 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 :: 118.753 Ave N Shift Values>> N :: 120.73(4.2) I151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.71 I 0.27 C Shift Assignments>> C :: 174.834 CA :: 63.079 CB :: 35.565 CG1 :: 28.010 CG2 :: 14.021 CD1 :: 10.325 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 :: 7.888 HA :: 3.539 HB :: 1.620 HG2 :: 0.759 HG12 :: 1.670 HG13 :: 0.796 HD1 :: 0.648 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 :: 118.900 Ave N Shift Values>> N :: 121.6(4.72) R152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.42 C 0.29 K 0.27 C Shift Assignments>> C :: 177.870 CA :: 56.494 CB :: 27.236 CG :: 24.380 CD :: 40.569 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 :: 8.484 HA :: 3.991 HB2 :: 1.850 HB3 :: 1.792 HG2 :: 1.650 HG3 :: 1.496 HD2 :: 3.124 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 :: 119.130 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) G153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.52 L 0.18 R 0.13 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 174.279 CA :: 44.637 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.269 HA2 :: 3.868 HA3 :: 3.705 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.900 Ave N Shift Values>> N :: 109.91(4.29) I154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 I 0.36 A 0.02 M 0.01 HN Overlap>> E229 C Shift Assignments>> C :: 175.368 CA :: 58.219 CB :: 35.774 CG1 :: 27.868 CG2 :: 17.760 CD1 :: 12.083 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 :: 8.587 HA :: 4.415 HB :: 2.053 HG2 :: 1.455 HG12 :: 1.471 HG13 :: 1.457 HD1 :: 0.757 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 :: 123.062 Ave N Shift Values>> N :: 121.6(4.72) Q155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 K 0.36 M 0.12 R 0.07 V 0.03 Q 0.01 C Shift Assignments>> C :: 177.321 CA :: 55.862 CB :: 23.892 CG :: 32.087 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 :: 8.652 HA :: 4.189 HB2 :: 2.097 HB3 :: 2.197 HG2 :: 2.961 HG3 :: 2.913 HE21 :: 8.256 HE22 :: 7.649 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 :: 123.400 NE2 :: 117.198 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) S156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.97 C 0.02 C Shift Assignments>> C :: 172.161 CA :: 58.902 CB :: 59.864 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.084 HA :: 4.169 HB2 :: 3.916 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 :: 117.418 Ave N Shift Values>> N :: 116.3(3.95) L157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.5 C 0.39 L 0.09 C Shift Assignments>> C :: 175.397 CA :: 53.831 CB :: 40.492 CG :: 24.413 CD1 :: 22.689 CD2 :: 21.097 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 :: 6.749 HA :: 4.036 HB2 :: 1.777 HB3 :: 1.726 HG :: 1.657 HD1 :: 0.629 HD2 :: 0.532 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 :: 118.102 Ave N Shift Values>> N :: 121.98(4.07) Y158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.25 C 0.23 F 0.2 D 0.07 I 0.06 N 0.06 E 0.06 L 0.03 M 0.01 C Shift Assignments>> CA :: 56.804 CB :: 38.603 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 :: 7.608 HA :: 4.004 HB2 :: 3.097 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 :: 112.416 Ave N Shift Values>> N :: 120.79(4.69) G159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.2 K 0.18 L 0.16 F 0.14 Y 0.09 C 0.08 I 0.05 N 0.03 R 0.02 C Shift Assignments>> CA :: 41.313 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.299 HA2 :: 4.208 HA3 :: 3.777 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.424 Ave N Shift Values>> N :: 109.91(4.29) D160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 G 0.35 N 0.21 P 0.02 M 0.01 HN Overlap>> T135 C Shift Assignments>> CA :: 48.436 CB :: 36.504 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 :: 7.879 HA :: 4.555 HB2 :: 2.615 HB3 :: 2.529 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 :: 116.396 Ave N Shift Values>> N :: 120.73(4.2) P161 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K162 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E163 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable N164 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable Q165 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable R166 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable L167 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable P168 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> C 0.68 G 0.3 C Shift Assignments>> CA :: 60.173 CB :: 29.196 CG :: 24.288 CD :: 46.964 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) N169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 G 0.35 N 0.13 P 0.08 M 0.02 C Shift Assignments>> CA :: 48.443 CB :: 35.859 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 :: 8.381 HA :: 4.775 HB2 :: 2.724 HB3 :: 2.560 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 :: 119.792 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) P170 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable D171 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable N172 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable S173 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable E174 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable P175 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.79 G 0.19 C Shift Assignments>> C :: 172.875 CA :: 59.919 CB :: 29.178 CG :: 23.746 CD :: 47.405 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 :: 4.202 HB2 :: 2.125 HB3 :: 1.673 HG2 :: 1.869 HG3 :: 1.501 HD2 :: 3.184 HD3 :: 2.838 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) A176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.72 M 0.15 G 0.08 C 0.02 C Shift Assignments>> C :: 174.935 CA :: 49.198 CB :: 16.161 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.294 HA :: 4.142 HB :: 1.220 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.286 Ave N Shift Values>> N :: 123.23(3.7) L177 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 A 0.44 C Shift Assignments>> C :: 173.363 CA :: 54.692 CB :: 39.853 CG :: 23.283 CD1 :: 21.472 CD2 :: 20.933 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 :: 7.717 HA :: 3.704 HB2 :: 1.311 HG :: 1.246 HD1 :: 0.233 HD2 :: 0.242 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 :: 122.165 Ave N Shift Values>> N :: 121.98(4.07) C178 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.7 C 0.18 M 0.03 G 0.02 HN Overlap>> G65 C Shift Assignments>> C :: 173.257 CA :: 49.101(M) CB :: 33.981 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.661 HA :: 5.058 HB2 :: 3.197 HB3 :: 2.453 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 :: 108.551 Ave N Shift Values>> N :: 119.95(4.79) D179 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.5 C 0.21 D 0.18 L 0.02 F 0.02 Y 0.02 G 0.01 C Shift Assignments>> C :: 173.619 CA :: 49.523 CB :: 39.448 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 :: 7.224 HA :: 4.466 HB2 :: 2.638 HB3 :: 2.596 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 :: 123.557 Ave N Shift Values>> N :: 120.73(4.2) P180 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.81 G 0.17 C Shift Assignments>> C :: 174.214 CA :: 61.409 CB :: 29.205 CG :: 23.654 CD :: 47.771 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 :: 4.019 HB2 :: 2.089 HB3 :: 1.784 HG2 :: 1.956 HG3 :: 1.554 HD2 :: 3.658 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) N Shift Assignments>> N :: 139.496 Ave N Shift Values>> N :: 127.4(10.05) N181 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 N 0.39 P 0.05 M 0.03 G 0.02 Y 0.01 D 0.01 C Shift Assignments>> C :: 171.978 CA :: 49.492 CB :: 36.417 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 :: 8.584 HA :: 4.741 HB2 :: 2.768 HB3 :: 2.471 HD21 :: 6.729 HD22 :: 6.301 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 :: 116.001 ND2 :: 108.751 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) L182 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.62 C 0.37 HN Overlap>> L220 C Shift Assignments>> C :: 171.404 CA :: 53.896 CB :: 39.858 CG :: 23.397 CD1 :: 20.668 CD2 :: 20.391 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 :: 6.967 HA :: 3.721 HB2 :: 1.323 HB3 :: 1.259 HG :: 0.467 HD1 :: 0.586 HD2 :: 0.584 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 :: 122.798 Ave N Shift Values>> N :: 121.98(4.07) S183 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.55 S 0.37 C 0.06 C Shift Assignments>> C :: 169.617 CA :: 52.913 CB :: 63.380 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.265 HA :: 4.162 HB2 :: 3.757 HB3 :: 3.344 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 :: 117.931 Ave N Shift Values>> N :: 116.3(3.95) F184 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 N 0.19 C 0.15 Y 0.13 F 0.12 L 0.09 K 0.02 I 0.01 C Shift Assignments>> C :: 173.489 CA :: 54.752 CB :: 39.732 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 :: 9.248 HA :: 4.977 HB2 :: 3.034 HB3 :: 2.055 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 :: 117.046 Ave N Shift Values>> N :: 120.69(4.18) D185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.5 N 0.26 C 0.21 HN Overlap>> W297 C Shift Assignments>> C :: 173.395 CA :: 53.210 CB :: 39.445 CG :: 178.747 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 :: 9.234 HA :: 4.949 HB3 :: 2.556 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 :: 121.592 Ave N Shift Values>> N :: 120.73(4.2) A186 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 M 0.07 C 0.02 HN Overlap>> I234 C Shift Assignments>> C :: 172.617 CA :: 49.805 CB :: 18.827 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.767 HA :: 4.995 HB :: 1.180 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.184 Ave N Shift Values>> N :: 123.23(3.7) V187 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.69 V 0.28 A 0.02 HN Overlap>> Q295 C Shift Assignments>> C :: 171.542 CA :: 58.604 CB :: 34.505 CG1 :: 20.005 CG2 :: 19.694 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 :: 8.627 HA :: 4.790 HB :: 1.393 HG1 :: -0.323(S) HG2 :: -0.026 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 :: 121.068 Ave N Shift Values>> N :: 121.02(4.96) T188 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.65 C 0.19 A 0.07 T 0.07 C Shift Assignments>> C :: 169.981 CA :: 58.690 CB :: 66.514 CG2 :: 18.518 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 :: 8.532 HA :: 4.838 HB :: 4.001 HG2 :: 0.811 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 :: 115.702 Ave N Shift Values>> N :: 115.7(5.05) T189 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.47 S 0.26 C 0.23 A 0.02 C Shift Assignments>> C :: 172.715 CA :: 59.097 CB :: 66.922 CG2 :: 20.601 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 :: 6.586 HA :: 4.675 HB :: 4.365 HG2 :: 1.241 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 :: 116.068 Ave N Shift Values>> N :: 115.7(5.05) V190 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 V 0.09 I 0.04 A 0.01 HN Overlap>> V240 C Shift Assignments>> C :: 175.128 CA :: 58.918 CB :: 30.440 CG1 :: 19.813 CG2 :: 17.684 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 :: 8.382 HA :: 4.084 HB :: 1.718 HG1 :: 0.282 HG2 :: 0.562 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 :: 122.863 Ave N Shift Values>> N :: 121.02(4.96) G191 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 :: 173.005 CA :: 44.966 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.994 HA2 :: 3.820 HA3 :: 3.789 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 120.094 Ave N Shift Values>> N :: 109.91(4.29) N192 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.72 N 0.27 C Shift Assignments>> C :: 171.410 CA :: 50.854 CB :: 34.708 CG :: 175.437 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 :: 8.711 HA :: 4.699 HB2 :: 3.095 HB3 :: 2.781 HD21 :: 7.629 HD22 :: 6.907 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 :: 126.467 ND2 :: 112.082 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) K193 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.52 A 0.45 M 0.02 C Shift Assignments>> C :: 173.484 CA :: 52.140 CB :: 32.965 CG :: 21.801 CD :: 25.914 CE :: 39.121 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 :: 7.908 HA :: 4.966 HB2 :: 1.952 HB3 :: 1.849 HG2 :: 1.543 HG3 :: 1.412 HD2 :: 1.282 HD3 :: 1.195 HE2 :: 2.882 HE3 :: 2.802 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 :: 119.903 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) I194 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.84 I 0.15 C Shift Assignments>> C :: 170.730 CA :: 59.721 CB :: 36.999 CG1 :: 23.546 CG2 :: 15.316 CD1 :: 10.335 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 :: 8.865 HA :: 3.937 HB :: 1.111 HG2 :: -0.943(S) HG12 :: 1.060 HG13 :: -0.005 HD1 :: -0.129 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 :: 120.417 Ave N Shift Values>> N :: 121.6(4.72) F195 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.43 C 0.17 D 0.16 Y 0.08 F 0.06 L 0.03 E 0.01 C Shift Assignments>> C :: 170.883 CA :: 53.307 CB :: 38.599 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 :: 8.607 HA :: 4.959 HB2 :: 2.721 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 :: 126.007 Ave N Shift Values>> N :: 120.69(4.18) F196 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 C 0.19 D 0.1 Y 0.06 F 0.04 E 0.02 M 0.01 L 0.01 C Shift Assignments>> C :: 172.533 CA :: 52.589 CB :: 37.905 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 :: 8.979 HA :: 4.984 HB2 :: 3.014 HB3 :: 2.557 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 :: 120.407 Ave N Shift Values>> N :: 120.69(4.18) F197 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.18 Y 0.18 F 0.1 N 0.1 M 0.04 I 0.03 D 0.03 K 0.01 C Shift Assignments>> C :: 173.707 CA :: 56.075 CB :: 37.357 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 :: 9.121 HA :: 5.255 HB2 :: 3.803 HB3 :: 3.026 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 :: 120.533 Ave N Shift Values>> N :: 120.69(4.18) K198 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.74 A 0.21 M 0.01 K 0.01 C Shift Assignments>> C :: 171.286 CA :: 54.444 CB :: 33.574 CG :: 22.028 CD :: 25.794 CE :: 39.707 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 :: 9.265 HA :: 4.530 HB2 :: 2.204 HB3 :: 2.183 HG2 :: 1.437 HG3 :: 1.221 HD2 :: 1.860 HD3 :: 1.640 HE2 :: 2.961 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 :: 123.624 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) D199 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.33 C 0.24 Y 0.11 E 0.09 F 0.07 D 0.06 M 0.03 L 0.01 I 0.01 K 0.01 HN Overlap>> D245 C Shift Assignments>> C :: 173.916 CA :: 54.171 CB :: 37.488 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 :: 10.086 HA :: 4.154 HB2 :: 3.124 HB3 :: 2.971 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 :: 129.271 Ave N Shift Values>> N :: 120.73(4.2) R200 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.3 K 0.13 A 0.06 C Shift Assignments>> C :: 172.350 CA :: 53.858 CB :: 27.664 CG :: 23.028 CD :: 40.376 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 :: 7.673 HA :: 4.481 HB2 :: 1.494 HB3 :: 1.352 HG2 :: 1.188 HG3 :: 0.851 HD2 :: 3.127 HD3 :: 2.973 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 :: 121.356 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) F201 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 C 0.14 F 0.13 N 0.13 Y 0.13 L 0.13 K 0.05 I 0.01 C Shift Assignments>> C :: 172.106 CA :: 55.070 CB :: 40.176 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 :: 8.788 HA :: 5.274 HB2 :: 2.800 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 :: 121.979 Ave N Shift Values>> N :: 120.69(4.18) F202 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.32 D 0.26 C 0.14 Y 0.08 F 0.08 L 0.07 C Shift Assignments>> C :: 170.798 CA :: 53.551 CB :: 39.563 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 :: 8.796 HA :: 5.787 HB2 :: 2.366 HB3 :: 2.240 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 :: 112.668 Ave N Shift Values>> N :: 120.69(4.18) W203 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.17 Q 0.15 K 0.14 C 0.13 W 0.1 R 0.1 E 0.08 M 0.04 L 0.03 C Shift Assignments>> C :: 172.394 CA :: 54.362 CB :: 29.119 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 :: 9.699 HA :: 5.116 HB2 :: 2.991 HE1 :: 9.901 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 :: 124.263 NE1 :: 128.514 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) L204 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.7 G 0.14 C 0.14 L 0.01 HN Overlap>> Y138 C Shift Assignments>> C :: 172.221 CA :: 50.640 CB :: 42.685 CG :: 24.035 CD1 :: 21.984 CD2 :: 20.582 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 :: 8.551 HA :: 5.004 HB2 :: 1.549 HB3 :: 0.747 HG :: 0.933 HD1 :: 0.452 HD2 :: 0.002 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 :: 124.003 Ave N Shift Values>> N :: 121.98(4.07) K205 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.49 A 0.48 M 0.01 C Shift Assignments>> C :: 172.170 CA :: 51.259 CB :: 32.688 CG :: 21.837 CD :: 25.754 CE :: 39.436 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 :: 8.987 HA :: 4.941 HB2 :: 1.913 HB3 :: 1.658 HG2 :: 1.486 HG3 :: 1.347 HD2 :: 1.848 HD3 :: 1.542 HE2 :: 3.226 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 :: 128.877 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) V206 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.85 V 0.06 I 0.05 A 0.02 HN Overlap>> A60 C Shift Assignments>> C :: 173.479 CA :: 58.742 CB :: 30.279 CG1 :: 18.831 CG2 :: 18.158 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 :: 9.087 HA :: 4.296 HB :: 1.980 HG1 :: 0.874 HG2 :: 0.861 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 :: 125.670 Ave N Shift Values>> N :: 121.02(4.96) S207 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> I264 C Shift Assignments>> C :: 172.484 CA :: 58.340 CB :: 60.558 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.559 HA :: 4.054 HB2 :: 3.855 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 :: 121.413 Ave N Shift Values>> N :: 116.3(3.95) E208 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.35 K 0.35 Q 0.13 R 0.09 M 0.04 E 0.01 C Shift Assignments>> C :: 172.990 CA :: 55.141 CB :: 25.599 CG :: 33.618 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 :: 8.663 HA :: 4.007 HB2 :: 2.124 HB3 :: 2.030 HG2 :: 2.184 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 :: 117.000 Ave N Shift Values>> N :: 120.68(3.68) R209 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.41 C 0.41 K 0.12 A 0.03 C Shift Assignments>> C :: 173.082 CA :: 50.372 CB :: 28.213 CG :: 24.127 CD :: 40.284 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 :: 7.693 HA :: 4.780 HB2 :: 1.921 HB3 :: 1.694 HG2 :: 1.532 HD2 :: 3.072 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 :: 119.239 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) P210 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.75 G 0.23 C Shift Assignments>> C :: 174.366 CA :: 61.616 CB :: 29.040 CG :: 23.740 CD :: 47.592 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 :: 4.254 HB2 :: 2.127 HB3 :: 1.921 HG2 :: 1.900 HG3 :: 1.776 HD2 :: 3.687 HD3 :: 3.648 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) N Shift Assignments>> N :: 134.865 Ave N Shift Values>> N :: 127.4(10.05) K211 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.63 A 0.32 M 0.02 C Shift Assignments>> C :: 173.703 CA :: 53.866 CB :: 30.736 CG :: 21.868 CD :: 25.845 CE :: 39.184 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 :: 7.605 HA :: 4.314 HB2 :: 1.659 HG2 :: 1.263 HG3 :: 1.212 HD2 :: 1.544 HE2 :: 2.878 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 :: 118.653 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) T212 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.62 C 0.22 S 0.13 A 0.01 HN Overlap>> E229 C Shift Assignments>> C :: 170.788 CA :: 60.076 CB :: 67.708 CG2 :: 18.922 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 :: 8.383 HA :: 4.613 HB :: 3.603 HG2 :: 0.683 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 :: 123.085 Ave N Shift Values>> N :: 115.7(5.05) S213 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.76 P 0.16 C 0.07 HN Overlap>> K359 C Shift Assignments>> C :: 169.471 CA :: 53.437 CB :: 62.939 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.123 HA :: 4.596 HB2 :: 3.625 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 :: 119.452 Ave N Shift Values>> N :: 116.3(3.95) V214 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.76 I 0.17 A 0.05 HN Overlap>> K44 D96 C Shift Assignments>> C :: 171.359 CA :: 57.746 CB :: 30.442 CG1 :: 17.677 CG2 :: 16.478 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 :: 8.203 HA :: 4.141 HB :: 1.289 HG1 :: -0.247(S) HG2 :: 0.180 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 :: 122.646 Ave N Shift Values>> N :: 121.02(4.96) N215 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.23 C 0.23 G 0.22 D 0.2 L 0.04 F 0.01 Y 0.01 HN Overlap>> R255 C Shift Assignments>> C :: 170.572 CA :: 48.610 CB :: 40.800 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 :: 7.977 HA :: 4.573 HD21 :: 5.870 HD22 :: 6.652 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 :: 123.640 ND2 :: 113.980 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) L216 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 C 0.24 C Shift Assignments>> C :: 176.944 CA :: 51.614 CB :: 38.801 CG :: 24.122 CD1 :: 22.092 CD2 :: 20.337 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 :: 8.746 HA :: 4.423 HB2 :: 1.471 HB3 :: 1.389 HG :: 1.492 HD1 :: 0.690 HD2 :: 0.373 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 :: 120.622 Ave N Shift Values>> N :: 121.98(4.07) I217 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.64 C 0.35 C Shift Assignments>> C :: 175.127 CA :: 64.135 CB :: 36.074 CG1 :: 28.676 CG2 :: 14.451 CD1 :: 11.671 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 :: 8.961 HA :: 3.754 HB :: 1.634 HG2 :: 0.945 HG12 :: 1.685 HG13 :: 1.124 HD1 :: 1.179 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 :: 127.860 Ave N Shift Values>> N :: 121.6(4.72) S218 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.96 C 0.03 C Shift Assignments>> C :: 172.011 CA :: 57.410 CB :: 60.144 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.611 HA :: 3.700 HB2 :: 3.851 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 :: 112.595 Ave N Shift Values>> N :: 116.3(3.95) S219 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 C Shift Assignments>> C :: 171.018 CA :: 57.952 CB :: 60.565 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.439 HA :: 4.074 HB2 :: 3.740 HB3 :: 3.825 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 :: 116.711 Ave N Shift Values>> N :: 116.3(3.95) L220 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.74 C 0.25 HN Overlap>> L182 C Shift Assignments>> C :: 173.269 CA :: 53.055 CB :: 41.149 CG :: 23.040 CD1 :: 21.659 CD2 :: 20.295 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 :: 6.957 HA :: 4.190 HB2 :: 0.717 HB3 :: 0.542 HG :: -0.136(S) HD1 :: -0.353(S) HD2 :: 0.309 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 :: 122.841 Ave N Shift Values>> N :: 121.98(4.07) W221 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.76 C 0.07 L 0.07 R 0.02 K 0.01 H 0.01 C Shift Assignments>> C :: 172.968 CA :: 50.640 CB :: 26.202 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 :: 7.893 HA :: 5.265 HB2 :: 2.906 HB3 :: 2.707 HE1 :: 9.374 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 :: 116.950 NE1 :: 126.200 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) P222 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.71 G 0.27 C Shift Assignments>> C :: 175.169 CA :: 62.145 CB :: 29.393 CG :: 24.092 CD :: 47.567 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 :: 4.255 HB2 :: 2.405 HB3 :: 1.852 HG2 :: 1.978 HG3 :: 1.871 HD2 :: 3.194 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) N Shift Assignments>> N :: 134.800 Ave N Shift Values>> N :: 127.4(10.05) T223 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.75 C 0.15 T 0.05 A 0.03 C Shift Assignments>> C :: 171.833 CA :: 59.079 CB :: 66.202 CG2 :: 18.553 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 :: 8.308 HA :: 4.228 HB :: 4.410 HG2 :: 1.061 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 :: 107.640 Ave N Shift Values>> N :: 115.7(5.05) L224 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.74 C 0.24 C Shift Assignments>> C :: 174.580 CA :: 49.911 CB :: 37.382 CG :: 25.588 CD1 :: 21.771 CD2 :: 20.045 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 :: 7.165 HA :: 3.719 HB2 :: 1.364 HB3 :: 0.909 HG :: 0.484 HD1 :: -0.146(S) HD2 :: -0.324(S) 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 :: 125.874 Ave N Shift Values>> N :: 121.98(4.07) P225 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 K 0.37 R 0.06 L 0.06 V 0.05 M 0.02 C Shift Assignments>> C :: 171.365 CA :: 59.445 CB :: 29.032 CG :: 23.902 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 :: 4.322 HB2 :: 1.942 HB3 :: 1.823 HG2 :: 1.567 HG3 :: 1.196 HD2 :: 2.657 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) N Shift Assignments>> N :: 139.637 Ave N Shift Values>> N :: 127.4(10.05) S226 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.9 C 0.09 C Shift Assignments>> C :: 171.895 CA :: 54.450 CB :: 61.504 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.325 HA :: 4.264 HB2 :: 3.615 HB3 :: 3.577 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 :: 107.852 Ave N Shift Values>> N :: 116.3(3.95) G227 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.74 L 0.1 C 0.08 R 0.04 C Shift Assignments>> C :: 172.349 CA :: 45.198 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.627 HA2 :: 3.896 HA3 :: 3.593 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.364 Ave N Shift Values>> N :: 109.91(4.29) I228 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 A 0.01 C Shift Assignments>> C :: 172.145 CA :: 57.655 CB :: 34.533 CG1 :: 23.889 CG2 :: 15.331 CD1 :: 7.671 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 :: 8.107 HA :: 3.522 HB :: 1.345 HG2 :: 0.381 HG12 :: 0.999 HG13 :: 0.817 HD1 :: 0.115 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 :: 122.190 Ave N Shift Values>> N :: 121.6(4.72) E229 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 E 0.26 K 0.17 Q 0.16 M 0.07 I 0.01 HN Overlap>> I154 T212 C Shift Assignments>> C :: 173.746 CA :: 55.008 CB :: 29.493 CG :: 35.334 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 :: 8.475 HA :: 4.246 HB2 :: 2.568 HB3 :: 1.880 HG2 :: 2.644 HG3 :: 2.395 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 :: 123.049 Ave N Shift Values>> N :: 120.68(3.68) A230 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.05 G 0.04 C 0.02 HN Overlap>> V36 C Shift Assignments>> C :: 172.781 CA :: 49.134 CB :: 19.085 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.607 HA :: 5.097 HB :: 1.014 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 117.055 Ave N Shift Values>> N :: 123.23(3.7) A231 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.77 G 0.11 C 0.05 M 0.04 L 0.01 C Shift Assignments>> C :: 171.613 CA :: 48.910 CB :: 20.503 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.780 HA :: 5.828(S) HB :: 1.045 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.657 Ave N Shift Values>> N :: 123.23(3.7) Y232 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.31 C 0.27 E 0.11 Y 0.09 M 0.05 F 0.05 D 0.04 K 0.01 C Shift Assignments>> C :: 168.464(M) CA :: 54.013 CB :: 37.027 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 :: 9.259 HA :: 5.114 HB2 :: 2.597 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 :: 119.420 Ave N Shift Values>> N :: 120.79(4.69) E233 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 P 0.19 M 0.19 K 0.11 Q 0.08 R 0.04 C Shift Assignments>> C :: 171.919 CA :: 50.908 CB :: 30.061 CG :: 32.377 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 :: 8.990 HA :: 5.367 HB2 :: 2.215 HG2 :: 2.251 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 :: 118.285 Ave N Shift Values>> N :: 120.68(3.68) I234 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 I 0.01 HN Overlap>> A186 C Shift Assignments>> C :: 174.591 CA :: 58.597 CB :: 36.092 CG1 :: 22.860 CG2 :: 13.779 CD1 :: 10.012 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 :: 7.857 HA :: 3.793 HB :: 1.534 HG2 :: 0.278 HD1 :: 0.447 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 :: 118.181 Ave N Shift Values>> N :: 121.6(4.72) E235 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 K 0.32 R 0.15 Q 0.11 M 0.03 V 0.01 C Shift Assignments>> C :: 177.941 CA :: 57.519 CB :: 25.732 CG :: 32.988 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 :: 9.329 HA :: 4.102 HB2 :: 2.043 HG2 :: 2.353 HG3 :: 2.170 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 :: 132.211 Ave N Shift Values>> N :: 120.68(3.68) A236 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.61 M 0.36 C 0.01 C Shift Assignments>> C :: 175.728 CA :: 51.660 CB :: 16.142 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.761 HA :: 4.060 HB :: 1.413 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.851 Ave N Shift Values>> N :: 123.23(3.7) R237 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.42 C 0.28 K 0.27 A 0.01 R 0.01 C Shift Assignments>> C :: 172.305 CA :: 52.130 CB :: 28.242 CG :: 24.484 CD :: 40.622 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 :: 7.016 HA :: 4.261 HB2 :: 1.949 HB3 :: 1.489 HG2 :: 1.517 HG3 :: 1.371 HD2 :: 3.065 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 :: 112.349 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) N238 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 P 0.25 M 0.14 Q 0.06 N 0.06 K 0.05 E 0.02 H 0.01 W 0.01 HN Overlap>> D27 C Shift Assignments>> C :: 171.318 CA :: 51.228 CB :: 34.526 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 :: 8.243 HA :: 4.252 HB2 :: 2.975 HB3 :: 2.686 HD21 :: 7.463 HD22 :: 6.670 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 :: 118.350 ND2 :: 112.066 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Q239 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.21 P 0.18 H 0.16 R 0.08 Q 0.08 W 0.08 K 0.06 M 0.06 E 0.03 L 0.01 C Shift Assignments>> C :: 173.147 CA :: 51.654 CB :: 29.666 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 :: 7.057 HA :: 4.882 HB2 :: 1.622 HB3 :: 1.511 HG2 :: 2.945 HE21 :: 7.173 HE22 :: 6.367 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 :: 113.976 NE2 :: 107.332 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) V240 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.76 V 0.2 A 0.02 HN Overlap>> V190 C Shift Assignments>> C :: 169.069 CA :: 58.380 CB :: 32.814 CG1 :: 21.089 CG2 :: 18.026 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 :: 8.464 HA :: 4.332 HB :: 1.275 HG1 :: 0.679 HG2 :: 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 :: 122.931 Ave N Shift Values>> N :: 121.02(4.96) F241 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.33 D 0.27 C 0.13 L 0.07 Y 0.07 F 0.07 K 0.01 C Shift Assignments>> C :: 170.802 CA :: 53.302 CB :: 39.678 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 :: 9.084 HA :: 4.901 HB2 :: 2.047 HB3 :: 1.918 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 :: 125.473 Ave N Shift Values>> N :: 120.69(4.18) L242 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 C 0.21 G 0.02 C Shift Assignments>> C :: 173.845 CA :: 50.365 CB :: 41.587 CG :: 23.253 CD1 :: 21.194 CD2 :: 20.926 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 :: 8.148 HA :: 5.060 HB2 :: 1.314 HB3 :: 1.069 HD1 :: 0.296 HD2 :: 0.310 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 :: 119.233 Ave N Shift Values>> N :: 121.98(4.07) F243 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.22 C 0.16 Y 0.15 N 0.15 F 0.15 L 0.09 K 0.02 I 0.01 HN Overlap>> Y28 R31 K359 C Shift Assignments>> C :: 172.435 CA :: 55.237 CB :: 39.692 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 :: 8.193 HA :: 5.136 HB2 :: 2.752 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 :: 119.583 Ave N Shift Values>> N :: 120.69(4.18) K244 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 A 0.08 M 0.03 K 0.03 C Shift Assignments>> C :: 173.135 CA :: 55.647 CB :: 33.266 CG :: 22.355 CD :: 27.009 CE :: 39.287 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 :: 8.853 HA :: 4.389 HB2 :: 1.564 HG2 :: 1.435 HD2 :: 1.710 HE2 :: 2.976 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 :: 120.302 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) D245 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.3 C 0.28 E 0.12 Y 0.09 M 0.06 F 0.04 D 0.03 K 0.02 HN Overlap>> D199 C Shift Assignments>> C :: 171.402 CA :: 53.914 CB :: 36.894 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 :: 10.129 HA :: 4.274 HB2 :: 3.064 HB3 :: 2.949 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 :: 129.223 Ave N Shift Values>> N :: 120.73(4.2) D246 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 N 0.24 P 0.16 M 0.07 E 0.01 K 0.01 Y 0.01 Q 0.01 HN Overlap>> T357 C Shift Assignments>> C :: 173.231 CA :: 50.303 CB :: 35.650 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 :: 8.343 HA :: 4.298 HB2 :: 2.909 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 :: 118.702 Ave N Shift Values>> N :: 120.73(4.2) K247 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.53 C 0.45 HN Overlap>> D96 C Shift Assignments>> C :: 170.995 CA :: 51.505 CB :: 34.222 CG :: 21.541 CD :: 25.605 CE :: 39.489 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 :: 8.135 HA :: 5.073 HB2 :: 1.756 HG2 :: 1.260 HG3 :: 1.126 HD2 :: 1.181 HE2 :: 3.059 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 :: 122.516 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Y248 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> N 0.4 D 0.25 C 0.13 Y 0.06 F 0.06 L 0.05 C Shift Assignments>> C :: 169.517 CA :: 52.826 CB :: 39.432 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 :: 8.351 HA :: 5.096 HB2 :: 1.170(S) HB3 :: 0.908(S) 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 :: 114.058 Ave N Shift Values>> N :: 120.79(4.69) W249 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.19 C 0.15 R 0.14 H 0.13 Q 0.12 K 0.1 W 0.06 E 0.03 M 0.01 C Shift Assignments>> C :: 173.221 CA :: 53.201 CB :: 27.813 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 :: 8.982 HA :: 4.186 HB2 :: 1.701(S) HE1 :: 10.020 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 :: 120.228 NE1 :: 127.895 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) L250 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.83 C 0.15 C Shift Assignments>> C :: 170.869 CA :: 50.155 CB :: 40.594 CG :: 23.962 CD1 :: 22.702 CD2 :: 19.157 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 :: 8.190 HA :: 4.091 HB2 :: 1.671 HB3 :: 1.483 HG :: 0.603 HD1 :: 0.460 HD2 :: -0.206(S) 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 :: 124.719 Ave N Shift Values>> N :: 121.98(4.07) I251 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.98 A 0.01 HN Overlap>> F281 C Shift Assignments>> C :: 172.152 CA :: 55.842 CB :: 34.628 CG1 :: 23.653 CG2 :: 14.104 CD1 :: 7.499 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 :: 8.919 HA :: 3.831 HB :: 1.307 HG2 :: 0.138 HG12 :: 0.196 HD1 :: -0.652(S) 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 :: 129.185 Ave N Shift Values>> N :: 121.6(4.72) S252 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.38 P 0.31 C 0.29 C Shift Assignments>> C :: 172.663 CA :: 53.188 CB :: 61.426 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.311 HA :: 5.093 HB2 :: 3.620 HB3 :: 3.435 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 :: 122.409 Ave N Shift Values>> N :: 116.3(3.95) N253 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 M 0.2 Q 0.09 N 0.09 K 0.08 E 0.05 P 0.02 H 0.02 Y 0.01 W 0.01 R 0.01 HN Overlap>> L358 C Shift Assignments>> C :: 171.660 CA :: 52.319 CB :: 34.842 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 :: 8.949 HA :: 4.172 HB2 :: 2.937 HB3 :: 2.554 HD21 :: 7.479 HD22 :: 6.777 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 :: 127.151 ND2 :: 113.219 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) L254 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Anomalous PRTL>> C 0.5 A 0.48 C Shift Assignments>> C :: 173.476 CA :: 54.594 CB :: 37.635 CG :: 25.088 CD1 :: 21.815 CD2 :: 20.276 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 :: 9.196 HA :: 3.437 HB2 :: 1.998 HB3 :: 1.737 HG :: 1.511 HD1 :: 0.786 HD2 :: 0.760 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 :: 108.343(M) Ave N Shift Values>> N :: 121.98(4.07) R255 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.55 L 0.2 K 0.16 A 0.06 HN Overlap>> A33 N215 C Shift Assignments>> C :: 172.400 CA :: 50.171 CB :: 29.139 CG :: 23.859 CD :: 40.461 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 :: 7.933 HA :: 5.027 HB2 :: 1.812 HB3 :: 1.704 HG2 :: 1.641 HG3 :: 1.500 HD2 :: 3.166 HD3 :: 3.129 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 :: 123.592 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) P256 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.93 G 0.05 P 0.01 C Shift Assignments>> C :: 174.003 CA :: 60.525 CB :: 28.579 CG :: 24.679 CD :: 48.503 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 :: 4.180 HB2 :: 1.793 HB3 :: 1.719 HG2 :: 2.060 HG3 :: 1.280 HD2 :: 3.826 HD3 :: 3.659 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) N Shift Assignments>> N :: 135.314 Ave N Shift Values>> N :: 127.4(10.05) E257 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 P 0.27 Q 0.15 K 0.12 R 0.1 M 0.01 C Shift Assignments>> C :: 172.235 CA :: 52.125 CB :: 27.074 CG :: 33.260 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 :: 7.985 HA :: 4.486 HB2 :: 2.134 HB3 :: 1.589 HG2 :: 2.044 HG3 :: 1.927 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 :: 126.471 Ave N Shift Values>> N :: 120.68(3.68) P258 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.82 G 0.17 C Shift Assignments>> C :: 174.006 CA :: 60.603 CB :: 29.507 CG :: 24.158 CD :: 47.616 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 :: 4.269 HB2 :: 2.125 HB3 :: 1.825 HG2 :: 1.891 HG3 :: 1.528 HD2 :: 3.171 HD3 :: 2.850 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) N Shift Assignments>> N :: 133.356 Ave N Shift Values>> N :: 127.4(10.05) N259 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 P 0.21 M 0.18 Q 0.09 K 0.08 H 0.04 R 0.02 W 0.02 N 0.01 E 0.01 C Shift Assignments>> C :: 169.864 CA :: 51.741 CB :: 33.601 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 :: 8.744 HA :: 4.128 HB2 :: 2.723 HB3 :: 2.572 HD21 :: 7.281 HD22 :: 6.800 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 :: 112.463 ND2 :: 113.451 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Y260 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 E 0.17 M 0.14 N 0.13 K 0.06 Y 0.06 Q 0.03 F 0.02 C Shift Assignments>> C :: 171.325 CA :: 54.303 CB :: 35.913 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 :: 7.157 HA :: 3.606 HB2 :: 2.723 HB3 :: 2.555 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 :: 116.089 Ave N Shift Values>> N :: 120.79(4.69) P261 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 G 0.04 C Shift Assignments>> C :: 172.919 CA :: 58.349 CB :: 32.409 CD :: 48.203 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 :: 4.010 HG2 :: 1.036 HD2 :: 2.799 HD3 :: 2.720 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) N Shift Assignments>> N :: 137.686 Ave N Shift Values>> N :: 127.4(10.05) K262 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 C 0.41 C Shift Assignments>> C :: 171.643 CA :: 51.701 CB :: 33.870 CG :: 21.266 CD :: 25.412 CE :: 39.321 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 :: 7.696 HA :: 4.302 HB2 :: 1.396 HG2 :: 1.251 HD2 :: 1.295 HD3 :: 1.175 HE2 :: 2.783 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 :: 119.355 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) S263 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.92 C 0.07 C Shift Assignments>> C :: 176.515 CA :: 54.945 CB :: 61.198 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.171 HA :: 4.212 HB2 :: 3.977 HB3 :: 3.701 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 :: 111.671 Ave N Shift Values>> N :: 116.3(3.95) I264 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 I 0.04 HN Overlap>> S207 C Shift Assignments>> C :: 174.354 CA :: 62.372 CB :: 37.870 CG1 :: 20.686 CG2 :: 15.244 CD1 :: 9.873 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 :: 8.537 HA :: 4.170 HB :: 1.632 HG2 :: 0.877 HG12 :: 0.654 HG13 :: 0.211 HD1 :: -0.063 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 :: 121.503 Ave N Shift Values>> N :: 121.6(4.72) H265 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.19 K 0.18 C 0.15 I 0.15 L 0.11 Q 0.06 W 0.05 H 0.03 E 0.02 C Shift Assignments>> C :: 174.781 CA :: 58.633 CB :: 25.947 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 :: 8.241 HA :: 4.047 HB2 :: 3.236 HB3 :: 2.873 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 :: 121.082 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) S266 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.933 CA :: 58.664 CB :: 60.447 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.928 HA :: 4.087 HB2 :: 3.813 HB3 :: 3.756 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 :: 118.037 Ave N Shift Values>> N :: 116.3(3.95) F267 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.25 Y 0.17 F 0.08 I 0.08 M 0.05 K 0.02 N 0.01 HN Overlap>> R284 C Shift Assignments>> C :: 172.602 CA :: 57.874 CB :: 36.782 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 :: 7.495 HA :: 3.666 HB2 :: 2.240 HB3 :: 1.834 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 :: 117.625 Ave N Shift Values>> N :: 120.69(4.18) G268 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.19 K 0.19 L 0.17 F 0.13 Y 0.09 C 0.08 I 0.05 N 0.03 R 0.03 C Shift Assignments>> C :: 172.299 CA :: 41.374 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.470 HA2 :: 4.158 HA3 :: 3.484 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 100.114 Ave N Shift Values>> N :: 109.91(4.29) F269 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.31 E 0.17 M 0.14 N 0.13 K 0.06 Y 0.06 Q 0.03 F 0.02 C Shift Assignments>> C :: 173.645 CA :: 54.244 CB :: 35.906 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 :: 5.839(S) HA :: 3.524 HB2 :: 2.286 HB3 :: 1.805 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 :: 115.334 Ave N Shift Values>> N :: 120.69(4.18) P270 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable N271 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable F272 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.25 M 0.21 Q 0.16 K 0.13 E 0.1 N 0.02 H 0.02 W 0.02 Y 0.02 R 0.01 C Shift Assignments>> C :: 172.921 CA :: 54.517 CB :: 34.654 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 :: 6.783 HA :: 4.433 HB2 :: 3.382 HB3 :: 2.870 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 :: 111.214 Ave N Shift Values>> N :: 120.69(4.18) V273 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.77 I 0.18 V 0.04 C Shift Assignments>> C :: 171.930 CA :: 61.114 CB :: 28.142 CG1 :: 17.898 CG2 :: 19.855 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 :: 7.164 HA :: 3.583 HB :: 1.452 HG1 :: -0.157(S) HG2 :: 0.136 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 :: 124.925 Ave N Shift Values>> N :: 121.02(4.96) K274 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.58 C 0.38 M 0.01 HN Overlap>> L350 C Shift Assignments>> C :: 171.675 CA :: 51.978 CB :: 30.905 CG :: 21.260 CD :: 25.566 CE :: 39.436 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 :: 8.411 HA :: 4.294 HB2 :: 1.864 HB3 :: 1.512 HG2 :: 1.358 HD3 :: 1.545 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 :: 125.344 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) K275 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.72 C 0.26 M 0.01 HN Overlap>> Y335 S362 C Shift Assignments>> C :: 170.036(M) CA :: 52.088 CB :: 31.007 CG :: 20.032(S) CD :: 26.524 CE :: 39.291 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 :: 7.132 HA :: 4.394 HB2 :: 1.882 HG2 :: 1.127 HG3 :: 1.059 HD2 :: 1.572 HE2 :: 2.909 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 :: 114.392 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) I276 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.92 A 0.07 C Shift Assignments>> C :: 172.037 CA :: 55.657 CB :: 34.910 CG1 :: 23.746 CG2 :: 15.235 CD1 :: 7.668 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 :: 9.756 HA :: 3.916 HB :: 1.373 HG2 :: 0.188 HG12 :: 0.607 HD1 :: -0.785(S) 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 :: 120.678 Ave N Shift Values>> N :: 121.6(4.72) D277 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.44 C 0.17 D 0.16 Y 0.08 F 0.06 L 0.03 E 0.01 C Shift Assignments>> C :: 173.052 CA :: 53.234 CB :: 38.574 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 :: 8.398 HA :: 4.892 HB2 :: 2.773 HB3 :: 3.318 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 :: 121.434 Ave N Shift Values>> N :: 120.73(4.2) A278 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.89 M 0.06 C 0.02 G 0.01 C Shift Assignments>> C :: 172.094 CA :: 49.450 CB :: 19.190 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.878 HA :: 5.323 HB :: 1.343 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.301 Ave N Shift Values>> N :: 123.23(3.7) A279 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.55 G 0.31 C 0.06 M 0.03 L 0.01 HN Overlap>> I55 C Shift Assignments>> C :: 171.104 CA :: 48.540 CB :: 21.024 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.858 HA :: 5.500 HB :: 0.842 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.277 Ave N Shift Values>> N :: 123.23(3.7) V280 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.87 I 0.09 A 0.02 C Shift Assignments>> C :: 167.743(M) CA :: 58.416 CB :: 30.657 CG1 :: 20.637 CG2 :: 15.252(S) 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 :: 7.990 HA :: 4.534 HB :: 2.247 HG1 :: 1.030 HG2 :: 0.369 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 :: 113.074 Ave N Shift Values>> N :: 121.02(4.96) F281 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.47 C 0.2 D 0.1 Y 0.08 F 0.05 E 0.03 M 0.01 L 0.01 HN Overlap>> I251 C Shift Assignments>> C :: 171.378 CA :: 53.144 CB :: 37.896 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 :: 8.972 HA :: 5.088 HB2 :: 3.322 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 :: 129.217 Ave N Shift Values>> N :: 120.69(4.18) N282 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.99 HN Overlap>> I314 C Shift Assignments>> C :: 172.300 CA :: 45.509(S) CB :: 37.038 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 :: 8.728 HA :: 4.454 HB2 :: 2.831 HB3 :: 2.356 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 :: 126.167 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) P283 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.87 G 0.11 C Shift Assignments>> C :: 174.455 CA :: 60.864 CB :: 29.521 CG :: 23.837 CD :: 47.950 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 :: 3.579 HB2 :: 2.283 HB3 :: 1.930 HG2 :: 1.897 HG3 :: 1.754 HD2 :: 3.060 HD3 :: 2.311(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) N Shift Assignments>> N :: 135.344 Ave N Shift Values>> N :: 127.4(10.05) R284 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.53 C 0.31 K 0.14 HN Overlap>> F267 Y310 K312 C Shift Assignments>> C :: 174.937 CA :: 55.427 CB :: 26.225 CG :: 24.127 CD :: 40.684 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 :: 7.559 HA :: 3.905 HB2 :: 1.402 HB3 :: 1.319 HG2 :: 1.244 HD2 :: 3.130 HD3 :: 2.936 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 :: 117.712 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) F285 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 C 0.26 Y 0.04 D 0.04 M 0.03 E 0.03 F 0.02 HN Overlap>> S125 C Shift Assignments>> C :: 172.191 CA :: 51.909 CB :: 37.042 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 :: 6.649 HA :: 4.832 HB2 :: 3.310 HB3 :: 2.281 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 :: 113.789 Ave N Shift Values>> N :: 120.69(4.18) Y286 Overall: Suspicious Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.23 Q 0.16 M 0.14 K 0.14 E 0.14 V 0.04 W 0.03 Y 0.02 H 0.02 R 0.02 I 0.01 C Shift Assignments>> C :: 171.926 CA :: 57.595 CB :: 34.519 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 :: 8.301 HA :: 3.638 HB2 :: 3.682 HB3 :: 2.734 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 :: 123.626 Ave N Shift Values>> N :: 120.79(4.69) SRO Rule Breaks>> (HA > HB2 : 0.9923) R287 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.74 K 0.2 A 0.03 C Shift Assignments>> C :: 170.756 CA :: 50.037 CB :: 32.947 CG :: 24.278 CD :: 40.514 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 :: 6.666 HA :: 5.184 HB2 :: 1.284 HB3 :: 1.131 HG2 :: 1.083 HD2 :: 3.155 HD3 :: 2.556 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 :: 113.573 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) T288 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> S 0.75 C 0.13 A 0.08 T 0.02 C Shift Assignments>> C :: 169.889 CA :: 58.345 CB :: 66.011 CG2 :: 18.541 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 :: 9.045 HA :: 4.689 HB :: 3.222 HG2 :: -1.186(M) 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 :: 121.676 Ave N Shift Values>> N :: 115.7(5.05) Y289 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 C 0.26 E 0.1 Y 0.09 F 0.05 M 0.05 D 0.04 K 0.01 HN Overlap>> R23 C Shift Assignments>> C :: 170.623 CA :: 53.860 CB :: 37.112 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 :: 8.801 HA :: 4.676 HB2 :: 2.540 HB3 :: 2.015 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 :: 125.949 Ave N Shift Values>> N :: 120.79(4.69) F290 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.32 N 0.21 L 0.13 C 0.12 F 0.07 Y 0.06 K 0.05 C Shift Assignments>> C :: 171.753 CA :: 53.457 CB :: 40.498 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 :: 8.345 HA :: 4.850 HB2 :: 3.020 HB3 :: 2.557 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 :: 118.958 Ave N Shift Values>> N :: 120.69(4.18) F291 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 E 0.19 N 0.15 Y 0.13 F 0.07 M 0.06 D 0.03 K 0.02 I 0.02 HN Overlap>> F93 C Shift Assignments>> C :: 172.133 CA :: 55.320 CB :: 37.006 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 :: 8.871 HA :: 4.947 HB2 :: 3.137 HB3 :: 2.739 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 :: 122.434 Ave N Shift Values>> N :: 120.69(4.18) V292 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.89 V 0.05 I 0.04 C Shift Assignments>> C :: 172.445 CA :: 59.627 CB :: 32.587 CG1 :: 17.535 CG2 :: 18.530 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 :: 9.532 HA :: 4.068 HB :: 2.429 HG1 :: 0.702 HG2 :: 1.010 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 :: 124.488 Ave N Shift Values>> N :: 121.02(4.96) D293 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 N 0.26 E 0.14 Y 0.1 M 0.07 F 0.05 D 0.03 K 0.02 I 0.01 C Shift Assignments>> C :: 171.015 CA :: 54.248 CB :: 36.870 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 :: 9.504 HA :: 4.087 HB2 :: 2.953 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 :: 131.264 Ave N Shift Values>> N :: 120.73(4.2) N294 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 N 0.24 P 0.14 M 0.09 E 0.02 K 0.02 Q 0.01 Y 0.01 C Shift Assignments>> C :: 173.511 CA :: 50.660 CB :: 35.569 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 :: 8.169 HA :: 5.456 HB2 :: 3.131 HB3 :: 2.777 HD21 :: 7.351 HD22 :: 6.858 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 :: 117.670 ND2 :: 110.481 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Q295 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.9 M 0.03 K 0.03 E 0.02 HN Overlap>> V187 C Shift Assignments>> C :: 170.540 CA :: 52.156 CB :: 32.329 CG :: 39.225(S) 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 :: 8.615 HA :: 5.574 HB2 :: 1.944 HB3 :: 1.858 HG2 :: 2.962 HE21 :: 8.246 HE22 :: 6.734 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 :: 121.123 NE2 :: 109.479 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) Y296 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.31 D 0.26 C 0.14 Y 0.09 F 0.08 L 0.07 K 0.01 C Shift Assignments>> C :: 169.462 CA :: 53.697 CB :: 39.567 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 :: 8.937 HA :: 5.566 HB2 :: 2.672 HB3 :: 2.205 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 :: 114.095 Ave N Shift Values>> N :: 120.79(4.69) W297 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.19 C 0.16 K 0.16 R 0.1 H 0.1 W 0.08 Q 0.08 E 0.06 V 0.01 HN Overlap>> D185 C Shift Assignments>> C :: 173.659 CA :: 55.596 CB :: 32.375 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 :: 9.249 HA :: 4.234 HB2 :: 3.574 HB3 :: 2.839 HE1 :: 10.312 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 :: 121.497 NE1 :: 128.083 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) R298 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable Y299 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 L 0.16 C 0.12 F 0.12 Y 0.11 K 0.09 N 0.09 R 0.01 I 0.01 C Shift Assignments>> C :: 171.115 CA :: 55.129 CB :: 40.636 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 :: 9.516 HA :: 4.486 HB2 :: 2.606 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 :: 129.296 Ave N Shift Values>> N :: 120.79(4.69) D300 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.6 C 0.23 D 0.07 Y 0.03 F 0.02 M 0.01 C Shift Assignments>> C :: 173.891 CA :: 50.635 CB :: 37.782 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 :: 8.161 HA :: 4.469 HB2 :: 2.932 HB3 :: 2.608 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 :: 126.932 Ave N Shift Values>> N :: 120.73(4.2) E301 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.42 C 0.34 K 0.17 Q 0.02 M 0.02 C Shift Assignments>> C :: 176.212 CA :: 55.050 CB :: 26.968 CG :: 31.069 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 :: 7.369 HA :: 4.393 HB2 :: 1.980 HG2 :: 2.217 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 :: 123.517 Ave N Shift Values>> N :: 120.68(3.68) R302 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.45 C 0.32 K 0.21 C Shift Assignments>> C :: 175.313 CA :: 56.287 CB :: 26.884 CG :: 25.044 CD :: 40.360 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 :: 8.829 HA :: 4.179 HB2 :: 1.861 HB3 :: 1.770 HG2 :: 1.562 HG3 :: 1.315 HD2 :: 2.911 HD3 :: 2.798 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 :: 119.531 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) R303 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.36 C 0.31 K 0.29 R 0.01 C Shift Assignments>> C :: 172.531 CA :: 53.439 CB :: 28.415 CG :: 25.324 CD :: 40.333 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 :: 7.286 HA :: 4.003 HB2 :: 1.857 HB3 :: 1.147 HG2 :: 1.586 HG3 :: 1.378 HD2 :: 3.061 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 :: 116.581 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) Q304 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 M 0.24 K 0.17 A 0.07 V 0.02 R 0.02 C Shift Assignments>> C :: 171.228 CA :: 54.052 CB :: 22.816 CG :: 31.793 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 :: 7.804 HA :: 3.357 HB2 :: 2.114 HB3 :: 1.895 HG2 :: 2.097 HE21 :: 7.763 HE22 :: 6.714 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 :: 115.372 NE2 :: 113.965 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) M305 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.36 C 0.3 Q 0.14 K 0.11 R 0.03 E 0.02 C Shift Assignments>> C :: 171.577 CA :: 51.451 CB :: 34.187 CG :: 27.892 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 :: 6.723 HA :: 4.532 HB2 :: 1.848 HB3 :: 1.576 HG2 :: 2.221 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 :: 113.435 Ave N Shift Values>> N :: 120.1(3.88) M306 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 K 0.34 L 0.16 R 0.07 A 0.02 C Shift Assignments>> C :: 174.358 CA :: 52.636 CB :: 29.266 CG :: 24.072(S) 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 :: 8.849 HA :: 4.489 HB2 :: 2.138 HB3 :: 2.013 HG2 :: 1.580 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 :: 122.215 Ave N Shift Values>> N :: 120.1(3.88) D307 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.6 C 0.22 D 0.07 Y 0.03 F 0.02 M 0.01 E 0.01 C Shift Assignments>> CA :: 51.112 CB :: 37.691 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 :: 8.482 HA :: 4.882 HB2 :: 2.883 HB3 :: 2.379 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 :: 125.927 Ave N Shift Values>> N :: 120.73(4.2) P308 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.88 G 0.1 C Shift Assignments>> C :: 174.874 CA :: 59.934 CB :: 29.182 CG :: 24.052 CD :: 47.884 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 :: 4.510 HB2 :: 2.200 HB3 :: 1.819 HG2 :: 1.952 HG3 :: 1.541 HD2 :: 3.625 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) G309 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.31 R 0.21 K 0.14 D 0.09 C 0.07 F 0.06 Y 0.04 I 0.01 G 0.01 C Shift Assignments>> C :: 170.169 CA :: 42.570 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.509 HA2 :: 3.698 HA3 :: 3.386 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.310 Ave N Shift Values>> N :: 109.91(4.29) Y310 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 E 0.17 M 0.14 N 0.13 K 0.06 Y 0.06 Q 0.04 F 0.02 HN Overlap>> R284 C Shift Assignments>> C :: 170.719 CA :: 54.230 CB :: 35.879 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 :: 7.605 HA :: 3.723 HB2 :: 2.221 HB3 :: 1.919 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 :: 117.792 Ave N Shift Values>> N :: 120.79(4.69) P311 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 0.15 E 0.14 C 0.12 Q 0.11 H 0.11 K 0.11 R 0.11 I 0.06 M 0.03 V 0.01 C Shift Assignments>> C :: 172.828 CA :: 58.367 CB :: 29.521 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 :: 3.947 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) N Shift Assignments>> N :: 138.885 Ave N Shift Values>> N :: 127.4(10.05) K312 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.75 A 0.23 HN Overlap>> R284 C Shift Assignments>> C :: 172.374 CA :: 51.875 CB :: 34.839 CG :: 22.879 CD :: 26.078 CE :: 39.150 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 :: 7.616 HA :: 4.380 HB2 :: 1.609 HG2 :: 0.953 HD2 :: 1.009 HE2 :: 2.350 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 :: 117.621 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) L313 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 C 0.24 HN Overlap>> K32 V328 S360 C Shift Assignments>> C :: 176.920 CA :: 52.261 CB :: 39.789 CG :: 24.038 CD1 :: 22.193 CD2 :: 20.330 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 :: 8.505 HA :: 4.712 HB2 :: 1.652 HB3 :: 1.550 HG :: 1.516 HD1 :: 0.791 HD2 :: 0.757 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 :: 118.996 Ave N Shift Values>> N :: 121.98(4.07) I314 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.69 C 0.3 HN Overlap>> N282 C Shift Assignments>> C :: 175.966 CA :: 64.455 CB :: 36.581 CG1 :: 27.868 CG2 :: 13.956 CD1 :: 12.809 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 :: 8.637 HA :: 3.936 HB :: 1.982 HG2 :: 0.764 HG12 :: 0.940 HD1 :: 1.261 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 :: 126.162 Ave N Shift Values>> N :: 121.6(4.72) T315 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.64 C 0.18 T 0.17 C Shift Assignments>> C :: 173.744 CA :: 61.820 CB :: 66.135 CG2 :: 18.363 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 :: 4.114 HB :: 4.157 HG2 :: 1.304 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 :: 109.090 Ave N Shift Values>> N :: 115.7(5.05) K316 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.62 A 0.32 L 0.02 M 0.01 C Shift Assignments>> C :: 173.380 CA :: 53.582 CB :: 30.451 CG :: 22.025 CD :: 25.839 CE :: 39.339 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 :: 6.326 HA :: 4.180 HB2 :: 1.660 HG2 :: 1.435 HG3 :: 1.300 HD2 :: 1.617 HE2 :: 2.880 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 :: 115.616 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) N317 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 N 0.18 L 0.16 C 0.12 K 0.07 F 0.04 Y 0.03 R 0.02 C Shift Assignments>> C :: 170.364 CA :: 52.129 CB :: 41.318 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 :: 7.277 HA :: 4.561 HB2 :: 2.471 HB3 :: 2.278 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 :: 115.985 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) F318 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 M 0.19 N 0.11 E 0.1 K 0.08 Q 0.08 Y 0.02 H 0.01 W 0.01 C Shift Assignments>> C :: 170.755 CA :: 53.193 CB :: 35.246 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 :: 8.206 HA :: 4.416 HB2 :: 2.308 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 :: 121.411 Ave N Shift Values>> N :: 120.69(4.18) Q319 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 K 0.31 R 0.28 M 0.04 C Shift Assignments>> C :: 174.268 CA :: 55.555 CB :: 25.414 CG :: 31.010 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 :: 7.913 HA :: 3.814 HB2 :: 2.008 HG2 :: 2.316 HG3 :: 2.211 HE21 :: 7.467 HE22 :: 6.681 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 :: 120.885 NE2 :: 111.530 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) G320 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.31 K 0.18 R 0.15 D 0.1 F 0.07 C 0.07 Y 0.04 I 0.02 N 0.01 G 0.01 C Shift Assignments>> C :: 170.455 CA :: 42.319 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.735 HA2 :: 3.995 HA3 :: 3.346 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 113.946 Ave N Shift Values>> N :: 109.91(4.29) I321 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.83 A 0.16 C Shift Assignments>> C :: 172.488 CA :: 53.828 CB :: 32.594 CG1 :: 22.748 CG2 :: 12.961 CD1 :: 6.198(S) 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 :: 7.593 HA :: 3.613 HB :: 1.300 HG2 :: -0.789(S) HG12 :: 0.669 HG13 :: 0.499 HD1 :: -0.110 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 :: 123.017 Ave N Shift Values>> N :: 121.6(4.72) G322 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 D 0.19 Y 0.16 I 0.11 N 0.1 C 0.09 L 0.06 K 0.02 C Shift Assignments>> CA :: 40.186(S) Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.784 HA2 :: 3.682 HA3 :: 2.888 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.945 Ave N Shift Values>> N :: 109.91(4.29) P323 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.79 G 0.18 A 0.01 C Shift Assignments>> C :: 170.208(M) CA :: 61.982 CB :: 32.005 CG :: 21.788(S) CD :: 47.729 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 :: 4.111 HB2 :: 2.207 HB3 :: 2.123 HG2 :: 1.782 HG3 :: 1.683 HD2 :: 3.446 HD3 :: 3.331 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) K324 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 A 0.43 M 0.01 C Shift Assignments>> C :: 172.941 CA :: 51.906 CB :: 31.702 CG :: 21.985 CD :: 25.765 CE :: 39.597 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 :: 7.445 HA :: 4.697 HB2 :: 1.727 HB3 :: 1.520 HG2 :: 1.281 HD2 :: 1.716 HE2 :: 2.894 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 :: 118.129 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) I325 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.88 I 0.06 A 0.05 C Shift Assignments>> C :: 172.723 CA :: 56.955 CB :: 37.075 CG1 :: 23.679 CG2 :: 16.034 CD1 :: 9.861 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 :: 10.160 HA :: 4.218 HB :: 1.751 HG2 :: 0.548 HG12 :: 1.033 HG13 :: 0.708 HD1 :: -0.085 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 :: 127.116 Ave N Shift Values>> N :: 121.6(4.72) D326 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.49 C 0.17 D 0.15 Y 0.06 F 0.05 L 0.02 E 0.01 C Shift Assignments>> C :: 173.669 CA :: 52.763 CB :: 38.467 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 :: 8.764 HA :: 5.262 HB2 :: 3.320 HB3 :: 2.820 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 :: 123.182 Ave N Shift Values>> N :: 120.73(4.2) A327 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 G 0.17 C 0.04 M 0.04 C Shift Assignments>> C :: 171.965 CA :: 48.696 CB :: 20.105 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.829 HB :: 1.385 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.318 Ave N Shift Values>> N :: 123.23(3.7) V328 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.61 I 0.26 A 0.12 HN Overlap>> K32 L313 S360 C Shift Assignments>> C :: 168.811(S) CA :: 56.928 CB :: 29.488 CG1 :: 17.971 CG2 :: 15.315(S) 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 :: 8.485 HA :: 5.830 HB :: 1.881 HG1 :: -0.299(S) HG2 :: 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 :: 119.001 Ave N Shift Values>> N :: 121.02(4.96) F329 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 D 0.19 C 0.16 Y 0.1 F 0.08 L 0.04 E 0.01 C Shift Assignments>> C :: 168.025(M) CA :: 53.790 CB :: 38.903 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 :: 7.925 HA :: 5.157 HB2 :: 3.468 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 :: 119.249 Ave N Shift Values>> N :: 120.69(4.18) Y330 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 D 0.26 C 0.14 Y 0.08 F 0.07 L 0.07 C Shift Assignments>> C :: 171.931 CA :: 53.441 CB :: 39.524 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 :: 9.393 HA :: 5.265 HB2 :: 3.320 HB3 :: 2.884 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 :: 124.509 Ave N Shift Values>> N :: 120.79(4.69) S331 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> S360 C Shift Assignments>> C :: 170.581 CA :: 55.167 CB :: 63.399 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.498 HA :: 4.394 HB2 :: 3.953 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 :: 118.837 Ave N Shift Values>> N :: 116.3(3.95) K332 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.49 C 0.42 A 0.06 HN Overlap>> A91 C Shift Assignments>> C :: 173.310 CA :: 54.948 CB :: 27.766 CG :: 22.693 CD :: 25.056 CE :: 39.728 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 :: 8.594 HA :: 3.850 HB2 :: 2.046 HB3 :: 1.981 HG2 :: 1.636 HG3 :: 1.474 HD2 :: 1.969 HE2 :: 2.979 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 :: 119.821 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) N333 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 N 0.2 M 0.14 E 0.11 K 0.06 Y 0.04 Q 0.03 F 0.01 C Shift Assignments>> C :: 172.526 CA :: 53.187 CB :: 35.766 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 :: 7.932 HA :: 4.499 HB2 :: 2.868 HD21 :: 7.561 HD22 :: 6.982 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 :: 111.597 ND2 :: 113.405 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) K334 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.47 C 0.47 M 0.04 C Shift Assignments>> C :: 169.742(M) CA :: 54.365 CB :: 31.546 CG :: 20.320(S) CD :: 26.758 CE :: 39.160 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 :: 7.528 HA :: 3.626 HB2 :: 0.921(S) HB3 :: 0.781(S) HG2 :: 0.429(S) HG3 :: 0.138(S) HD2 :: 1.223 HD3 :: 1.155 HE2 :: 2.597 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 :: 115.169 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Y335 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.33 D 0.28 C 0.13 L 0.08 Y 0.06 F 0.06 K 0.01 HN Overlap>> K275 S362 C Shift Assignments>> C :: 173.996 CA :: 53.070 CB :: 39.784 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 :: 7.242 HA :: 5.523 HB2 :: 2.464 HB3 :: 2.164 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 :: 114.382 Ave N Shift Values>> N :: 120.79(4.69) Y336 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 C 0.17 D 0.14 Y 0.04 F 0.03 L 0.01 C Shift Assignments>> C :: 172.101 CA :: 51.306 CB :: 38.528 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 :: 9.071 HA :: 5.490 HB2 :: 2.578 HB3 :: 2.161 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 :: 116.309 Ave N Shift Values>> N :: 120.79(4.69) Y337 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 E 0.22 M 0.14 K 0.07 N 0.07 Y 0.07 Q 0.04 F 0.02 I 0.01 C Shift Assignments>> C :: 172.185 CA :: 55.157 CB :: 35.855 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 :: 8.413 HA :: 4.681 HB2 :: 2.742 HB3 :: 2.647 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 :: 120.714 Ave N Shift Values>> N :: 120.79(4.69) F338 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.26 L 0.15 C 0.13 N 0.12 F 0.12 Y 0.11 K 0.07 R 0.01 HN Overlap>> N49 C Shift Assignments>> C :: 172.878 CA :: 54.848 CB :: 40.488 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 :: 8.702 HA :: 4.700 HB2 :: 2.798 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 :: 119.516 Ave N Shift Values>> N :: 120.69(4.18) F339 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 N 0.19 Y 0.16 E 0.13 F 0.09 D 0.05 M 0.04 I 0.02 K 0.01 L 0.01 HN Overlap>> F109 C Shift Assignments>> C :: 172.886 CA :: 55.234 CB :: 37.513 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 :: 9.171 HA :: 4.935 HB2 :: 3.786 HB3 :: 3.054 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 :: 119.790 Ave N Shift Values>> N :: 120.69(4.18) Q340 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 P 0.25 R 0.19 K 0.17 Q 0.06 M 0.04 C Shift Assignments>> C :: 172.266 CA :: 52.208 CB :: 27.916 CG :: 31.979 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 :: 9.173 HA :: 4.666 HB2 :: 2.217 HG2 :: 2.464 HE21 :: 7.074 HE22 :: 6.859 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 :: 123.937 NE2 :: 107.303 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) G341 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.28 L 0.26 G 0.24 C 0.1 D 0.03 F 0.03 Y 0.02 K 0.01 C Shift Assignments>> C :: 172.069 CA :: 44.008 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.314 HA2 :: 4.062 HA3 :: 3.641 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 117.860 Ave N Shift Values>> N :: 109.91(4.29) S342 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.94 C 0.05 C Shift Assignments>> C :: 171.577 CA :: 55.642 CB :: 60.922 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.754 HA :: 4.702 HB2 :: 3.958 HB3 :: 3.844 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 :: 121.254 Ave N Shift Values>> N :: 116.3(3.95) N343 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.57 C 0.2 D 0.14 Y 0.02 F 0.02 L 0.01 C Shift Assignments>> C :: 168.587(M) CA :: 50.007 CB :: 38.769 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 :: 8.009 HA :: 4.828 HB2 :: 2.808 HB3 :: 2.035 HD21 :: 7.701 HD22 :: 6.964 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 :: 120.821 ND2 :: 114.952 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) Q344 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> P 0.83 C 0.1 R 0.02 K 0.01 G 0.01 M 0.01 HN Overlap>> A29 D54 C Shift Assignments>> C :: 174.327 CA :: 49.262(S) CB :: 28.662 CG :: 30.941 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 :: 7.946 HA :: 4.955 HB2 :: 0.994(S) HG2 :: 1.385 HG3 :: 0.826(S) HE21 :: 7.608 HE22 :: 6.679 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 :: 121.387 NE2 :: 109.224 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) F345 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.38 D 0.25 C 0.14 Y 0.07 F 0.06 L 0.06 C Shift Assignments>> C :: 171.894 CA :: 53.098 CB :: 39.428 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 :: 9.205 HA :: 4.979 HB2 :: 2.562 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 :: 124.993 Ave N Shift Values>> N :: 120.69(4.18) E346 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.29 Q 0.23 M 0.18 K 0.14 E 0.12 R 0.01 C Shift Assignments>> C :: 170.802 CA :: 53.260 CB :: 30.158 CG :: 34.503 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 :: 8.671 HA :: 4.001 HB2 :: 1.563 HB3 :: 1.334 HG2 :: 1.465(S) HG3 :: 0.811(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 :: 125.801 Ave N Shift Values>> N :: 120.68(3.68) Y347 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.26 N 0.19 C 0.14 F 0.11 Y 0.11 L 0.11 K 0.03 C Shift Assignments>> C :: 171.020 CA :: 54.571 CB :: 39.941 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 :: 9.546 HA :: 4.946 HB2 :: 3.533 HB3 :: 2.583 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 :: 130.514 Ave N Shift Values>> N :: 120.79(4.69) D348 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 D 0.23 C 0.18 L 0.03 F 0.02 Y 0.02 C Shift Assignments>> C :: 174.238 CA :: 49.999 CB :: 39.754 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 :: 8.131 HA :: 4.691 HB2 :: 2.561 HB3 :: 2.429 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 :: 128.779 Ave N Shift Values>> N :: 120.73(4.2) F349 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.2 M 0.16 K 0.1 Q 0.08 Y 0.05 N 0.03 F 0.01 W 0.01 H 0.01 HN Overlap>> W363 C Shift Assignments>> C :: 173.042 CA :: 55.477 CB :: 35.442 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 :: 7.466 HA :: 4.531 HB2 :: 3.579 HB3 :: 2.413 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 :: 122.126 Ave N Shift Values>> N :: 120.69(4.18) L350 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.59 C 0.39 HN Overlap>> K274 C Shift Assignments>> C :: 176.437 CA :: 54.052 CB :: 37.963 CG :: 23.539 CD1 :: 22.375 CD2 :: 19.906 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 :: 8.378 HA :: 4.350 HB2 :: 1.745 HB3 :: 1.263 HG :: 1.199 HD1 :: 0.693 HD2 :: 0.813 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 :: 125.362 Ave N Shift Values>> N :: 121.98(4.07) L351 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.78 C 0.21 C Shift Assignments>> C :: 174.431 CA :: 52.727 CB :: 39.880 CG :: 23.537 CD1 :: 22.152 CD2 :: 19.129 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 :: 8.172 HA :: 3.905 HB2 :: 1.115 HG :: 1.419 HD1 :: 0.609 HD2 :: 0.588 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 :: 119.910 Ave N Shift Values>> N :: 121.98(4.07) Q352 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 M 0.23 K 0.17 A 0.07 R 0.02 V 0.02 C Shift Assignments>> C :: 171.352 CA :: 54.006 CB :: 22.881 CG :: 31.399 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 :: 7.993 HA :: 3.476 HB2 :: 2.287 HB3 :: 1.991 HG2 :: 2.072 HE21 :: 7.523 HE22 :: 6.738 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 :: 113.987 NE2 :: 111.856 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) R353 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.62 A 0.26 K 0.1 C Shift Assignments>> C :: 171.363 CA :: 51.554 CB :: 31.224 CG :: 22.726 CD :: 40.620 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 :: 6.769 HA :: 4.538 HB2 :: 1.585 HB3 :: 1.386 HG2 :: 1.140 HD2 :: 2.990 HD3 :: 2.911 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 :: 112.407 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) I354 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 I 0.32 C Shift Assignments>> C :: 174.827 CA :: 59.366 CB :: 36.494 CG1 :: 27.200 CG2 :: 14.774 CD1 :: 11.515 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 :: 8.712 HA :: 4.521 HB :: 1.625 HG2 :: 0.956 HG12 :: 2.000 HG13 :: 0.790 HD1 :: 0.498 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 :: 122.255 Ave N Shift Values>> N :: 121.6(4.72) T355 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.73 C 0.18 T 0.08 C Shift Assignments>> C :: 173.460 CA :: 59.800 CB :: 65.269 CG2 :: 21.478 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 :: 9.267 HA :: 4.225 HB :: 4.175 HG2 :: 1.085 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 :: 120.554 Ave N Shift Values>> N :: 115.7(5.05) K356 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 A 0.17 M 0.01 C Shift Assignments>> C :: 171.320 CA :: 54.507 CB :: 34.228 CG :: 22.286 CD :: 26.719 CE :: 38.846 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 :: 7.530 HA :: 4.362 HB2 :: 1.570 HB3 :: 1.473 HG2 :: 1.248 HD2 :: 1.492 HD3 :: 1.375 HE2 :: 2.785 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 :: 121.653 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) T357 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.53 C 0.24 T 0.18 A 0.03 HN Overlap>> D246 C Shift Assignments>> C :: 170.451 CA :: 59.486 CB :: 66.949 CG2 :: 18.397 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 :: 8.272 HA :: 4.694 HB :: 3.926 HG2 :: 1.059 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 :: 118.697 Ave N Shift Values>> N :: 115.7(5.05) L358 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.46 G 0.43 C 0.08 L 0.01 HN Overlap>> N253 C Shift Assignments>> C :: 173.794 CA :: 50.679 CB :: 43.706 CG :: 24.138 CD1 :: 22.667 CD2 :: 20.898 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 :: 8.967 HA :: 4.623 HB2 :: 1.545 HB3 :: 1.167 HG :: 1.121 HD1 :: 0.457 HD2 :: 0.575 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 :: 127.259 Ave N Shift Values>> N :: 121.98(4.07) K359 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.49 C 0.43 L 0.05 HN Overlap>> S213 F243 C Shift Assignments>> C :: 177.789 CA :: 51.772 CB :: 29.564 CG :: 21.836 CD :: 24.718 CE :: 39.151 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 :: 8.191 HA :: 4.937 HB2 :: 1.868 HB3 :: 1.670 HG2 :: 1.453 HD2 :: 1.650 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 :: 119.470 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) S360 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.93 C 0.06 HN Overlap>> K32 L313 V328 S331 C Shift Assignments>> C :: 170.554 CA :: 58.761 CB :: 59.301 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.450 HA :: 4.156 HB2 :: 4.152 HB3 :: 3.917 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 :: 118.912 Ave N Shift Values>> N :: 116.3(3.95) N361 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.45 N 0.27 P 0.13 G 0.04 M 0.04 Y 0.01 C Shift Assignments>> C :: 175.477 CA :: 49.271 CB :: 35.992 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 :: 6.979 HA :: 4.058 HB2 :: 3.533 HB3 :: 2.456 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 :: 114.092 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) S362 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.96 C 0.03 HN Overlap>> K275 Y335 C Shift Assignments>> C :: 174.174 CA :: 60.089 CB :: 59.487 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.185 HA :: 4.693 HB2 :: 3.578 HB3 :: 3.432 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 :: 114.386 Ave N Shift Values>> N :: 116.3(3.95) W363 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 K 0.28 C 0.12 R 0.11 Q 0.03 H 0.02 M 0.02 I 0.01 W 0.01 HN Overlap>> F349 C Shift Assignments>> C :: 173.499 CA :: 55.454 CB :: 25.079 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 :: 7.435 HA :: 4.029 HB2 :: 2.999 HB3 :: 2.301 HE1 :: 9.826 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 :: 122.026 NE1 :: 127.644 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) F364 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 P 0.17 M 0.15 N 0.1 Q 0.06 K 0.05 E 0.02 H 0.01 Y 0.01 W 0.01 C Shift Assignments>> C :: 173.907 CA :: 51.297 CB :: 34.820 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 :: 7.102 HA :: 4.705 HB2 :: 3.200 HB3 :: 3.005 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 :: 116.316 Ave N Shift Values>> N :: 120.69(4.18) G365 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 L 0.27 C 0.07 G 0.06 K 0.05 D 0.05 F 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 171.148 CA :: 43.293 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.736 HA2 :: 3.924 HA3 :: 3.653 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.975 Ave N Shift Values>> N :: 109.91(4.29) C366 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.41 C 0.26 E 0.07 Y 0.07 M 0.04 D 0.04 F 0.04 K 0.01 C Shift Assignments>> CA :: 53.162 CB :: 37.053 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 6.869 HA :: 4.099 HB2 :: 2.829 HB3 :: 2.192 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 :: 122.974 Ave N Shift Values>> N :: 119.95(4.79) ########################################################################### Overall Results: #Consistent: 297 #Clerical: 0 #Suspicious: 28 #Anomalous: 15 #Mistyped: 26 #Indeterminable: 0 Typing Results: #Consistent: 316 #Suspicious: 3 #Mistyped: 26 #Indeterminable: 21 Shift Relative Order (SRO) Results: #Consistent: 365 #Suspicious: 1 C Shift Results: #Consistent:1294 #Duplicate: 0 #Unknown: 0 #Suspicious: 19 #Anomalous: 13 H Shift Results: #Consistent:1623 #Duplicate: 0 #Unknown: 0 #Suspicious: 37 #Anomalous: 4 N Shift Results: #Consistent: 374 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 1 Error Summary: Y12 C = 169.021(M), Expected = 175.39, Std = 1.8900, ChiSquare = 7.5211e-04 N16 C = 167.039(M), Expected = 175.16, Std = 1.7600, ChiSquare = 3.9460e-06 M21 HE = 0.306(S), Expected = 1.86, Std = 0.4700, ChiSquare = 9.4509e-04 I30 Typing: Mistyped I30 CD1 = 5.650(S), Expected = 13.41, Std = 1.9100, ChiSquare = 4.8482e-05 K32 Typing: Mistyped S46 C = 168.253(S), Expected = 174.53, Std = 1.7300, ChiSquare = 2.8527e-04 I55 CG2 = 12.079(S), Expected = 17.36, Std = 1.6000, ChiSquare = 9.6470e-04 G72 Typing: Mistyped G74 Typing: Mistyped G74 CA = 40.107(S), Expected = 45.33, Std = 1.4200, ChiSquare = 2.3491e-04 L77 Typing: Mistyped F81 H = 11.910(M), Expected = 8.42, Std = 0.7400, ChiSquare = 2.4027e-06 G84 H = 5.621(S), Expected = 8.34, Std = 0.7400, ChiSquare = 2.3848e-04 H92 CA = 48.022(S), Expected = 56.37, Std = 2.4000, ChiSquare = 5.0454e-04 W99 CB = 23.024(M), Expected = 30.16, Std = 2.1900, ChiSquare = 1.1202e-03 W99 HB3 = 1.777(S), Expected = 3.18, Std = 0.3600, ChiSquare = 9.7302e-05 T100 Typing: Mistyped T100 CA = 52.624(S), Expected = 62.15, Std = 2.7200, ChiSquare = 4.6142e-04 T106 HB = 2.355(S), Expected = 4.17, Std = 0.3700, ChiSquare = 9.3235e-07 T106 HG2 = 0.203(S), Expected = 1.16, Std = 0.2800, ChiSquare = 6.3116e-04 L108 HD2 = -0.330(S), Expected = 0.76, Std = 0.2800, ChiSquare = 9.9070e-05 I116 HD1 = -0.609(S), Expected = 0.70, Std = 0.3000, ChiSquare = 1.2810e-05 G117 HA3 = 2.234(S), Expected = 3.93, Std = 0.4000, ChiSquare = 2.2352e-05 L120 Typing: Mistyped G123 Typing: Mistyped G123 CA = 40.113(S), Expected = 45.33, Std = 1.4200, ChiSquare = 2.3884e-04 P128 HA = 2.464(S), Expected = 4.41, Std = 0.3600, ChiSquare = 6.4608e-08 K129 HD2 = 2.465(S), Expected = 1.61, Std = 0.2500, ChiSquare = 6.2621e-04 V131 H = 11.387(M), Expected = 8.29, Std = 0.7100, ChiSquare = 1.2890e-05 M132 Typing: Suspicious M132 CB = 24.407(M), Expected = 32.90, Std = 2.2300, ChiSquare = 1.3980e-04 P134 Typing: Suspicious P134 CB = 24.689(M), Expected = 31.81, Std = 1.5400, ChiSquare = 3.7636e-06 V139 H = 5.727(S), Expected = 8.29, Std = 0.7100, ChiSquare = 3.0636e-04 P168 Typing: Mistyped P175 Typing: Mistyped C178 CA = 49.101(M), Expected = 57.43, Std = 3.4100, ChiSquare = 1.4585e-02 V187 HG1 = -0.323(S), Expected = 0.84, Std = 0.2700, ChiSquare = 1.6518e-05 I194 HG2 = -0.943(S), Expected = 0.80, Std = 0.2900, ChiSquare = 1.8513e-09 V214 HG1 = -0.247(S), Expected = 0.84, Std = 0.2700, ChiSquare = 5.6752e-05 L220 HG = -0.136(S), Expected = 1.54, Std = 0.3300, ChiSquare = 3.7985e-07 L220 HD1 = -0.353(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.1928e-05 L224 HD1 = -0.146(S), Expected = 0.77, Std = 0.2700, ChiSquare = 6.9235e-04 L224 HD2 = -0.324(S), Expected = 0.76, Std = 0.2800, ChiSquare = 1.0820e-04 A231 HA = 5.828(S), Expected = 4.26, Std = 0.4200, ChiSquare = 1.8896e-04 Y232 C = 168.464(M), Expected = 175.39, Std = 1.8900, ChiSquare = 2.4777e-04 K247 Typing: Mistyped Y248 HB2 = 1.170(S), Expected = 2.91, Std = 0.3700, ChiSquare = 2.5674e-06 Y248 HB3 = 0.908(S), Expected = 2.91, Std = 0.3700, ChiSquare = 6.2740e-08 W249 HB2 = 1.701(S), Expected = 3.22, Std = 0.3600, ChiSquare = 2.4491e-05 L250 HD2 = -0.206(S), Expected = 0.76, Std = 0.2800, ChiSquare = 5.6059e-04 I251 Typing: Mistyped I251 HD1 = -0.652(S), Expected = 0.70, Std = 0.3000, ChiSquare = 6.5854e-06 L254 N = 108.343(M), Expected = 121.98, Std = 4.0700, ChiSquare = 8.0633e-04 K262 Typing: Mistyped F269 H = 5.839(S), Expected = 8.42, Std = 0.7400, ChiSquare = 4.8694e-04 V273 HG1 = -0.157(S), Expected = 0.84, Std = 0.2700, ChiSquare = 2.2198e-04 K274 Typing: Mistyped K275 Typing: Mistyped K275 C = 170.036(M), Expected = 176.46, Std = 2.0500, ChiSquare = 1.7264e-03 K275 CG = 20.032(S), Expected = 24.91, Std = 1.3100, ChiSquare = 1.9635e-04 I276 HD1 = -0.785(S), Expected = 0.70, Std = 0.3000, ChiSquare = 7.4213e-07 V280 C = 167.743(M), Expected = 175.69, Std = 2.0300, ChiSquare = 9.0487e-05 V280 CG2 = 15.252(S), Expected = 21.31, Std = 1.7600, ChiSquare = 5.7733e-04 N282 Typing: Mistyped N282 CA = 45.509(S), Expected = 53.43, Std = 1.9400, ChiSquare = 4.4460e-05 P283 HD3 = 2.311(S), Expected = 3.63, Std = 0.4000, ChiSquare = 9.7550e-04 Y286 SRO Rule Break>> HA > HB2 : 0.992304403591278 T288 HG2 = -1.186(M), Expected = 1.16, Std = 0.2800, ChiSquare = 5.3574e-17 Q295 Typing: Mistyped Q295 CG = 39.225(S), Expected = 33.72, Std = 1.1000, ChiSquare = 5.5994e-07 M306 Typing: Suspicious M306 CG = 24.072(S), Expected = 32.07, Std = 1.4500, ChiSquare = 3.4707e-08 P311 Typing: Mistyped I321 Typing: Mistyped I321 CD1 = 6.198(S), Expected = 13.41, Std = 1.9100, ChiSquare = 1.5942e-04 I321 HG2 = -0.789(S), Expected = 0.80, Std = 0.2900, ChiSquare = 4.2699e-08 G322 Typing: Mistyped G322 CA = 40.186(S), Expected = 45.33, Std = 1.4200, ChiSquare = 2.9173e-04 P323 Typing: Mistyped P323 C = 170.208(M), Expected = 176.70, Std = 1.6900, ChiSquare = 1.2232e-04 P323 CG = 21.788(S), Expected = 27.14, Std = 1.1800, ChiSquare = 5.7442e-06 V328 Typing: Mistyped V328 C = 168.811(S), Expected = 175.69, Std = 2.0300, ChiSquare = 7.0232e-04 V328 CG2 = 15.315(S), Expected = 21.31, Std = 1.7600, ChiSquare = 6.5862e-04 V328 HG1 = -0.299(S), Expected = 0.84, Std = 0.2700, ChiSquare = 2.4591e-05 F329 C = 168.025(M), Expected = 175.49, Std = 2.1300, ChiSquare = 4.5713e-04 K332 Typing: Mistyped K334 Typing: Mistyped K334 C = 169.742(M), Expected = 176.46, Std = 2.0500, ChiSquare = 1.0489e-03 K334 CG = 20.320(S), Expected = 24.91, Std = 1.3100, ChiSquare = 4.5864e-04 K334 HB2 = 0.921(S), Expected = 1.79, Std = 0.2500, ChiSquare = 5.0895e-04 K334 HB3 = 0.781(S), Expected = 1.78, Std = 0.2600, ChiSquare = 1.2188e-04 K334 HG2 = 0.429(S), Expected = 1.38, Std = 0.2700, ChiSquare = 4.2795e-04 K334 HG3 = 0.138(S), Expected = 1.37, Std = 0.2900, ChiSquare = 2.1542e-05 N343 C = 168.587(M), Expected = 175.16, Std = 1.7600, ChiSquare = 1.8797e-04 Q344 CA = 49.262(S), Expected = 56.62, Std = 2.1900, ChiSquare = 7.7994e-04 Q344 HB2 = 0.994(S), Expected = 2.05, Std = 0.2800, ChiSquare = 1.6232e-04 Q344 HG3 = 0.826(S), Expected = 2.32, Std = 0.2900, ChiSquare = 2.5810e-07 E346 HG2 = 1.465(S), Expected = 2.31, Std = 0.2100, ChiSquare = 5.7264e-05 E346 HG3 = 0.811(M), Expected = 2.31, Std = 0.2100, ChiSquare = 9.4633e-13 L350 Typing: Mistyped K359 Typing: Mistyped