Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.M2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> E 0.29 C 0.24 M 0.13 K 0.07 Y 0.07 Q 0.06 F 0.03 I 0.02 N 0.01 V 0.01 C Shift Assignments>> CA :: 56.938 CB :: 35.773 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> HA :: 5.467 HB2 :: 2.995 HB3 :: 2.833 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) 1.G3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.55 A 0.15 G 0.12 N 0.06 C 0.05 D 0.01 C Shift Assignments>> C :: 175.646 CA :: 48.549 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.998 HA2 :: 3.776 HA3 :: 4.917 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.190 Ave N Shift Values>> N :: 109.67(3.87) 1.M4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.21 K 0.17 R 0.14 M 0.13 H 0.11 E 0.1 V 0.06 Q 0.05 C Shift Assignments>> C :: 177.720 CA :: 58.089 CB :: 31.994 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 9.076 HA :: 4.342 HB2 :: 1.864 HB3 :: 2.269 HG2 :: 2.623 HG3 :: 1.928 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 116.252 Ave N Shift Values>> N :: 120.09(3.57) 1.V5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.64 P 0.22 C 0.1 I 0.02 C Shift Assignments>> C :: 177.032 CA :: 66.530 CB :: 31.559 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.908 HA :: 3.374 HB :: 2.066 HG11 :: 0.881 HG12 :: 0.881 HG13 :: 0.881 HG21 :: 0.514 HG22 :: 0.514 HG23 :: 0.514 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.716 Ave N Shift Values>> N :: 121.14(4.54) 1.F6 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> F 0.38 Y 0.36 C 0.24 C Shift Assignments>> C :: 178.572 CA :: 62.161 CB :: 38.188 CD1 :: 131.533 CD2 :: 131.533 CE1 :: 131.929 CE2 :: 131.929 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 6.792 HA :: 3.314 HB2 :: 2.323 HB3 :: 1.612(S) HD1 :: 7.189 HD2 :: 7.189 HE1 :: 7.450 HE2 :: 7.450 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.285 Ave N Shift Values>> N :: 120.45(4.18) 1.T7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 177.191 CA :: 66.472 CB :: 67.805 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.872 HA :: 3.772 HB :: 4.022 HG21 :: 1.140 HG22 :: 1.140 HG23 :: 1.140 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 113.966 Ave N Shift Values>> N :: 115.42(4.75) 1.G8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 C 0.06 L 0.04 A 0.01 C Shift Assignments>> C :: 175.804 CA :: 47.100 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.548 HA2 :: 3.943 HA3 :: 3.428 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.219 Ave N Shift Values>> N :: 109.67(3.87) 1.L9 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.54 I 0.45 C Shift Assignments>> C :: 177.935 CA :: 57.494 CB :: 39.713 CG :: 27.044 CD1 :: 14.381(S) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.727 HA :: 4.384 HB2 :: 1.484 HD11 :: -0.049 HD12 :: -0.049 HD13 :: -0.049 HD21 :: 0.305 HD22 :: 0.305 HD23 :: 0.305 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 125.018 Ave N Shift Values>> N :: 121.86(3.9) 1.M10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 V 0.19 K 0.14 R 0.09 M 0.08 H 0.06 E 0.06 Q 0.05 P 0.01 HN Overlap>> 1.D23 1.L26 1.D23 1.L26 C Shift Assignments>> C :: 178.543 CA :: 59.710 CB :: 32.418 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.330 HA :: 3.777 HB2 :: 2.264 HB3 :: 2.048 HG2 :: 2.854 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 118.197 Ave N Shift Values>> N :: 120.09(3.57) 1.E11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 E 0.34 I 0.18 K 0.05 Q 0.02 M 0.01 C Shift Assignments>> C :: 178.105 CA :: 59.368 CB :: 29.486 CG :: 36.520 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.947 HA :: 3.990 HB2 :: 2.052 HB3 :: 1.976 HG2 :: 2.423 HG3 :: 2.126 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.060 Ave N Shift Values>> N :: 120.67(3.48) 1.L12 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> F 0.23 K 0.21 Y 0.18 L 0.12 C 0.09 D 0.06 I 0.05 R 0.03 C Shift Assignments>> C :: 178.594 CA :: 58.239 CB :: 41.453 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.497 HA :: 4.214 HB2 :: 1.586 HB3 :: 2.077 HG :: -0.071(S) HD11 :: 0.921 HD12 :: 0.921 HD13 :: 0.921 HD21 :: 0.777 HD22 :: 0.777 HD23 :: 0.777 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.521 Ave N Shift Values>> N :: 121.86(3.9) 1.I13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.92 C 0.07 C Shift Assignments>> C :: 177.870 CA :: 66.224 CB :: 37.468 CG2 :: 17.737 CD1 :: 13.808 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.561 HA :: 3.589 HB :: 1.869 HG12 :: 1.949 HG13 :: 1.949 HG21 :: 0.738 HG22 :: 0.738 HG23 :: 0.738 HD11 :: 0.527 HD12 :: 0.527 HD13 :: 0.527 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.226 Ave N Shift Values>> N :: 121.46(4.28) 1.E14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 E 0.29 I 0.23 K 0.04 Q 0.01 M 0.01 HN Overlap>> 1.E47 1.F189 1.E47 1.F189 C Shift Assignments>> C :: 178.264 CA :: 60.227 CB :: 29.448 CG :: 36.359 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.159 HA :: 3.458 HB2 :: 1.693 HB3 :: 2.020 HG2 :: 2.216 HG3 :: 2.171 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.713 Ave N Shift Values>> N :: 120.67(3.48) 1.D15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.2 K 0.2 Y 0.16 L 0.16 D 0.1 C 0.08 I 0.03 R 0.02 N 0.01 C Shift Assignments>> C :: 177.979 CA :: 57.368 CB :: 41.306 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.289 HA :: 4.271 HB2 :: 2.762 HB3 :: 2.586 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.412 Ave N Shift Values>> N :: 120.65(3.86) 1.E16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.34 C 0.31 Q 0.11 M 0.1 K 0.08 I 0.02 C Shift Assignments>> C :: 177.602 CA :: 57.474 CB :: 30.284 CG :: 35.624 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.611 HA :: 3.957 HB2 :: 1.558 HB3 :: 1.237 HG2 :: 1.973 HG3 :: 1.625 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 115.649 Ave N Shift Values>> N :: 120.67(3.48) 1.F17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.44 Y 0.36 C 0.19 C Shift Assignments>> C :: 176.781 CA :: 58.141 CB :: 40.125 CD1 :: 131.231 CD2 :: 131.231 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.409 HA :: 4.701 HB2 :: 3.297 HB3 :: 2.924 HD1 :: 7.317 HD2 :: 7.317 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 114.340 Ave N Shift Values>> N :: 120.45(4.18) 1.G18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.64 L 0.19 R 0.06 C 0.04 F 0.02 D 0.01 Y 0.01 C Shift Assignments>> C :: 174.504 CA :: 44.756 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.778 HA2 :: 4.621 HA3 :: 4.064 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.584 Ave N Shift Values>> N :: 109.67(3.87) 1.Y19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.48 C 0.21 Y 0.15 F 0.11 E 0.02 C Shift Assignments>> C :: 176.815 CA :: 61.695 CB :: 37.776 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.748 HA :: 3.937 HB2 :: 3.159 HB3 :: 2.966 HD1 :: 7.077 HD2 :: 7.077 HE1 :: 6.769 HE2 :: 6.769 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.486 Ave N Shift Values>> N :: 120.52(4.2) 1.E20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 I 0.29 E 0.27 K 0.04 Q 0.01 C Shift Assignments>> C :: 179.388 CA :: 59.669 CB :: 28.691 CG :: 36.668 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.868 HA :: 3.913 HB2 :: 1.926 HB3 :: 1.922 HG2 :: 2.109 HG3 :: 2.215 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.668 Ave N Shift Values>> N :: 120.67(3.48) 1.T21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 175.322 CA :: 66.550 CB :: 67.596 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.537 HA :: 3.728 HB :: 3.925 HG21 :: 0.805 HG22 :: 0.805 HG23 :: 0.805 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.066 Ave N Shift Values>> N :: 115.42(4.75) 1.L22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.21 K 0.16 C 0.11 L 0.09 I 0.07 D 0.04 R 0.01 C Shift Assignments>> C :: 176.994 CA :: 58.651 CB :: 41.167 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.159 HA :: 3.812 HB2 :: 1.964 HB3 :: 1.080 HD11 :: 0.942 HD12 :: 0.942 HD13 :: 0.942 HD21 :: 0.736 HD22 :: 0.736 HD23 :: 0.736 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.002 Ave N Shift Values>> N :: 121.86(3.9) 1.D23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.25 Y 0.21 L 0.12 K 0.11 C 0.1 D 0.09 I 0.05 N 0.01 HN Overlap>> 1.M10 1.M10 1.L26 1.L26 C Shift Assignments>> C :: 178.838 CA :: 57.701 CB :: 40.842 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.352 HA :: 4.197 HB2 :: 2.463 HB3 :: 2.526 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.287 Ave N Shift Values>> N :: 120.65(3.86) 1.T24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.992 CA :: 66.207 CB :: 68.373 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.856 HA :: 3.891 HB :: 4.213 HG21 :: 1.157 HG22 :: 1.157 HG23 :: 1.157 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.039 Ave N Shift Values>> N :: 115.42(4.75) 1.L25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 R 0.05 L 0.05 A 0.01 G 0.01 C Shift Assignments>> C :: 178.922 CA :: 58.568 CB :: 41.822 CG :: 25.324 CD1 :: 20.935 CD2 :: 26.722 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.157 HA :: 3.327 HB2 :: 1.498 HB3 :: 1.740 HG :: 1.045 HD11 :: -0.066 HD12 :: -0.066 HD13 :: -0.066 HD21 :: 0.326 HD22 :: 0.326 HD23 :: 0.326 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.049 Ave N Shift Values>> N :: 121.86(3.9) 1.L26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.22 L 0.11 K 0.11 C 0.11 D 0.08 I 0.06 HN Overlap>> 1.M10 1.D23 1.M10 1.D23 C Shift Assignments>> C :: 179.438 CA :: 57.933 CB :: 40.835 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.326 HA :: 3.843 HB2 :: 1.868 HB3 :: 1.389 HG :: 1.779 HD11 :: 0.868 HD12 :: 0.868 HD13 :: 0.868 HD21 :: 0.754 HD22 :: 0.754 HD23 :: 0.754 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.267 Ave N Shift Values>> N :: 121.86(3.9) 1.E27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.34 K 0.08 Q 0.06 I 0.06 M 0.04 C Shift Assignments>> C :: 178.098 CA :: 58.084 CB :: 29.827 CG :: 36.061 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.737 HA :: 4.095 HB2 :: 2.053 HB3 :: 2.053 HG2 :: 2.295 HG3 :: 2.244 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.795 Ave N Shift Values>> N :: 120.67(3.48) 1.S28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.793 CA :: 59.710 CB :: 64.300 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.740 HA :: 4.434 HB2 :: 3.933 HB3 :: 3.917 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.315 Ave N Shift Values>> N :: 116.28(3.52) 1.C29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.17 K 0.16 E 0.16 Q 0.14 H 0.13 R 0.11 I 0.06 M 0.02 C Shift Assignments>> C :: 173.007 CA :: 58.275 CB :: 29.159 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 7.537 HA :: 4.421 HB3 :: 2.627 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 119.003 Ave N Shift Values>> N :: 120.17(4.64) 1.E30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.18 K 0.18 H 0.15 E 0.13 C 0.13 R 0.11 M 0.03 L 0.02 I 0.01 HN Overlap>> 1.R182 1.R182 C Shift Assignments>> C :: 175.158 CA :: 56.022 CB :: 28.934 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.488 HA :: 4.259 HB2 :: 1.944 HB3 :: 1.892 HG2 :: 2.091 HG3 :: 2.195 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.621 Ave N Shift Values>> N :: 120.67(3.48) 1.L31 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> L 0.3 D 0.26 R 0.13 K 0.1 F 0.04 C 0.04 N 0.04 Y 0.02 G 0.01 HN Overlap>> 1.D94 1.D94 C Shift Assignments>> C :: 178.572 CA :: 53.298 CB :: 42.516 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.412 HA :: 4.496 HB2 :: 1.446 HB3 :: 1.401 HD11 :: 0.758 HD12 :: 0.758 HD13 :: 0.758 HD21 :: -3.242(A) HD22 :: -3.242(A) HD23 :: -3.242(A) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.463 Ave N Shift Values>> N :: 121.86(3.9) 1.Q32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 Q 0.25 K 0.24 E 0.07 R 0.05 I 0.02 M 0.01 C Shift Assignments>> C :: 177.618 CA :: 58.665 CB :: 28.436 CG :: 34.043 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.307 HA :: 4.063 HB2 :: 2.192 HB3 :: 2.464 HG2 :: 2.459 HG3 :: 2.181 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 127.404 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.S33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.969 CA :: 58.918 CB :: 63.326 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.798 HA :: 4.227 HB2 :: 3.721 HB3 :: 3.782 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.132 Ave N Shift Values>> N :: 116.28(3.52) 1.E34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 E 0.33 I 0.17 K 0.06 Q 0.03 C Shift Assignments>> C :: 175.500 CA :: 57.492 CB :: 27.986 CG :: 36.645 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.871 HA :: 3.819 HB2 :: 2.135 HB3 :: 2.105 HG2 :: 2.858 HG3 :: 2.858 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.357 Ave N Shift Values>> N :: 120.67(3.48) 1.G35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.86 L 0.08 C 0.02 C Shift Assignments>> C :: 172.617 CA :: 45.496 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.181 HA2 :: 3.662 HA3 :: 3.128 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.278 Ave N Shift Values>> N :: 109.67(3.87) 1.I36 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 174.322 CA :: 59.737 CB :: 37.346 CG2 :: 12.164(S) CD1 :: 17.056 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 6.635 HA :: 3.783 HB :: 1.651 HG12 :: 1.231 HG13 :: 0.861 HG21 :: 0.676 HG22 :: 0.676 HG23 :: 0.676 HD11 :: 0.650 HD12 :: 0.650 HD13 :: 0.650 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.302 Ave N Shift Values>> N :: 121.46(4.28) 1.Y37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.21 D 0.19 Y 0.18 L 0.16 C 0.09 K 0.06 N 0.04 I 0.02 C Shift Assignments>> C :: 176.136 CA :: 56.382 CB :: 40.519 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.097 HA :: 4.391 HB2 :: 2.237 HB3 :: 2.359 HD1 :: 6.850 HD2 :: 6.850 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 125.098 Ave N Shift Values>> N :: 120.52(4.2) 1.T38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.469 CA :: 60.649 CB :: 69.929 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.739 HA :: 4.860 HB :: 4.347 HG21 :: 1.244 HG22 :: 1.244 HG23 :: 1.244 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.747 Ave N Shift Values>> N :: 115.42(4.75) 1.S39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.904 CA :: 61.714 CB :: 63.153 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.036 HA :: 4.136 HB2 :: 4.024 HB3 :: 3.986 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 121.568 Ave N Shift Values>> N :: 116.28(3.52) 1.V40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.75 V 0.23 C Shift Assignments>> C :: 177.555 CA :: 60.361 CB :: 31.282 CG1 :: 21.500 CG2 :: 18.089 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.479 HA :: 4.790 HB :: 2.464 HG11 :: 1.040 HG12 :: 1.040 HG13 :: 1.040 HG21 :: 0.915 HG22 :: 0.915 HG23 :: 0.915 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 107.864 Ave N Shift Values>> N :: 121.14(4.54) 1.G41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.73 L 0.14 R 0.03 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 171.981 CA :: 44.969 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.871 HA2 :: 4.006 HA3 :: 3.648 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 111.025 Ave N Shift Values>> N :: 109.67(3.87) 1.S42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.245 CA :: 57.061 CB :: 64.732 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.828 HA :: 4.841 HB2 :: 3.619 HB3 :: 3.582 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 113.625 Ave N Shift Values>> N :: 116.28(3.52) 1.Y43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.24 L 0.21 F 0.13 D 0.13 Y 0.1 R 0.08 C 0.06 I 0.01 N 0.01 HN Overlap>> 1.I129 1.I129 C Shift Assignments>> C :: 174.924 CA :: 56.582 CB :: 41.864 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.340 HA :: 4.618 HB2 :: 2.906 HB3 :: 2.637 HD1 :: 7.096 HD2 :: 7.096 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 124.763 Ave N Shift Values>> N :: 120.52(4.2) 1.D44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.25 L 0.25 K 0.17 F 0.09 Y 0.06 C 0.05 N 0.04 R 0.04 C Shift Assignments>> C :: 179.302 CA :: 54.795 CB :: 41.654 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.069 HA :: 4.716 HB2 :: 2.656 HB3 :: 2.596 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 123.139 Ave N Shift Values>> N :: 120.65(3.86) 1.H45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.16 C 0.13 T 0.12 V 0.11 S 0.1 F 0.09 Y 0.09 E 0.03 K 0.03 R 0.02 H 0.02 Q 0.01 M 0.01 P 0.01 C Shift Assignments>> C :: 177.251 CA :: 60.377 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 9.913 HA :: 4.594 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 127.215 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.Q46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.19 I 0.14 K 0.13 R 0.13 Q 0.12 E 0.11 H 0.09 L 0.03 M 0.01 C Shift Assignments>> C :: 179.005 CA :: 58.778 CB :: 28.142 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.705 HA :: 3.681 HB2 :: 2.125 HG2 :: 1.867 HG3 :: 2.011 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.999 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.E47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.26 I 0.15 E 0.12 R 0.09 H 0.09 K 0.08 Q 0.07 V 0.06 M 0.02 HN Overlap>> 1.F189 1.E14 1.E80 1.F189 1.E14 1.E80 C Shift Assignments>> C :: 178.018 CA :: 60.272 CB :: 29.737 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.219 HA :: 4.113 HB3 :: 2.431 HG2 :: 2.640 HG3 :: 2.416 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.691 Ave N Shift Values>> N :: 120.67(3.48) 1.L48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.54 C 0.44 C Shift Assignments>> C :: 178.873 CA :: 58.649 CB :: 41.232 CD1 :: 25.065 CD2 :: 25.212 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.096 HA :: 3.689 HB2 :: 1.817 HB3 :: 1.091 HD11 :: 0.393 HD12 :: 0.393 HD13 :: 0.393 HD21 :: 0.011 HD22 :: 0.011 HD23 :: 0.011 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.238 Ave N Shift Values>> N :: 121.86(3.9) 1.L49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.22 L 0.13 C 0.1 D 0.1 K 0.09 I 0.05 N 0.01 C Shift Assignments>> C :: 178.187 CA :: 57.561 CB :: 40.716 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.319 HA :: 3.949 HB2 :: 1.854 HB3 :: 1.528 HG :: 0.846 HD11 :: 0.729 HD12 :: 0.729 HD13 :: 0.729 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 115.750 Ave N Shift Values>> N :: 121.86(3.9) 1.Q50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.34 K 0.21 Q 0.21 E 0.12 I 0.05 R 0.02 C Shift Assignments>> C :: 178.817 CA :: 59.298 CB :: 28.724 CG :: 34.461 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.159 HA :: 3.925 HB2 :: 2.245 HB3 :: 2.130 HG2 :: 2.528 HG3 :: 2.316 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.406 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.L51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.35 C 0.26 L 0.24 K 0.07 I 0.04 G 0.02 C Shift Assignments>> C :: 178.624 CA :: 58.357 CB :: 42.856 CG :: 27.075 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.656 HA :: 3.965 HB2 :: 2.044 HB3 :: 1.036 HG :: 1.205 HD11 :: 0.395 HD12 :: 0.395 HD13 :: 0.395 HD21 :: 0.015 HD22 :: 0.015 HD23 :: 0.015 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.277 Ave N Shift Values>> N :: 121.86(3.9) 1.V52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.63 P 0.21 C 0.1 I 0.04 C Shift Assignments>> C :: 177.685 CA :: 66.607 CB :: 31.314 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.878 HA :: 3.485 HB :: 2.017 HG11 :: 0.878 HG12 :: 0.878 HG13 :: 0.878 HG21 :: 0.859 HG22 :: 0.859 HG23 :: 0.859 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 115.569 Ave N Shift Values>> N :: 121.14(4.54) 1.V53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.71 P 0.14 C 0.1 I 0.03 C Shift Assignments>> C :: 179.298 CA :: 67.107 CB :: 31.436 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.728 HA :: 3.495 HB :: 2.080 HG11 :: 1.046 HG12 :: 1.046 HG13 :: 1.046 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.598 Ave N Shift Values>> N :: 121.14(4.54) 1.K54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.51 K 0.33 R 0.13 V 0.01 C Shift Assignments>> C :: 178.607 CA :: 57.599 CB :: 30.414 CG :: 24.770 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.898 HA :: 4.114 HB2 :: 1.662 HB3 :: 1.753 HG2 :: 0.728 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.663 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 Y 0.19 L 0.15 D 0.14 K 0.1 C 0.09 I 0.03 N 0.02 C Shift Assignments>> C :: 179.958 CA :: 56.993 CB :: 40.748 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.430 HA :: 3.834 HB2 :: 1.937 HB3 :: 1.291 HG :: 1.143 HD11 :: 0.532 HD12 :: 0.532 HD13 :: 0.532 HD21 :: 0.218 HD22 :: 0.218 HD23 :: 0.218 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.687 Ave N Shift Values>> N :: 121.86(3.9) 1.S56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 177.235 CA :: 60.662 CB :: 63.922 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.652 HA :: 4.244 HB2 :: 4.047 HB3 :: 3.879 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 118.996 Ave N Shift Values>> N :: 116.28(3.52) 1.E57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 E 0.34 I 0.12 K 0.08 Q 0.05 M 0.02 C Shift Assignments>> C :: 179.299 CA :: 59.308 CB :: 29.601 CG :: 36.028 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.701 HA :: 3.943 HB2 :: 2.227 HB3 :: 2.132 HG2 :: 2.205 HG3 :: 2.435 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.491 Ave N Shift Values>> N :: 120.67(3.48) 1.V58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.84 C 0.15 HN Overlap>> 1.F154 1.F154 C Shift Assignments>> C :: 177.486 CA :: 64.436 CB :: 32.451 CG1 :: 21.047 CG2 :: 21.047 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.863 HA :: 3.924 HB :: 2.033 HG11 :: 0.609 HG12 :: 0.609 HG13 :: 0.609 HG21 :: 0.895 HG22 :: 0.895 HG23 :: 0.895 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 114.672 Ave N Shift Values>> N :: 121.14(4.54) 1.S59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.59 T 0.4 C Shift Assignments>> C :: 175.477 CA :: 59.878 CB :: 66.567 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.303 HA :: 4.393 HB2 :: 3.920 HB3 :: 3.322 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.232 Ave N Shift Values>> N :: 116.28(3.52) 1.S60 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> S 0.99 HN Overlap>> 1.E144 1.E144 C Shift Assignments>> C :: 173.142 CA :: 60.708 CB :: 62.015 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.002 HA :: 4.113 HB2 :: 1.695(A) HB3 :: 1.695(S) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 115.883 Ave N Shift Values>> N :: 116.28(3.52) 1.V61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 V 0.24 K 0.12 Q 0.09 M 0.07 R 0.03 H 0.03 E 0.01 P 0.01 I 0.01 HN Overlap>> 1.D172 1.D172 C Shift Assignments>> C :: 174.498 CA :: 60.135 CB :: 33.571 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.820 HB :: 1.832 HG11 :: 0.621 HG12 :: 0.621 HG13 :: 0.621 HG21 :: 0.950 HG22 :: 0.950 HG23 :: 0.950 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 125.344 Ave N Shift Values>> N :: 121.14(4.54) 1.P62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.5 P 0.28 C 0.17 I 0.01 C Shift Assignments>> C :: 176.902 CA :: 63.319 CB :: 33.195 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.294 HB2 :: 2.489 HB3 :: 1.746 HG2 :: 1.961 HG3 :: 1.961 HD2 :: 3.806 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.V63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.82 C 0.08 P 0.08 C Shift Assignments>> C :: 177.368 CA :: 67.516 CB :: 32.266 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.629 HA :: 3.386 HB :: 2.077 HG11 :: 1.133 HG12 :: 1.133 HG13 :: 1.133 HG21 :: 0.893 HG22 :: 0.893 HG23 :: 0.893 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 123.761 Ave N Shift Values>> N :: 121.14(4.54) 1.T64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 176.334 CA :: 65.250 CB :: 67.948 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.119 HA :: 3.847 HB :: 4.215 HG21 :: 1.261 HG22 :: 1.261 HG23 :: 1.261 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 108.292 Ave N Shift Values>> N :: 115.42(4.75) 1.E65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.36 C 0.34 I 0.1 K 0.09 Q 0.05 M 0.02 C Shift Assignments>> C :: 179.338 CA :: 58.647 CB :: 29.461 CG :: 36.077 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 6.694 HA :: 4.077 HB2 :: 2.012 HB3 :: 2.012 HG2 :: 2.232 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.639 Ave N Shift Values>> N :: 120.67(3.48) 1.L66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.29 L 0.18 K 0.14 F 0.12 Y 0.08 C 0.07 D 0.04 G 0.02 I 0.01 C Shift Assignments>> C :: 178.572 CA :: 57.841 CB :: 42.928 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.886 HA :: 3.970 HB2 :: 2.051 HB3 :: 1.606 HD11 :: 1.028 HD12 :: 1.028 HD13 :: 1.028 HD21 :: 0.738 HD22 :: 0.738 HD23 :: 0.738 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.215 Ave N Shift Values>> N :: 121.86(3.9) 1.V67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.68 P 0.16 C 0.1 I 0.04 C Shift Assignments>> C :: 176.127 CA :: 66.951 CB :: 31.312 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.355 HA :: 3.620 HB :: 2.050 HG11 :: 1.033 HG12 :: 1.033 HG13 :: 1.033 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 116.574 Ave N Shift Values>> N :: 121.14(4.54) 1.R68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.13 R 0.12 V 0.1 H 0.1 Q 0.06 K 0.06 I 0.05 M 0.04 P 0.01 C Shift Assignments>> CA :: 59.943 CB :: 30.634 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 7.378 HA :: 4.070 HB2 :: 1.849 HB3 :: 2.007 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 120.649 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.L69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.25 F 0.18 L 0.15 Y 0.13 R 0.09 C 0.08 D 0.06 I 0.02 C Shift Assignments>> C :: 178.900 CA :: 57.987 CB :: 41.951 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.036 HA :: 3.936 HB2 :: 1.736 HB3 :: 1.859 HG :: 0.804 HD11 :: 1.586 HD12 :: 1.586 HD13 :: 1.586 HD21 :: 0.852 HD22 :: 0.852 HD23 :: 0.852 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.314 Ave N Shift Values>> N :: 121.86(3.9) 1.F70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.27 C 0.21 F 0.21 I 0.14 E 0.08 M 0.01 D 0.01 N 0.01 L 0.01 C Shift Assignments>> C :: 176.436 CA :: 58.223 CB :: 38.030 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.077 HA :: 4.358 HB2 :: 3.185 HB3 :: 3.005 HD1 :: 6.810 HD2 :: 6.810 HE1 :: 6.924 HE2 :: 6.924 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 117.738 Ave N Shift Values>> N :: 120.45(4.18) 1.G71 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.78 C 0.08 L 0.04 A 0.03 P 0.03 C Shift Assignments>> C :: 172.723 CA :: 47.487 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.327 HA2 :: 2.859 HA3 :: 2.290(S) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.143 Ave N Shift Values>> N :: 109.67(3.87) 1.K72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 V 0.2 K 0.12 R 0.09 M 0.07 H 0.07 E 0.06 Q 0.03 P 0.02 C Shift Assignments>> C :: 178.444 CA :: 59.883 CB :: 32.260 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.381 HA :: 3.379 HB2 :: 1.730 HB3 :: 1.846 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.286 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.44 K 0.43 R 0.06 Q 0.02 V 0.02 C Shift Assignments>> C :: 178.320 CA :: 57.877 CB :: 32.618 CG :: 24.762 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.194 HA :: 3.863 HB2 :: 1.824 HB3 :: 1.859 HG2 :: 1.433 HG3 :: 1.240 HD2 :: 1.578 HD3 :: 1.578 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.168 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L74 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.48 L 0.4 A 0.11 C Shift Assignments>> C :: 177.212 CA :: 55.828 CB :: 40.777 CG :: 25.439 CD1 :: 22.182 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.867 HA :: 3.382 HB2 :: 0.294(S) HB3 :: 0.206(S) HG :: -0.419(S) HD11 :: -1.624(S) HD12 :: -1.624(S) HD13 :: -1.624(S) HD21 :: -3.093(A) HD22 :: -3.093(A) HD23 :: -3.093(A) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.681 Ave N Shift Values>> N :: 121.86(3.9) 1.F75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.64 C 0.14 Y 0.1 F 0.1 C Shift Assignments>> C :: 175.308 CA :: 63.189 CB :: 39.113 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 6.993 HB2 :: 2.630 HB3 :: 2.500 HE1 :: 6.482 HE2 :: 6.482 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 115.651 Ave N Shift Values>> N :: 120.45(4.18) 1.V76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.45 P 0.4 C 0.1 I 0.03 C Shift Assignments>> C :: 176.326 CA :: 65.241 CB :: 31.392 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.301 HA :: 3.143 HB :: 2.005 HG11 :: 1.050 HG12 :: 1.050 HG13 :: 1.050 HG21 :: 0.868 HG22 :: 0.868 HG23 :: 0.868 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 114.518 Ave N Shift Values>> N :: 121.14(4.54) 1.E77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.17 K 0.17 Q 0.15 E 0.14 H 0.12 R 0.09 I 0.08 M 0.02 L 0.01 C Shift Assignments>> C :: 180.863 CA :: 58.265 CB :: 28.755 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 6.615 HA :: 3.854 HB2 :: 1.638 HB3 :: 1.765 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.720 Ave N Shift Values>> N :: 120.67(3.48) 1.L78 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.58 L 0.37 A 0.03 C Shift Assignments>> C :: 179.806 CA :: 57.639 CB :: 40.428 CG :: 25.805 CD1 :: 23.914 CD2 :: 21.267 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.688 HA :: 3.970 HB2 :: 2.690 HB3 :: 0.826 HG :: 0.573 HD11 :: -2.380(A) HD12 :: -2.380(A) HD13 :: -2.380(A) HD21 :: 0.234 HD22 :: 0.234 HD23 :: 0.234 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.362 Ave N Shift Values>> N :: 121.86(3.9) 1.I79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.63 C 0.36 C Shift Assignments>> C :: 178.627 CA :: 62.206 CB :: 36.541 CG1 :: 27.916 CG2 :: 17.828 CD1 :: 11.142 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.587 HA :: 3.833 HB :: 1.207 HG12 :: 0.753 HG13 :: 0.721 HG21 :: 0.373 HG22 :: 0.373 HG23 :: 0.373 HD11 :: 0.617 HD12 :: 0.617 HD13 :: 0.617 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.163 Ave N Shift Values>> N :: 121.46(4.28) 1.E80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 E 0.28 I 0.27 K 0.03 HN Overlap>> 1.E47 1.E47 C Shift Assignments>> C :: 178.815 CA :: 58.773 CB :: 28.846 CG :: 37.307 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.246 HA :: 3.942 HB2 :: 1.949 HB3 :: 1.904 HG2 :: 2.477 HG3 :: 2.156 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.583 Ave N Shift Values>> N :: 120.67(3.48) 1.G81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.71 L 0.16 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.236 CA :: 44.911 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.562 HA2 :: 4.031 HA3 :: 3.649 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 103.555 Ave N Shift Values>> N :: 109.67(3.87) 1.H82 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 172.699 CA :: 55.085 CB :: 29.479 CE1 :: 130.072(S) Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 7.231 HA :: 5.175 HB2 :: 3.502 HB3 :: 3.224 HD2 :: 7.423 HE1 :: 5.063(S) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 116.408 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.P83 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Indeterminable PRTL>> G 0.47 C 0.47 I 0.03 R 0.01 C Shift Assignments>> C :: 177.891 CA :: 65.354 CB :: 31.503 CD :: 43.184(S) Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.462 HB2 :: 2.039 HB3 :: 2.387 HD2 :: 3.402 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.E84 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.36 I 0.33 E 0.24 K 0.03 C Shift Assignments>> C :: 179.357 CA :: 59.687 CB :: 28.572 CG :: 36.885 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 9.306 HA :: 4.146 HB2 :: 2.099 HB3 :: 2.230 HG2 :: 2.419 HG3 :: 3.391(S) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 116.823 Ave N Shift Values>> N :: 120.67(3.48) 1.I85 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> I 0.86 C 0.13 C Shift Assignments>> C :: 177.061 CA :: 64.237 CB :: 39.366 CD1 :: 12.513 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.570 HA :: 4.213 HB :: 0.958 HG12 :: 1.337 HG13 :: 1.337 HG21 :: 2.162(S) HG22 :: 2.162(S) HG23 :: 2.162(S) HD11 :: 0.778 HD12 :: 0.778 HD13 :: 0.778 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 118.634 Ave N Shift Values>> N :: 121.46(4.28) 1.A86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 M 0.16 C 0.1 L 0.1 V 0.04 T 0.01 I 0.01 C Shift Assignments>> C :: 180.227 CA :: 55.377 CB :: 20.230 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.185 HA :: 4.025 HB1 :: 1.597 HB2 :: 1.597 HB3 :: 1.597 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.131 Ave N Shift Values>> N :: 123.23(3.54) 1.N87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.23 Y 0.19 F 0.16 C 0.15 D 0.11 L 0.04 E 0.03 I 0.02 M 0.01 C Shift Assignments>> C :: 176.144 CA :: 55.395 CB :: 38.477 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.578 HA :: 4.543 HB2 :: 2.958 HB3 :: 2.867 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 113.595 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.34 C 0.27 Q 0.14 K 0.11 M 0.1 I 0.01 C Shift Assignments>> C :: 176.161 CA :: 55.923 CB :: 30.016 CG :: 35.635 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.559 HA :: 4.259 HB2 :: 2.091 HB3 :: 1.854 HG2 :: 2.301 HG3 :: 2.301 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 115.440 Ave N Shift Values>> N :: 120.67(3.48) 1.M89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.53 C 0.29 Q 0.13 E 0.02 C Shift Assignments>> C :: 176.241 CA :: 53.682 CB :: 33.839 CG :: 32.446 Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 7.625 HA :: 4.872 HB2 :: 2.690 HB3 :: 2.690 HG2 :: 2.832 HG3 :: 2.787 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 117.191 Ave N Shift Values>> N :: 120.09(3.57) 1.K90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.52 C 0.47 C Shift Assignments>> C :: 175.808 CA :: 56.929 CB :: 33.471 CG :: 24.765 CD :: 28.535 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 9.562 HA :: 4.435 HB2 :: 1.928 HB3 :: 1.646 HG2 :: 1.462 HG3 :: 1.372 HD2 :: 1.595 HD3 :: 1.610 HE2 :: 2.954 HE3 :: 2.954 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.073 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 D 0.28 R 0.13 K 0.08 N 0.05 C 0.04 F 0.03 G 0.03 Y 0.02 HN Overlap>> 1.E152 1.E152 C Shift Assignments>> C :: 175.092 CA :: 52.582 CB :: 42.597 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.508 HA :: 4.288 HB2 :: 2.945 HB3 :: 2.801 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 115.736 Ave N Shift Values>> N :: 120.65(3.86) 1.S92 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.718 CA :: 61.333 CB :: 62.276 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.140 HA :: 3.118(S) HB2 :: 3.745 HB3 :: 3.474 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.090 Ave N Shift Values>> N :: 116.28(3.52) 1.F93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.24 Y 0.15 I 0.12 F 0.09 M 0.04 K 0.02 V 0.01 C Shift Assignments>> C :: 178.755 CA :: 58.865 CB :: 36.610 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.545 HA :: 4.379 HB2 :: 3.172 HB3 :: 2.776 HD1 :: 6.946 HE1 :: 6.551 HE2 :: 6.551 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 124.347 Ave N Shift Values>> N :: 120.45(4.18) 1.D94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.22 K 0.19 L 0.18 F 0.13 Y 0.09 C 0.07 D 0.06 I 0.01 G 0.01 HN Overlap>> 1.L31 1.L31 C Shift Assignments>> C :: 178.430 CA :: 57.619 CB :: 42.582 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.414 HA :: 4.354 HB2 :: 2.815 HB3 :: 2.738 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 124.519 Ave N Shift Values>> N :: 120.65(3.86) 1.L95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.26 Y 0.21 I 0.21 C 0.14 K 0.1 L 0.02 R 0.01 HN Overlap>> 1.V107 1.V107 C Shift Assignments>> C :: 180.095 CA :: 60.687 CB :: 41.340 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.775 HA :: 4.362 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 119.315 Ave N Shift Values>> N :: 121.86(3.9) 1.L96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.41 L 0.33 C 0.2 I 0.03 R 0.01 C Shift Assignments>> C :: 178.689 CA :: 57.854 CB :: 41.287 CD1 :: 24.606 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.452 HA :: 3.864 HG :: 2.278 HD11 :: 0.895 HD12 :: 0.895 HD13 :: 0.895 HD21 :: 0.689 HD22 :: 0.689 HD23 :: 0.689 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.851 Ave N Shift Values>> N :: 121.86(3.9) 1.S97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.120 CA :: 60.495 CB :: 63.383 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.972 HA :: 4.398 HB2 :: 4.065 HB3 :: 3.908 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 111.634 Ave N Shift Values>> N :: 116.28(3.52) 1.K98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 E 0.24 Q 0.22 K 0.2 I 0.02 R 0.02 M 0.01 C Shift Assignments>> C :: 177.699 CA :: 56.142 CB :: 35.194 CD :: 28.555 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.794 HA :: 4.555 HB2 :: 1.878 HD2 :: 1.325 HD3 :: 1.557 HE2 :: 2.678 HE3 :: 2.601 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.868 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.I99 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.79 I 0.2 C Shift Assignments>> C :: 175.168 CA :: 65.745 CB :: 37.996 CG2 :: 14.289 CD1 :: 16.907 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.326 HA :: 2.693 HB :: 1.081 HG12 :: 0.959 HG13 :: 0.215 HG21 :: 0.410 HG22 :: 0.410 HG23 :: 0.410 HD11 :: -1.324(A) HD12 :: -1.324(A) HD13 :: -1.324(A) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.722 Ave N Shift Values>> N :: 121.46(4.28) 1.D100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.72 L 0.14 C 0.07 F 0.01 C Shift Assignments>> C :: 177.235 CA :: 56.833 CB :: 45.849 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.776 HA :: 3.954 HB2 :: 2.884 HB3 :: 2.468 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 116.018 Ave N Shift Values>> N :: 120.65(3.86) 1.S101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.967 CA :: 58.972 CB :: 63.609 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.906 HA :: 4.105 HB2 :: 3.849 HB3 :: 3.849 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 107.647 Ave N Shift Values>> N :: 116.28(3.52) 1.F102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 K 0.18 Y 0.17 C 0.13 I 0.11 R 0.08 L 0.05 D 0.01 C Shift Assignments>> C :: 174.082 CA :: 60.221 CB :: 42.078 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.567 HA :: 4.713 HB2 :: 2.989 HB3 :: 3.131 HD1 :: 7.132 HD2 :: 7.132 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 120.363 Ave N Shift Values>> N :: 120.45(4.18) 1.I103 Overall: Mistyped Typing: Mistyped SRO: Suspicious C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 176.811 CA :: 66.120 CB :: 36.882 CG1 :: 13.406(S) CG2 :: 13.847 CD1 :: 15.630 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.431 HA :: 2.727 HB :: 1.599 HG12 :: 1.103 HG13 :: 1.068 HG21 :: 0.878 HG22 :: 0.878 HG23 :: 0.878 HD11 :: -0.136 HD12 :: -0.136 HD13 :: -0.136 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 120.210 Ave N Shift Values>> N :: 121.46(4.28) SRO Rule Breaks>> (CG1 > CG2 : 0.9944) (CG1 > CD1 : 0.9935) 1.H104 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> R 0.22 L 0.21 Q 0.15 C 0.13 H 0.1 K 0.08 E 0.06 I 0.01 M 0.01 C Shift Assignments>> C :: 176.889 CA :: 55.440 CB :: 27.501 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.050 HA :: 3.061(S) HB2 :: 2.205 HB3 :: 1.789(S) HE1 :: 7.761 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 112.749 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.V105 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.64 P 0.24 C 0.09 C Shift Assignments>> C :: 177.763 CA :: 66.117 CB :: 32.373 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 5.711(S) HA :: 3.404 HG11 :: 0.762 HG12 :: 0.762 HG13 :: 0.762 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.140 Ave N Shift Values>> N :: 121.14(4.54) 1.E106 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.18 K 0.16 E 0.15 Q 0.13 H 0.11 R 0.1 I 0.09 M 0.02 L 0.01 C Shift Assignments>> C :: 177.782 CA :: 58.656 CB :: 28.940 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.948 HA :: 3.645 HB2 :: 1.524 HB3 :: 2.644 HG2 :: 1.746 HG3 :: 1.431(S) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.349 Ave N Shift Values>> N :: 120.67(3.48) 1.V107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.65 P 0.21 C 0.09 I 0.02 HN Overlap>> 1.L95 1.L95 C Shift Assignments>> C :: 176.175 CA :: 66.582 CB :: 31.691 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 7.837 HA :: 3.621 HB :: 1.829 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 119.229 Ave N Shift Values>> N :: 121.14(4.54) 1.Y108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.25 C 0.22 F 0.19 I 0.18 E 0.09 M 0.01 C Shift Assignments>> C :: 176.940 CA :: 58.858 CB :: 37.821 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.327 HA :: 4.231 HB2 :: 3.393 HB3 :: 3.499 HD1 :: 6.981 HD2 :: 6.981 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 120.901 Ave N Shift Values>> N :: 120.52(4.2) 1.K109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 K 0.28 Q 0.19 M 0.09 R 0.04 E 0.01 C Shift Assignments>> C :: 178.793 CA :: 58.890 CB :: 32.629 CD :: 29.603 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.230 HA :: 3.703 HB2 :: 1.730 HB3 :: 1.535 HG2 :: 1.404 HG3 :: 1.262 HD2 :: 1.562 HD3 :: 1.429 HE2 :: 2.796 HE3 :: 2.655 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 115.333 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.L110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.23 R 0.2 K 0.19 F 0.11 D 0.09 Y 0.07 C 0.05 C Shift Assignments>> C :: 177.372 CA :: 56.711 CB :: 42.514 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.063 HA :: 3.829 HB2 :: 1.373 HB3 :: 0.531 HG :: 0.971 HD11 :: 0.961 HD12 :: 0.961 HD13 :: 0.961 HD21 :: 0.777 HD22 :: 0.777 HD23 :: 0.777 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.165 Ave N Shift Values>> N :: 121.86(3.9) 1.Y111 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.55 C 0.44 C Shift Assignments>> C :: 172.396 CA :: 52.837 CB :: 38.737 CE1 :: 130.012(S) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.329 HA :: 5.190 HB2 :: 3.054 HB3 :: 2.882 HE1 :: 6.708 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 117.867 Ave N Shift Values>> N :: 120.52(4.2) 1.P112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.59 G 0.26 P 0.13 C Shift Assignments>> C :: 177.146 CA :: 64.183 CB :: 31.396 CD :: 47.618 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.081 HB2 :: 1.840 HB3 :: 2.140 HD2 :: 3.312 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.Q113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.32 K 0.25 C 0.24 R 0.09 E 0.05 M 0.02 C Shift Assignments>> C :: 176.317 CA :: 55.504 CB :: 28.178 CG :: 33.886 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 9.741 HA :: 4.497 HB2 :: 2.223 HB3 :: 2.896 HG2 :: 2.257 HG3 :: 2.486 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 117.268 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.86 M 0.08 C 0.02 L 0.02 C Shift Assignments>> C :: 177.245 CA :: 53.060 CB :: 19.823 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.787 HA :: 4.569 HB1 :: 1.709 HB2 :: 1.709 HB3 :: 1.709 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 127.911 Ave N Shift Values>> N :: 123.23(3.54) 1.E115 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> H 0.18 R 0.16 Q 0.16 E 0.15 C 0.13 K 0.1 M 0.07 C Shift Assignments>> C :: 174.177 CA :: 55.997 CB :: 29.992 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 10.895(S) HA :: 4.409 HB2 :: 2.299 HB3 :: 2.178 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 127.264 Ave N Shift Values>> N :: 120.67(3.48) 1.L116 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.66 L 0.15 C 0.15 G 0.02 C Shift Assignments>> C :: 174.586 CA :: 50.876 CB :: 41.824 CG :: 25.697 CD1 :: 21.621 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.770 HA :: 4.227 HB2 :: 2.914(S) HG :: -0.044(S) HD11 :: -1.179(S) HD12 :: -1.179(S) HD13 :: -1.179(S) HD21 :: 0.851 HD22 :: 0.851 HD23 :: 0.851 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.663 Ave N Shift Values>> N :: 121.86(3.9) 1.P117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.28 V 0.21 I 0.15 P 0.14 E 0.05 R 0.04 H 0.03 Q 0.02 K 0.02 M 0.01 C Shift Assignments>> C :: 174.205 CA :: 61.815 CB :: 30.338 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.391 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.K118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.25 Q 0.21 C 0.2 K 0.14 E 0.07 H 0.03 R 0.03 N 0.01 Y 0.01 C Shift Assignments>> C :: 173.957 CA :: 54.594 CB :: 34.506 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.241 HA :: 4.366 HB2 :: 1.337 HB3 :: 1.533 HG2 :: 1.091 HG3 :: 1.091 HE2 :: 2.687 HE3 :: 2.613 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.475 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.F119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.41 L 0.25 R 0.14 C 0.07 F 0.04 Y 0.02 D 0.02 C Shift Assignments>> C :: 176.137 CA :: 56.761 CB :: 44.695 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.884 HA :: 5.706 HB2 :: 2.848 HB3 :: 2.416 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.647 Ave N Shift Values>> N :: 120.45(4.18) 1.T120 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 180.604(S) CA :: 61.877 CB :: 70.717 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.275 HA :: 4.838 HB :: 4.646 HG21 :: 0.865 HG22 :: 0.865 HG23 :: 0.865 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 113.588 Ave N Shift Values>> N :: 115.42(4.75) 1.C121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.17 Q 0.16 E 0.15 C 0.14 H 0.14 R 0.11 I 0.03 M 0.03 L 0.01 C Shift Assignments>> C :: 172.596 CA :: 57.356 CB :: 29.099 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> HA :: 5.234 HB2 :: 2.909 HB3 :: 2.472 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) 1.D122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.33 R 0.21 G 0.18 D 0.14 C 0.04 F 0.02 K 0.01 Y 0.01 N 0.01 HN Overlap>> 1.I160 1.I160 C Shift Assignments>> C :: 174.080 CA :: 53.183 CB :: 43.709 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 9.152 HA :: 4.968 HB2 :: 2.554 HB3 :: 2.492 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 128.657 Ave N Shift Values>> N :: 120.65(3.86) 1.R123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.18 R 0.17 Q 0.15 E 0.14 C 0.13 M 0.09 K 0.08 C Shift Assignments>> C :: 175.188 CA :: 55.678 CB :: 30.194 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.063 HA :: 4.438 HB2 :: 2.103 HB3 :: 1.605 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 125.905 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.L124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.56 C 0.35 A 0.06 G 0.01 C Shift Assignments>> C :: 176.855 CA :: 55.346 CB :: 42.158 CG :: 27.378 CD1 :: 22.574 CD2 :: 22.724 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.023 HA :: 4.373 HB2 :: 1.571 HB3 :: 1.353 HG :: 1.500 HD11 :: 0.760 HD12 :: 0.760 HD13 :: 0.760 HD21 :: 0.694 HD22 :: 0.694 HD23 :: 0.694 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 129.501 Ave N Shift Values>> N :: 121.86(3.9) 1.G125 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.71 L 0.16 R 0.04 C 0.03 F 0.01 D 0.01 C Shift Assignments>> C :: 173.911 CA :: 44.900 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.152 HA2 :: 4.141 HA3 :: 4.244 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 106.655 Ave N Shift Values>> N :: 109.67(3.87) 1.D126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.24 Y 0.2 L 0.13 K 0.13 C 0.1 D 0.09 I 0.04 N 0.01 R 0.01 C Shift Assignments>> C :: 177.496 CA :: 57.627 CB :: 40.922 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.293 HA :: 4.348 HB2 :: 2.573 HB3 :: 2.462 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.991 Ave N Shift Values>> N :: 120.65(3.86) 1.N127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.35 N 0.31 L 0.13 F 0.06 C 0.05 Y 0.04 K 0.01 C Shift Assignments>> C :: 173.182 CA :: 52.607 CB :: 40.452 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.142 HA :: 4.832 HB2 :: 3.524 HB3 :: 2.552 HD21 :: 6.544 HD22 :: 6.544 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 112.694 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.D128 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> G 0.8 L 0.13 C 0.03 D 0.01 C Shift Assignments>> C :: 173.582 CA :: 53.768 CB :: 45.724 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.002 HA :: 5.926(S) HB2 :: 2.453 HB3 :: 2.282 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 117.952 Ave N Shift Values>> N :: 120.65(3.86) 1.I129 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 G 0.24 I 0.06 HN Overlap>> 1.Y43 1.Y43 C Shift Assignments>> C :: 172.200 CA :: 60.063 CB :: 43.926 CG1 :: 30.322 CG2 :: 18.168 CD1 :: 14.369 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.330 HA :: 4.650 HB :: 0.875 HG12 :: 1.168 HG13 :: 0.633 HG21 :: 0.274 HG22 :: 0.274 HG23 :: 0.274 HD11 :: -0.057 HD12 :: -0.057 HD13 :: -0.057 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.786 Ave N Shift Values>> N :: 121.46(4.28) 1.R130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 R 0.24 G 0.21 K 0.07 C Shift Assignments>> C :: 174.773 CA :: 54.626 CB :: 33.582 CD :: 43.796 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.775 HA :: 5.418 HB2 :: 1.798 HB3 :: 1.751 HG2 :: 1.395 HG3 :: 1.507 HD2 :: 3.137 HD3 :: 3.137 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 128.124 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.L131 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.79 G 0.19 C 0.01 C Shift Assignments>> C :: 174.082 CA :: 53.055 CB :: 47.053 CG :: 17.966(S) Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 9.534 HA :: 5.419 HB2 :: 2.106 HB3 :: 1.560 HG :: 1.726 HD11 :: 1.161 HD12 :: 1.161 HD13 :: 1.161 HD21 :: 0.838 HD22 :: 0.838 HD23 :: 0.838 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 128.531 Ave N Shift Values>> N :: 121.86(3.9) 1.H132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.26 C 0.19 H 0.15 R 0.14 K 0.12 Q 0.05 E 0.04 P 0.01 C Shift Assignments>> C :: 174.163 CA :: 53.080 CB :: 31.936 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 9.500 HA :: 5.534 HB2 :: 2.828 HB3 :: 3.466 HD2 :: 7.114 Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 126.133 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.Y133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.2 L 0.19 F 0.17 D 0.14 Y 0.13 C 0.07 R 0.03 I 0.01 N 0.01 C Shift Assignments>> C :: 172.740 CA :: 56.792 CB :: 41.371 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 9.870 HA :: 4.260 HB2 :: 3.229 HB3 :: 3.013 HD1 :: 6.987 HD2 :: 6.987 HE1 :: 6.618 HE2 :: 6.618 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 131.679 Ave N Shift Values>> N :: 120.52(4.2) 1.Q134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 M 0.33 E 0.07 Q 0.02 C Shift Assignments>> C :: 174.342 CA :: 54.437 CB :: 33.812 CG :: 35.268 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.014 HA :: 4.737 HB2 :: 1.331 HB3 :: 1.562 HG2 :: 1.878 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 124.774 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.S135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.026 CA :: 56.287 CB :: 64.037 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.744 HA :: 4.373 HB2 :: 3.548 HB3 :: 3.548 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 118.113 Ave N Shift Values>> N :: 116.28(3.52) 1.K136 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.82 G 0.17 C Shift Assignments>> C :: 177.229 CA :: 56.721 CB :: 33.063 CG :: 24.919 CE :: 47.099(S) Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.689 HA :: 4.280 HB2 :: 1.813 HB3 :: 1.646 HG2 :: 1.420 HG3 :: 1.420 HD2 :: 1.425 HD3 :: 1.425 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.721 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.R137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.21 C 0.19 H 0.14 P 0.14 R 0.13 K 0.08 Q 0.05 E 0.03 C Shift Assignments>> C :: 173.610 CA :: 52.267 CB :: 31.634 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.996 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 121.925 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.P138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.49 C 0.26 K 0.05 E 0.04 R 0.03 H 0.03 Q 0.03 V 0.02 C Shift Assignments>> C :: 175.748 CA :: 61.570 CB :: 28.390 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.866 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.F139 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> F 0.28 Y 0.26 C 0.12 L 0.09 D 0.09 I 0.07 K 0.03 N 0.01 C Shift Assignments>> C :: 177.396 CA :: 57.651 CB :: 40.159 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.816 HA :: 5.371 HB2 :: 4.374(S) HB3 :: 3.623 HD1 :: 7.117 HD2 :: 7.117 HE1 :: 6.645 HE2 :: 6.645 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 121.365 Ave N Shift Values>> N :: 120.45(4.18) 1.A140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.33 A 0.2 C 0.13 V 0.13 I 0.09 T 0.04 L 0.04 C Shift Assignments>> C :: 180.251 CA :: 56.959 CB :: 19.690 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 9.087 HA :: 3.451 HB1 :: 1.483 HB2 :: 1.483 HB3 :: 1.483 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.569 Ave N Shift Values>> N :: 123.23(3.54) 1.S141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.26 T 0.23 P 0.19 I 0.18 C 0.05 F 0.01 Y 0.01 S 0.01 C Shift Assignments>> C :: 175.596 CA :: 62.758 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.361 HA :: 4.491 HB2 :: 4.043 HB3 :: 4.043 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 112.836 Ave N Shift Values>> N :: 116.28(3.52) 1.F142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.29 F 0.29 I 0.19 C 0.15 L 0.02 D 0.02 C Shift Assignments>> C :: 176.783 CA :: 59.166 CB :: 39.611 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.262 HA :: 3.940 HB2 :: 3.800 HB3 :: 2.833 HD1 :: 6.665 HD2 :: 6.665 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 123.330 Ave N Shift Values>> N :: 120.45(4.18) 1.A143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.69 A 0.21 I 0.06 C 0.02 C Shift Assignments>> C :: 178.510 CA :: 55.689 CB :: 17.421 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.196 HA :: 4.261 HB1 :: 2.067 HB2 :: 2.067 HB3 :: 2.067 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 120.337 Ave N Shift Values>> N :: 123.23(3.54) 1.E144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 I 0.17 E 0.11 R 0.08 H 0.08 V 0.07 K 0.07 Q 0.06 M 0.01 P 0.01 HN Overlap>> 1.S60 1.S60 C Shift Assignments>> C :: 177.882 CA :: 60.564 CB :: 29.768 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.106 HA :: 3.391 HB2 :: 2.449 HB3 :: 1.834 HG2 :: 2.437 HG3 :: 2.437 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 115.891 Ave N Shift Values>> N :: 120.67(3.48) 1.G145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.35 P 0.33 A 0.13 C 0.09 N 0.04 L 0.01 D 0.01 C Shift Assignments>> C :: 175.184 CA :: 48.196 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 7.553 HA2 :: 4.311 HA3 :: 3.733 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 105.549 Ave N Shift Values>> N :: 109.67(3.87) 1.L146 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> L 0.52 C 0.43 K 0.03 C Shift Assignments>> C :: 179.050 CA :: 58.037 CB :: 41.312 CG :: 25.719 CD1 :: 24.749 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.733 HA :: 3.093 HB2 :: 0.123(S) HB3 :: 1.247 HG :: -0.624(S) HD11 :: -3.095(A) HD12 :: -3.095(A) HD13 :: -3.095(A) HD21 :: -1.621(S) HD22 :: -1.621(S) HD23 :: -1.621(S) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 124.432 Ave N Shift Values>> N :: 121.86(3.9) 1.L147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.25 F 0.19 Y 0.14 L 0.13 R 0.09 C 0.08 D 0.05 I 0.03 C Shift Assignments>> C :: 178.117 CA :: 58.291 CB :: 41.971 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.043 HA :: 3.822 HB2 :: 2.026 HB3 :: 2.272 HG :: 0.841 HD11 :: 1.140 HD12 :: 1.140 HD13 :: 1.140 HD21 :: 0.340 HD22 :: 0.340 HD23 :: 0.340 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.366 Ave N Shift Values>> N :: 121.86(3.9) 1.D148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 Y 0.2 L 0.15 D 0.13 K 0.1 C 0.09 I 0.03 N 0.02 C Shift Assignments>> C :: 180.303 CA :: 57.039 CB :: 40.740 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.784 HA :: 4.228 HB2 :: 2.911 HB3 :: 2.423 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.002 Ave N Shift Values>> N :: 120.65(3.86) 1.G149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.85 C 0.07 L 0.04 A 0.01 C Shift Assignments>> C :: 174.557 CA :: 47.154 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.598 HA2 :: 3.543 HA3 :: 3.396 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 109.194 Ave N Shift Values>> N :: 109.67(3.87) 1.C150 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.41 C 0.24 P 0.19 K 0.05 R 0.04 L 0.01 Q 0.01 C Shift Assignments>> C :: 175.248 CA :: 61.529 CB :: 25.964 Ave C Shift Values>> C :: 174.95(2.07) CA :: 58.3(3.33) CB :: 32.49(6.01) H Shift Assignments>> H :: 8.086 HA :: 3.147 HB2 :: 2.122 HB3 :: 2.122 Ave H Shift Values>> H :: 8.39(0.67) HA :: 4.66(0.55) HB2 :: 2.96(0.44) HB3 :: 2.89(0.46) HG :: 1.98(1.38) N Shift Assignments>> N :: 126.041 Ave N Shift Values>> N :: 120.17(4.64) 1.A151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.77 A 0.12 I 0.08 C 0.02 C Shift Assignments>> C :: 179.480 CA :: 56.103 CB :: 16.763 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.651 HA :: 3.147 HB1 :: 0.499 HB2 :: 0.499 HB3 :: 0.499 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 121.521 Ave N Shift Values>> N :: 123.23(3.54) 1.E152 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.36 E 0.34 I 0.13 K 0.08 Q 0.04 M 0.01 HN Overlap>> 1.D91 1.D91 C Shift Assignments>> C :: 180.003 CA :: 59.226 CB :: 29.480 CG :: 36.106 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.486 HA :: 3.930 HB2 :: 2.027 HB3 :: 2.191 HG2 :: 3.455(S) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 115.662 Ave N Shift Values>> N :: 120.67(3.48) 1.Y153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.53 C 0.23 F 0.23 C Shift Assignments>> C :: 177.079 CA :: 61.443 CB :: 39.271 CD1 :: 132.949 CD2 :: 132.949 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.366 HA :: 4.026 HB2 :: 3.109 HB3 :: 3.076 HD1 :: 6.452 HD2 :: 6.452 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 122.454 Ave N Shift Values>> N :: 120.52(4.2) 1.F154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.49 C 0.25 F 0.24 HN Overlap>> 1.V58 1.V58 C Shift Assignments>> C :: 173.602 CA :: 59.499 CB :: 39.128 CD1 :: 133.199 CD2 :: 133.199 CE1 :: 131.027 CE2 :: 131.027 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.809 HA :: 4.278 HB2 :: 3.647 HB3 :: 2.630 HD1 :: 7.749 HD2 :: 7.749 HE1 :: 7.436 HE2 :: 7.436 HZ :: 7.205 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 114.586 Ave N Shift Values>> N :: 120.45(4.18) 1.K155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.47 L 0.33 K 0.13 R 0.05 C Shift Assignments>> C :: 175.296 CA :: 57.057 CB :: 28.522 CG :: 24.969 CE :: 41.589 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.950 HA :: 3.748 HB2 :: 2.122 HB3 :: 1.793 HG2 :: 1.293 HG3 :: 1.259 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 117.824 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.74 M 0.18 E 0.05 C Shift Assignments>> C :: 174.540 CA :: 54.479 CB :: 34.381 CG :: 35.829 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.543 HA :: 4.584 HB2 :: 1.814 HB3 :: 1.624 HG2 :: 1.596 HG3 :: 2.281 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.472 Ave N Shift Values>> N :: 120.67(3.48) 1.D157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 D 0.26 R 0.14 K 0.1 F 0.04 C 0.04 N 0.04 Y 0.02 G 0.02 HN Overlap>> 1.E170 1.E170 C Shift Assignments>> C :: 176.202 CA :: 53.303 CB :: 42.562 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.684 HA :: 4.885 HB2 :: 2.593 HB3 :: 2.417 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 118.843 Ave N Shift Values>> N :: 120.65(3.86) 1.F158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 Y 0.16 F 0.15 C Shift Assignments>> C :: 176.761 CA :: 52.721 CB :: 39.706 CD1 :: 129.533 CD2 :: 129.533 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.954 HA :: 5.792 HB2 :: 3.232 HB3 :: 2.920 HD1 :: 6.932 HD2 :: 6.932 HE1 :: 7.402 HE2 :: 7.402 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 123.347 Ave N Shift Values>> N :: 120.45(4.18) 1.T159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.812 CA :: 62.610 CB :: 69.679 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 9.132 HA :: 4.498 HB :: 4.038 HG1 :: 1.200 HG21 :: 1.180 HG22 :: 1.180 HG23 :: 1.180 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 119.070 Ave N Shift Values>> N :: 115.42(4.75) 1.I160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.61 C 0.38 HN Overlap>> 1.D122 1.D122 C Shift Assignments>> C :: 175.375 CA :: 60.790 CB :: 40.451 CG1 :: 27.897 CG2 :: 17.989 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.136 HA :: 4.836 HB :: 1.834 HG21 :: 0.854 HG22 :: 0.854 HG23 :: 0.854 HD11 :: 0.951 HD12 :: 0.951 HD13 :: 0.951 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 128.725 Ave N Shift Values>> N :: 121.46(4.28) 1.S161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 T 0.01 C Shift Assignments>> C :: 173.606 CA :: 56.563 CB :: 65.706 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 9.075 HA :: 5.001 HB2 :: 3.887 HB3 :: 3.887 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 122.058 Ave N Shift Values>> N :: 116.28(3.52) 1.R162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.22 R 0.16 H 0.15 C 0.15 K 0.14 E 0.08 Q 0.07 C Shift Assignments>> C :: 178.282 CA :: 54.862 CB :: 31.739 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.985 HA :: 5.301 HB2 :: 1.559 HB3 :: 1.948 HG2 :: 1.258 HG3 :: 1.258 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.750 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.T163 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> T 0.92 S 0.07 C Shift Assignments>> C :: 174.150 CA :: 60.048 CB :: 67.677 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.372 HA :: 4.431 HB :: 1.705(S) HG21 :: 1.200 HG22 :: 1.200 HG23 :: 1.200 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.711 Ave N Shift Values>> N :: 115.42(4.75) 1.P164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.79 C 0.18 C Shift Assignments>> C :: 179.370 CA :: 65.387 CB :: 31.578 CG :: 28.178 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.259 HB2 :: 2.351 HB3 :: 1.902 HD2 :: 4.106 HD3 :: 4.106 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.E165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.19 K 0.15 I 0.13 Q 0.13 E 0.12 R 0.1 H 0.1 L 0.03 M 0.01 C Shift Assignments>> C :: 177.409 CA :: 58.791 CB :: 28.346 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.937 HA :: 4.235 HB2 :: 2.063 HB3 :: 2.174 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 113.712 Ave N Shift Values>> N :: 120.67(3.48) 1.T166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.858 CA :: 61.313 CB :: 69.853 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 7.867 HA :: 4.711 HB :: 5.167 HG21 :: 0.986 HG22 :: 0.986 HG23 :: 0.986 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 108.164 Ave N Shift Values>> N :: 115.42(4.75) 1.Q167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 K 0.29 Q 0.21 R 0.09 M 0.05 E 0.01 C Shift Assignments>> C :: 176.262 CA :: 58.580 CB :: 28.806 CG :: 32.864 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.161 HA :: 3.824 HB2 :: 2.120 HB3 :: 1.967 HG2 :: 2.481 HG3 :: 2.356 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 119.267 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D168 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.33 L 0.19 N 0.16 F 0.09 Y 0.07 C 0.06 K 0.05 C Shift Assignments>> C :: 175.612 CA :: 54.057 CB :: 40.761 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.307 HA :: 4.687 HB2 :: 2.770 HB3 :: 2.559 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 115.447 Ave N Shift Values>> N :: 120.65(3.86) 1.S169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 173.580 CA :: 56.992 CB :: 64.479 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.343 HA :: 4.455 HB2 :: 3.862 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.725 Ave N Shift Values>> N :: 116.28(3.52) 1.E170 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 M 0.32 E 0.24 Q 0.02 HN Overlap>> 1.D157 1.D157 C Shift Assignments>> C :: 175.767 CA :: 54.879 CB :: 32.315 CG :: 36.248 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.585 HA :: 4.900 HB2 :: 2.476 HB3 :: 2.404 HG2 :: 2.437 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.807 Ave N Shift Values>> N :: 120.67(3.48) 1.T171 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.375 CA :: 61.989 CB :: 70.789 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.474 HA :: 5.761 HB :: 6.306(S) HG21 :: 0.956 HG22 :: 0.956 HG23 :: 0.956 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 108.061 Ave N Shift Values>> N :: 115.42(4.75) 1.D172 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 L 0.2 N 0.14 F 0.09 K 0.07 Y 0.06 C 0.05 HN Overlap>> 1.V61 1.V61 C Shift Assignments>> C :: 175.112 CA :: 53.949 CB :: 40.921 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 7.824 HA :: 5.510 HB2 :: 2.846 HB3 :: 2.361 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 125.370 Ave N Shift Values>> N :: 120.65(3.86) 1.V173 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.84 I 0.09 V 0.05 C Shift Assignments>> C :: 173.698 CA :: 61.220 CB :: 38.064 CG1 :: 21.283 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.939 HA :: 4.211 HB :: 1.413 HG11 :: -0.032(S) HG12 :: -0.032(S) HG13 :: -0.032(S) HG21 :: 0.854 HG22 :: 0.854 HG23 :: 0.854 Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.876 Ave N Shift Values>> N :: 121.14(4.54) 1.I174 Overall: Suspicious Typing: Suspicious SRO: Suspicious C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.99 C Shift Assignments>> C :: 173.740 CA :: 60.733 CB :: 37.388 CG1 :: 13.426(S) CG2 :: 18.180 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 7.910 HA :: 4.431 HB :: 1.695 HG12 :: 0.431 HG13 :: 1.195 HG21 :: 0.533 HG22 :: 0.533 HG23 :: 0.533 HD11 :: 0.060 HD12 :: 0.060 HD13 :: 0.060 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.189 Ave N Shift Values>> N :: 121.46(4.28) SRO Rule Breaks>> (CG1 > CG2 : 0.9944) 1.F175 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.21 D 0.19 K 0.17 F 0.15 Y 0.12 C 0.06 N 0.03 R 0.02 I 0.01 C Shift Assignments>> C :: 175.607 CA :: 56.096 CB :: 41.291 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.290 HA :: 5.303 HB2 :: 3.130 HB3 :: 2.800 HD1 :: 7.156 HD2 :: 7.156 HE1 :: 6.528 HE2 :: 6.528 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 123.610 Ave N Shift Values>> N :: 120.45(4.18) 1.N176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.36 D 0.3 L 0.1 F 0.07 C 0.06 Y 0.06 C Shift Assignments>> C :: 174.632 CA :: 53.148 CB :: 39.908 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 9.440 HA :: 5.207 HB2 :: 2.700 HB3 :: 2.660 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 122.178 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.I177 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.58 C 0.41 C Shift Assignments>> C :: 174.832 CA :: 60.464 CB :: 40.560 CG1 :: 28.079 CG2 :: 17.329 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.015 HA :: 4.990 HB :: 1.383 HG12 :: 1.417 HG13 :: 1.417 HG21 :: 0.141 HG22 :: 0.141 HG23 :: 0.141 HD11 :: 0.687 HD12 :: 0.687 HD13 :: 0.687 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.699 Ave N Shift Values>> N :: 121.46(4.28) 1.T178 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 173.786 CA :: 60.435 CB :: 71.943 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.464 HA :: 5.618 HB :: 3.785 HG21 :: 1.220 HG22 :: 1.220 HG23 :: 1.220 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 123.220 Ave N Shift Values>> N :: 115.42(4.75) 1.R179 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.46 C 0.37 Q 0.07 R 0.06 C Shift Assignments>> C :: 173.832 CA :: 53.375 CB :: 33.515 CG :: 25.176 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.656 HA :: 5.585 HB2 :: 1.545 HB3 :: 1.422 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.451 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.A180 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.95 C 0.02 M 0.01 C Shift Assignments>> C :: 174.516 CA :: 49.898 CB :: 19.990 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.386 HA :: 4.683 HB1 :: 1.370 HB2 :: 1.370 HB3 :: 1.370 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 125.117 Ave N Shift Values>> N :: 123.23(3.54) 1.P181 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.65 C 0.27 R 0.04 K 0.01 C Shift Assignments>> C :: 176.968 CA :: 62.754 CB :: 32.015 CG :: 27.440 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.423 HB2 :: 2.302 HB3 :: 1.851 HG2 :: 1.932 HG3 :: 2.017 HD2 :: 3.723 HD3 :: 3.596 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.R182 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.47 C 0.39 G 0.08 K 0.05 HN Overlap>> 1.E30 1.E30 C Shift Assignments>> C :: 177.184 CA :: 56.453 CB :: 30.762 CG :: 27.371 CD :: 43.549 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.460 HA :: 4.245 HB2 :: 1.734 HB3 :: 1.574 HG2 :: 2.083 HG3 :: 2.083 HD2 :: 3.060 HD3 :: 3.262 HE :: 6.552 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.609 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.G183 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.78 L 0.12 C 0.03 R 0.02 F 0.01 C Shift Assignments>> C :: 173.815 CA :: 45.116 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.602 HA2 :: 3.958 HA3 :: 3.862 Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.971 Ave N Shift Values>> N :: 109.67(3.87) 1.A184 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.87 M 0.09 C 0.01 C Shift Assignments>> C :: 177.812 CA :: 52.562 CB :: 19.303 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.227 HA :: 4.249 HB1 :: 1.344 HB2 :: 1.344 HB3 :: 1.344 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.848 Ave N Shift Values>> N :: 123.23(3.54) 1.E185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.4 C 0.33 M 0.08 K 0.07 Q 0.06 I 0.03 C Shift Assignments>> C :: 176.109 CA :: 56.649 CB :: 30.050 CG :: 36.217 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.547 HA :: 4.153 HB2 :: 1.971 HB3 :: 1.867 HG2 :: 2.221 HG3 :: 2.184 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.617 Ave N Shift Values>> N :: 120.67(3.48) 1.N186 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 D 0.16 C 0.09 Y 0.07 F 0.07 L 0.04 C Shift Assignments>> C :: 174.611 CA :: 53.125 CB :: 38.751 Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.370 HA :: 4.610 HB2 :: 2.670 HB3 :: 2.632 Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.175 Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.L187 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.65 C 0.26 A 0.03 R 0.02 G 0.01 C Shift Assignments>> C :: 175.962 CA :: 55.113 CB :: 42.261 CG :: 26.726 CD1 :: 24.898 CD2 :: 23.056 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.086 HA :: 4.210 HB2 :: 1.369 HB3 :: 1.420 HD11 :: 0.820 HD12 :: 0.820 HD13 :: 0.820 HD21 :: 0.736 HD22 :: 0.736 HD23 :: 0.736 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.628 Ave N Shift Values>> N :: 121.86(3.9) 1.Y188 Overall: Suspicious Typing: Suspicious SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 F 0.21 C Shift Assignments>> C :: 180.397 CA :: 58.776 CB :: 39.339 CD1 :: 133.208 CD2 :: 133.208 CE1 :: 133.425(S) CE2 :: 133.425(S) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.569 HA :: 4.331 HB2 :: 3.046 HB3 :: 2.802 HD1 :: 7.039 HD2 :: 7.039 HE1 :: 7.132 HE2 :: 7.132 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 124.641 Ave N Shift Values>> N :: 120.52(4.2) 1.F189 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Consistent HN Overlap>> 1.E47 1.E47 1.E14 1.E14 H Shift Assignments>> H :: 8.217 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.720 Ave N Shift Values>> N :: 120.45(4.18) 1.Q190 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.HEM1 Overall Status: Residue type HEM not supported. 3.CMO1 Overall Status: Residue type CMO not supported. ########################################################################### Overall Results: #Consistent: 156 #Clerical: 0 #Suspicious: 23 #Anomalous: 6 #Mistyped: 5 #Indeterminable: 0 Typing Results: #Consistent: 178 #Suspicious: 4 #Mistyped: 5 #Indeterminable: 3 Shift Relative Order (SRO) Results: #Consistent: 188 #Suspicious: 2 C Shift Results: #Consistent: 645 #Duplicate: 0 #Unknown: 0 #Suspicious: 12 #Anomalous: 0 H Shift Results: #Consistent:1106 #Duplicate: 0 #Unknown: 0 #Suspicious: 39 #Anomalous: 16 N Shift Results: #Consistent: 179 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.F6 HB3 = 1.612(S), Expected = 2.93, Std = 0.4000, ChiSquare = 9.8422e-04 1.L9 Typing: Mistyped 1.L9 CD1 = 14.381(S), Expected = 24.72, Std = 1.5900, ChiSquare = 7.8988e-11 1.L12 HG = -0.071(S), Expected = 1.51, Std = 0.3300, ChiSquare = 1.6603e-06 1.L31 HD21 = -3.242(A), Expected = 0.73, Std = 0.2900, ChiSquare = 1.0646e-42 1.L31 HD22 = -3.242(A), Expected = 0.73, Std = 0.2900, ChiSquare = 1.0646e-42 1.L31 HD23 = -3.242(A), Expected = 0.73, Std = 0.2900, ChiSquare = 1.0646e-42 1.I36 Typing: Suspicious 1.I36 CG2 = 12.164(S), Expected = 17.53, Std = 1.3600, ChiSquare = 7.9604e-05 1.S60 HB2 = 1.695(A), Expected = 3.88, Std = 0.2500, ChiSquare = 2.3311e-18 1.S60 HB3 = 1.695(S), Expected = 3.85, Std = 0.2700, ChiSquare = 1.4459e-15 1.G71 HA3 = 2.290(S), Expected = 3.90, Std = 0.3700, ChiSquare = 1.3530e-05 1.L74 HB2 = 0.294(S), Expected = 1.61, Std = 0.3400, ChiSquare = 1.0857e-04 1.L74 HB3 = 0.206(S), Expected = 1.52, Std = 0.3600, ChiSquare = 2.6224e-04 1.L74 HG = -0.419(S), Expected = 1.51, Std = 0.3300, ChiSquare = 5.0519e-09 1.L74 HD11 = -1.624(S), Expected = 0.75, Std = 0.2800, ChiSquare = 2.2798e-17 1.L74 HD12 = -1.624(S), Expected = 0.75, Std = 0.2800, ChiSquare = 2.2798e-17 1.L74 HD13 = -1.624(S), Expected = 0.75, Std = 0.2800, ChiSquare = 2.2798e-17 1.L74 HD21 = -3.093(A), Expected = 0.73, Std = 0.2900, ChiSquare = 1.1028e-39 1.L74 HD22 = -3.093(A), Expected = 0.73, Std = 0.2900, ChiSquare = 1.1028e-39 1.L74 HD23 = -3.093(A), Expected = 0.73, Std = 0.2900, ChiSquare = 1.1028e-39 1.L78 HD11 = -2.380(A), Expected = 0.75, Std = 0.2800, ChiSquare = 5.1919e-29 1.L78 HD12 = -2.380(A), Expected = 0.75, Std = 0.2800, ChiSquare = 5.1919e-29 1.L78 HD13 = -2.380(A), Expected = 0.75, Std = 0.2800, ChiSquare = 5.1919e-29 1.H82 CE1 = 130.072(S), Expected = 137.71, Std = 2.1200, ChiSquare = 3.1477e-04 1.H82 HE1 = 5.063(S), Expected = 7.95, Std = 0.4800, ChiSquare = 1.8035e-09 1.P83 Typing: Mistyped 1.P83 CD = 43.184(S), Expected = 50.32, Std = 0.9900, ChiSquare = 5.6746e-13 1.E84 HG3 = 3.391(S), Expected = 2.25, Std = 0.2200, ChiSquare = 2.1444e-07 1.I85 HG21 = 2.162(S), Expected = 0.77, Std = 0.2700, ChiSquare = 2.5288e-07 1.I85 HG22 = 2.162(S), Expected = 0.77, Std = 0.2700, ChiSquare = 2.5288e-07 1.I85 HG23 = 2.162(S), Expected = 0.77, Std = 0.2700, ChiSquare = 2.5288e-07 1.S92 HA = 3.118(S), Expected = 4.48, Std = 0.4000, ChiSquare = 6.6164e-04 1.I99 HD11 = -1.324(A), Expected = 0.68, Std = 0.2900, ChiSquare = 4.8348e-12 1.I99 HD12 = -1.324(A), Expected = 0.68, Std = 0.2900, ChiSquare = 4.8348e-12 1.I99 HD13 = -1.324(A), Expected = 0.68, Std = 0.2900, ChiSquare = 4.8348e-12 1.I103 Typing: Mistyped 1.I103 CG1 = 13.406(S), Expected = 27.71, Std = 1.6800, ChiSquare = 1.6762e-17 1.I103 SRO Rule Break>> CG1 > CG2 : 0.99435736677116 1.I103 SRO Rule Break>> CG1 > CD1 : 0.993514915693904 1.H104 HA = 3.061(S), Expected = 4.61, Std = 0.4300, ChiSquare = 3.1538e-04 1.H104 HB3 = 1.789(S), Expected = 3.04, Std = 0.3800, ChiSquare = 9.9440e-04 1.V105 H = 5.711(S), Expected = 8.29, Std = 0.6700, ChiSquare = 1.1848e-04 1.E106 HG3 = 1.431(S), Expected = 2.25, Std = 0.2200, ChiSquare = 1.9708e-04 1.Y111 Typing: Suspicious 1.Y111 CE1 = 130.012(S), Expected = 117.93, Std = 1.1900, ChiSquare = 3.2152e-24 1.E115 H = 10.895(S), Expected = 8.33, Std = 0.5900, ChiSquare = 1.3772e-05 1.L116 HB2 = 2.914(S), Expected = 1.61, Std = 0.3400, ChiSquare = 1.2541e-04 1.L116 HG = -0.044(S), Expected = 1.51, Std = 0.3300, ChiSquare = 2.4882e-06 1.L116 HD11 = -1.179(S), Expected = 0.75, Std = 0.2800, ChiSquare = 5.6073e-12 1.L116 HD12 = -1.179(S), Expected = 0.75, Std = 0.2800, ChiSquare = 5.6073e-12 1.L116 HD13 = -1.179(S), Expected = 0.75, Std = 0.2800, ChiSquare = 5.6073e-12 1.T120 C = 180.604(S), Expected = 174.54, Std = 1.7600, ChiSquare = 5.7010e-04 1.D128 HA = 5.926(S), Expected = 4.59, Std = 0.3200, ChiSquare = 2.9799e-05 1.L131 Typing: Mistyped 1.L131 CG = 17.966(S), Expected = 26.78, Std = 1.1000, ChiSquare = 1.1219e-15 1.K136 Typing: Mistyped 1.K136 CE = 47.099(S), Expected = 41.89, Std = 0.8200, ChiSquare = 2.1193e-10 1.F139 HB2 = 4.374(S), Expected = 3.00, Std = 0.3700, ChiSquare = 2.0440e-04 1.L146 HB2 = 0.123(S), Expected = 1.61, Std = 0.3400, ChiSquare = 1.2225e-05 1.L146 HG = -0.624(S), Expected = 1.51, Std = 0.3300, ChiSquare = 1.0019e-10 1.L146 HD11 = -3.095(A), Expected = 0.75, Std = 0.2800, ChiSquare = 6.5177e-43 1.L146 HD12 = -3.095(A), Expected = 0.75, Std = 0.2800, ChiSquare = 6.5177e-43 1.L146 HD13 = -3.095(A), Expected = 0.75, Std = 0.2800, ChiSquare = 6.5177e-43 1.L146 HD21 = -1.621(S), Expected = 0.73, Std = 0.2900, ChiSquare = 5.1929e-16 1.L146 HD22 = -1.621(S), Expected = 0.73, Std = 0.2900, ChiSquare = 5.1929e-16 1.L146 HD23 = -1.621(S), Expected = 0.73, Std = 0.2900, ChiSquare = 5.1929e-16 1.E152 HG2 = 3.455(S), Expected = 2.27, Std = 0.2100, ChiSquare = 1.6725e-08 1.T163 HB = 1.705(S), Expected = 4.17, Std = 0.3300, ChiSquare = 8.0380e-14 1.T171 HB = 6.306(S), Expected = 4.17, Std = 0.3300, ChiSquare = 9.6250e-11 1.V173 HG11 = -0.032(S), Expected = 0.83, Std = 0.2600, ChiSquare = 9.1517e-04 1.V173 HG12 = -0.032(S), Expected = 0.83, Std = 0.2600, ChiSquare = 9.1517e-04 1.V173 HG13 = -0.032(S), Expected = 0.83, Std = 0.2600, ChiSquare = 9.1517e-04 1.I174 Typing: Suspicious 1.I174 CG1 = 13.426(S), Expected = 27.71, Std = 1.6800, ChiSquare = 1.8574e-17 1.I174 SRO Rule Break>> CG1 > CG2 : 0.99435736677116 1.Y188 Typing: Suspicious 1.Y188 CE1 = 133.425(S), Expected = 117.93, Std = 1.1900, ChiSquare = 9.2935e-39 1.Y188 CE2 = 133.425(S), Expected = 117.90, Std = 1.1800, ChiSquare = 1.5558e-39