Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> D 0.21 K 0.16 L 0.15 F 0.14 Y 0.09 C 0.08 I 0.05 N 0.04 R 0.02 C Shift Assignments>> CA :: 41.256 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> HA2 :: 3.792 HA3 :: 3.792 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) 1.S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G4 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> R 0.38 L 0.27 C 0.07 K 0.06 D 0.05 F 0.04 G 0.04 Y 0.02 I 0.01 C Shift Assignments>> CA :: 43.110 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> HA2 :: 3.945 HA3 :: 3.945 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) 1.S5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Indeterminable H Shift Assignments>> H :: 7.774 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) 1.S6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> C :: 172.584 CA :: 56.499 CB :: 61.635 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> HA :: 4.387 HB2 :: 3.833 HB3 :: 3.833 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) 1.G7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.36 L 0.27 K 0.07 C 0.07 D 0.06 F 0.05 G 0.04 Y 0.03 I 0.01 C Shift Assignments>> C :: 170.993 CA :: 43.040 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.328 HA2 :: 3.859 HA3 :: 3.859 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.246 Ave N Shift Values>> N :: 109.91(4.29) 1.M8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 M 0.35 A 0.18 C Shift Assignments>> C :: 173.357 CA :: 51.865 CB :: 31.863 CG :: 29.929 CE :: 15.095 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.773 HA :: 4.429 HB2 :: 2.028 HB3 :: 1.813 HG2 :: 2.515 HG3 :: 2.338 HE1 :: 1.996 HE2 :: 1.996 HE3 :: 1.996 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 117.620 Ave N Shift Values>> N :: 120.1(3.88) 1.A9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.88 M 0.08 C 0.01 C Shift Assignments>> C :: 174.457 CA :: 49.713 CB :: 18.069 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.179 HA :: 4.083 HB1 :: 1.069 HB2 :: 1.069 HB3 :: 1.069 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.747 Ave N Shift Values>> N :: 123.23(3.7) 1.V10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 V 0.15 I 0.05 C Shift Assignments>> C :: 173.781 CA :: 60.378 CB :: 29.768 CG1 :: 18.858 CG2 :: 18.804 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 9.363 HA :: 3.871 HB :: 1.594 HG11 :: 0.834 HG12 :: 0.834 HG13 :: 0.834 HG21 :: 0.760 HG22 :: 0.760 HG23 :: 0.760 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 122.292 Ave N Shift Values>> N :: 121.02(4.96) 1.N11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.55 D 0.18 C 0.15 Y 0.04 F 0.03 L 0.02 C Shift Assignments>> C :: 172.448 CA :: 51.346 CB :: 38.930 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.357 HA :: 4.784 HB2 :: 2.574 HB3 :: 2.230 HD21 :: 7.138 HD22 :: 7.658 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 123.112 ND2 :: 114.694 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.V12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 V 0.09 A 0.02 I 0.01 C Shift Assignments>> C :: 172.561 CA :: 58.761 CB :: 32.524 CG1 :: 19.131 CG2 :: 17.736 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.704 HA :: 4.091 HB :: 1.681 HG11 :: 0.630 HG12 :: 0.630 HG13 :: 0.630 HG21 :: 0.514 HG22 :: 0.514 HG23 :: 0.514 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 117.140 Ave N Shift Values>> N :: 121.02(4.96) 1.Y13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 Y 0.42 HN Overlap>> 1.F70 1.F70 C Shift Assignments>> C :: 173.807 CA :: 54.923 CB :: 37.812 CD1 :: 131.006 CD2 :: 131.006 CE1 :: 115.768 CE2 :: 115.768 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.647 HA :: 4.709 HB2 :: 3.161 HB3 :: 2.634 HD1 :: 7.024 HD2 :: 7.024 HE1 :: 6.703 HE2 :: 6.703 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 124.134 Ave N Shift Values>> N :: 120.79(4.69) 1.S14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> I 0.22 T 0.18 V 0.17 F 0.07 C 0.06 Y 0.05 P 0.05 W 0.04 S 0.02 E 0.02 R 0.02 K 0.01 H 0.01 C Shift Assignments>> CB :: 61.194 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.089 HA :: 4.695 HB2 :: 3.818 HB3 :: 3.818 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) 1.T15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> T 0.48 C 0.25 S 0.2 A 0.05 C Shift Assignments>> CA :: 58.967 CB :: 67.442 CG2 :: 19.385 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> HA :: 4.358 HB :: 4.296 HG21 :: 1.116 HG22 :: 1.116 HG23 :: 1.116 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) 1.S16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 56.511 CB :: 61.581 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.363 HA :: 4.391 HB2 :: 3.831 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) 1.V17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 V 0.11 I 0.1 HN Overlap>> 1.K41 1.K41 C Shift Assignments>> CA :: 60.283 CB :: 29.950 CG1 :: 18.933 CG2 :: 18.187 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.087 HA :: 4.091 HB :: 2.001 HG11 :: 0.835 HG12 :: 0.835 HG13 :: 0.835 HG21 :: 0.845 HG22 :: 0.845 HG23 :: 0.845 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.500 Ave N Shift Values>> N :: 121.02(4.96) 1.T18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.56 C 0.24 S 0.15 A 0.03 HN Overlap>> 1.S19 1.S19 C Shift Assignments>> CA :: 59.363 CB :: 67.639 CG2 :: 19.216 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 8.142 HA :: 4.296 HB :: 4.200 HG21 :: 1.074 HG22 :: 1.074 HG23 :: 1.074 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 116.923 Ave N Shift Values>> N :: 115.7(5.05) 1.S19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 HN Overlap>> 1.T18 1.T18 C Shift Assignments>> C :: 171.925 CA :: 56.328 CB :: 61.347 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.127 HA :: 4.302 HB2 :: 3.770 HB3 :: 3.770 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 116.825 Ave N Shift Values>> N :: 116.3(3.95) 1.E20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.29 Q 0.29 K 0.23 R 0.08 E 0.05 M 0.02 C Shift Assignments>> C :: 173.781 CA :: 54.023 CB :: 27.739 CG :: 33.925 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.184 HA :: 4.144 HB2 :: 1.773 HB3 :: 1.926 HG2 :: 2.126 HG3 :: 2.126 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 121.010 Ave N Shift Values>> N :: 120.68(3.68) 1.N21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.48 C 0.34 M 0.04 Y 0.02 D 0.02 E 0.02 P 0.01 F 0.01 C Shift Assignments>> C :: 172.874 CA :: 50.746 CB :: 36.571 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.227 HA :: 4.447 HB2 :: 2.539 HB3 :: 2.586 HD21 :: 6.831 HD22 :: 7.458 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 120.254 ND2 :: 111.380 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.L22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.46 L 0.29 C 0.24 C Shift Assignments>> C :: 175.540 CA :: 52.399 CB :: 41.319 CG :: 25.456 CD1 :: 22.992 CD2 :: 21.436 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.108 HA :: 4.522 HB2 :: 1.560 HB3 :: 1.522 HG :: 1.615 HD11 :: 0.712 HD12 :: 0.712 HD13 :: 0.712 HD21 :: 0.718 HD22 :: 0.718 HD23 :: 0.718 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 121.865 Ave N Shift Values>> N :: 121.98(4.07) 1.S23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.940 CA :: 55.100 CB :: 63.130 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.170 HA :: 4.568 HB2 :: 4.317 HB3 :: 4.117 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 117.420 Ave N Shift Values>> N :: 116.3(3.95) 1.R24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.41 K 0.28 C 0.28 C Shift Assignments>> C :: 174.680 CA :: 57.796 CB :: 27.124 CG :: 23.581 CD :: 41.344 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 9.176 HA :: 4.007 HB2 :: 1.797 HB3 :: 1.677 HG2 :: 1.333 HG3 :: 1.428 HD2 :: 2.929 HD3 :: 3.031 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 120.337 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.H25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.44 C 0.33 W 0.21 C Shift Assignments>> C :: 175.995 CA :: 57.026 CB :: 27.952 CD2 :: 117.899 CE1 :: 136.388 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 7.841 HA :: 4.220 HB2 :: 3.044 HB3 :: 3.044 HD2 :: 7.050 HE1 :: 7.802 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 117.021 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.D26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.26 C 0.23 Y 0.15 F 0.1 D 0.09 E 0.07 M 0.02 L 0.02 I 0.01 HN Overlap>> 1.H36 1.H36 C Shift Assignments>> C :: 176.936 CA :: 54.831 CB :: 37.964 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.880 HA :: 4.437 HB2 :: 2.621 HB3 :: 2.743 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 121.014 Ave N Shift Values>> N :: 120.73(4.2) 1.M27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.43 M 0.4 A 0.15 C Shift Assignments>> C :: 175.688 CA :: 55.507 CB :: 30.187 CG :: 30.992 CE :: 16.817 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 8.745 HA :: 4.510 HB2 :: 2.177 HB3 :: 2.177 HG2 :: 2.447 HG3 :: 2.447 HE1 :: 1.743 HE2 :: 1.743 HE3 :: 1.743 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 120.871 Ave N Shift Values>> N :: 120.1(3.88) 1.L28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 A 0.22 L 0.07 C Shift Assignments>> C :: 175.469 CA :: 55.577 CB :: 39.438 CG :: 24.271 CD1 :: 22.707 CD2 :: 21.388 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.991 HA :: 3.856 HB2 :: 1.653 HB3 :: 1.406 HG :: 1.585 HD11 :: 0.618 HD12 :: 0.618 HD13 :: 0.618 HD21 :: 0.568 HD22 :: 0.568 HD23 :: 0.568 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.787 Ave N Shift Values>> N :: 121.98(4.07) 1.A29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.64 A 0.33 C 0.01 C Shift Assignments>> C :: 176.678 CA :: 52.942 CB :: 15.465 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.776 HA :: 4.017 HB1 :: 1.395 HB2 :: 1.395 HB3 :: 1.395 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.323 Ave N Shift Values>> N :: 123.23(3.7) 1.W30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 W 0.01 C Shift Assignments>> C :: 176.841 CA :: 58.978 CB :: 24.206 CD1 :: 124.057 CE3 :: 118.418 CZ2 :: 112.300 CZ3 :: 118.671 CH2 :: 120.768 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.660 HA :: 4.370 HB2 :: 3.184 HB3 :: 3.529 HD1 :: 7.112 HE1 :: 8.707 HE3 :: 7.463 HZ2 :: 4.899 HZ3 :: 6.503 HH2 :: 5.666 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 118.067 NE1 :: 127.844 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.V31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.73 C 0.25 I 0.01 HN Overlap>> 1.K41 1.K41 C Shift Assignments>> C :: 174.506 CA :: 64.596 CB :: 29.588 CG1 :: 19.120 CG2 :: 20.880 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.965 HA :: 2.703 HB :: 1.998 HG11 :: 0.499 HG12 :: 0.499 HG13 :: 0.499 HG21 :: 1.012 HG22 :: 1.012 HG23 :: 1.012 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.543 Ave N Shift Values>> N :: 121.02(4.96) 1.N32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 M 0.2 Q 0.1 E 0.1 K 0.09 N 0.08 Y 0.02 H 0.01 W 0.01 C Shift Assignments>> C :: 176.865 CA :: 53.417 CB :: 35.079 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.400 HA :: 3.914 HB2 :: 2.659 HB3 :: 2.551 HD21 :: 7.530 HD22 :: 6.971 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 117.372 ND2 :: 106.613 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.D33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.31 C 0.2 Y 0.13 D 0.13 F 0.1 E 0.04 L 0.03 M 0.01 I 0.01 C Shift Assignments>> C :: 176.481 CA :: 54.472 CB :: 38.360 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.861 HA :: 4.261 HB2 :: 2.727 HB3 :: 2.507 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.344 Ave N Shift Values>> N :: 120.73(4.2) 1.S34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.644 CA :: 59.620 CB :: 61.247 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.588 HA :: 4.048 HB2 :: 3.358 HB3 :: 3.237 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 112.622 Ave N Shift Values>> N :: 116.3(3.95) 1.L35 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.81 C 0.18 C Shift Assignments>> C :: 174.029 CA :: 50.819 CB :: 40.001 CG :: 23.880 CD1 :: 23.941 CD2 :: 19.747 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.221 HA :: 4.178 HB2 :: 1.156 HB3 :: 0.809 HG :: 0.492 HD11 :: -0.343(S) HD12 :: -0.343(S) HD13 :: -0.343(S) HD21 :: 0.083 HD22 :: 0.083 HD23 :: 0.083 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 112.946 Ave N Shift Values>> N :: 121.98(4.07) 1.H36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 H 0.25 A 0.03 W 0.01 HN Overlap>> 1.D26 1.D26 C Shift Assignments>> C :: 172.017 CA :: 54.032 CB :: 24.444 CD2 :: 117.122 CE1 :: 134.589 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 7.839 HA :: 4.327 HB2 :: 3.211 HB3 :: 2.911 HD2 :: 6.840 HE1 :: 8.128 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 121.000 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.L37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.82 C 0.13 G 0.04 C Shift Assignments>> C :: 172.910 CA :: 50.839 CB :: 42.167 CG :: 23.489 CD1 :: 19.691 CD2 :: 23.096 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.479 HA :: 4.277 HB2 :: 1.013 HB3 :: 0.684 HG :: 0.889 HD11 :: 0.511 HD12 :: 0.511 HD13 :: 0.511 HD21 :: 0.125 HD22 :: 0.125 HD23 :: 0.125 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.489 Ave N Shift Values>> N :: 121.98(4.07) 1.N38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 N 0.37 P 0.08 M 0.04 Y 0.01 E 0.01 D 0.01 C Shift Assignments>> C :: 173.481 CA :: 49.829 CB :: 36.212 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.691 HA :: 4.539 HB2 :: 2.625 HB3 :: 2.411 HD21 :: 6.600 HD22 :: 7.368 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 117.466 ND2 :: 111.692 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.Y39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.85 W 0.1 H 0.03 C Shift Assignments>> C :: 175.827 CA :: 53.879 CB :: 34.900 CD1 :: 128.386 CD2 :: 128.386 CE1 :: 115.374 CE2 :: 115.374 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.954 HA :: 4.728 HB2 :: 2.950 HB3 :: 2.950 HD1 :: 6.723 HD2 :: 6.723 HE1 :: 6.458 HE2 :: 6.458 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 120.856 Ave N Shift Values>> N :: 120.79(4.69) 1.T40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.67 C 0.22 S 0.06 A 0.03 C Shift Assignments>> C :: 172.447 CA :: 58.982 CB :: 67.986 CG2 :: 19.743 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 9.517 HA :: 4.364 HB :: 4.298 HG21 :: 1.132 HG22 :: 1.132 HG23 :: 1.132 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 110.830 Ave N Shift Values>> N :: 115.7(5.05) 1.K41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.62 A 0.28 K 0.04 M 0.03 R 0.01 HN Overlap>> 1.V17 1.V17 1.V31 1.V31 C Shift Assignments>> C :: 174.056 CA :: 53.013 CB :: 33.238 CG :: 22.253 CD :: 27.023 CE :: 39.873 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.074 HA :: 4.757 HB2 :: 2.177 HB3 :: 1.594 HG2 :: 1.321 HG3 :: 1.321 HD2 :: 1.538 HD3 :: 1.538 HE2 :: 2.807 HE3 :: 2.807 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 121.515 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.I42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 M 0.01 C Shift Assignments>> C :: 174.781 CA :: 58.642 CB :: 33.668 CG1 :: 25.892 CG2 :: 14.994 CD1 :: 7.240 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 9.351 HA :: 3.732 HB :: 2.214 HG12 :: 1.545 HG13 :: 1.795 HG21 :: 0.668 HG22 :: 0.668 HG23 :: 0.668 HD11 :: 0.923 HD12 :: 0.923 HD13 :: 0.923 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 125.780 Ave N Shift Values>> N :: 121.6(4.72) 1.E43 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.45 I 0.32 E 0.14 K 0.04 Q 0.01 C Shift Assignments>> C :: 175.870 CA :: 59.256 CB :: 26.729 CG :: 36.415 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 11.211(S) HA :: 3.373 HB2 :: 1.862 HB3 :: 1.663 HG2 :: 2.651 HG3 :: 1.891 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 118.571 Ave N Shift Values>> N :: 120.68(3.68) 1.Q44 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.39 K 0.29 Q 0.15 R 0.05 E 0.03 M 0.03 I 0.01 C Shift Assignments>> C :: 174.814 CA :: 56.287 CB :: 25.893 CG :: 34.496 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.413 HA :: 3.719 HB2 :: 1.651 HB3 :: 0.983(S) HG2 :: 2.163 HG3 :: 1.991 HE21 :: 7.049 HE22 :: 7.561 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 116.835 NE2 :: 111.403 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.L45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.48 A 0.41 L 0.1 HN Overlap>> 1.V142 1.V142 C Shift Assignments>> C :: 175.193 CA :: 53.826 CB :: 38.150 CG :: 26.130 CD1 :: 23.303 CD2 :: 21.313 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.850 HA :: 4.017 HB2 :: 2.034 HB3 :: 1.712 HG :: 1.669 HD11 :: 0.961 HD12 :: 0.961 HD13 :: 0.961 HD21 :: 0.649 HD22 :: 0.649 HD23 :: 0.649 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.927 Ave N Shift Values>> N :: 121.98(4.07) 1.C46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.2 R 0.2 L 0.18 C 0.13 Q 0.07 I 0.05 H 0.04 W 0.04 E 0.02 M 0.01 C Shift Assignments>> C :: 170.112 CA :: 57.045 CB :: 25.950 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.564 HA :: 4.239 HB2 :: 3.516 HB3 :: 2.578 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 116.402 Ave N Shift Values>> N :: 119.95(4.79) 1.S47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.93 C 0.03 P 0.03 C Shift Assignments>> C :: 173.860 CA :: 53.830 CB :: 63.533 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 6.446 HA :: 3.713 HB2 :: 3.352 HB3 :: 3.846 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 111.327 Ave N Shift Values>> N :: 116.3(3.95) 1.G48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.42 L 0.21 R 0.18 C 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> C :: 170.859 CA :: 44.432 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.371 HA2 :: 2.789 HA3 :: 2.789 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.309 Ave N Shift Values>> N :: 109.91(4.29) 1.A49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.48 A 0.48 C 0.01 I 0.01 C Shift Assignments>> C :: 176.082 CA :: 53.259 CB :: 16.559 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 6.619 HA :: 3.267 HB1 :: 0.885 HB2 :: 0.885 HB3 :: 0.885 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.998 Ave N Shift Values>> N :: 123.23(3.7) 1.A50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.86 A 0.09 I 0.02 C 0.01 C Shift Assignments>> C :: 176.704 CA :: 52.730 CB :: 13.828 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.997 HA :: 3.610 HB1 :: 0.839 HB2 :: 0.839 HB3 :: 0.839 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.491 Ave N Shift Values>> N :: 123.23(3.7) 1.Y51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.88 Y 0.1 C Shift Assignments>> C :: 175.914 CA :: 59.569 CB :: 36.954 CD1 :: 129.473 CD2 :: 129.473 CE1 :: 115.622 CE2 :: 115.622 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.531 HA :: 4.036 HB2 :: 2.890 HB3 :: 2.435 HD1 :: 6.146 HD2 :: 6.146 HE1 :: 6.641 HE2 :: 6.641 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 113.582 Ave N Shift Values>> N :: 120.79(4.69) 1.C52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.47 P 0.3 C 0.1 V 0.04 R 0.02 K 0.02 W 0.01 C Shift Assignments>> C :: 174.061 CA :: 62.772 CB :: 25.582 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.271 HA :: 3.811 HB2 :: 3.046 HB3 :: 2.036 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 113.968 Ave N Shift Values>> N :: 119.95(4.79) 1.Q53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 K 0.37 Q 0.06 R 0.05 M 0.05 V 0.03 I 0.01 C Shift Assignments>> C :: 176.057 CA :: 57.960 CB :: 24.803 CG :: 33.691 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.784 HA :: 3.977 HB2 :: 1.962 HB3 :: 1.887 HG2 :: 2.535 HG3 :: 2.535 HE21 :: 7.230 HE22 :: 7.146 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 117.809 NE2 :: 108.973 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.F54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 F 0.05 C Shift Assignments>> C :: 176.792 CA :: 59.715 CB :: 37.956 CD1 :: 128.966 CD2 :: 128.966 CE1 :: 127.446 CE2 :: 127.446 CZ :: 127.401 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.071 HA :: 4.370 HB2 :: 3.429 HB3 :: 3.364 HD1 :: 6.891 HD2 :: 6.891 HE1 :: 6.182 HE2 :: 6.182 HZ :: 5.426 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 118.997 Ave N Shift Values>> N :: 120.69(4.18) 1.M55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.74 M 0.16 A 0.09 C Shift Assignments>> C :: 175.175 CA :: 54.675 CB :: 27.485 CG :: 32.149 CE :: 15.018 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.867 HA :: 4.780 HB2 :: 2.481 HB3 :: 2.273 HG2 :: 2.808 HG3 :: 3.197 HE1 :: 2.330 HE2 :: 2.330 HE3 :: 2.330 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 114.919 Ave N Shift Values>> N :: 120.1(3.88) 1.D56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.24 L 0.17 C 0.12 F 0.12 K 0.11 Y 0.1 N 0.08 R 0.02 C Shift Assignments>> C :: 173.210 CA :: 55.153 CB :: 40.810 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.277 HA :: 4.470 HB2 :: 3.117 HB3 :: 2.465 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.563 Ave N Shift Values>> N :: 120.73(4.2) 1.M57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.74 M 0.22 A 0.02 C Shift Assignments>> C :: 175.267 CA :: 56.450 CB :: 30.720 CG :: 29.161 CE :: 15.082 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.453 HA :: 3.160 HB2 :: 1.971 HB3 :: 1.156 HG2 :: 1.873 HG3 :: 1.844 HE1 :: 1.947 HE2 :: 1.947 HE3 :: 1.947 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 115.363 Ave N Shift Values>> N :: 120.1(3.88) 1.L58 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> A 0.5 C 0.38 L 0.08 G 0.02 C Shift Assignments>> C :: 175.184 CA :: 54.445 CB :: 42.091 CG :: 23.591 CD1 :: 24.040 CD2 :: 20.926 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.833 HA :: 3.645 HB2 :: 1.572 HB3 :: -0.295(S) HG :: 1.644 HD11 :: 0.602 HD12 :: 0.602 HD13 :: 0.602 HD21 :: -0.106 HD22 :: -0.106 HD23 :: -0.106 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 116.245 Ave N Shift Values>> N :: 121.98(4.07) 1.F59 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 F 0.03 Y 0.01 C Shift Assignments>> C :: 168.998(A) CA :: 50.589 CB :: 36.659 CD1 :: 132.228 CD2 :: 132.228 CE1 :: 127.689 CE2 :: 127.689 CZ :: 126.212 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.160 HA :: 5.147 HB2 :: 3.613 HB3 :: 3.130 HD1 :: 7.382 HD2 :: 7.382 HE1 :: 7.098 HE2 :: 7.098 HZ :: 6.839 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 115.716 Ave N Shift Values>> N :: 120.69(4.18) 1.P60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.57 G 0.4 P 0.01 C Shift Assignments>> C :: 176.622 CA :: 62.670 CB :: 29.173 CG :: 25.121 CD :: 47.302 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.684 HB2 :: 1.894 HB3 :: 2.416 HG2 :: 2.091 HG3 :: 2.185 HD2 :: 3.330 HD3 :: 3.639 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.G61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 L 0.27 C 0.07 K 0.07 D 0.06 F 0.04 G 0.04 Y 0.03 I 0.01 C Shift Assignments>> C :: 174.202 CA :: 43.072 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 9.111 HA2 :: 4.407 HA3 :: 3.827 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 113.486 Ave N Shift Values>> N :: 109.91(4.29) 1.C62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.21 L 0.15 C 0.12 Q 0.11 K 0.09 H 0.07 W 0.07 I 0.06 E 0.05 C Shift Assignments>> C :: 170.529 CA :: 57.433 CB :: 26.993 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.539 HA :: 4.391 HB2 :: 3.274 HB3 :: 2.809 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 116.858 Ave N Shift Values>> N :: 119.95(4.79) 1.V63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.77 A 0.16 V 0.06 C Shift Assignments>> C :: 171.561 CA :: 56.776 CB :: 33.312 CG1 :: 18.369 CG2 :: 19.644 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.670 HA :: 4.459 HB :: 1.909 HG11 :: 0.914 HG12 :: 0.914 HG13 :: 0.914 HG21 :: 0.871 HG22 :: 0.871 HG23 :: 0.871 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 117.302 Ave N Shift Values>> N :: 121.02(4.96) 1.H64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.41 C 0.41 W 0.17 C Shift Assignments>> C :: 173.708 CA :: 51.952 CB :: 27.251 CD2 :: 115.773 CE1 :: 136.436 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.414 HA :: 4.882 HB2 :: 3.073 HB3 :: 2.925 HD2 :: 6.949 HE1 :: 7.699 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 127.008 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.L65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 A 0.22 L 0.09 C Shift Assignments>> C :: 176.555 CA :: 55.610 CB :: 39.373 CG :: 24.689 CD1 :: 21.291 CD2 :: 23.441 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.433 HA :: 3.901 HB2 :: 1.784 HB3 :: 1.644 HG :: 1.810 HD11 :: 0.776 HD12 :: 0.776 HD13 :: 0.776 HD21 :: 0.915 HD22 :: 0.915 HD23 :: 0.915 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 125.600 Ave N Shift Values>> N :: 121.98(4.07) 1.R66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.43 K 0.29 C 0.25 R 0.01 C Shift Assignments>> C :: 174.961 CA :: 55.604 CB :: 27.235 CG :: 25.084 CD :: 40.791 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 8.458 HA :: 4.246 HB2 :: 1.758 HB3 :: 1.758 HG2 :: 1.634 HG3 :: 1.634 HD2 :: 3.165 HD3 :: 3.165 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 115.876 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.K67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.85 A 0.07 R 0.02 K 0.01 L 0.01 M 0.01 C Shift Assignments>> C :: 174.476 CA :: 53.799 CB :: 31.240 CG :: 23.504 CD :: 25.094 CE :: 39.822 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.748 HA :: 4.326 HB2 :: 1.992 HB3 :: 1.878 HG2 :: 1.429 HG3 :: 1.343 HD2 :: 1.636 HD3 :: 1.636 HE2 :: 2.838 HE3 :: 2.838 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 115.520 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.V68 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.85 V 0.08 I 0.06 C Shift Assignments>> C :: 172.778 CA :: 60.847 CB :: 29.462 CG1 :: 17.451 CG2 :: 20.934 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.506 HA :: 3.538 HB :: 1.869 HG11 :: -0.220(S) HG12 :: -0.220(S) HG13 :: -0.220(S) HG21 :: 0.821 HG22 :: 0.821 HG23 :: 0.821 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.916 Ave N Shift Values>> N :: 121.02(4.96) 1.K69 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.63 A 0.25 L 0.07 M 0.01 K 0.01 R 0.01 C Shift Assignments>> C :: 175.382 CA :: 52.481 CB :: 29.426 CG :: 22.748 CD :: 27.505 CE :: 39.449 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 9.498 HA :: 4.519 HB2 :: 1.722 HB3 :: 1.622 HG2 :: 1.263 HG3 :: 1.195 HD2 :: 1.280 HD3 :: 1.487 HE2 :: 1.978(S) HE3 :: 2.482 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 127.054 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.F70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 F 0.15 HN Overlap>> 1.Y13 1.Y13 C Shift Assignments>> C :: 174.615 CA :: 60.367 CB :: 36.412 CD1 :: 129.691 CD2 :: 129.691 CE1 :: 129.120 CE2 :: 129.120 CZ :: 126.382 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.653 HA :: 3.813 HB2 :: 3.056 HB3 :: 2.866 HD1 :: 7.237 HD2 :: 7.237 HE1 :: 7.107 HE2 :: 7.107 HZ :: 6.817 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 124.216 Ave N Shift Values>> N :: 120.69(4.18) 1.Q71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.4 K 0.26 R 0.11 P 0.11 M 0.06 HN Overlap>> 1.Q86 1.Q86 C Shift Assignments>> C :: 172.725 CA :: 52.040 CB :: 24.787 CG :: 31.696 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.838 HA :: 4.612 HB2 :: 2.257 HB3 :: 1.894 HG2 :: 2.263 HG3 :: 2.263 HE21 :: 7.491 HE22 :: 6.846 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.272 NE2 :: 112.274 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.A72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.86 M 0.1 C 0.01 C Shift Assignments>> C :: 174.781 CA :: 50.773 CB :: 18.701 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 6.697 HA :: 3.912 HB1 :: 1.425 HB2 :: 1.425 HB3 :: 1.425 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.481 Ave N Shift Values>> N :: 123.23(3.7) 1.K73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 A 0.26 K 0.03 M 0.02 R 0.01 C Shift Assignments>> C :: 172.030 CA :: 53.915 CB :: 33.566 CG :: 21.963 CD :: 26.801 CE :: 39.942 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.883 HA :: 4.670 HB2 :: 1.684 HB3 :: 1.817 HG2 :: 1.419 HG3 :: 1.419 HD2 :: 1.605 HD3 :: 1.605 HE2 :: 2.939 HE3 :: 2.939 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.818 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.L74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.65 G 0.17 C 0.12 L 0.05 C Shift Assignments>> C :: 174.695 CA :: 50.240 CB :: 42.743 CG :: 24.746 CD1 :: 23.675 CD2 :: 20.430 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.586 HA :: 4.401 HB2 :: 1.343 HB3 :: 1.026 HG :: 1.389 HD11 :: 0.839 HD12 :: 0.839 HD13 :: 0.839 HD21 :: 0.799 HD22 :: 0.799 HD23 :: 0.799 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 119.073 Ave N Shift Values>> N :: 121.98(4.07) 1.E75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 Q 0.16 K 0.16 E 0.15 I 0.09 R 0.03 C Shift Assignments>> C :: 175.743 CA :: 58.831 CB :: 27.413 CG :: 34.872 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.563 HA :: 3.398 HB2 :: 1.882 HB3 :: 2.034 HG2 :: 2.094 HG3 :: 2.094 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 122.176 Ave N Shift Values>> N :: 120.68(3.68) 1.H76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.46 H 0.45 W 0.07 C Shift Assignments>> C :: 176.047 CA :: 57.036 CB :: 26.836 CD2 :: 116.756 CE1 :: 136.877 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 8.230 HA :: 4.250 HB2 :: 3.110 HB3 :: 3.013 HD2 :: 6.959 HE1 :: 7.598 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 112.718 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.E77 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.28 E 0.25 K 0.19 Q 0.18 M 0.04 I 0.02 R 0.01 C Shift Assignments>> C :: 175.397 CA :: 55.904 CB :: 29.038 CG :: 35.249 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 6.875 HA :: 3.969 HB2 :: 1.678 HB3 :: 2.341 HG2 :: 1.417(S) HG3 :: 1.685 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 121.884 Ave N Shift Values>> N :: 120.68(3.68) 1.Y78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.81 H 0.1 W 0.07 C Shift Assignments>> C :: 176.919 CA :: 54.127 CB :: 33.823 CD1 :: 129.257 CD2 :: 129.257 CE1 :: 115.277 CE2 :: 115.277 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.498 HA :: 4.873 HB2 :: 3.453 HB3 :: 3.726 HD1 :: 6.860 HD2 :: 6.860 HE1 :: 6.469 HE2 :: 6.469 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 119.892 Ave N Shift Values>> N :: 120.79(4.69) 1.I79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.61 C 0.38 C Shift Assignments>> C :: 175.401 CA :: 64.014 CB :: 35.892 CG1 :: 28.312 CG2 :: 14.742 CD1 :: 10.995 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.483 HA :: 3.499 HB :: 1.871 HG12 :: 1.884 HG13 :: 0.892 HG21 :: 0.880 HG22 :: 0.880 HG23 :: 0.880 HD11 :: 0.840 HD12 :: 0.840 HD13 :: 0.840 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 118.038 Ave N Shift Values>> N :: 121.6(4.72) 1.H80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> H 0.43 C 0.43 W 0.12 HN Overlap>> 1.Q138 1.Q138 C Shift Assignments>> C :: 175.320 CA :: 58.506 CB :: 28.051 CD2 :: 116.590 CE1 :: 135.664 Ave C Shift Values>> C :: 175.19(2.14) CA :: 56.37(2.4) CB :: 29.95(2.15) CG :: 130.59(3.41) CD2 :: 119.84(3.3) CE1 :: 136.05(3.58) H Shift Assignments>> H :: 7.533 HA :: 4.087 HB2 :: 3.605 HB3 :: 3.130 HD2 :: 7.145 HE1 :: 7.696 Ave H Shift Values>> H :: 8.25(0.74) HA :: 4.62(0.51) HB2 :: 3.12(0.43) HB3 :: 3.11(0.45) HD1 :: 10.14(3.5) HD2 :: 7.08(0.5) HE1 :: 8.08(0.57) HE2 :: 10.43(3.11) N Shift Assignments>> N :: 118.837 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.N81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.32 M 0.21 Q 0.12 K 0.1 E 0.07 N 0.07 H 0.02 Y 0.01 W 0.01 R 0.01 HN Overlap>> 1.I115 1.I115 C Shift Assignments>> C :: 176.038 CA :: 53.093 CB :: 34.831 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.868 HA :: 4.201 HB2 :: 1.927 HB3 :: 3.551 HD21 :: 7.524 HD22 :: 7.042 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.015 ND2 :: 105.380 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.F82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 F 0.2 C Shift Assignments>> C :: 176.098 CA :: 61.406 CB :: 37.494 CD1 :: 129.197 CD2 :: 129.197 CE1 :: 129.154 CE2 :: 129.154 CZ :: 126.862 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.522 HA :: 4.055 HB2 :: 2.814 HB3 :: 2.814 HD1 :: 6.939 HD2 :: 6.939 HE1 :: 7.017 HE2 :: 7.017 HZ :: 6.970 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.864 Ave N Shift Values>> N :: 120.69(4.18) 1.K83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.76 L 0.12 K 0.05 R 0.04 C Shift Assignments>> C :: 178.416 CA :: 57.606 CB :: 29.308 CG :: 23.514 CD :: 26.874 CE :: 39.776 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.503 HA :: 4.197 HB2 :: 1.997 HB3 :: 1.759 HG2 :: 1.351 HG3 :: 1.595 HD2 :: 1.598 HD3 :: 1.598 HE2 :: 2.833 HE3 :: 2.833 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 123.447 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.V84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.6 C 0.38 I 0.01 C Shift Assignments>> C :: 177.272 CA :: 64.267 CB :: 28.294 CG1 :: 19.994 CG2 :: 20.144 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.541 HA :: 3.531 HB :: 2.456 HG11 :: 0.649 HG12 :: 0.649 HG13 :: 0.649 HG21 :: 0.777 HG22 :: 0.777 HG23 :: 0.777 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 123.679 Ave N Shift Values>> N :: 121.02(4.96) 1.L85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.69 L 0.19 A 0.11 C Shift Assignments>> C :: 175.875 CA :: 55.489 CB :: 39.110 CG :: 24.908 CD1 :: 22.219 CD2 :: 24.625 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.850 HA :: 3.857 HB2 :: 1.968 HB3 :: 1.385 HD11 :: 0.899 HD12 :: 0.899 HD13 :: 0.899 HD21 :: 0.728 HD22 :: 0.728 HD23 :: 0.728 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 122.390 Ave N Shift Values>> N :: 121.98(4.07) 1.Q86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.3 R 0.24 K 0.22 Q 0.18 M 0.02 E 0.01 HN Overlap>> 1.Q71 1.Q71 C Shift Assignments>> C :: 176.502 CA :: 56.758 CB :: 27.117 CG :: 32.591 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.839 HA :: 3.657 HB2 :: 2.198 HB3 :: 2.052 HG2 :: 2.258 HG3 :: 2.443 HE21 :: 7.276 HE22 :: 7.096 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.193 NE2 :: 112.868 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.A87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.61 A 0.36 C 0.01 C Shift Assignments>> C :: 178.036 CA :: 52.799 CB :: 15.517 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.764 HA :: 4.203 HB1 :: 1.516 HB2 :: 1.516 HB3 :: 1.516 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 121.595 Ave N Shift Values>> N :: 123.23(3.7) 1.A88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.48 M 0.48 C 0.01 C Shift Assignments>> C :: 177.093 CA :: 52.911 CB :: 16.305 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.763 HA :: 4.299 HB1 :: 1.615 HB2 :: 1.615 HB3 :: 1.615 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.730 Ave N Shift Values>> N :: 123.23(3.7) 1.F89 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.95 H 0.02 W 0.02 C Shift Assignments>> C :: 176.081 CA :: 57.016 CB :: 35.038 CD1 :: 127.542 CD2 :: 127.542 CE1 :: 129.092 CE2 :: 129.092 CZ :: 124.855 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.980 HA :: 4.141 HB2 :: 3.658 HB3 :: 3.239 HD1 :: 7.203 HD2 :: 7.203 HE1 :: 7.340 HE2 :: 7.340 HZ :: 7.275 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 118.927 Ave N Shift Values>> N :: 120.69(4.18) 1.K90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 L 0.07 R 0.05 K 0.04 A 0.02 M 0.01 C Shift Assignments>> C :: 177.829 CA :: 56.868 CB :: 29.803 CG :: 22.644 CD :: 26.783 CE :: 39.860 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.215 HA :: 4.137 HB2 :: 1.938 HB3 :: 1.938 HG2 :: 1.493 HG3 :: 1.429 HD2 :: 1.662 HD3 :: 1.662 HE2 :: 2.927 HE3 :: 2.927 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.065 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.K91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 K 0.07 R 0.06 M 0.02 A 0.02 L 0.01 C Shift Assignments>> C :: 175.581 CA :: 56.893 CB :: 30.545 CG :: 22.635 CD :: 27.040 CE :: 39.895 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.074 HA :: 3.951 HB2 :: 1.945 HB3 :: 1.945 HG2 :: 1.475 HG3 :: 1.415 HD2 :: 1.674 HD3 :: 1.674 HE2 :: 2.934 HE3 :: 2.934 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 120.397 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.M92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.98 G 0.01 C Shift Assignments>> C :: 173.547 CA :: 50.112 CB :: 27.535 CG :: 27.931 CE :: 11.655 Ave C Shift Values>> C :: 176.3(2.13) CA :: 56.16(2.34) CB :: 32.9(2.23) CG :: 32.07(1.45) CE :: 17.21(3.42) H Shift Assignments>> H :: 7.470 HA :: 4.670 HB2 :: 1.667 HB3 :: 1.667 HG2 :: 2.298 HG3 :: 2.298 HE1 :: 1.182 HE2 :: 1.182 HE3 :: 1.182 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 110.991 Ave N Shift Values>> N :: 120.1(3.88) 1.G93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.49 L 0.19 R 0.14 C 0.1 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> C :: 173.017 CA :: 44.576 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.600 HA2 :: 3.892 HA3 :: 3.776 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.943 Ave N Shift Values>> N :: 109.91(4.29) 1.V94 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.85 V 0.09 I 0.05 C Shift Assignments>> C :: 174.162 CA :: 59.882 CB :: 28.890 CG1 :: 18.356 CG2 :: 20.152 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 8.531 HA :: 3.979 HB :: 1.414 HG11 :: -0.155(S) HG12 :: -0.155(S) HG13 :: -0.155(S) HG21 :: 0.527 HG22 :: 0.527 HG23 :: 0.527 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.306 Ave N Shift Values>> N :: 121.02(4.96) 1.D95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 C 0.27 D 0.04 Y 0.02 M 0.01 F 0.01 E 0.01 C Shift Assignments>> C :: 172.387 CA :: 50.483 CB :: 37.293 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.710 HA :: 4.454 HB2 :: 2.528 HB3 :: 2.528 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 129.525 Ave N Shift Values>> N :: 120.73(4.2) 1.K96 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Anomalous N Shifts: Consistent PRTL>> A 0.68 C 0.3 C Shift Assignments>> C :: 172.196 CA :: 52.352 CB :: 33.168 CG :: 20.169(S) CD :: 25.844 CE :: 39.664 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 6.786 HA :: 3.901 HB2 :: 1.112 HB3 :: 0.960 HG2 :: 0.317(S) HG3 :: -0.674(S) HD2 :: -0.020(A) HD3 :: 1.099 HE2 :: 1.951(S) HE3 :: 1.490(S) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 122.331 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.I97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.97 I 0.01 C Shift Assignments>> C :: 173.815 CA :: 57.544 CB :: 34.865 CG1 :: 24.943 CG2 :: 14.742 CD1 :: 9.333 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.378 HA :: 4.024 HB :: 1.606 HG12 :: 1.414 HG13 :: 1.109 HG21 :: 0.602 HG22 :: 0.602 HG23 :: 0.602 HD11 :: 0.701 HD12 :: 0.701 HD13 :: 0.701 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 128.728 Ave N Shift Values>> N :: 121.6(4.72) 1.I98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.78 I 0.17 A 0.03 C Shift Assignments>> C :: 173.492 CA :: 56.676 CB :: 36.792 CG1 :: 25.441 CG2 :: 15.517 CD1 :: 11.401 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 8.887 HA :: 3.753 HB :: 1.431 HG12 :: 0.493 HG13 :: 1.587 HG21 :: -0.036 HG22 :: -0.036 HG23 :: -0.036 HD11 :: 0.211 HD12 :: 0.211 HD13 :: 0.211 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 129.863 Ave N Shift Values>> N :: 121.6(4.72) 1.P99 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.82 G 0.13 L 0.04 C Shift Assignments>> C :: 173.271 CA :: 59.026 CB :: 25.168(A) CG :: 24.282 CD :: 48.001 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.742 HB2 :: 2.046 HB3 :: 1.679 HG2 :: 2.015 HG3 :: 1.522 HD2 :: 2.875 HD3 :: 3.687 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.V100 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> V 0.77 C 0.19 I 0.02 C Shift Assignments>> C :: 173.130 CA :: 65.274 CB :: 30.227 CG1 :: 18.974 CG2 :: 19.915 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.976 HA :: 2.238(S) HB :: 1.683 HG11 :: 0.654 HG12 :: 0.654 HG13 :: 0.654 HG21 :: 0.629 HG22 :: 0.629 HG23 :: 0.629 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 124.128 Ave N Shift Values>> N :: 121.02(4.96) 1.E101 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.38 K 0.24 Q 0.18 R 0.07 E 0.05 I 0.02 M 0.02 C Shift Assignments>> C :: 175.645 CA :: 57.290 CB :: 26.218 CG :: 34.337 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.601 HA :: 3.667 HB2 :: 1.804 HB3 :: 1.804 HG2 :: 2.128 HG3 :: 2.128 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 114.117 Ave N Shift Values>> N :: 120.68(3.68) 1.K102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 K 0.06 R 0.04 A 0.04 M 0.02 L 0.01 C Shift Assignments>> C :: 177.126 CA :: 55.720 CB :: 30.722 CG :: 22.986 CD :: 26.610 CE :: 39.778 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 6.996 HA :: 4.065 HB2 :: 1.626 HB3 :: 1.626 HG2 :: 1.206 HG3 :: 1.363 HD2 :: 1.467 HD3 :: 1.547 HE2 :: 2.833 HE3 :: 2.833 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 114.033 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.L103 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.65 A 0.34 C Shift Assignments>> C :: 178.762 CA :: 55.976 CB :: 38.855 CG :: 23.533 CD1 :: 23.515 CD2 :: 19.397 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.818 HA :: 3.672 HB2 :: 0.964 HB3 :: 1.062 HG :: 1.156 HD11 :: -0.479(S) HD12 :: -0.479(S) HD13 :: -0.479(S) HD21 :: 0.353 HD22 :: 0.353 HD23 :: 0.353 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.679 Ave N Shift Values>> N :: 121.98(4.07) 1.V104 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.57 C 0.41 C Shift Assignments>> C :: 173.101 CA :: 62.122 CB :: 29.480 CG1 :: 19.900 CG2 :: 15.001(S) Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.754 HA :: 4.120 HB :: 2.665 HG11 :: 1.155 HG12 :: 1.155 HG13 :: 1.155 HG21 :: 0.875 HG22 :: 0.875 HG23 :: 0.875 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 107.538 Ave N Shift Values>> N :: 121.02(4.96) 1.K105 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.5 A 0.27 L 0.18 R 0.02 C Shift Assignments>> C :: 176.514 CA :: 53.418 CB :: 29.309 CG :: 22.159 CD :: 25.672 CE :: 39.965 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 6.935 HA :: 4.232 HB2 :: 1.942 HB3 :: 1.942 HG2 :: 1.571 HG3 :: 1.571 HD2 :: 1.571 HD3 :: 1.571 HE2 :: 2.909 HE3 :: 2.973 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 115.841 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.G106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.63 L 0.14 C 0.09 R 0.08 F 0.01 D 0.01 C Shift Assignments>> C :: 171.380 CA :: 44.898 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.954 HA2 :: 3.958 HA3 :: 3.594 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 103.335 Ave N Shift Values>> N :: 109.91(4.29) 1.K107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 A 0.25 L 0.04 R 0.01 C Shift Assignments>> C :: 176.506 CA :: 52.465 CB :: 30.260 CG :: 22.743 CD :: 26.143 CE :: 39.427 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.817 HA :: 4.670 HB2 :: 1.968 HB3 :: 1.968 HG2 :: 1.440 HG3 :: 1.343 HD2 :: 1.658 HD3 :: 1.658 HE2 :: 2.481 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 116.810 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.F108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 F 0.31 Y 0.1 C Shift Assignments>> C :: 174.791 CA :: 61.672 CB :: 37.043 CD1 :: 129.590 CD2 :: 129.590 CZ :: 128.463 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.095 HA :: 3.698 HB2 :: 3.316 HB3 :: 2.902 HD1 :: 7.069 HD2 :: 7.069 HZ :: 7.203 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 123.369 Ave N Shift Values>> N :: 120.69(4.18) 1.Q109 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 K 0.28 R 0.27 M 0.02 V 0.01 C Shift Assignments>> C :: 176.144 CA :: 58.174 CB :: 25.311 CG :: 30.752 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 9.203 HA :: 3.666 HB2 :: 2.295 HB3 :: 1.950 HG2 :: 2.449 HG3 :: 2.385 HE21 :: 6.873 HE22 :: 7.940 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.544 NE2 :: 112.407 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.D110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.28 D 0.19 C 0.17 Y 0.13 F 0.11 L 0.05 E 0.01 I 0.01 C Shift Assignments>> C :: 176.735 CA :: 54.463 CB :: 38.979 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.615 HA :: 4.281 HB2 :: 2.311 HB3 :: 2.311 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 113.283 Ave N Shift Values>> N :: 120.73(4.2) 1.N111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.28 N 0.2 E 0.16 Y 0.11 M 0.06 F 0.06 D 0.03 K 0.02 I 0.01 C Shift Assignments>> C :: 175.313 CA :: 54.751 CB :: 36.914 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.171 HA :: 4.343 HB2 :: 2.646 HB3 :: 2.157 HD21 :: 7.892 HD22 :: 7.261 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 115.939 ND2 :: 110.025 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.F112 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.96 F 0.02 C Shift Assignments>> C :: 174.370 CA :: 56.338 CB :: 36.205 CD1 :: 129.422 CD2 :: 129.422 CE1 :: 127.106 CE2 :: 127.106(S) CZ :: 128.441 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.234 HA :: 4.367 HB2 :: 2.529 HB3 :: 1.865 HD1 :: 7.064 HD2 :: 7.064 HE1 :: 6.019 HE2 :: 6.019 HZ :: 6.916 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 123.525 Ave N Shift Values>> N :: 120.69(4.18) 1.E113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 Q 0.24 K 0.19 E 0.1 R 0.07 I 0.03 C Shift Assignments>> C :: 177.501 CA :: 57.357 CB :: 27.205 CG :: 34.331 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 8.039 HA :: 3.823 HB2 :: 2.087 HB3 :: 2.031 HG2 :: 2.494 HG3 :: 2.233 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 117.591 Ave N Shift Values>> N :: 120.68(3.68) 1.F114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.84 F 0.14 Y 0.01 C Shift Assignments>> C :: 174.997 CA :: 60.388 CB :: 37.351 CD1 :: 130.246 CD2 :: 130.246 CE1 :: 127.913 CE2 :: 127.913 CZ :: 126.116 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.539 HA :: 4.513 HB2 :: 3.096 HB3 :: 3.096 HD1 :: 7.260 HD2 :: 7.260 HE1 :: 6.281 HE2 :: 6.281 HZ :: 6.889 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 117.888 Ave N Shift Values>> N :: 120.69(4.18) 1.I115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.61 I 0.32 M 0.05 HN Overlap>> 1.N81 1.N81 C Shift Assignments>> C :: 173.998 CA :: 60.565 CB :: 33.829 CG1 :: 28.486 CG2 :: 16.933 CD1 :: 12.690 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.882 HA :: 4.495 HB :: 2.488 HG12 :: 1.615 HG13 :: 1.946 HG21 :: 1.229 HG22 :: 1.229 HG23 :: 1.229 HD11 :: 1.217 HD12 :: 1.217 HD13 :: 1.217 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 118.012 Ave N Shift Values>> N :: 121.6(4.72) 1.Q116 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.35 K 0.29 R 0.29 M 0.03 C Shift Assignments>> C :: 176.936 CA :: 56.791 CB :: 25.432 CG :: 30.875 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.563 HA :: 3.713 HB2 :: 1.787 HB3 :: 1.787 HG2 :: 1.840 HG3 :: 1.840 HE21 :: 7.092 HE22 :: 5.197(S) Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 120.554 NE2 :: 111.163 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.W117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.94 W 0.05 C Shift Assignments>> C :: 174.055 CA :: 59.866 CB :: 24.935 CD1 :: 124.071 CE3 :: 117.422 CZ2 :: 112.707 CZ3 :: 118.906 CH2 :: 121.291 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) H Shift Assignments>> H :: 7.087 HA :: 3.747 HB2 :: 3.150 HB3 :: 3.150 HD1 :: 7.006 HE1 :: 9.444 HE3 :: 6.588 HZ2 :: 7.234 HZ3 :: 6.617 HH2 :: 5.694 Ave H Shift Values>> H :: 8.35(0.84) HA :: 4.74(0.55) HB2 :: 3.22(0.36) HB3 :: 3.18(0.36) HD1 :: 7.16(0.34) HE1 :: 10.13(0.53) HE3 :: 7.17(1.03) HZ2 :: 7.14(0.89) HZ3 :: 6.68(1.02) HH2 :: 6.82(0.94) N Shift Assignments>> N :: 118.721 NE1 :: 129.033 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.F118 Overall: Anomalous Typing: Consistent SRO: Suspicious C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.78 F 0.2 C Shift Assignments>> C :: 174.315 CA :: 59.357 CB :: 37.445 CD1 :: 129.998 CD2 :: 129.998 CE1 :: 128.287 CE2 :: 128.287 CZ :: 126.637 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.953 HA :: 2.633(A) HB2 :: 2.971 HB3 :: 2.652 HD1 :: 7.047 HD2 :: 7.047 HE1 :: 7.236 HE2 :: 7.236 HZ :: 7.439 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 120.415 Ave N Shift Values>> N :: 120.69(4.18) SRO Rule Breaks>> (HA > HB2 : 0.9952) (HA > HB3 : 0.9955) 1.K119 Overall: Mistyped Typing: Mistyped SRO: Suspicious C Shifts: Suspicious H Shifts: Anomalous N Shifts: Consistent PRTL>> C 0.71 A 0.11 L 0.1 V 0.04 C Shift Assignments>> C :: 174.596 CA :: 55.816 CB :: 29.425 CG :: 21.965 CD :: 23.765(S) CE :: 39.267 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.701 HA :: 3.282 HB2 :: 1.454 HB3 :: 1.187 HG2 :: 0.419(S) HG3 :: 0.364(S) HD2 :: -0.931(A) HD3 :: 0.582(S) HE2 :: 1.150(A) HE3 :: 1.824(S) Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 118.566 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) SRO Rule Breaks>> (HE2 > HB2 : 0.9970) (HE2 > HB3 : 0.9957) 1.K120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.76 L 0.09 R 0.05 K 0.04 A 0.02 M 0.01 C Shift Assignments>> C :: 177.255 CA :: 56.709 CB :: 29.648 CG :: 22.823 CD :: 26.848 CE :: 39.860 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 6.463 HA :: 3.755 HB2 :: 1.558 HB3 :: 1.462 HG2 :: 1.163 HG3 :: 1.363 HD2 :: 1.417 HD3 :: 1.469 HE2 :: 2.806 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 117.439 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.F121 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> C 0.96 F 0.01 C Shift Assignments>> C :: 174.657 CA :: 58.779 CB :: 35.581 CD1 :: 128.963 CD2 :: 128.963 CE1 :: 129.015 CE2 :: 129.015 CZ :: 125.868 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 7.509 HA :: 3.395 HB2 :: 1.697(S) HB3 :: 1.394(S) HD1 :: 6.354 HD2 :: 6.354 HE1 :: 6.944 HE2 :: 6.944 HZ :: 6.693 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 122.040 Ave N Shift Values>> N :: 120.69(4.18) 1.F122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 F 0.32 C Shift Assignments>> C :: 175.200 CA :: 58.850 CB :: 36.851 CD1 :: 129.682 CD2 :: 129.682 CE1 :: 129.490 CE2 :: 129.490 CZ :: 127.918 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 9.114 HA :: 3.292 HB2 :: 2.361 HB3 :: 2.996 HD1 :: 6.957 HD2 :: 6.957 HE1 :: 7.163 HE2 :: 7.163 HZ :: 6.397 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 123.891 Ave N Shift Values>> N :: 120.69(4.18) 1.D123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 N 0.24 E 0.14 Y 0.12 F 0.06 M 0.05 D 0.04 K 0.01 I 0.01 C Shift Assignments>> C :: 176.133 CA :: 54.657 CB :: 37.139 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.652 HA :: 4.120 HB2 :: 2.426 HB3 :: 2.426 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.802 Ave N Shift Values>> N :: 120.73(4.2) 1.A124 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.72 M 0.25 C 0.01 C Shift Assignments>> C :: 175.050 CA :: 50.886 CB :: 16.392 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.154 HA :: 3.963 HB1 :: 1.013 HB2 :: 1.013 HB3 :: 1.013 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.334 Ave N Shift Values>> N :: 123.23(3.7) 1.N125 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> D 0.34 N 0.24 L 0.13 C 0.12 K 0.04 F 0.04 Y 0.03 R 0.01 C Shift Assignments>> C :: 172.008 CA :: 51.669 CB :: 41.014 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 6.942 HA :: 4.453 HB2 :: 2.069 HB3 :: 1.631(S) HD21 :: 6.846 HD22 :: 7.866 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 112.789 ND2 :: 119.930 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.Y126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.68 Y 0.22 H 0.09 C Shift Assignments>> C :: 173.023 CA :: 55.453 CB :: 35.235 CD1 :: 130.774 CD2 :: 130.774 CE1 :: 117.351 CE2 :: 117.351 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 7.945 HA :: 4.093 HB2 :: 2.298 HB3 :: 1.744 HD1 :: 6.951 HD2 :: 6.951 HE1 :: 6.891 HE2 :: 6.891 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 122.790 Ave N Shift Values>> N :: 120.79(4.69) 1.D127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.59 C 0.18 D 0.13 Y 0.03 F 0.02 L 0.01 C Shift Assignments>> C :: 174.609 CA :: 50.581 CB :: 38.623 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.857 HA :: 4.196 HB2 :: 2.754 HB3 :: 2.393 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 128.317 Ave N Shift Values>> N :: 120.73(4.2) 1.G128 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Indeterminable PRTL>> R 0.3 L 0.26 G 0.21 C 0.09 D 0.03 F 0.03 Y 0.02 K 0.01 C Shift Assignments>> C :: 172.195 CA :: 43.922 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 4.858(S) HA2 :: 3.718 HA3 :: 3.090 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) 1.K129 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.57 C 0.4 M 0.01 L 0.01 C Shift Assignments>> C :: 174.043 CA :: 54.212 CB :: 28.935 CG :: 19.922(S) CD :: 25.954 CE :: 38.232(S) Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 7.242 HA :: 4.084 HB2 :: 2.038 HB3 :: 1.712 HG2 :: 1.414 HG3 :: 1.414 HD2 :: 1.726 HD3 :: 2.068 HE2 :: 2.876 HE3 :: 3.141 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 118.237 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.D130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.49 D 0.18 C 0.15 Y 0.06 F 0.05 L 0.03 C Shift Assignments>> C :: 173.096 CA :: 52.570 CB :: 38.788 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.534 HA :: 4.568 HB2 :: 2.518 HB3 :: 2.573 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 122.564 Ave N Shift Values>> N :: 120.73(4.2) 1.Y131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.56 Y 0.43 C Shift Assignments>> C :: 171.115 CA :: 55.701 CB :: 39.714 CD1 :: 130.908 CD2 :: 130.908 CE1 :: 115.113 CE2 :: 115.113 Ave C Shift Values>> C :: 175.39(1.89) CA :: 58.02(2.64) CB :: 39.16(2.23) CG :: 129.29(1.21) CD1 :: 132.54(1.35) CD2 :: 132.26(1.99) CE1 :: 117.81(2.09) CE2 :: 117.91(2.6) CZ :: 156.37(2.5) H Shift Assignments>> H :: 8.399 HA :: 4.525 HB2 :: 2.942 HB3 :: 2.853 HD1 :: 7.003 HD2 :: 7.003 HE1 :: 6.536 HE2 :: 6.536 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 123.627 Ave N Shift Values>> N :: 120.79(4.69) 1.N132 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.98 C 0.01 C Shift Assignments>> C :: 171.403 CA :: 46.541(S) CB :: 36.068 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 7.988 HA :: 5.008 HB2 :: 2.770 HB3 :: 2.504 HD21 :: 6.995 HD22 :: 7.766 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 124.872 ND2 :: 113.453 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.P133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.85 P 0.09 G 0.04 C Shift Assignments>> C :: 175.245 CA :: 61.290 CB :: 30.133 CG :: 24.780 CD :: 48.562 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 3.831 HB2 :: 2.031 HB3 :: 1.737 HG2 :: 1.572 HG3 :: 1.950 HD2 :: 3.764 HD3 :: 3.720 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.L134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.58 A 0.35 L 0.06 C Shift Assignments>> C :: 176.814 CA :: 54.764 CB :: 38.923 CG :: 25.063 CD1 :: 22.150 CD2 :: 21.163 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 7.385 HA :: 3.762 HB2 :: 1.473 HB3 :: 1.324 HG :: 1.291 HD11 :: 0.622 HD12 :: 0.622 HD13 :: 0.622 HD21 :: 0.615 HD22 :: 0.615 HD23 :: 0.615 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.046 Ave N Shift Values>> N :: 121.98(4.07) 1.L135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.59 A 0.36 L 0.03 C Shift Assignments>> C :: 177.383 CA :: 54.710 CB :: 38.995 CG :: 24.445 CD1 :: 22.070 CD2 :: 21.204 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 6.775 HA :: 3.780 HB2 :: 1.323 HB3 :: 1.323 HG :: 1.324 HD11 :: 0.742 HD12 :: 0.742 HD13 :: 0.742 HD21 :: 0.669 HD22 :: 0.669 HD23 :: 0.669 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 118.780 Ave N Shift Values>> N :: 121.98(4.07) 1.A136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.71 M 0.26 C 0.01 C Shift Assignments>> C :: 176.042 CA :: 51.766 CB :: 16.946 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.618 HA :: 3.955 HB1 :: 1.153 HB2 :: 1.153 HB3 :: 1.153 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.935 Ave N Shift Values>> N :: 123.23(3.7) 1.R137 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> K 0.38 L 0.3 C 0.22 R 0.07 C Shift Assignments>> C :: 173.817 CA :: 54.439 CB :: 28.410 CG :: 25.394 CD :: 41.374 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 6.789 HA :: 3.898 HB2 :: 1.351 HB3 :: 1.195 HG2 :: 0.682(S) HG3 :: 1.137 HD2 :: 2.592 HD3 :: 2.076(S) HE :: 7.024 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 112.100 NE :: 83.004 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.Q138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.36 C 0.34 K 0.2 Q 0.05 M 0.02 HN Overlap>> 1.H80 1.H80 C Shift Assignments>> C :: 174.381 CA :: 54.410 CB :: 26.547 CG :: 31.603 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.511 HA :: 4.074 HB2 :: 1.978 HB3 :: 1.978 HG2 :: 2.259 HG3 :: 2.259 HE21 :: 7.321 HE22 :: 6.656 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.787 NE2 :: 111.107 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.G139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 L 0.27 C 0.07 G 0.06 K 0.05 D 0.05 F 0.04 Y 0.02 I 0.01 C Shift Assignments>> C :: 171.817 CA :: 43.249 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.167 HA2 :: 3.867 HA3 :: 3.786 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.300 Ave N Shift Values>> N :: 109.91(4.29) 1.Q140 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.33 C 0.32 K 0.21 Q 0.06 M 0.04 P 0.01 C Shift Assignments>> C :: 173.095 CA :: 53.455 CB :: 27.498 CG :: 31.595 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 7.966 HA :: 4.249 HB2 :: 2.046 HB3 :: 1.807 HG2 :: 2.231 HG3 :: 2.231 HE21 :: 6.854 HE22 :: 7.425 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 118.617 NE2 :: 112.099 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.D141 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 D 0.17 C 0.15 Y 0.05 F 0.04 L 0.02 C Shift Assignments>> C :: 173.525 CA :: 52.005 CB :: 38.811 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.354 HA :: 4.510 HB2 :: 2.575 HB3 :: 2.466 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 120.857 Ave N Shift Values>> N :: 120.73(4.2) 1.V142 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.83 I 0.08 V 0.07 A 0.01 HN Overlap>> 1.L45 1.L45 C Shift Assignments>> C :: 173.091 CA :: 59.344 CB :: 30.549 CG1 :: 18.880 CG2 :: 17.881 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.892 HA :: 4.039 HB :: 1.963 HG11 :: 0.811 HG12 :: 0.811 HG13 :: 0.811 HG21 :: 0.775 HG22 :: 0.775 HG23 :: 0.775 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 118.943 Ave N Shift Values>> N :: 121.02(4.96) 1.A143 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 A 0.14 M 0.02 C Shift Assignments>> C :: 172.496 CA :: 47.990 CB :: 15.873 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.225 HA :: 4.488 HB1 :: 1.233 HB2 :: 1.233 HB3 :: 1.233 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 128.743 Ave N Shift Values>> N :: 123.23(3.7) 1.P144 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.88 G 0.09 P 0.01 C Shift Assignments>> CA :: 60.546 CB :: 29.665 CG :: 24.822 CD :: 48.010 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.285 HB2 :: 2.165 HB3 :: 1.759 HG2 :: 1.922 HG3 :: 1.922 HD2 :: 3.540 HD3 :: 3.701 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.P145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.89 G 0.08 L 0.01 C Shift Assignments>> CA :: 58.990 CB :: 28.380 CG :: 24.990 CD :: 47.982 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.590 HB2 :: 2.221 HB3 :: 1.791 HG2 :: 1.926 HG3 :: 1.926 HD2 :: 3.487 HD3 :: 3.542 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.P146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.91 G 0.05 P 0.03 C Shift Assignments>> C :: 174.055 CA :: 60.490 CB :: 29.721 CG :: 24.940 CD :: 48.370 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.288 HB2 :: 1.737 HB3 :: 2.158 HD2 :: 3.643 HD3 :: 3.729 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.N147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.42 N 0.3 G 0.15 P 0.04 M 0.02 Y 0.01 D 0.01 C Shift Assignments>> C :: 171.524 CA :: 48.815 CB :: 36.480 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 8.456 HA :: 4.860 HB2 :: 2.733 HB3 :: 2.601 HD21 :: 6.878 HD22 :: 7.620 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 119.481 ND2 :: 113.576 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.P148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.83 P 0.09 G 0.07 C Shift Assignments>> C :: 175.282 CA :: 61.661 CB :: 29.638 CG :: 24.918 CD :: 48.374 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.269 HB2 :: 2.187 HB3 :: 1.882 HG2 :: 1.939 HD2 :: 3.638 HD3 :: 3.726 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.G149 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.36 L 0.27 K 0.07 C 0.07 D 0.06 F 0.05 G 0.04 Y 0.03 I 0.01 C Shift Assignments>> C :: 171.877 CA :: 43.038 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.337 HA2 :: 3.828 HA3 :: 3.828 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.998 Ave N Shift Values>> N :: 109.91(4.29) 1.D150 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.52 D 0.17 C 0.15 Y 0.05 F 0.04 L 0.02 C Shift Assignments>> C :: 174.029 CA :: 52.216 CB :: 38.747 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 7.928 HA :: 4.495 HB2 :: 2.584 HB3 :: 2.584 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 119.874 Ave N Shift Values>> N :: 120.73(4.2) 1.Q151 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.38 C 0.35 K 0.16 Q 0.04 M 0.02 P 0.01 C Shift Assignments>> C :: 173.281 CA :: 53.445 CB :: 27.042 CG :: 31.452 Ave C Shift Values>> C :: 176.39(1.96) CA :: 56.62(2.19) CB :: 29.1(1.97) CG :: 33.72(1.1) CD :: 179.68(1.17) H Shift Assignments>> H :: 8.118 HA :: 4.168 HB2 :: 1.827 HB3 :: 1.915 HG2 :: 2.158 HG3 :: 2.158 HE21 :: 7.408 HE22 :: 6.767 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 119.668 NE2 :: 112.289 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.I152 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.86 I 0.13 C Shift Assignments>> C :: 173.569 CA :: 58.750 CB :: 36.282 CG1 :: 24.819 CG2 :: 14.997 CD1 :: 10.432 Ave C Shift Values>> C :: 175.82(1.95) CA :: 61.59(2.78) CB :: 38.58(2.09) CG1 :: 27.65(2.32) CG2 :: 17.36(1.6) CD1 :: 13.41(1.91) H Shift Assignments>> H :: 7.972 HA :: 3.991 HB :: 1.663 HG12 :: 1.248 HG13 :: 0.997 HG21 :: 0.673 HG22 :: 0.673 HG23 :: 0.673 HD11 :: 0.701 HD12 :: 0.701 HD13 :: 0.701 Ave H Shift Values>> H :: 8.26(0.71) HA :: 4.2(0.56) HB :: 1.8(0.31) HG2 :: 0.8(0.29) HG12 :: 1.3(0.4) HG13 :: 1.24(0.4) HD1 :: 0.7(0.3) N Shift Assignments>> N :: 121.305 Ave N Shift Values>> N :: 121.6(4.72) 1.F153 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.53 Y 0.32 F 0.13 C Shift Assignments>> C :: 173.252 CA :: 55.323 CB :: 37.341 CD1 :: 129.494 CD2 :: 129.494 Ave C Shift Values>> C :: 175.49(2.13) CA :: 58.25(2.73) CB :: 39.95(2.04) CG :: 138.35(1.12) CD1 :: 131.38(1.38) CD2 :: 131.33(1.48) CE1 :: 130.48(1.29) CE2 :: 130.6(0.97) CZ :: 129.11(1.68) H Shift Assignments>> H :: 8.308 HA :: 4.599 HB2 :: 3.042 HB3 :: 2.919 HD1 :: 7.164 HD2 :: 7.164 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 124.297 Ave N Shift Values>> N :: 120.69(4.18) 1.S154 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 C Shift Assignments>> C :: 171.842 CA :: 55.635 CB :: 61.644 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.151 HA :: 4.356 HB2 :: 3.697 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 118.017 Ave N Shift Values>> N :: 116.3(3.95) 1.G155 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.3 K 0.19 R 0.14 D 0.1 F 0.07 C 0.07 Y 0.05 I 0.02 N 0.01 G 0.01 C Shift Assignments>> C :: 169.435 CA :: 42.290 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.695 HA2 :: 3.976 HA3 :: 3.939 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.053 Ave N Shift Values>> N :: 109.91(4.29) 1.P156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.76 G 0.22 C Shift Assignments>> C :: 175.024 CA :: 60.883 CB :: 29.803 CG :: 24.775 CD :: 47.423 Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.379 HB2 :: 2.201 HB3 :: 1.875 HG2 :: 1.919 HG3 :: 1.919 HD2 :: 3.535 HD3 :: 3.535 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) 1.S157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 C 0.01 C Shift Assignments>> C :: 172.302 CA :: 55.949 CB :: 61.622 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.434 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 115.997 Ave N Shift Values>> N :: 116.3(3.95) 1.S158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.98 C 0.01 C Shift Assignments>> CA :: 56.099 CB :: 61.539 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> HA :: 4.394 HB2 :: 3.784 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) 1.G159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.31 L 0.27 G 0.18 C 0.09 D 0.03 F 0.03 Y 0.02 K 0.02 C Shift Assignments>> CA :: 43.851 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.949 HA2 :: 3.693 HA3 :: 3.642 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 116.458 Ave N Shift Values>> N :: 109.91(4.29) ########################################################################### Overall Results: #Consistent: 134 #Clerical: 0 #Suspicious: 18 #Anomalous: 2 #Mistyped: 5 #Indeterminable: 0 Typing Results: #Consistent: 151 #Suspicious: 0 #Mistyped: 5 #Indeterminable: 3 Shift Relative Order (SRO) Results: #Consistent: 157 #Suspicious: 2 C Shift Results: #Consistent: 702 #Duplicate: 0 #Unknown: 0 #Suspicious: 7 #Anomalous: 2 H Shift Results: #Consistent:1069 #Duplicate: 0 #Unknown: 0 #Suspicious: 33 #Anomalous: 4 N Shift Results: #Consistent: 161 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.L35 HD11 = -0.343(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.7523e-05 1.L35 HD12 = -0.343(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.7523e-05 1.L35 HD13 = -0.343(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.7523e-05 1.E43 H = 11.211(S), Expected = 8.34, Std = 0.6100, ChiSquare = 2.5194e-06 1.Q44 HB3 = 0.983(S), Expected = 2.04, Std = 0.2900, ChiSquare = 2.6757e-04 1.L58 HB3 = -0.295(S), Expected = 1.57, Std = 0.3600, ChiSquare = 2.2123e-07 1.F59 C = 168.998(A), Expected = 175.49, Std = 2.1300, ChiSquare = 2.3046e-03 1.V68 HG11 = -0.220(S), Expected = 0.84, Std = 0.2700, ChiSquare = 8.6397e-05 1.V68 HG12 = -0.220(S), Expected = 0.84, Std = 0.2700, ChiSquare = 8.6397e-05 1.V68 HG13 = -0.220(S), Expected = 0.84, Std = 0.2700, ChiSquare = 8.6397e-05 1.K69 HE2 = 1.978(S), Expected = 2.93, Std = 0.2000, ChiSquare = 1.9359e-06 1.E77 HG2 = 1.417(S), Expected = 2.31, Std = 0.2100, ChiSquare = 2.1151e-05 1.F89 Typing: Mistyped 1.V94 HG11 = -0.155(S), Expected = 0.84, Std = 0.2700, ChiSquare = 2.2854e-04 1.V94 HG12 = -0.155(S), Expected = 0.84, Std = 0.2700, ChiSquare = 2.2854e-04 1.V94 HG13 = -0.155(S), Expected = 0.84, Std = 0.2700, ChiSquare = 2.2854e-04 1.K96 Typing: Mistyped 1.K96 CG = 20.169(S), Expected = 24.91, Std = 1.3100, ChiSquare = 2.9565e-04 1.K96 HG2 = 0.317(S), Expected = 1.38, Std = 0.2700, ChiSquare = 8.2494e-05 1.K96 HG3 = -0.674(S), Expected = 1.37, Std = 0.2900, ChiSquare = 1.8115e-12 1.K96 HD2 = -0.020(A), Expected = 1.61, Std = 0.2500, ChiSquare = 7.0307e-11 1.K96 HE2 = 1.951(S), Expected = 2.93, Std = 0.2000, ChiSquare = 9.8306e-07 1.K96 HE3 = 1.490(S), Expected = 2.93, Std = 0.2000, ChiSquare = 6.0213e-13 1.P99 Typing: Mistyped 1.P99 CB = 25.168(A), Expected = 31.81, Std = 1.5400, ChiSquare = 1.6106e-05 1.V100 HA = 2.238(S), Expected = 4.16, Std = 0.5700, ChiSquare = 7.4643e-04 1.L103 HD11 = -0.479(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.7293e-06 1.L103 HD12 = -0.479(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.7293e-06 1.L103 HD13 = -0.479(S), Expected = 0.77, Std = 0.2700, ChiSquare = 3.7293e-06 1.V104 CG2 = 15.001(S), Expected = 21.31, Std = 1.7600, ChiSquare = 3.3752e-04 1.F112 CE2 = 127.106(S), Expected = 130.60, Std = 0.9700, ChiSquare = 3.1570e-04 1.Q116 HE22 = 5.197(S), Expected = 7.07, Std = 0.4900, ChiSquare = 1.3213e-04 1.F118 HA = 2.633(A), Expected = 4.62, Std = 0.5800, ChiSquare = 6.1285e-04 1.F118 SRO Rule Break>> HA > HB2 : 0.995201919232307 1.F118 SRO Rule Break>> HA > HB3 : 0.99548625359048 1.K119 Typing: Mistyped 1.K119 CD = 23.765(S), Expected = 28.78, Std = 1.3900, ChiSquare = 3.0867e-04 1.K119 HG2 = 0.419(S), Expected = 1.38, Std = 0.2700, ChiSquare = 3.7190e-04 1.K119 HG3 = 0.364(S), Expected = 1.37, Std = 0.2900, ChiSquare = 5.2247e-04 1.K119 HD2 = -0.931(A), Expected = 1.61, Std = 0.2500, ChiSquare = 2.8705e-24 1.K119 HD3 = 0.582(S), Expected = 1.61, Std = 0.2500, ChiSquare = 3.9225e-05 1.K119 HE2 = 1.150(A), Expected = 2.93, Std = 0.2000, ChiSquare = 5.5847e-19 1.K119 HE3 = 1.824(S), Expected = 2.93, Std = 0.2000, ChiSquare = 3.2023e-08 1.K119 SRO Rule Break>> HE2 > HB2 : 0.997029997029997 1.K119 SRO Rule Break>> HE2 > HB3 : 0.995656220912194 1.F121 HB2 = 1.697(S), Expected = 2.99, Std = 0.3700, ChiSquare = 4.7478e-04 1.F121 HB3 = 1.394(S), Expected = 2.97, Std = 0.3800, ChiSquare = 3.3632e-05 1.N125 HB3 = 1.631(S), Expected = 2.78, Std = 0.3400, ChiSquare = 7.2641e-04 1.G128 H = 4.858(S), Expected = 8.34, Std = 0.7400, ChiSquare = 2.5336e-06 1.K129 Typing: Mistyped 1.K129 CG = 19.922(S), Expected = 24.91, Std = 1.3100, ChiSquare = 1.4030e-04 1.K129 CE = 38.232(S), Expected = 41.78, Std = 0.9800, ChiSquare = 2.9414e-04 1.N132 CA = 46.541(S), Expected = 53.43, Std = 1.9400, ChiSquare = 3.8373e-04 1.R137 HG2 = 0.682(S), Expected = 1.58, Std = 0.2700, ChiSquare = 8.8125e-04 1.R137 HD3 = 2.076(S), Expected = 3.13, Std = 0.2200, ChiSquare = 1.6603e-06