G1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable S2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable C Shift Assignments>> C :: 174.828 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> HA :: 4.220 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) H3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Consistent PRTL>> H 0.18 R 0.16 Q 0.15 E 0.14 C 0.13 K 0.1 M 0.08 I 0.01 HN Overlap>> A10 C Shift Assignments>> C :: 174.625(D) CA :: 55.979(D) CB :: 30.096(D) 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 :: 8.219 HA :: 4.200(D) HB2 :: 3.143(D) HB3 :: 3.077(D) HD2 :: 8.229(D) HE1 :: 7.378(D) 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 :: 122.085 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) M4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.24 M 0.24 K 0.14 H 0.11 R 0.09 Q 0.08 E 0.03 HN Overlap>> A76 A6 C Shift Assignments>> CA :: 53.209(D) CB :: 32.496(D) 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 :: 8.275(D) HA :: 4.755(D) HB2 :: 1.889(D) HB3 :: 2.007(D) HG2 :: 2.561(D) HG3 :: 2.472(D) 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 :: 123.257(D) Ave N Shift Values>> N :: 120.1(3.88) P5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.81 C 0.18 C Shift Assignments>> C :: 177.216(D) CA :: 63.202(D) CB :: 32.035(D) CG :: 27.423(D) CD :: 50.517(D) 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 :: 4.389(D) HB2 :: 2.268(D) HB3 :: 1.902(D) HG2 :: 1.995(D) HG3 :: 1.995(D) HD2 :: 3.753(D) HD3 :: 3.664(D) 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) Q6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.17 R 0.16 H 0.15 C 0.14 Q 0.14 K 0.1 M 0.06 I 0.03 V 0.01 HN Overlap>> D16 C Shift Assignments>> CA :: 57.343 CB :: 30.104 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 :: 8.505 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.221 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) P7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.83 C 0.16 C Shift Assignments>> C :: 176.642 CA :: 63.472 CB :: 32.050 CG :: 27.234 CD :: 50.511 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 :: 4.389 HB2 :: 2.268 HB3 :: 1.902 HG2 :: 1.966 HG3 :: 1.966 HD2 :: 3.748 HD3 :: 3.645 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) D8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.27 L 0.19 K 0.12 C 0.1 N 0.09 F 0.08 Y 0.06 R 0.03 C Shift Assignments>> C :: 176.216 CA :: 54.269 CB :: 41.212 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.300 HA :: 4.519 HB2 :: 2.658 HB3 :: 2.639 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 :: 120.030 Ave N Shift Values>> N :: 120.73(4.2) A9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.7 M 0.24 C 0.02 C Shift Assignments>> C :: 177.168 CA :: 53.039 CB :: 19.267 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.121 HA :: 4.230 HB :: 1.380 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.383 Ave N Shift Values>> N :: 123.23(3.7) A10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.68 M 0.27 C 0.02 HN Overlap>> H3 C Shift Assignments>> C :: 178.416 CA :: 53.220 CB :: 18.948 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.213 HA :: 4.273 HB :: 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 :: 122.085 Ave N Shift Values>> N :: 123.23(3.7) T11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.94 C 0.05 C Shift Assignments>> C :: 174.542 CA :: 62.303 CB :: 69.605 CG2 :: 21.032 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.864 HA :: 4.218 HB :: 3.628 HG2 :: 1.198 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 112.663 Ave N Shift Values>> N :: 115.7(5.05) A12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.73 M 0.22 C 0.02 C Shift Assignments>> C :: 177.591 CA :: 52.762 CB :: 19.211 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.057 HA :: 4.276 HB :: 1.358 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 125.886 Ave N Shift Values>> N :: 123.23(3.7) L13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.6 C 0.28 R 0.06 G 0.02 A 0.01 C Shift Assignments>> C :: 177.022(D) CA :: 55.143(D) CB :: 42.510(D) CG :: 26.976(D) CD1 :: 23.479(D) CD2 :: 24.818(D) 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 :: 7.970(D) HA :: 4.257(D) HB2 :: 1.617(D) HB3 :: 1.571(D) HG :: 1.423 HD1 :: 0.849(D) HD2 :: 0.901(D) Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 120.858(D) Ave N Shift Values>> N :: 121.98(4.07) A14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 M 0.19 C 0.02 C Shift Assignments>> C :: 177.490 CA :: 52.390 CB :: 19.261 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.048 HA :: 4.313 HB :: 1.347 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 124.661 Ave N Shift Values>> N :: 123.23(3.7) I15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.69 C 0.3 C Shift Assignments>> C :: 176.505 CA :: 61.148 CB :: 38.782 CG1 :: 27.181 CG2 :: 17.566 CD1 :: 12.633 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 :: 7.971 HA :: 4.192 HB :: 1.855 HG2 :: 0.884 HG12 :: 1.176 HG13 :: 1.462 HD1 :: 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 :: 119.929 Ave N Shift Values>> N :: 121.6(4.72) T16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.92 C 0.07 HN Overlap>> D7 C Shift Assignments>> C :: 174.262 CA :: 61.721 CB :: 69.862 CG2 :: 21.637 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 :: 8.082 HA :: 4.323 HB :: 4.209 HG2 :: 1.180 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.992 Ave N Shift Values>> N :: 115.7(5.05) A17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.74 M 0.21 C 0.02 L 0.01 C Shift Assignments>> C :: 177.407 CA :: 52.646 CB :: 19.442 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.263 HA :: 4.309 HB :: 1.361 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 126.450 Ave N Shift Values>> N :: 123.23(3.7) D18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.25 L 0.2 K 0.14 C 0.11 F 0.08 N 0.08 Y 0.07 R 0.04 C Shift Assignments>> C :: 176.449 CA :: 54.556 CB :: 41.245 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 :: 8.237 HA :: 4.568 HB2 :: 2.678 HB3 :: 2.612 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 :: 119.631 Ave N Shift Values>> N :: 120.73(4.2) S19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.99 C Shift Assignments>> C :: 174.648(D) CA :: 58.793(D) CB :: 63.856 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.120(D) HA :: 4.366(D) HB2 :: 3.880(D) HB3 :: 3.829(D) 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 :: 115.641(D) Ave N Shift Values>> N :: 116.3(3.95) E20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 M 0.11 K 0.07 I 0.04 Q 0.04 C Shift Assignments>> C :: 176.489 CA :: 56.728 CB :: 30.378 CG :: 36.289 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 :: 8.327 HA :: 4.319 HB2 :: 2.054 HB3 :: 1.939 HG2 :: 2.268 HG3 :: 2.201 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 122.288 Ave N Shift Values>> N :: 120.68(3.68) T21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.9 C 0.09 C Shift Assignments>> C :: 174.207 CA :: 61.533 CB :: 69.776 CG2 :: 22.052 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 :: 8.033 HA :: 4.287 HB :: 4.128 HG2 :: 1.177 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 115.376 Ave N Shift Values>> N :: 115.7(5.05) L22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.6 L 0.14 R 0.11 A 0.09 G 0.03 C Shift Assignments>> CA :: 53.091 CB :: 41.893 CG :: 23.618 CD1 :: 25.322 CD2 :: 26.982 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 :: 8.191 HA :: 4.589 HB2 :: 1.567 HB3 :: 1.494 HG :: 1.632 HD1 :: 0.867 HD2 :: 0.872 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 :: 126.176 Ave N Shift Values>> N :: 121.98(4.07) P23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.81 C 0.18 C Shift Assignments>> C :: 177.289 CA :: 63.223 CB :: 32.092 CG :: 27.472 CD :: 50.480 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 :: 4.417 HB2 :: 2.292 HB3 :: 1.898 HG2 :: 2.003 HG3 :: 2.003 HD2 :: 3.744 HD3 :: 3.644 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) E24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.36 C 0.35 I 0.1 K 0.09 M 0.04 Q 0.03 C Shift Assignments>> C :: 176.999 CA :: 57.614 CB :: 29.624 CG :: 36.452 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 :: 8.636 HA :: 4.142 HB2 :: 2.308 HB3 :: 2.041 HG2 :: 2.229 HG3 :: 2.229 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.850 Ave N Shift Values>> N :: 120.68(3.68) S25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.091 CA :: 59.627 CB :: 63.483 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.128 HA :: 4.344 HB2 :: 3.953 HB3 :: 3.888 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 114.375 Ave N Shift Values>> N :: 116.3(3.95) E26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.36 C 0.34 K 0.09 M 0.07 I 0.06 Q 0.05 C Shift Assignments>> C :: 177.322 CA :: 56.883 CB :: 29.931 CG :: 36.232 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 :: 8.271 HA :: 4.279 HB2 :: 2.044 HB3 :: 1.874 HG2 :: 2.264 HG3 :: 2.175 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 :: 121.452 Ave N Shift Values>> N :: 120.68(3.68) K27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.42 C 0.41 R 0.13 M 0.02 HN Overlap>> L60 C Shift Assignments>> C :: 175.562 CA :: 56.473 CB :: 33.824 CG :: 24.544 CD :: 29.062 CE :: 41.910 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 :: 7.807 HA :: 4.154 HB2 :: 1.438 HB3 :: 1.438 HE2 :: 2.976 HE3 :: 2.976 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 119.663 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Y28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.2 Y 0.19 C 0.16 D 0.15 L 0.12 K 0.07 N 0.04 I 0.03 C Shift Assignments>> C :: 176.057 CA :: 56.569 CB :: 40.264 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 :: 7.732 HA :: 5.267 HB2 :: 3.054 HB3 :: 2.601 HD1 :: 7.082 HD2 :: 7.082 HE1 :: 6.613 HE2 :: 6.613 Ave H Shift Values>> H :: 8.37(0.75) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.91(0.37) HD1 :: 6.87(0.65) HD2 :: 6.86(0.68) HE1 :: 6.64(0.58) HE2 :: 6.63(0.61) HH :: 9.25(1.34) N Shift Assignments>> N :: 118.571 Ave N Shift Values>> N :: 120.79(4.69) N29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.58 C 0.17 D 0.14 Y 0.03 F 0.02 L 0.01 C Shift Assignments>> CA :: 50.900 CB :: 38.616 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 :: 8.892 HA :: 4.981 HB2 :: 2.770 HB3 :: 2.898 HD21 :: 8.159 HD22 :: 7.145 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 :: 123.766 ND2 :: 114.110 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) P30 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Anomalous H Shifts: Consistent N Shifts: Indeterminable PRTL>> C 0.68 S 0.31 C Shift Assignments>> C :: 177.800 CA :: 65.416 CB :: 32.207 CG :: 27.448 CD :: 56.986(M) Ave C Shift Values>> C :: 176.7(1.69) CA :: 63.3(1.64) CB :: 31.81(1.54) CG :: 27.14(1.18) CD :: 50.28(1.04) H Shift Assignments>> HA :: 4.329 HB2 :: 2.370 HB3 :: 2.058 HG2 :: 2.135 HG3 :: 2.135 HD2 :: 3.665 HD3 :: 3.551 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) G31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.33 G 0.23 C 0.22 A 0.1 N 0.04 D 0.01 C Shift Assignments>> CA :: 48.270 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.683 HA2 :: 4.061 HA3 :: 3.931 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 105.330 Ave N Shift Values>> N :: 109.91(4.29) P32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> V 0.64 P 0.24 C 0.07 I 0.03 C Shift Assignments>> CA :: 65.417 CB :: 33.707 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 :: 4.208 HB2 :: 2.161 HB3 :: 1.937 HG2 :: 2.197 HG3 :: 2.197 HD2 :: 3.549 HD3 :: 3.549 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) Q33 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.18 I 0.16 E 0.14 R 0.12 H 0.09 Q 0.08 K 0.08 V 0.07 M 0.03 P 0.01 C Shift Assignments>> C :: 176.485 CA :: 60.005 CB :: 29.875 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 :: 7.315 HA :: 3.898 HB2 :: 2.197 HB3 :: 2.102 HE21 :: 6.818 HE22 :: 6.535 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 115.653 NE2 :: 108.434 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) D34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.23 Y 0.21 C 0.16 D 0.1 L 0.1 K 0.08 I 0.05 N 0.02 R 0.01 C Shift Assignments>> C :: 178.503 CA :: 57.225 CB :: 40.328 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 :: 8.723 HA :: 4.362 HB2 :: 2.940 HB3 :: 2.502 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.492 Ave N Shift Values>> N :: 120.73(4.2) F35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.21 C 0.21 F 0.16 Y 0.1 G 0.09 I 0.08 K 0.06 L 0.04 HN Overlap>> T87 C Shift Assignments>> C :: 177.387 CA :: 60.934 CB :: 43.063 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 :: 7.483 HA :: 3.908 HB2 :: 3.216 HB3 :: 2.693 HD1 :: 6.761 HD2 :: 6.761 HE1 :: 6.939 HE2 :: 6.939 HZ :: 7.437 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 :: 118.872 Ave N Shift Values>> N :: 120.69(4.18) L36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.34 C 0.31 K 0.18 G 0.07 R 0.06 C Shift Assignments>> C :: 178.763 CA :: 58.176 CB :: 43.154 CD1 :: 26.603 CD2 :: 24.956 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 :: 8.352 HA :: 4.003 HB2 :: 1.602 HB3 :: 1.602 HG :: 1.490 HD1 :: 0.542 HD2 :: 0.969 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 :: 118.678 Ave N Shift Values>> N :: 121.98(4.07) L37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 L 0.29 R 0.2 K 0.1 C Shift Assignments>> C :: 178.039 CA :: 56.316 CB :: 41.610 CG :: 27.863 CD1 :: 27.877 CD2 :: 24.416 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 :: 7.942 HA :: 3.768 HB2 :: 1.752 HB3 :: 1.489 HG :: 1.802 HD1 :: 0.737 HD2 :: 0.823 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 113.593 Ave N Shift Values>> N :: 121.98(4.07) K38 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.45 C 0.41 R 0.1 G 0.02 C Shift Assignments>> CA :: 54.586 CB :: 33.537 CG :: 18.643(S) CD :: 24.788 CE :: 42.374 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 :: 7.173 HA :: 4.216 HB2 :: 1.844 HB3 :: 1.740 HG2 :: 1.183 HG3 :: 1.183 HD2 :: 1.383 HD3 :: 1.383 HE2 :: 2.977 HE3 :: 2.977 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 :: 116.451 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) M39 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Consistent HN Overlap>> L81 H Shift Assignments>> H :: 7.853 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 :: 121.886 Ave N Shift Values>> N :: 120.1(3.88) P40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.84 C 0.15 C Shift Assignments>> C :: 173.799 CA :: 63.651 CB :: 32.057 CG :: 27.411 CD :: 50.649 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 :: 3.938 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) G41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.68 L 0.12 C 0.09 R 0.06 F 0.01 C Shift Assignments>> CA :: 45.009 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 7.813 HA2 :: 3.945 HA3 :: 4.426 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.992 Ave N Shift Values>> N :: 109.91(4.29) V42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.66 C 0.33 C Shift Assignments>> C :: 175.669 CA :: 61.726 CB :: 31.595 CG1 :: 22.442 CG2 :: 22.755 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 :: 7.369 HA :: 4.265 HB :: 2.138 HG1 :: 0.781 HG2 :: 0.686 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.771 Ave N Shift Values>> N :: 121.02(4.96) N43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.34 N 0.28 C 0.12 L 0.11 F 0.04 Y 0.03 K 0.03 C Shift Assignments>> CA :: 51.601 CB :: 40.750 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) H Shift Assignments>> H :: 9.216 HA :: 4.763 HB2 :: 3.061 HB3 :: 2.778 HD21 :: 7.604 HD22 :: 6.450 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 :: 123.721 ND2 :: 114.840 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) A44 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K45 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable C Shift Assignments>> C :: 177.217 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>> HA :: 4.229 HB2 :: 1.819 HB3 :: 1.819 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) N46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.34 D 0.27 C 0.13 L 0.07 Y 0.07 F 0.07 K 0.01 HN Overlap>> F43 C Shift Assignments>> C :: 179.225 CA :: 53.195 CB :: 39.653 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 :: 8.105 HA :: 4.755 HB2 :: 3.135 HB3 :: 2.772 HD21 :: 7.663 HD22 :: 7.395 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 :: 117.086 ND2 :: 108.699 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) C47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.44 P 0.23 C 0.13 R 0.08 K 0.02 Q 0.01 L 0.01 H 0.01 E 0.01 C Shift Assignments>> C :: 176.086 CA :: 61.439 CB :: 26.572 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 8.021 HA :: 3.919 HB2 :: 2.940 HB3 :: 2.541 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 :: 118.790 Ave N Shift Values>> N :: 119.95(4.79) R48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.17 I 0.16 E 0.15 R 0.11 K 0.1 H 0.1 Q 0.09 V 0.04 M 0.02 C Shift Assignments>> C :: 178.430 CA :: 59.767 CB :: 29.452 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.983 HA :: 3.735 HB2 :: 1.830 HB3 :: 1.773 HG2 :: 1.671 HG3 :: 1.592 HD2 :: 3.122 HD3 :: 3.122 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 121.907 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) S49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 177.594 CA :: 61.529 CB :: 62.496 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.785 HA :: 4.278 HB2 :: 3.956 HB3 :: 3.956 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 114.923 Ave N Shift Values>> N :: 116.3(3.95) L50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.79 R 0.08 G 0.06 L 0.05 C Shift Assignments>> C :: 177.700 CA :: 58.856 CB :: 42.381 CG :: 23.169 CD1 :: 24.648 CD2 :: 26.396 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 :: 7.250 HA :: 3.860 HB2 :: 1.458 HB3 :: 1.380 HG :: 1.627 HD1 :: 0.698 HD2 :: 0.789 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 :: 121.037 Ave N Shift Values>> N :: 121.98(4.07) M51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.27 Q 0.24 K 0.24 E 0.11 R 0.06 M 0.03 I 0.02 C Shift Assignments>> C :: 175.411 CA :: 58.866 CB :: 33.736 CG :: 28.987 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 :: 7.707 HA :: 3.553 HB2 :: 1.561 HB3 :: 1.561 HG2 :: 2.140 HG3 :: 1.971 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 :: 114.079 Ave N Shift Values>> N :: 120.1(3.88) H52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.16 H 0.15 Q 0.15 R 0.14 C 0.13 K 0.13 M 0.05 I 0.03 V 0.01 C Shift Assignments>> C :: 175.604 CA :: 57.328 CB :: 29.666 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 :: 7.596 HA :: 4.489 HB2 :: 3.127 HB3 :: 2.997 HD2 :: 8.088 HE1 :: 7.087 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 :: 112.010 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) H53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.19 K 0.16 M 0.14 R 0.13 E 0.1 H 0.09 V 0.07 Q 0.06 I 0.01 HN Overlap>> Q80 C Shift Assignments>> C :: 173.877 CA :: 58.145 CB :: 32.149 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 :: 7.733 HA :: 4.648 HB2 :: 3.337 HB3 :: 3.005 HD2 :: 8.088 HE1 :: 7.087 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 :: 116.352 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) V54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.53 C 0.46 HN Overlap>> E47 C Shift Assignments>> C :: 175.709 CA :: 60.587 CB :: 34.059 CG1 :: 21.544 CG2 :: 23.081 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 :: 7.937 HA :: 4.477 HB :: 2.320 HG1 :: 1.034 HG2 :: 1.161 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 :: 118.097 Ave N Shift Values>> N :: 121.02(4.96) K55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.44 C 0.42 R 0.12 C Shift Assignments>> C :: 176.373 CA :: 59.903 CB :: 34.006 CG :: 25.072 CD :: 29.041 CE :: 41.724 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 :: 8.895 HA :: 4.002 HB2 :: 1.827 HB3 :: 1.509 HG2 :: 1.521 HG3 :: 1.521 HD2 :: 1.675 HD3 :: 1.675 HE2 :: 2.975 HE3 :: 2.975 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 :: 122.800 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) N56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> N 0.49 D 0.23 C 0.15 L 0.04 F 0.03 Y 0.03 C Shift Assignments>> CA :: 50.746 CB :: 39.598 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 :: 7.287 HB2 :: 3.110 HB3 :: 3.110 HD21 :: 6.863 HD22 :: 7.601 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 :: 112.740 ND2 :: 109.779 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) I57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.83 C 0.16 C Shift Assignments>> CA :: 64.817 CB :: 35.992 CG1 :: 30.513 CG2 :: 17.206 CD1 :: 12.641 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 :: 9.041 HA :: 3.504 HB :: 1.618 HG2 :: 0.552 HG12 :: 1.173 HG13 :: 1.000 HD1 :: 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 :: 120.864 Ave N Shift Values>> N :: 121.6(4.72) A58 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.57 A 0.35 I 0.03 C 0.02 C Shift Assignments>> C :: 180.243(D) CA :: 54.978(D) CB :: 17.664(D) Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 6.953(D) HA :: 3.736(D) HB :: 1.372(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.901(D) Ave N Shift Values>> N :: 123.23(3.7) E59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 E 0.29 I 0.29 K 0.02 M 0.01 C Shift Assignments>> C :: 179.232 CA :: 59.288 CB :: 29.780 CG :: 37.528 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 :: 8.194 HA :: 3.976 HB2 :: 2.191 HB3 :: 2.057 HG2 :: 2.641 HG3 :: 2.620 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 :: 118.361 Ave N Shift Values>> N :: 120.68(3.68) L60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.45 C 0.37 R 0.13 G 0.02 HN Overlap>> K27 C Shift Assignments>> C :: 179.033 CA :: 57.907 CB :: 42.413 CG :: 26.307 CD1 :: 24.176 CD2 :: 26.647 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 :: 7.866 HA :: 4.003 HB2 :: 1.997 HB3 :: 1.862 HG :: 1.492 HD1 :: 0.974 HD2 :: 1.032 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 :: 119.596 Ave N Shift Values>> N :: 121.98(4.07) A61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.56 M 0.38 C 0.03 I 0.01 HN Overlap>> R69 C Shift Assignments>> C :: 175.738 CA :: 54.156 CB :: 19.020 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.591 HA :: 3.908 HB :: 1.341 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 116.818 Ave N Shift Values>> N :: 123.23(3.7) A62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.8 M 0.15 C 0.02 L 0.01 C Shift Assignments>> C :: 178.025 CA :: 51.921 CB :: 19.643 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.406 HA :: 4.518 HB :: 1.533 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.213 Ave N Shift Values>> N :: 123.23(3.7) L63 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> C 0.3 R 0.3 L 0.23 G 0.11 A 0.04 C Shift Assignments>> C :: 177.835(D) CA :: 54.884(D) CB :: 43.434(D) CG :: 27.786 CD1 :: 22.928(D) CD2 :: 27.251(D) 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 :: 7.002(D) HA :: 4.550(D) HB2 :: 1.824(D) HB3 :: 1.549(D) HG :: 1.530(D) HD1 :: 0.874(D) HD2 :: 0.914 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 :: 118.590(D) Ave N Shift Values>> N :: 121.98(4.07) S64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.98 T 0.01 C Shift Assignments>> C :: 174.709 CA :: 57.180 CB :: 65.334 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 9.427 HA :: 4.596 HB2 :: 4.051 HB3 :: 4.051 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 119.207 Ave N Shift Values>> N :: 116.3(3.95) Q65 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> I 0.3 C 0.16 R 0.11 K 0.09 E 0.08 Q 0.07 H 0.06 P 0.04 L 0.01 V 0.01 C Shift Assignments>> C :: 179.075 CA :: 60.303 CB :: 28.251 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 :: 8.715 HA :: 3.565 HB2 :: 1.079(S) HB3 :: 1.533 HE21 :: 7.121 HE22 :: 6.545 Ave H Shift Values>> H :: 8.22(0.62) HA :: 4.28(0.44) HB2 :: 2.05(0.28) HB3 :: 2.04(0.29) HG2 :: 2.32(0.29) HG3 :: 2.32(0.29) HE21 :: 7.17(0.46) HE22 :: 7.07(0.49) N Shift Assignments>> N :: 121.867 NE2 :: 109.826 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) D66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.25 Y 0.22 C 0.17 L 0.09 K 0.08 D 0.07 I 0.07 N 0.01 R 0.01 C Shift Assignments>> C :: 178.992 CA :: 57.778 CB :: 40.339 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 :: 8.414 HA :: 4.273 HB2 :: 2.557 HB3 :: 2.485 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 :: 120.118 Ave N Shift Values>> N :: 120.73(4.2) E67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.31 Q 0.19 E 0.18 K 0.14 M 0.09 I 0.04 R 0.01 HN Overlap>> F84 C Shift Assignments>> C :: 179.947 CA :: 59.624 CB :: 30.231 CG :: 34.191 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.961 HA :: 4.007 HB2 :: 2.312 HB3 :: 1.925 HG2 :: 2.372 HG3 :: 2.253 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 :: 122.538 Ave N Shift Values>> N :: 120.68(3.68) L68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.29 L 0.17 C 0.13 K 0.13 F 0.1 Y 0.07 G 0.03 D 0.03 I 0.01 C Shift Assignments>> C :: 178.615 CA :: 57.986 CB :: 43.001 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 :: 8.330 HA :: 3.949 HB2 :: 1.351 HB3 :: 2.087 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 :: 118.827 Ave N Shift Values>> N :: 121.98(4.07) T69 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent C Shift Assignments>> C :: 178.720 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 :: 8.379 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 119.319 Ave N Shift Values>> N :: 115.7(5.05) S70 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent HN Overlap>> R70 C Shift Assignments>> C :: 176.038 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.564 HA :: 4.099 HB2 :: 3.912 HB3 :: 3.912 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 :: 117.040 Ave N Shift Values>> N :: 116.3(3.95) I71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.9 C 0.09 C Shift Assignments>> C :: 177.354 CA :: 64.282 CB :: 39.422 CG1 :: 28.578 CG2 :: 17.585 CD1 :: 14.505 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 :: 7.587 HA :: 3.505 HB :: 1.518 HG2 :: 0.464 HG12 :: 1.616 HG13 :: 1.616 HD1 :: 0.634 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 :: 119.282 Ave N Shift Values>> N :: 121.6(4.72) L72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.36 C 0.33 R 0.24 K 0.03 G 0.02 C Shift Assignments>> C :: 178.890 CA :: 56.278 CB :: 42.549 CG :: 27.281 CD1 :: 25.165 CD2 :: 27.281 Ave C Shift Values>> C :: 176.97(2.09) CA :: 55.65(2.21) CB :: 42.37(1.86) CG :: 26.77(1.25) CD1 :: 24.73(1.71) CD2 :: 24.1(1.78) H Shift Assignments>> H :: 8.492 HA :: 4.154 HB2 :: 1.445 HB3 :: 1.445 HD1 :: 0.711 HD2 :: 0.765 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 :: 115.591 Ave N Shift Values>> N :: 121.98(4.07) G73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.81 C 0.1 L 0.06 R 0.01 C Shift Assignments>> C :: 173.417 CA :: 46.005 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.120 HA2 :: 4.092 HA3 :: 3.830 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 107.922 Ave N Shift Values>> N :: 109.91(4.29) N74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.28 L 0.21 K 0.13 C 0.1 N 0.08 F 0.06 R 0.05 Y 0.05 C Shift Assignments>> CA :: 53.730 CB :: 41.595 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 :: 6.591 HB2 :: 2.754 HB3 :: 2.638 HD21 :: 7.774 HD22 :: 6.878 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 114.462 ND2 :: 113.632 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) A75 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable A76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.6 A 0.3 I 0.05 C 0.02 HN Overlap>> M4 A6 C Shift Assignments>> CA :: 55.325 CB :: 17.711 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.331 HA :: 4.176 HB :: 1.460 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.291 Ave N Shift Values>> N :: 123.23(3.7) N77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.25 Y 0.21 F 0.14 E 0.11 N 0.11 D 0.06 I 0.04 M 0.02 L 0.01 HN Overlap>> V18 C Shift Assignments>> C :: 176.483 CA :: 56.111 CB :: 37.931 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 :: 8.361 HA :: 4.425 HB2 :: 3.283 HB3 :: 2.397 HD21 :: 7.419 HD22 :: 6.904 Ave H Shift Values>> H :: 8.37(0.65) HA :: 4.7(0.39) HB2 :: 2.8(0.34) HB3 :: 2.78(0.34) HD21 :: 7.27(0.52) HD22 :: 7.2(0.52) N Shift Assignments>> N :: 118.142 ND2 :: 109.734 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) A78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.46 A 0.31 C 0.07 L 0.07 V 0.03 T 0.02 I 0.01 C Shift Assignments>> C :: 178.308 CA :: 55.357 CB :: 20.269 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.540 HA :: 3.813 HB :: 1.423 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 119.660 Ave N Shift Values>> N :: 123.23(3.7) K79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.23 V 0.2 K 0.12 M 0.09 R 0.09 E 0.07 Q 0.05 H 0.05 I 0.02 P 0.02 C Shift Assignments>> C :: 177.663 CA :: 59.779 CB :: 32.500 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 :: 8.009 HA :: 3.950 HB2 :: 1.946 HB3 :: 1.946 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 :: 118.665 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) Q80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.16 I 0.15 E 0.15 K 0.13 Q 0.11 H 0.11 R 0.1 V 0.02 M 0.02 L 0.01 HN Overlap>> H53 C Shift Assignments>> CA :: 59.313 CB :: 29.064 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 :: 7.661 HA :: 4.062 HB2 :: 1.936 HB3 :: 1.815 HG2 :: 2.419 HG3 :: 2.419 HE21 :: 7.164 HE22 :: 6.688 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 :: 116.265 NE2 :: 110.122 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) L81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.23 K 0.18 L 0.15 C 0.13 F 0.12 Y 0.09 D 0.03 I 0.02 G 0.01 HN Overlap>> M39 C Shift Assignments>> CA :: 58.140 CB :: 42.568 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 :: 7.835 HA :: 3.290 HB2 :: 1.399 HB3 :: 1.685 HD1 :: 0.672 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 :: 121.886 Ave N Shift Values>> N :: 121.98(4.07) Y82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.63 F 0.13 C 0.13 Y 0.09 C Shift Assignments>> C :: 178.828 CA :: 63.623 CB :: 39.661 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 :: 8.872 HA :: 3.818 HD1 :: 7.196 HD2 :: 7.196 HE1 :: 6.786 HE2 :: 6.786 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 :: 119.747 Ave N Shift Values>> N :: 120.79(4.69) D83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.26 C 0.22 F 0.21 I 0.07 D 0.06 E 0.05 N 0.04 L 0.03 C Shift Assignments>> C :: 179.684 CA :: 57.142 CB :: 38.703 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 9.255 HA :: 4.637 HB2 :: 2.929 HB3 :: 2.929 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.973 Ave N Shift Values>> N :: 120.73(4.2) F84 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.38 C 0.2 P 0.17 K 0.05 R 0.03 I 0.03 M 0.03 E 0.02 Q 0.02 H 0.02 HN Overlap>> E67 C Shift Assignments>> C :: 175.666 CA :: 61.369 CB :: 32.717(S) 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 :: 8.034 HA :: 4.434 HB2 :: 3.807 HB3 :: 3.362 HD1 :: 6.945 HD2 :: 6.945 HE1 :: 6.710 HE2 :: 6.710 HZ :: 7.175 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 :: 122.477 Ave N Shift Values>> N :: 120.69(4.18) I85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.88 C 0.11 C Shift Assignments>> C :: 175.472 CA :: 64.347 CB :: 39.353 CG1 :: 29.782 CG2 :: 16.762 CD1 :: 13.840 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 :: 7.657 HA :: 3.393 HB :: 2.129 HG2 :: 1.386 HG12 :: 1.596 HG13 :: 1.596 HD1 :: 0.669 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 :: 114.654 Ave N Shift Values>> N :: 121.6(4.72) H86 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> H 0.16 Q 0.16 E 0.15 R 0.14 K 0.13 C 0.13 M 0.05 I 0.02 L 0.01 C Shift Assignments>> C :: 174.803 CA :: 56.600 CB :: 29.667 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 :: 7.560 HA :: 4.453 HB2 :: 2.648 HB3 :: 2.648 HD2 :: 8.841(M) HE1 :: 6.333 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 :: 110.686 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) T87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 C 0.01 HN Overlap>> F35 C Shift Assignments>> C :: 172.659 CA :: 64.698 CB :: 69.757 CG2 :: 20.765 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.523 HA :: 4.104 HB :: 3.804 HG2 :: 0.703 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.940 Ave N Shift Values>> N :: 115.7(5.05) S88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.252 CA :: 56.556 CB :: 64.295 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.525 HA :: 4.754 HB2 :: 3.931 HB3 :: 3.836 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 120.093 Ave N Shift Values>> N :: 116.3(3.95) F89 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.27 Y 0.27 C 0.19 I 0.17 L 0.02 D 0.02 E 0.01 K 0.01 C Shift Assignments>> CA :: 58.937 CB :: 39.431 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 :: 9.028 HA :: 4.367 HB2 :: 3.141 HB3 :: 2.292 HD1 :: 7.318 HD2 :: 7.318 HE1 :: 7.262 HE2 :: 7.262 HZ :: 7.479 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 126.435 Ave N Shift Values>> N :: 120.69(4.18) A90 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.54 M 0.38 C 0.03 I 0.01 HN Overlap>> R54 C Shift Assignments>> C :: 178.992 CA :: 54.238 CB :: 19.052 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.303 HA :: 4.029 HB :: 1.369 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 120.956 Ave N Shift Values>> N :: 123.23(3.7) E91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 I 0.09 K 0.07 M 0.06 Q 0.02 C Shift Assignments>> C :: 177.621 CA :: 57.652 CB :: 30.011 CG :: 36.529 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.817 HA :: 4.135 HB2 :: 2.228 HB3 :: 2.039 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 :: 117.311 Ave N Shift Values>> N :: 120.68(3.68) V92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.87 C 0.12 C Shift Assignments>> C :: 177.321 CA :: 64.150 CB :: 32.294 CG1 :: 21.313 CG2 :: 21.313 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 :: 7.611 HA :: 3.872 HB :: 2.038 HG1 :: 0.793 HG2 :: 0.853 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 :: 118.827 Ave N Shift Values>> N :: 121.02(4.96) V93 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.84 C 0.15 C Shift Assignments>> C :: 177.031 CA :: 63.567 CB :: 31.992 CG1 :: 21.110 CG2 :: 21.110 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 :: 7.816 HA :: 3.929 HB :: 1.933 HG1 :: 0.790 HG2 :: 0.810 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 119.143 Ave N Shift Values>> N :: 121.02(4.96) S94 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 175.297 CA :: 59.292 CB :: 63.575 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.959 HA :: 4.322 HB2 :: 3.904 HB3 :: 3.861 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 :: 116.942 Ave N Shift Values>> N :: 116.3(3.95) K95 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.38 C 0.37 R 0.19 M 0.03 HN Overlap>> K81 C Shift Assignments>> C :: 177.447 CA :: 57.068 CB :: 32.627 CG :: 24.870 CD :: 29.059 CE :: 42.051 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 :: 8.026 HA :: 4.243 HB2 :: 1.825 HB3 :: 1.825 HG2 :: 1.509 HG3 :: 1.434 HD2 :: 1.666 HD3 :: 1.666 HE2 :: 2.971 HE3 :: 2.971 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 :: 122.273 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) G96 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.08 L 0.07 R 0.02 C Shift Assignments>> C :: 174.362 CA :: 45.612 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.202 HA2 :: 4.308 HA3 :: 3.924 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.698 Ave N Shift Values>> N :: 109.91(4.29) K97 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.39 C 0.37 R 0.18 M 0.03 G 0.01 C Shift Assignments>> C :: 177.185 CA :: 56.543 CB :: 33.081 CG :: 24.708 CD :: 28.992 CE :: 42.261 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 :: 8.011 HA :: 4.299 HB2 :: 1.865 HB3 :: 1.764 HG2 :: 1.460 HG3 :: 1.397 HD2 :: 1.664 HD3 :: 1.664 HE2 :: 2.979 HE3 :: 2.979 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 120.475 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) G98 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.75 L 0.09 C 0.08 R 0.04 C Shift Assignments>> C :: 173.832 CA :: 45.240 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.354 HA2 :: 3.927 HA3 :: 3.927 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 109.636 Ave N Shift Values>> N :: 109.91(4.29) K99 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.39 C 0.37 R 0.17 M 0.03 HN Overlap>> L9 C Shift Assignments>> C :: 175.616 CA :: 56.404 CB :: 33.075 CG :: 24.565 CD :: 29.031 CE :: 42.139 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 :: 8.016 HA :: 4.316 HB2 :: 1.827 HB3 :: 1.725 HG2 :: 1.388 HG3 :: 1.388 HD2 :: 1.644 HD3 :: 1.644 HE2 :: 2.980 HE3 :: 2.980 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 :: 121.242 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) K100 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 K 0.39 R 0.17 M 0.02 C Shift Assignments>> CA :: 57.759 CB :: 33.681 CG :: 24.767 CD :: 29.411 CE :: 42.087 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 :: 7.912 HA :: 4.123 HB2 :: 1.791 HB3 :: 1.664 HG2 :: 1.387 HG3 :: 1.387 HD2 :: 2.084 HD3 :: 2.084 HE2 :: 2.977 HE3 :: 2.977 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 128.152 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) A6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.66 M 0.28 C 0.02 HN Overlap>> M4 A76 C Shift Assignments>> C :: 178.062 CA :: 53.374 CB :: 19.203 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 8.366 HA :: 4.179 HB :: 1.377 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 123.289 Ave N Shift Values>> N :: 123.23(3.7) D7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.25 L 0.17 K 0.12 C 0.12 F 0.11 Y 0.09 N 0.08 R 0.02 HN Overlap>> T16 C Shift Assignments>> C :: 176.825 CA :: 54.917 CB :: 40.905 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) H Shift Assignments>> H :: 8.168 HA :: 4.486 HB2 :: 2.690 HB3 :: 2.623 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 118.033 Ave N Shift Values>> N :: 120.73(4.2) L8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.58 C 0.31 R 0.07 G 0.01 C Shift Assignments>> C :: 177.913 CA :: 56.059 CB :: 42.252 CG :: 27.087 CD1 :: 24.845 CD2 :: 23.609 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 :: 7.863 HA :: 4.236 HB2 :: 1.653 HB3 :: 1.609 HG :: 1.480 HD1 :: 0.853 HD2 :: 0.911 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 :: 121.660 Ave N Shift Values>> N :: 121.98(4.07) L9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.57 C 0.31 R 0.08 G 0.01 HN Overlap>> K99 C Shift Assignments>> C :: 177.981 CA :: 56.028 CB :: 42.112 CG :: 27.199 CD1 :: 23.874 CD2 :: 24.874 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 :: 7.970 HA :: 4.254 HB2 :: 1.614 HB3 :: 1.614 HD1 :: 0.842 HD2 :: 0.898 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 :: 121.342 Ave N Shift Values>> N :: 121.98(4.07) M10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.19 M 0.19 C 0.19 Q 0.14 R 0.09 H 0.08 E 0.06 V 0.03 HN Overlap>> L40 C Shift Assignments>> C :: 177.224 CA :: 56.615 CB :: 32.825 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 :: 8.040 HA :: 4.334 HB2 :: 2.333 HB3 :: 2.074 HG2 :: 2.648 HG3 :: 2.565 Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.39(0.46) HB2 :: 2.03(0.38) HB3 :: 2.01(0.36) HG2 :: 2.44(0.36) HG3 :: 2.41(0.4) HE :: 1.86(0.47) N Shift Assignments>> N :: 119.516 Ave N Shift Values>> N :: 120.1(3.88) E11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.37 C 0.35 I 0.1 K 0.07 M 0.06 Q 0.03 C Shift Assignments>> C :: 177.350 CA :: 57.881 CB :: 30.002 CG :: 36.397 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 :: 8.203 HA :: 4.194 HB2 :: 2.069 HB3 :: 2.007 HG2 :: 2.320 HG3 :: 2.239 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.715 Ave N Shift Values>> N :: 120.68(3.68) K12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 K 0.37 R 0.19 M 0.04 C Shift Assignments>> CA :: 57.633 CB :: 32.733 CG :: 24.926 CD :: 29.851 CE :: 42.086 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 :: 8.059 HA :: 4.196 HB2 :: 2.009 HB3 :: 1.843 HG2 :: 1.453 HG3 :: 1.453 HD2 :: 1.673 HD3 :: 1.673 HE2 :: 2.987 HE3 :: 2.987 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 :: 120.996 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) E14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.35 C 0.33 I 0.12 K 0.08 M 0.04 Q 0.04 C Shift Assignments>> C :: 177.287 CA :: 58.406 CB :: 29.704 CG :: 36.216 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 :: 8.235 HA :: 4.102 HB2 :: 2.092 HB3 :: 2.092 HG2 :: 2.282 HG3 :: 2.223 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 120.475 Ave N Shift Values>> N :: 120.68(3.68) Q15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.16 Q 0.15 E 0.15 H 0.14 C 0.13 R 0.11 I 0.05 M 0.03 L 0.01 C Shift Assignments>> C :: 177.643 CA :: 57.708 CB :: 29.130 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 :: 8.202 HA :: 4.189 HB2 :: 2.239 HB3 :: 1.884 HG3 :: 2.026 HE21 :: 7.500 HE22 :: 6.811 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 :: 119.459 NE2 :: 111.949 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) D16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.18 K 0.18 D 0.16 F 0.13 C 0.11 Y 0.1 R 0.05 N 0.03 I 0.01 HN Overlap>> Q6 C Shift Assignments>> C :: 177.921 CA :: 55.992 CB :: 41.275 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 :: 8.498 HA :: 4.544 HB2 :: 2.856 HB3 :: 2.732 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 :: 121.221 Ave N Shift Values>> N :: 120.73(4.2) F17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.43 F 0.21 Y 0.17 C 0.15 C Shift Assignments>> CA :: 61.715 CB :: 39.622 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 :: 8.222 HA :: 4.447 HB2 :: 3.459 HB3 :: 3.179 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 121.688 Ave N Shift Values>> N :: 120.69(4.18) V18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.95 C 0.04 HN Overlap>> N77 C Shift Assignments>> C :: 179.646 CA :: 66.850 CB :: 31.679 CG1 :: 21.136 CG2 :: 23.494 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 :: 8.344 HA :: 4.177 HG1 :: 0.846 HG2 :: 1.104 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 :: 118.142 Ave N Shift Values>> N :: 121.02(4.96) R20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.42 C 0.35 K 0.17 G 0.02 L 0.01 C Shift Assignments>> C :: 179.595 CA :: 58.252 CB :: 30.129 CG :: 27.519 CD :: 42.628 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 :: 8.140 HA :: 4.137 HB2 :: 2.110 HB3 :: 2.110 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 121.992 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) V21 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.96 C 0.03 C Shift Assignments>> C :: 178.131 CA :: 67.527 CB :: 31.477 CG1 :: 23.298 CG2 :: 21.783 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 :: 8.555 HA :: 3.634 HB :: 1.839 HG1 :: 0.462 HG2 :: 0.710 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 :: 120.939 Ave N Shift Values>> N :: 121.02(4.96) T22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 S 0.01 C Shift Assignments>> C :: 176.308 CA :: 60.208 CB :: 68.392 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 :: 8.164 HA :: 4.379 HB :: 3.795 HG2 :: 1.206 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.344 Ave N Shift Values>> N :: 115.7(5.05) E23 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.17 C 0.17 E 0.14 R 0.11 K 0.1 H 0.09 Q 0.09 V 0.04 M 0.02 C Shift Assignments>> C :: 178.102 CA :: 59.842 CB :: 29.420 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 :: 8.176 HA :: 3.782 HB2 :: 2.174 HB3 :: 1.948 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 :: 122.702 Ave N Shift Values>> N :: 120.68(3.68) C24 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> P 0.44 I 0.43 C 0.07 V 0.01 R 0.01 C Shift Assignments>> C :: 176.663 CA :: 63.401 CB :: 26.073 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.323 HA :: 3.598 HB2 :: 3.061 HB3 :: 3.061 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 :: 114.638 Ave N Shift Values>> N :: 119.95(4.79) L25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.67 L 0.31 C Shift Assignments>> C :: 177.699 CA :: 58.828 CB :: 41.477 CG :: 24.452 CD1 :: 23.200 CD2 :: 23.200 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 :: 8.274 HA :: 3.928 HB2 :: 1.835 HB3 :: 1.835 HD1 :: 0.832 HD2 :: 0.896 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 120.266 Ave N Shift Values>> N :: 121.98(4.07) T26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.95 C 0.04 C Shift Assignments>> C :: 176.180 CA :: 63.187 CB :: 69.237 CG2 :: 19.181 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.974 HA :: 4.544 HB :: 4.328 HG2 :: 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 :: 102.819 Ave N Shift Values>> N :: 115.7(5.05) T27 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.97 C 0.02 C Shift Assignments>> C :: 175.242 CA :: 64.576 CB :: 69.864 CG2 :: 21.347 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.389 HA :: 4.164 HG2 :: 1.381 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 112.319 Ave N Shift Values>> N :: 115.7(5.05) V28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.13 M 0.1 H 0.09 D 0.09 Q 0.08 C 0.07 K 0.07 R 0.07 E 0.05 Y 0.04 N 0.04 F 0.04 A 0.03 S 0.01 C Shift Assignments>> CA :: 55.408 Ave C Shift Values>> C :: 175.69(2.03) CA :: 62.48(3.04) CB :: 32.66(1.91) CG1 :: 21.38(1.53) CG2 :: 21.31(1.76) H Shift Assignments>> H :: 7.516 HA :: 3.853 HB :: 2.353 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 :: 124.356 Ave N Shift Values>> N :: 121.02(4.96) K29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.48 C 0.47 M 0.03 C Shift Assignments>> C :: 177.827 CA :: 58.435 CB :: 32.212 CG :: 24.555 CD :: 29.015 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 :: 8.289 HA :: 3.979 HB2 :: 1.846 HB3 :: 1.700 HG2 :: 1.530 HG3 :: 1.465 Ave H Shift Values>> H :: 8.22(0.64) HA :: 4.28(0.45) HB2 :: 1.79(0.25) HB3 :: 1.78(0.26) HG2 :: 1.38(0.27) HG3 :: 1.37(0.29) HD2 :: 1.61(0.25) HD3 :: 1.61(0.25) HE2 :: 2.93(0.2) HE3 :: 2.93(0.2) HZ :: 7.52(0.36) N Shift Assignments>> N :: 128.101 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) S30 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.25 T 0.21 V 0.19 P 0.07 F 0.05 C 0.05 Y 0.04 S 0.03 E 0.01 R 0.01 HN Overlap>> F72 C Shift Assignments>> C :: 173.696 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>> H :: 8.605 HA :: 4.276 HB2 :: 4.102 HB3 :: 4.102 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 :: 118.895 Ave N Shift Values>> N :: 116.3(3.95) V31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.65 V 0.32 A 0.01 C Shift Assignments>> CA :: 58.661 CB :: 34.633 CG1 :: 19.856 CG2 :: 21.228 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 :: 8.215 HA :: 4.379 HB :: 1.977 HG1 :: 0.856 HG2 :: 0.884 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 126.302 Ave N Shift Values>> N :: 121.02(4.96) N32 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K33 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable T34 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.98 C 0.01 C Shift Assignments>> C :: 176.816 CA :: 66.373 CB :: 67.911 CG2 :: 21.921 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 :: 8.004 HA :: 4.269 HB :: 3.982 HG2 :: 1.216 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 119.053 Ave N Shift Values>> N :: 115.7(5.05) D35 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.2 L 0.17 F 0.15 C 0.12 Y 0.12 D 0.11 R 0.06 I 0.02 N 0.01 C Shift Assignments>> C :: 178.460 CA :: 56.787 CB :: 41.414 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 :: 8.553 HA :: 4.297 HB2 :: 3.003 HB3 :: 2.312 Ave H Shift Values>> H :: 8.33(0.57) HA :: 4.61(0.31) HB2 :: 2.74(0.29) HB3 :: 2.7(0.29) N Shift Assignments>> N :: 124.060 Ave N Shift Values>> N :: 120.73(4.2) S36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.96 S 0.03 C Shift Assignments>> CA :: 62.614 CB :: 67.254 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.067 HA :: 4.103 HB2 :: 3.930 HB3 :: 3.930 Ave H Shift Values>> H :: 8.29(0.62) HA :: 4.51(0.43) HB2 :: 3.88(0.29) HB3 :: 3.87(0.31) HG :: 5.33(1.16) N Shift Assignments>> N :: 113.490 Ave N Shift Values>> N :: 116.3(3.95) Q37 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.15 K 0.15 C 0.14 Q 0.13 E 0.11 I 0.11 H 0.1 L 0.05 M 0.01 C Shift Assignments>> C :: 178.731 CA :: 58.447 CB :: 28.153 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 :: 7.609 HA :: 3.840 HB2 :: 2.154 HB3 :: 2.154 HE21 :: 7.302 HE22 :: 6.561 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 :: 120.149 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) T38 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.97 C 0.02 C Shift Assignments>> C :: 177.594 CA :: 66.222 CB :: 68.164 CG2 :: 22.276 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 :: 8.426 HA :: 4.359 HB :: 3.915 HG2 :: 1.288 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 118.527 Ave N Shift Values>> N :: 115.7(5.05) L39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.46 C 0.37 R 0.13 G 0.01 K 0.01 C Shift Assignments>> C :: 178.796 CA :: 58.856 CB :: 42.102 CG :: 26.816 CD1 :: 26.687 CD2 :: 24.540 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 :: 8.737 HA :: 4.204 HB2 :: 1.941 HB3 :: 1.941 HD1 :: 0.816 HD2 :: 1.082 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 :: 125.296 Ave N Shift Values>> N :: 121.98(4.07) L40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.58 C 0.38 R 0.02 HN Overlap>> M10 C Shift Assignments>> CA :: 57.715 CB :: 41.587 CG :: 27.293 CD1 :: 23.800 CD2 :: 23.920 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 :: 8.117 HA :: 4.023 HB2 :: 1.342 HB3 :: 1.490 HG :: 1.530 HD1 :: 0.547 HD2 :: 0.656 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 :: 119.595 Ave N Shift Values>> N :: 121.98(4.07) T41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.97 C 0.02 C Shift Assignments>> C :: 175.841 CA :: 65.452 CB :: 69.198 CG2 :: 19.088 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 :: 8.069 HA :: 4.237 HB :: 3.978 HG2 :: 1.175 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 111.521 Ave N Shift Values>> N :: 115.7(5.05) T42 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent C Shift Assignments>> C :: 174.746 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) H Shift Assignments>> H :: 7.797 HA :: 4.035 HB :: 3.851 HG2 :: 0.481 Ave H Shift Values>> H :: 8.27(0.62) HA :: 4.48(0.5) HB :: 4.17(0.37) HG1 :: 4.4(1.92) HG2 :: 1.16(0.28) HG21 :: 1.16(0.28) HG22 :: 1.16(0.28) HG23 :: 1.16(0.28) N Shift Assignments>> N :: 117.094 Ave N Shift Values>> N :: 115.7(5.05) F43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.28 Y 0.22 I 0.19 C 0.17 K 0.06 L 0.03 D 0.01 R 0.01 HN Overlap>> N46 C Shift Assignments>> C :: 177.089 CA :: 59.929 CB :: 40.537 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 :: 8.130 HA :: 4.527 HB2 :: 3.077 HB3 :: 2.785 HD1 :: 6.945 HD2 :: 6.945 HE1 :: 6.710 HE2 :: 6.710 HZ :: 7.175 Ave H Shift Values>> H :: 8.42(0.74) HA :: 4.62(0.58) HB2 :: 2.99(0.37) HB3 :: 2.97(0.38) HD1 :: 6.91(0.82) HD2 :: 6.89(0.86) HE1 :: 6.95(0.82) HE2 :: 6.94(0.86) HZ :: 6.92(0.8) N Shift Assignments>> N :: 116.998 Ave N Shift Values>> N :: 120.69(4.18) G44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.55 C 0.26 P 0.07 A 0.04 L 0.02 N 0.01 C Shift Assignments>> C :: 173.278 CA :: 47.710 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.246 HA2 :: 4.329 HA3 :: 4.028 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 108.820 Ave N Shift Values>> N :: 109.91(4.29) S45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.81 T 0.17 C Shift Assignments>> C :: 174.660 CA :: 55.769 CB :: 66.770 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 7.617 HA :: 4.476 HB2 :: 3.806 HB3 :: 3.806 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 :: 111.413 Ave N Shift Values>> N :: 116.3(3.95) L46 Overall: Suspicious Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Suspicious N Shifts: Consistent PRTL>> L 0.48 C 0.43 R 0.06 K 0.01 C Shift Assignments>> C :: 177.587 CA :: 57.554 CB :: 40.930 CG :: 27.877 CD1 :: 25.308 CD2 :: 25.422 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 :: 10.440(S) HA :: 4.059 HB2 :: 1.546 HB3 :: 1.655 HD1 :: 0.766 HD2 :: 0.828 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 124.047 Ave N Shift Values>> N :: 121.98(4.07) E47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.33 E 0.31 I 0.15 K 0.07 Q 0.06 M 0.04 HN Overlap>> V54 C Shift Assignments>> CA :: 60.053 CB :: 30.061 CG :: 35.602 Ave C Shift Values>> C :: 176.93(2.11) CA :: 57.42(2.19) CB :: 30.07(1.84) CG :: 36.01(1.51) CD :: 181.94(1.85) H Shift Assignments>> H :: 7.830 HA :: 3.417 HB2 :: 1.965 HB3 :: 1.778 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 :: 118.132 Ave N Shift Values>> N :: 120.68(3.68) Q48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.16 K 0.15 Q 0.14 C 0.14 H 0.13 R 0.11 I 0.07 M 0.03 L 0.01 V 0.01 HN Overlap>> F79 C Shift Assignments>> C :: 178.185 CA :: 58.185 CB :: 29.147 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 :: 7.756 HA :: 4.076 HB2 :: 2.382 HB3 :: 2.267 HE21 :: 7.731 HE22 :: 6.946 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 :: 117.415 NE2 :: 113.698 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) L49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.36 L 0.26 K 0.19 R 0.13 G 0.03 C Shift Assignments>> CA :: 58.139 CB :: 42.549 CD1 :: 26.514 CD2 :: 26.514 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 :: 7.740 HA :: 3.243 HB2 :: 1.643 HB3 :: 1.456 HD1 :: 0.638 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 :: 122.536 Ave N Shift Values>> N :: 121.98(4.07) I50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.87 C 0.12 HN Overlap>> E55 C Shift Assignments>> C :: 174.829 CA :: 64.648 CB :: 38.058 CD1 :: 14.501 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 :: 8.247 HA :: 3.272 HB :: 1.707 HG2 :: 0.698 HD1 :: 0.557 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 :: 117.625 Ave N Shift Values>> N :: 121.6(4.72) A51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.77 M 0.19 C 0.02 C Shift Assignments>> C :: 177.362 CA :: 52.411 CB :: 19.110 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.021 HA :: 4.197 HB :: 1.437 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 118.129 Ave N Shift Values>> N :: 123.23(3.7) A52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.75 M 0.18 C 0.03 L 0.01 C Shift Assignments>> C :: 177.923 CA :: 52.422 CB :: 19.867 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.024 HA :: 4.309 HB :: 1.290 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 122.132 Ave N Shift Values>> N :: 123.23(3.7) S53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 0.96 T 0.03 C Shift Assignments>> CA :: 57.031 CB :: 65.763 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) H Shift Assignments>> H :: 8.990 HA :: 4.514 HB2 :: 4.046 HB3 :: 4.046 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 :: 117.790 Ave N Shift Values>> N :: 116.3(3.95) R54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.18 I 0.18 E 0.13 R 0.11 V 0.08 H 0.08 Q 0.07 K 0.07 P 0.02 M 0.02 HN Overlap>> A90 C Shift Assignments>> CA :: 60.318 CB :: 29.886 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 :: 8.312 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 :: 120.956 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) E55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.38 C 0.34 E 0.23 K 0.02 HN Overlap>> I50 C Shift Assignments>> C :: 178.348 CA :: 59.737 CB :: 28.686 CG :: 37.353 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 :: 8.259 HA :: 3.802 HB2 :: 1.899 HB3 :: 1.854 HG2 :: 2.362 HG3 :: 2.098 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 :: 117.625 Ave N Shift Values>> N :: 120.68(3.68) D56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.2 Y 0.17 K 0.15 C 0.14 L 0.13 D 0.1 I 0.03 R 0.02 N 0.01 C Shift Assignments>> C :: 180.095 CA :: 57.181 CB :: 40.849 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 :: 7.840 HA :: 4.389 HB2 :: 3.071 HB3 :: 2.693 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 :: 119.944 Ave N Shift Values>> N :: 120.73(4.2) L57 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.37 L 0.36 K 0.18 G 0.05 R 0.01 C Shift Assignments>> C :: 178.190 CA :: 58.159 CB :: 42.782 CD1 :: 23.590 CD2 :: 26.359 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 :: 7.957 HA :: 4.072 HB2 :: 1.991 HB3 :: 1.777 HD1 :: 0.577 HD2 :: 0.978 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 :: 119.282 Ave N Shift Values>> N :: 121.98(4.07) L59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.57 L 0.23 R 0.08 G 0.06 A 0.04 C Shift Assignments>> C :: 177.821 CA :: 55.004 CB :: 42.490 CG :: 23.548 CD1 :: 26.409 CD2 :: 24.755 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 :: 7.305 HA :: 4.160 HB2 :: 1.833 HB3 :: 1.614 HD1 :: 0.847 HD2 :: 0.909 Ave H Shift Values>> H :: 8.22(0.65) HA :: 4.32(0.47) HB2 :: 1.63(0.34) HB3 :: 1.57(0.36) HG :: 1.54(0.33) HD1 :: 0.77(0.27) HD2 :: 0.76(0.28) N Shift Assignments>> N :: 117.060 Ave N Shift Values>> N :: 121.98(4.07) C60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.21 C 0.14 I 0.12 Q 0.11 L 0.11 K 0.1 H 0.08 E 0.07 C Shift Assignments>> CA :: 58.321 CB :: 27.199 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) H Shift Assignments>> H :: 7.592 HA :: 4.471 HB2 :: 2.960 HB3 :: 2.960 Ave H Shift Values>> H :: 8.42(0.66) HA :: 4.73(0.57) HB2 :: 2.95(0.43) HB3 :: 2.98(0.45) HG :: 1.66(0.48) N Shift Assignments>> N :: 122.462 Ave N Shift Values>> N :: 119.95(4.79) P61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> P 0.86 C 0.12 C Shift Assignments>> C :: 177.168 CA :: 64.666 CB :: 31.748 CG :: 27.504 CD :: 50.724 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 :: 4.188 HB2 :: 2.209 HB3 :: 1.885 HG2 :: 1.986 HG3 :: 1.986 HD2 :: 3.657 HD3 :: 3.657 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) G62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.8 C 0.09 L 0.07 R 0.01 C Shift Assignments>> C :: 174.177 CA :: 45.774 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.551 HA2 :: 4.186 HA3 :: 4.221 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 110.925 Ave N Shift Values>> N :: 109.91(4.29) G64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> G 0.55 L 0.17 R 0.12 C 0.09 F 0.01 D 0.01 Y 0.01 C Shift Assignments>> CA :: 44.709 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) H Shift Assignments>> H :: 8.073 HA2 :: 4.335 HA3 :: 4.026 Ave H Shift Values>> H :: 8.34(0.74) HA2 :: 3.95(0.4) HA3 :: 3.93(0.4) N Shift Assignments>> N :: 106.263 Ave N Shift Values>> N :: 109.91(4.29) P65 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Consistent N Shifts: Indeterminable H Shift Assignments>> HD2 :: 3.776 HD3 :: 3.659 Ave H Shift Values>> HA :: 4.41(0.36) HB2 :: 2.05(0.39) HB3 :: 2.05(0.39) HG2 :: 1.93(0.36) HG3 :: 1.92(0.37) HD2 :: 3.64(0.36) HD3 :: 3.63(0.4) Q66 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable K67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.43 C 0.39 R 0.14 M 0.01 C Shift Assignments>> C :: 178.245 CA :: 60.047 CB :: 33.385 CG :: 25.113 CD :: 29.215 CE :: 41.960 Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) H Shift Assignments>> H :: 8.462 HA :: 3.746 HB2 :: 1.638 HB3 :: 1.433 HG2 :: 1.221 HG3 :: 1.221 HE2 :: 2.964 HE3 :: 2.964 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 :: 120.322 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) A68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> M 0.53 A 0.32 C 0.05 V 0.02 I 0.02 L 0.02 T 0.01 C Shift Assignments>> C :: 178.720 CA :: 55.606 CB :: 19.419 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) H Shift Assignments>> H :: 7.644 HA :: 3.776 HB :: 1.381 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.42) HB :: 1.38(0.25) N Shift Assignments>> N :: 117.602 Ave N Shift Values>> N :: 123.23(3.7) R69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.36 C 0.35 K 0.12 G 0.08 I 0.05 L 0.01 HN Overlap>> A61 C Shift Assignments>> C :: 176.404 CA :: 59.583 CB :: 29.657 CD :: 43.303 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.564 HA :: 4.004 HB2 :: 1.937 HB3 :: 1.937 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 116.758 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) R70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 R 0.37 G 0.16 K 0.04 I 0.02 HN Overlap>> S70 C Shift Assignments>> C :: 179.226 CA :: 59.321 CB :: 30.286 CD :: 43.863 Ave C Shift Values>> C :: 176.49(2.16) CA :: 56.95(2.41) CB :: 30.66(1.77) CG :: 27.31(1.65) CD :: 43.1(1.1) CZ :: 159.01(0.87) H Shift Assignments>> H :: 7.556 HA :: 4.116 HB2 :: 1.831 HB3 :: 1.831 Ave H Shift Values>> H :: 8.24(0.6) HA :: 4.27(0.44) HB2 :: 1.79(0.28) HB3 :: 1.78(0.28) HG2 :: 1.58(0.27) HG3 :: 1.58(0.27) HD2 :: 3.13(0.23) HD3 :: 3.13(0.22) HE :: 7.32(0.52) HH11 :: 6.74(0.31) HH12 :: 6.75(0.32) HH21 :: 6.72(0.32) HH22 :: 6.72(0.33) N Shift Assignments>> N :: 117.109 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) L71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 C 0.33 R 0.03 G 0.01 C Shift Assignments>> C :: 176.670 CA :: 57.960 CB :: 42.241 CG :: 26.558 CD1 :: 24.403 CD2 :: 24.403 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 :: 8.206 HA :: 4.013 HB2 :: 1.455 HB3 :: 1.718 HD1 :: 0.896 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 :: 119.163 Ave N Shift Values>> N :: 121.98(4.07) F72 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.58 F 0.15 C 0.13 Y 0.11 HN Overlap>> S30 C Shift Assignments>> C :: 179.061 CA :: 63.092 CB :: 39.545 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 :: 8.543 HA :: 3.753 HB2 :: 3.110 HB3 :: 2.997 HD1 :: 6.976 HD2 :: 6.976 HE1 :: 7.301 HE2 :: 7.301 HZ :: 7.424 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 :: 118.814 Ave N Shift Values>> N :: 120.69(4.18) D73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.26 F 0.26 C 0.19 I 0.09 D 0.06 L 0.05 N 0.02 E 0.01 K 0.01 C Shift Assignments>> C :: 178.883 CA :: 57.743 CB :: 39.511 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 :: 8.635 HA :: 4.515 HB2 :: 2.857 HB3 :: 2.653 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 :: 119.357 Ave N Shift Values>> N :: 120.73(4.2) V74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.92 C 0.07 C Shift Assignments>> C :: 175.947 CA :: 66.977 CB :: 31.072 CG1 :: 21.205 CG2 :: 24.362 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 :: 7.758 HA :: 3.554 HB :: 1.986 HG1 :: 0.646 HG2 :: 1.010 Ave H Shift Values>> H :: 8.29(0.71) HA :: 4.16(0.57) HB :: 1.99(0.33) HG1 :: 0.84(0.27) HG2 :: 0.83(0.29) N Shift Assignments>> N :: 121.073 Ave N Shift Values>> N :: 121.02(4.96) L75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.39 L 0.38 A 0.15 G 0.04 K 0.01 C Shift Assignments>> C :: 175.159 CA :: 55.712 CB :: 42.527 CD1 :: 21.562 CD2 :: 25.447 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 :: 7.069 HA :: 3.512 HB2 :: 1.627 HB3 :: 1.332 HG :: 1.627 HD1 :: -0.042 HD2 :: 0.424 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 :: 114.032 Ave N Shift Values>> N :: 121.98(4.07) H76 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Anomalous N Shifts: Consistent PRTL>> H 0.17 R 0.15 Q 0.15 E 0.14 C 0.13 K 0.11 M 0.08 I 0.01 C Shift Assignments>> C :: 175.168 CA :: 56.064 CB :: 30.068 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 :: 7.234 HA :: 4.336 HB2 :: 3.068 HB3 :: 2.383 HD2 :: 8.821(M) HE1 :: 6.739 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 :: 110.270 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) E77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> C 0.41 E 0.38 K 0.07 I 0.05 M 0.04 Q 0.01 C Shift Assignments>> CA :: 55.432 CB :: 29.547 CG :: 37.012 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 :: 8.672 HA :: 4.408 HB2 :: 1.848 HB3 :: 2.100 HG2 :: 2.363 HG3 :: 2.363 Ave H Shift Values>> H :: 8.34(0.61) HA :: 4.26(0.43) HB2 :: 2.04(0.22) HB3 :: 2.04(0.23) HG2 :: 2.31(0.21) HG3 :: 2.31(0.21) N Shift Assignments>> N :: 126.314 Ave N Shift Values>> N :: 120.68(3.68) P78 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable F79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.35 F 0.25 Y 0.18 C 0.16 K 0.02 HN Overlap>> Q48 C Shift Assignments>> C :: 177.217 CA :: 61.531 CB :: 40.466 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 :: 7.819 HA :: 4.472 HB2 :: 3.041 HB3 :: 3.041 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 :: 117.482 Ave N Shift Values>> N :: 120.69(4.18) L80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.6 C 0.23 R 0.11 G 0.02 A 0.01 C Shift Assignments>> C :: 176.530 CA :: 54.034 CB :: 42.372 CG :: 27.454 CD1 :: 25.566 CD2 :: 23.782 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 :: 8.090 HA :: 4.682 HB2 :: 1.569 HB3 :: 1.667 HD1 :: 0.797 HD2 :: 0.623 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 :: 116.784 Ave N Shift Values>> N :: 121.98(4.07) K81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> K 0.53 C 0.43 M 0.03 HN Overlap>> K95 C Shift Assignments>> C :: 176.336 CA :: 54.677 CB :: 33.335 CG :: 25.113 CD :: 29.233 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 :: 8.068 HA :: 4.149 HB2 :: 1.792 HB3 :: 1.680 HG2 :: 1.652 HG3 :: 1.385 HE2 :: 2.964 HE3 :: 2.964 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 :: 122.245 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) V82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.49 C 0.49 C Shift Assignments>> CA :: 59.469 CB :: 32.533 CG1 :: 20.204 CG2 :: 21.322 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 :: 7.995 HA :: 4.418 HB :: 2.098 HG1 :: 0.926 HG2 :: 0.985 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 :: 122.890 Ave N Shift Values>> N :: 121.02(4.96) P83 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable ########################################################################### Overall Results: #Consistent: 160 #Clerical: 7 #Suspicious: 2 #Anomalous: 2 #Mistyped: 3 #Indeterminable: 0 Typing Results: #Consistent: 156 #Suspicious: 0 #Mistyped: 3 #Indeterminable: 15 Shift Relative Order (SRO) Results: #Consistent: 174 #Suspicious: 0 C Shift Results: #Consistent: 567 #Duplicate: 26 #Unknown: 0 #Suspicious: 2 #Anomalous: 1 H Shift Results: #Consistent: 813 #Duplicate: 37 #Unknown: 0 #Suspicious: 2 #Anomalous: 2 N Shift Results: #Consistent: 162 #Duplicate: 5 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: H3 C = 174.625(D), Expected = 175.19, Std = 2.1400, ChiSquare = 7.9177e-01 H3 CA = 55.979(D), Expected = 56.37, Std = 2.4000, ChiSquare = 8.7058e-01 H3 CB = 30.096(D), Expected = 29.95, Std = 2.1500, ChiSquare = 9.4586e-01 H3 HA = 4.200(D), Expected = 4.62, Std = 0.5100, ChiSquare = 4.1021e-01 H3 HB2 = 3.143(D), Expected = 3.12, Std = 0.4300, ChiSquare = 9.5734e-01 H3 HB3 = 3.077(D), Expected = 3.11, Std = 0.4500, ChiSquare = 9.4154e-01 H3 HD2 = 8.229(D), Expected = 7.08, Std = 0.5000, ChiSquare = 2.1562e-02 H3 HE1 = 7.378(D), Expected = 8.08, Std = 0.5700, ChiSquare = 2.1811e-01 M4 CA = 53.209(D), Expected = 56.16, Std = 2.3400, ChiSquare = 2.0727e-01 M4 CB = 32.496(D), Expected = 32.90, Std = 2.2300, ChiSquare = 8.5624e-01 M4 H = 8.275(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.8006e-01 M4 HA = 4.755(D), Expected = 4.39, Std = 0.4600, ChiSquare = 4.2750e-01 M4 HB2 = 1.889(D), Expected = 2.03, Std = 0.3800, ChiSquare = 7.1060e-01 M4 HB3 = 2.007(D), Expected = 2.01, Std = 0.3600, ChiSquare = 9.9335e-01 M4 HG2 = 2.561(D), Expected = 2.44, Std = 0.3600, ChiSquare = 7.3679e-01 M4 HG3 = 2.472(D), Expected = 2.41, Std = 0.4000, ChiSquare = 8.7682e-01 M4 N = 123.257(D), Expected = 120.10, Std = 3.8800, ChiSquare = 4.1584e-01 P5 C = 177.216(D), Expected = 176.70, Std = 1.6900, ChiSquare = 7.6012e-01 P5 CA = 63.202(D), Expected = 63.30, Std = 1.6400, ChiSquare = 9.5235e-01 P5 CB = 32.035(D), Expected = 31.81, Std = 1.5400, ChiSquare = 8.8384e-01 P5 CG = 27.423(D), Expected = 27.14, Std = 1.1800, ChiSquare = 8.1046e-01 P5 CD = 50.517(D), Expected = 50.28, Std = 1.0400, ChiSquare = 8.1974e-01 P5 HA = 4.389(D), Expected = 4.41, Std = 0.3600, ChiSquare = 9.5348e-01 P5 HB2 = 2.268(D), Expected = 2.05, Std = 0.3900, ChiSquare = 5.7618e-01 P5 HB3 = 1.902(D), Expected = 2.05, Std = 0.3900, ChiSquare = 7.0433e-01 P5 HG2 = 1.995(D), Expected = 1.93, Std = 0.3600, ChiSquare = 8.5672e-01 P5 HG3 = 1.995(D), Expected = 1.92, Std = 0.3700, ChiSquare = 8.3937e-01 P5 HD2 = 3.753(D), Expected = 3.64, Std = 0.3600, ChiSquare = 7.5361e-01 P5 HD3 = 3.664(D), Expected = 3.63, Std = 0.4000, ChiSquare = 9.3226e-01 L13 C = 177.022(D), Expected = 176.97, Std = 2.0900, ChiSquare = 9.8015e-01 L13 CA = 55.143(D), Expected = 55.65, Std = 2.2100, ChiSquare = 8.1855e-01 L13 CB = 42.510(D), Expected = 42.37, Std = 1.8600, ChiSquare = 9.4000e-01 L13 CG = 26.976(D), Expected = 26.77, Std = 1.2500, ChiSquare = 8.6910e-01 L13 CD1 = 23.479(D), Expected = 24.73, Std = 1.7100, ChiSquare = 4.6443e-01 L13 CD2 = 24.818(D), Expected = 24.10, Std = 1.7800, ChiSquare = 6.8668e-01 L13 H = 7.970(D), Expected = 8.22, Std = 0.6500, ChiSquare = 7.0052e-01 L13 HA = 4.257(D), Expected = 4.32, Std = 0.4700, ChiSquare = 8.9337e-01 L13 HB2 = 1.617(D), Expected = 1.63, Std = 0.3400, ChiSquare = 9.6950e-01 L13 HB3 = 1.571(D), Expected = 1.57, Std = 0.3600, ChiSquare = 9.9778e-01 L13 HD1 = 0.849(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.6983e-01 L13 HD2 = 0.901(D), Expected = 0.76, Std = 0.2800, ChiSquare = 6.1456e-01 L13 N = 120.858(D), Expected = 121.98, Std = 4.0700, ChiSquare = 7.8280e-01 S19 C = 174.648(D), Expected = 174.53, Std = 1.7300, ChiSquare = 9.4562e-01 S19 CA = 58.793(D), Expected = 58.57, Std = 2.1200, ChiSquare = 9.1623e-01 S19 H = 8.120(D), Expected = 8.29, Std = 0.6200, ChiSquare = 7.8394e-01 S19 HA = 4.366(D), Expected = 4.51, Std = 0.4300, ChiSquare = 7.3771e-01 S19 HB2 = 3.880(D), Expected = 3.88, Std = 0.2900, ChiSquare = 1.0000e+00 S19 HB3 = 3.829(D), Expected = 3.87, Std = 0.3100, ChiSquare = 8.9478e-01 S19 N = 115.641(D), Expected = 116.30, Std = 3.9500, ChiSquare = 8.6750e-01 P30 Typing: Mistyped P30 CD = 56.986(M), Expected = 50.28, Std = 1.0400, ChiSquare = 1.1328e-10 K38 Typing: Mistyped K38 CG = 18.643(S), Expected = 24.91, Std = 1.3100, ChiSquare = 1.7187e-06 A58 C = 180.243(D), Expected = 177.80, Std = 2.1800, ChiSquare = 2.6244e-01 A58 CA = 54.978(D), Expected = 53.16, Std = 2.0600, ChiSquare = 3.7749e-01 A58 CB = 17.664(D), Expected = 18.90, Std = 1.8500, ChiSquare = 5.0406e-01 A58 H = 6.953(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.7679e-02 A58 HA = 3.736(D), Expected = 4.26, Std = 0.4200, ChiSquare = 2.1217e-01 A58 HB = 1.372(D), Expected = 1.38, Std = 0.2500, ChiSquare = 9.7447e-01 A58 N = 119.901(D), Expected = 123.23, Std = 3.7000, ChiSquare = 3.6826e-01 L63 C = 177.835(D), Expected = 176.97, Std = 2.0900, ChiSquare = 6.7896e-01 L63 CA = 54.884(D), Expected = 55.65, Std = 2.2100, ChiSquare = 7.2889e-01 L63 CB = 43.434(D), Expected = 42.37, Std = 1.8600, ChiSquare = 5.6729e-01 L63 CD1 = 22.928(D), Expected = 24.73, Std = 1.7100, ChiSquare = 2.9197e-01 L63 CD2 = 27.251(D), Expected = 24.10, Std = 1.7800, ChiSquare = 7.6690e-02 L63 H = 7.002(D), Expected = 8.22, Std = 0.6500, ChiSquare = 6.0952e-02 L63 HA = 4.550(D), Expected = 4.32, Std = 0.4700, ChiSquare = 6.2459e-01 L63 HB2 = 1.824(D), Expected = 1.63, Std = 0.3400, ChiSquare = 5.6828e-01 L63 HB3 = 1.549(D), Expected = 1.57, Std = 0.3600, ChiSquare = 9.5348e-01 L63 HG = 1.530(D), Expected = 1.54, Std = 0.3300, ChiSquare = 9.7583e-01 L63 HD1 = 0.874(D), Expected = 0.77, Std = 0.2700, ChiSquare = 7.0010e-01 L63 N = 118.590(D), Expected = 121.98, Std = 4.0700, ChiSquare = 4.0489e-01 Q65 HB2 = 1.079(S), Expected = 2.05, Std = 0.2800, ChiSquare = 5.2463e-04 F84 Typing: Mistyped F84 CB = 32.717(S), Expected = 39.95, Std = 2.0400, ChiSquare = 3.9174e-04 H86 HD2 = 8.841(M), Expected = 7.08, Std = 0.5000, ChiSquare = 4.2830e-04 L46 H = 10.440(S), Expected = 8.22, Std = 0.6500, ChiSquare = 6.3692e-04 H76 HD2 = 8.821(M), Expected = 7.08, Std = 0.5000, ChiSquare = 4.9768e-04