Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Indeterminable PRTL>> R 0.43 L 0.32 G 0.09 D 0.06 K 0.03 Y 0.03 I 0.01 C Shift Assignments>> CA :: 43.458 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> HA2 :: 3.904(D) HA3 :: 3.904(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) 1.S2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> S 0.99 C Shift Assignments>> CA :: 58.296 CB :: 63.965 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> HA :: 4.625 HB2 :: 3.931 HB3 :: 3.886 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) 1.T3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 62.259 CB :: 69.812 CG2 :: 21.605 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.52 HA :: 4.434 HB :: 4.231 HG21 :: 1.199 HG22 :: 1.199 HG23 :: 1.199 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 115.476 Ave N Shift Values>> N :: 115.42(4.75) 1.G4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.89 L 0.09 C Shift Assignments>> CA :: 45.436 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.577 HA2 :: 3.985(D) HA3 :: 3.985(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.976 Ave N Shift Values>> N :: 109.67(3.87) 1.E5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.73 K 0.1 Q 0.09 I 0.05 C Shift Assignments>> CA :: 56.774 CB :: 30.272 CG :: 36.306 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.377 HA :: 4.263 HB2 :: 1.929 HB3 :: 1.929 HG2 :: 2.248 HG3 :: 2.248 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 120.651 Ave N Shift Values>> N :: 120.67(3.48) 1.D6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.45 L 0.29 K 0.11 Y 0.11 R 0.01 HN Overlap>> 1.V18 1.V18 C Shift Assignments>> CA :: 54.43 CB :: 40.921 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.481 HA :: 4.545 HB2 :: 2.646 HB3 :: 2.646 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 120.999 Ave N Shift Values>> N :: 120.65(3.86) 1.A7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> A 0.98 C Shift Assignments>> CA :: 53.241 CB :: 18.87 Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 8.294 HA :: 4.193 HB1 :: 1.332 HB2 :: 1.332 HB3 :: 1.332 Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 124.566 Ave N Shift Values>> N :: 123.23(3.54) 1.H8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> Q 0.22 K 0.2 H 0.19 E 0.17 R 0.15 I 0.01 L 0.01 C Shift Assignments>> CA :: 56.183 CB :: 29.196 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.469 HA :: 4.585 HB2 :: 3.187(D) HB3 :: 3.187(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 116.548 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.L9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> L 0.89 R 0.05 A 0.03 G 0.01 C Shift Assignments>> CA :: 55.576 CB :: 42.177 CG :: 26.938 CD1 :: 25.069 CD2 :: 23.215 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 8.1 HA :: 4.347 HB2 :: 1.663(D) HB3 :: 1.663(D) HG :: 1.475 HD11 :: 0.925 HD12 :: 0.925 HD13 :: 0.925 HD21 :: 0.855 HD22 :: 0.855 HD23 :: 0.855 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 121.681 Ave N Shift Values>> N :: 121.86(3.9) 1.T10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 62.339 CB :: 69.522 CG2 :: 21.602 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.158 HA :: 4.248 HB :: 4.169 HG21 :: 1.148 HG22 :: 1.148 HG23 :: 1.148 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 114.616 Ave N Shift Values>> N :: 115.42(4.75) 1.Q11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.45 K 0.41 E 0.07 R 0.05 HN Overlap>> 1.V30 1.V30 C Shift Assignments>> CA :: 55.813 CB :: 29.323 CG :: 33.593 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.359 HA :: 4.261 HB2 :: 1.953 HB3 :: 1.953 HG2 :: 2.225 HG3 :: 2.225 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 122.425 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.Y12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.58 I 0.23 D 0.07 E 0.05 L 0.05 HN Overlap>> 1.V35 1.V35 C Shift Assignments>> CA :: 57.893 CB :: 38.682 Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 8.33 HA :: 4.53 HB2 :: 2.96 HB3 :: 2.96 Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 122.094 Ave N Shift Values>> N :: 120.52(4.2) 1.K13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.84 R 0.12 G 0.01 A 0.01 C Shift Assignments>> CA :: 53.703 CB :: 33.031 CG :: 24.513 CD :: 29.171 CE :: 42.136 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.161 HA :: 4.534 HB2 :: 1.795 HB3 :: 1.739 HG2 :: 1.376(D) HG3 :: 1.376(D) HD2 :: 1.647 HD3 :: 1.647 HE2 :: 2.978 HE3 :: 2.978 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 125.887 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 62.76 CB :: 32.163 CG :: 27.281 CD :: 50.645 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.323 HB2 :: 2.312(D) HB3 :: 2.312(D) HG2 :: 1.993 HG3 :: 1.993 HD2 :: 3.603 HD3 :: 3.586 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.K15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.79 R 0.18 G 0.01 C Shift Assignments>> CA :: 56.373 CB :: 32.993 CG :: 24.858 CD :: 29.138 CE :: 42.136 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.546 HA :: 4.219 HB2 :: 1.762(D) HB3 :: 1.762(D) HG2 :: 1.461(D) HG3 :: 1.461(D) HD2 :: 1.67 HD3 :: 1.67 HE2 :: 2.977 HE3 :: 2.977 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 121.786 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.62 K 0.18 Q 0.16 I 0.02 C Shift Assignments>> CA :: 54.352 CB :: 29.517 CG :: 36.072 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.481 HA :: 4.565 HB2 :: 2.041 HB3 :: 2.041 HG2 :: 2.294 HG3 :: 2.294 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 123.517 Ave N Shift Values>> N :: 120.67(3.48) 1.P17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Indeterminable PRTL>> P 0.99 C Shift Assignments>> CA :: 63.027 CB :: 32.174 CG :: 27.446 CD :: 50.684 Ave C Shift Values>> C :: 176.75(1.51) CA :: 63.33(1.52) CB :: 31.85(1.18) CG :: 27.17(1.09) CD :: 50.32(0.99) H Shift Assignments>> HA :: 4.445 HB2 :: 2.278(D) HB3 :: 2.278(D) HG2 :: 2.031 HG3 :: 2.031 HD2 :: 3.829 HD3 :: 3.699 Ave H Shift Values>> HA :: 4.4(0.33) HB2 :: 2.08(0.35) HB3 :: 2(0.36) HG2 :: 1.93(0.31) HG3 :: 1.9(0.33) HD2 :: 3.65(0.35) HD3 :: 3.61(0.39) 1.V18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.D6 1.D6 C Shift Assignments>> CA :: 62.519 CB :: 32.625 CG1 :: 20.75 CG2 :: 20.75 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.459 HA :: 4.147 HB :: 2.066 HG11 :: 0.958(D) HG12 :: 0.958(D) HG13 :: 0.958(D) HG21 :: 0.958(D) HG22 :: 0.958(D) HG23 :: 0.958(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 120.928 Ave N Shift Values>> N :: 121.14(4.54) 1.T19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 61.78 CB :: 69.789 CG2 :: 21.616 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.425 HA :: 4.429 HB :: 4.158 HG21 :: 1.209 HG22 :: 1.209 HG23 :: 1.209 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 118.392 Ave N Shift Values>> N :: 115.42(4.75) 1.T20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 61.841 CB :: 69.853 CG2 :: 21.616 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.266 HA :: 4.433 HB :: 4.231 HG21 :: 1.211 HG22 :: 1.211 HG23 :: 1.211 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.976 Ave N Shift Values>> N :: 115.42(4.75) 1.R21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.8 G 0.11 K 0.06 L 0.01 C Shift Assignments>> CA :: 56.209 CB :: 30.244 CG :: 27.128 CD :: 43.381 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.481 HA :: 4.566 HB2 :: 1.849(D) HB3 :: 1.849 HG2 :: 1.633 HG3 :: 1.633 HD2 :: 3.185 HD3 :: 3.185 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 123.632 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.Q22 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> Q 0.47 K 0.38 E 0.09 R 0.03 C Shift Assignments>> CA :: 55.758 CB :: 29.688 CG :: 33.727 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.58 HA :: 4.406 HB2 :: 2.09 HB3 :: 2.09 HG2 :: 2.348 HG3 :: 2.348 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) 1.V23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 62.426 CB :: 32.764 CG1 :: 21.148 CG2 :: 21.148 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.428 HA :: 4.085 HB :: 2.022 HG11 :: 0.916(D) HG12 :: 0.916(D) HG13 :: 0.916(D) HG21 :: 0.916(D) HG22 :: 0.916(D) HG23 :: 0.916(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.835 Ave N Shift Values>> N :: 121.14(4.54) 1.R24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.79 G 0.11 K 0.09 C Shift Assignments>> CA :: 55.929 CB :: 30.951 CG :: 27.125 CD :: 43.367 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.59 HA :: 4.444 HB2 :: 1.796(D) HB3 :: 1.796(D) HG2 :: 1.631 HG3 :: 1.631 HD2 :: 3.185 HD3 :: 3.185 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 125.496 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.T25 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 62.04 CB :: 69.835 CG2 :: 21.634 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.461 HA :: 4.365 HB :: 4.135 HG21 :: 1.175 HG22 :: 1.175 HG23 :: 1.175 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.447 Ave N Shift Values>> N :: 115.42(4.75) 1.I26 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 61.154 CB :: 38.628 CG1 :: 27.334 CG2 :: 17.541 CD1 :: 12.788 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.385 HA :: 4.191 HB :: 1.851 HG12 :: 1.473 HG13 :: 1.178 HG21 :: 0.888 HG22 :: 0.888 HG23 :: 0.888 HD11 :: 0.838 HD12 :: 0.838 HD13 :: 0.838 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 124.199 Ave N Shift Values>> N :: 121.46(4.28) 1.V27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 62.47 CB :: 32.707 CG1 :: 21.041 CG2 :: 21.041 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.351 HA :: 4.086 HB :: 2.019 HG11 :: 0.911(D) HG12 :: 0.911(D) HG13 :: 0.911(D) HG21 :: 0.911(D) HG22 :: 0.911(D) HG23 :: 0.911(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 125.189 Ave N Shift Values>> N :: 121.14(4.54) 1.E28 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.75 Q 0.09 K 0.09 I 0.04 C Shift Assignments>> CA :: 56.465 CB :: 30.394 CG :: 36.303 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.539 HA :: 4.287 HB2 :: 1.929 HB3 :: 1.929 HG2 :: 2.246 HG3 :: 2.246 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 125.294 Ave N Shift Values>> N :: 120.67(3.48) 1.E29 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.76 Q 0.09 K 0.09 I 0.04 C Shift Assignments>> CA :: 56.495 CB :: 30.43 CG :: 36.306 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.564 HA :: 4.293 HB2 :: 1.957 HB3 :: 1.957 HG2 :: 2.251 HG3 :: 2.251 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 122.918 Ave N Shift Values>> N :: 120.67(3.48) 1.V30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.Q11 1.Q11 C Shift Assignments>> CA :: 62.461 CB :: 32.753 CG1 :: 21.044 CG2 :: 21.044 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.435 HA :: 4.093 HB :: 2.018 HG11 :: 0.911(D) HG12 :: 0.911(D) HG13 :: 0.911(D) HG21 :: 0.911(D) HG22 :: 0.911(D) HG23 :: 0.911(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.435 Ave N Shift Values>> N :: 121.14(4.54) 1.Q31 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.47 K 0.39 E 0.09 R 0.03 C Shift Assignments>> CA :: 55.662 CB :: 29.589 CG :: 33.73 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.695 HA :: 4.378 HB2 :: 2.008 HB3 :: 2.008 HG2 :: 2.35 HG3 :: 2.35 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 124.785 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.D32 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> D 0.41 L 0.29 K 0.13 Y 0.12 R 0.01 HN Overlap>> 1.Q44 1.Q44 C Shift Assignments>> CA :: 54.74 CB :: 40.977 Ave C Shift Values>> C :: 176.4(1.75) CA :: 54.69(2.03) CB :: 40.88(1.62) CG :: 179.17(1.79) H Shift Assignments>> H :: 8.616 HA :: 4.517 HB2 :: 2.698 HB3 :: 2.698 Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 122.622 Ave N Shift Values>> N :: 120.65(3.86) 1.G33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> G 0.9 L 0.08 C Shift Assignments>> CA :: 45.642 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.511 HA2 :: 3.905(D) HA3 :: 3.905(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.717 Ave N Shift Values>> N :: 109.67(3.87) 1.K34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> K 0.8 R 0.18 G 0.01 C Shift Assignments>> CA :: 56.244 CB :: 33.059 CG :: 24.761 CD :: 29.149 CE :: 42.136 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 8.115 HA :: 4.337 HB2 :: 1.789(D) HB3 :: 1.789(D) HG2 :: 1.394(D) HG3 :: 1.394(D) HD2 :: 1.663 HD3 :: 1.663 HE2 :: 2.977 HE3 :: 2.977 Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 120.651 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 HN Overlap>> 1.Y12 1.Y12 C Shift Assignments>> CA :: 62.552 CB :: 32.671 CG1 :: 21.041 CG2 :: 21.041 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.286 HA :: 4.088 HB :: 2.02 HG11 :: 0.916(D) HG12 :: 0.916(D) HG13 :: 0.916(D) HG21 :: 0.916(D) HG22 :: 0.916(D) HG23 :: 0.916(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 122.106 Ave N Shift Values>> N :: 121.14(4.54) 1.I36 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 61.097 CB :: 38.569 CG1 :: 27.313 CG2 :: 17.582 CD1 :: 12.788 Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 8.501 HA :: 4.194 HB :: 1.867 HG12 :: 1.472 HG13 :: 1.18 HG21 :: 0.876 HG22 :: 0.876 HG23 :: 0.876 HD11 :: 0.838 HD12 :: 0.838 HD13 :: 0.838 Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 125.998 Ave N Shift Values>> N :: 121.46(4.28) 1.S37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.352 CB :: 63.926 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.528 HA :: 4.493 HB2 :: 3.878(D) HB3 :: 3.878(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 120.214 Ave N Shift Values>> N :: 116.28(3.52) 1.S38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> CA :: 58.594 CB :: 63.754 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.526 HA :: 4.477 HB2 :: 3.894(D) HB3 :: 3.894(D) Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 118.15 Ave N Shift Values>> N :: 116.28(3.52) 1.R39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> R 0.79 G 0.11 K 0.08 C Shift Assignments>> CA :: 56.257 CB :: 30.621 CG :: 27.16 CD :: 43.381 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.45 HA :: 4.334 HB2 :: 2.005(D) HB3 :: 2.005(D) HG2 :: 1.588 HG3 :: 1.588 HD2 :: 3.185 HD3 :: 3.185 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 122.564 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) 1.E40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.74 K 0.1 Q 0.09 I 0.05 C Shift Assignments>> CA :: 56.639 CB :: 30.25 CG :: 36.329 Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 8.411 HA :: 4.317 HB2 :: 1.948 HB3 :: 1.948 HG2 :: 2.256 HG3 :: 2.256 Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 121.138 Ave N Shift Values>> N :: 120.67(3.48) 1.Q41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.46 K 0.39 E 0.1 R 0.03 C Shift Assignments>> CA :: 55.88 CB :: 29.575 CG :: 33.747 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.444 HA :: 4.292 HB2 :: 1.974 HB3 :: 1.974 HG2 :: 2.326 HG3 :: 2.326 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 121.584 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.V42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 62.554 CB :: 32.673 CG1 :: 21.037 CG2 :: 21.037 Ave C Shift Values>> C :: 175.62(1.9) CA :: 62.49(2.86) CB :: 32.73(1.79) CG1 :: 21.49(1.36) CG2 :: 21.26(1.56) H Shift Assignments>> H :: 8.251 HA :: 4.032 HB :: 1.995 HG11 :: 0.882(D) HG12 :: 0.882(D) HG13 :: 0.882(D) HG21 :: 0.882(D) HG22 :: 0.882(D) HG23 :: 0.882(D) Ave H Shift Values>> H :: 8.29(0.67) HA :: 4.19(0.58) HB :: 1.98(0.32) HG1 :: 0.83(0.26) HG2 :: 0.8(0.28) N Shift Assignments>> N :: 121.487 Ave N Shift Values>> N :: 121.14(4.54) 1.H43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Duplicate N Shifts: Consistent PRTL>> H 0.24 R 0.21 Q 0.2 E 0.19 K 0.12 C Shift Assignments>> CA :: 55.762 CB :: 30.115 Ave C Shift Values>> C :: 175.25(1.97) CA :: 56.52(2.31) CB :: 30.24(2.07) CG :: 131.52(3.27) CD2 :: 120.49(3.42) CE1 :: 137.71(2.12) H Shift Assignments>> H :: 8.626 HA :: 4.686 HB2 :: 3.123(D) HB3 :: 3.123(D) Ave H Shift Values>> H :: 8.24(0.68) HA :: 4.61(0.43) HB2 :: 3.1(0.36) HB3 :: 3.04(0.38) HD1 :: 8.68(2.62) HD2 :: 7(0.43) HE1 :: 7.95(0.48) HE2 :: 9.64(2.6) N Shift Assignments>> N :: 123.217 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.Q44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Q 0.46 K 0.39 E 0.09 R 0.03 HN Overlap>> 1.D32 1.D32 C Shift Assignments>> CA :: 55.823 CB :: 29.588 CG :: 33.73 Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 8.583 HA :: 4.341 HB2 :: 1.882 HB3 :: 1.882 HG2 :: 2.352 HG3 :: 2.352 Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 122.601 Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.T45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 62.086 CB :: 69.805 CG2 :: 21.617 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.491 HA :: 4.398 HB :: 4.304 HG21 :: 1.221 HG22 :: 1.221 HG23 :: 1.221 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 116.287 Ave N Shift Values>> N :: 115.42(4.75) 1.T46 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> CA :: 61.976 CB :: 69.916 CG2 :: 21.607 Ave C Shift Values>> C :: 174.54(1.76) CA :: 62.22(2.59) CB :: 69.73(1.63) CG2 :: 21.55(1.11) H Shift Assignments>> H :: 8.346 HA :: 4.332 HB :: 4.203 HG21 :: 1.198 HG22 :: 1.198 HG23 :: 1.198 Ave H Shift Values>> H :: 8.24(0.62) HA :: 4.46(0.48) HB :: 4.17(0.33) HG1 :: 4.92(1.58) HG2 :: 1.14(0.23) HG21 :: 1.14(0.23) HG22 :: 1.14(0.23) HG23 :: 1.14(0.23) N Shift Assignments>> N :: 117.413 Ave N Shift Values>> N :: 115.42(4.75) 1.R47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> R 0.77 K 0.11 G 0.11 C Shift Assignments>> CA :: 57.584 CB :: 31.36 CG :: 27.143 CD :: 43.381 Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 8.176 HA :: 4.185 HB2 :: 1.837 HB3 :: 1.719 HG2 :: 1.589 HG3 :: 1.589 HD2 :: 3.182 HD3 :: 3.182 Ave H Shift Values>> H :: 8.24(0.61) HA :: 4.3(0.46) HB2 :: 1.79(0.27) HB3 :: 1.76(0.28) HG2 :: 1.57(0.27) HG3 :: 1.54(0.29) HD2 :: 3.12(0.24) HD3 :: 3.1(0.26) HE :: 7.4(0.63) HH11 :: 6.91(0.46) HH12 :: 6.8(0.33) HH21 :: 6.81(0.48) HH22 :: 6.76(0.36) N Shift Assignments>> N :: 128.665 Ave N Shift Values>> N :: 120.8(3.68) NE :: 84.63(1.68) NH1 :: 73.82(4.62) NH2 :: 73.26(3.32) ########################################################################### Overall Results: #Consistent: 25 #Clerical: 22 #Suspicious: 0 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 47 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 47 #Suspicious: 0 C Shift Results: #Consistent: 150 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 238 #Duplicate: 71 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 42 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.G1 HA2 = 3.904(D), Expected = 3.97, Std = 0.3700, ChiSquare = 8.5843e-01 1.G1 HA3 = 3.904(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.9137e-01 1.G4 HA2 = 3.985(D), Expected = 3.97, Std = 0.3700, ChiSquare = 9.6766e-01 1.G4 HA3 = 3.985(D), Expected = 3.90, Std = 0.3700, ChiSquare = 8.1830e-01 1.H8 HB2 = 3.187(D), Expected = 3.10, Std = 0.3600, ChiSquare = 8.0904e-01 1.H8 HB3 = 3.187(D), Expected = 3.04, Std = 0.3800, ChiSquare = 6.9887e-01 1.L9 HB2 = 1.663(D), Expected = 1.61, Std = 0.3400, ChiSquare = 8.7613e-01 1.L9 HB3 = 1.663(D), Expected = 1.52, Std = 0.3600, ChiSquare = 6.9120e-01 1.K13 HG2 = 1.376(D), Expected = 1.37, Std = 0.2600, ChiSquare = 9.8159e-01 1.K13 HG3 = 1.376(D), Expected = 1.35, Std = 0.2800, ChiSquare = 9.2602e-01 1.P14 HB2 = 2.312(D), Expected = 2.08, Std = 0.3500, ChiSquare = 5.0742e-01 1.P14 HB3 = 2.312(D), Expected = 2.00, Std = 0.3600, ChiSquare = 3.8612e-01 1.K15 HB2 = 1.762(D), Expected = 1.78, Std = 0.2500, ChiSquare = 9.4260e-01 1.K15 HB3 = 1.762(D), Expected = 1.74, Std = 0.2700, ChiSquare = 9.3506e-01 1.K15 HG2 = 1.461(D), Expected = 1.37, Std = 0.2600, ChiSquare = 7.2634e-01 1.K15 HG3 = 1.461(D), Expected = 1.35, Std = 0.2800, ChiSquare = 6.9179e-01 1.P17 HB2 = 2.278(D), Expected = 2.08, Std = 0.3500, ChiSquare = 5.7159e-01 1.P17 HB3 = 2.278(D), Expected = 2.00, Std = 0.3600, ChiSquare = 4.3998e-01 1.V18 HG11 = 0.958(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.2250e-01 1.V18 HG12 = 0.958(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.2250e-01 1.V18 HG13 = 0.958(D), Expected = 0.83, Std = 0.2600, ChiSquare = 6.2250e-01 1.V18 HG21 = 0.958(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.7256e-01 1.V18 HG22 = 0.958(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.7256e-01 1.V18 HG23 = 0.958(D), Expected = 0.80, Std = 0.2800, ChiSquare = 5.7256e-01 1.R21 HB2 = 1.849(D), Expected = 1.79, Std = 0.2700, ChiSquare = 8.2703e-01 1.V23 HG11 = 0.916(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.4082e-01 1.V23 HG12 = 0.916(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.4082e-01 1.V23 HG13 = 0.916(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.4082e-01 1.V23 HG21 = 0.916(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.7866e-01 1.V23 HG22 = 0.916(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.7866e-01 1.V23 HG23 = 0.916(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.7866e-01 1.R24 HB2 = 1.796(D), Expected = 1.79, Std = 0.2700, ChiSquare = 9.8227e-01 1.R24 HB3 = 1.796(D), Expected = 1.76, Std = 0.2800, ChiSquare = 8.9770e-01 1.V27 HG11 = 0.911(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5539e-01 1.V27 HG12 = 0.911(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5539e-01 1.V27 HG13 = 0.911(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5539e-01 1.V27 HG21 = 0.911(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9179e-01 1.V27 HG22 = 0.911(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9179e-01 1.V27 HG23 = 0.911(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9179e-01 1.V30 HG11 = 0.911(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5539e-01 1.V30 HG12 = 0.911(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5539e-01 1.V30 HG13 = 0.911(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.5539e-01 1.V30 HG21 = 0.911(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9179e-01 1.V30 HG22 = 0.911(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9179e-01 1.V30 HG23 = 0.911(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.9179e-01 1.G33 HA2 = 3.905(D), Expected = 3.97, Std = 0.3700, ChiSquare = 8.6055e-01 1.G33 HA3 = 3.905(D), Expected = 3.90, Std = 0.3700, ChiSquare = 9.8922e-01 1.K34 HB2 = 1.789(D), Expected = 1.78, Std = 0.2500, ChiSquare = 9.7128e-01 1.K34 HB3 = 1.789(D), Expected = 1.74, Std = 0.2700, ChiSquare = 8.5599e-01 1.K34 HG2 = 1.394(D), Expected = 1.37, Std = 0.2600, ChiSquare = 9.2645e-01 1.K34 HG3 = 1.394(D), Expected = 1.35, Std = 0.2800, ChiSquare = 8.7513e-01 1.V35 HG11 = 0.916(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.4082e-01 1.V35 HG12 = 0.916(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.4082e-01 1.V35 HG13 = 0.916(D), Expected = 0.83, Std = 0.2600, ChiSquare = 7.4082e-01 1.V35 HG21 = 0.916(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.7866e-01 1.V35 HG22 = 0.916(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.7866e-01 1.V35 HG23 = 0.916(D), Expected = 0.80, Std = 0.2800, ChiSquare = 6.7866e-01 1.S37 HB2 = 3.878(D), Expected = 3.88, Std = 0.2500, ChiSquare = 9.9362e-01 1.S37 HB3 = 3.878(D), Expected = 3.85, Std = 0.2700, ChiSquare = 9.1740e-01 1.S38 HB2 = 3.894(D), Expected = 3.88, Std = 0.2500, ChiSquare = 9.5534e-01 1.S38 HB3 = 3.894(D), Expected = 3.85, Std = 0.2700, ChiSquare = 8.7055e-01 1.R39 HB2 = 2.005(D), Expected = 1.79, Std = 0.2700, ChiSquare = 4.2586e-01 1.R39 HB3 = 2.005(D), Expected = 1.76, Std = 0.2800, ChiSquare = 3.8157e-01 1.V42 HG11 = 0.882(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.4148e-01 1.V42 HG12 = 0.882(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.4148e-01 1.V42 HG13 = 0.882(D), Expected = 0.83, Std = 0.2600, ChiSquare = 8.4148e-01 1.V42 HG21 = 0.882(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.6963e-01 1.V42 HG22 = 0.882(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.6963e-01 1.V42 HG23 = 0.882(D), Expected = 0.80, Std = 0.2800, ChiSquare = 7.6963e-01 1.H43 HB2 = 3.123(D), Expected = 3.10, Std = 0.3600, ChiSquare = 9.4906e-01 1.H43 HB3 = 3.123(D), Expected = 3.04, Std = 0.3800, ChiSquare = 8.2710e-01