Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.K1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Indeterminable PRTL>> K 0.65 W 0.29 V 0.04 C Shift Assignments>> CA :: 55.497 CB :: 32.361 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>> HA :: 4.023 HB2 :: 1.882 HB3 :: 1.882 HG2 :: 1.415 HG3 :: 1.415 HD2 :: 1.728 HD3 :: 1.728 HE2 :: 3.022 HE3 :: 3.022 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) 1.F2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> CA :: 58.903 CB :: 39.580 CD1 :: 131.527 CE1 :: 130.754 CZ :: 129.091 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 9.026 HA :: 4.639 HB2 :: 3.119 HB3 :: 3.155 HD1 :: 7.324 HD2 :: 7.324 HE1 :: 7.289 HE2 :: 7.289 HZ :: 7.211 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 123.415 Ave N Shift Values>> N :: 120.45(4.18) 1.K3 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Unknown N Shifts: Consistent PRTL>> K 0.99 C Shift Assignments>> CA :: 56.457 CB :: 32.724 CG :: 23.780 CD :: 28.990 CE :: 41.807 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 :: 8.358 HA :: 4.240 HB2 :: 1.792 HB3 :: 1.739 HG2 :: 1.363 HG3 :: 1.431 HD2 :: 1.727 HD3 :: 1.727 HE2 :: 3.161 HE3 :: 3.161 HZ1 :: 7.701(U) HZ2 :: 7.701(U) HZ3 :: 7.701(U) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 123.503 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Unknown N Shifts: Consistent PRTL>> K 0.99 C Shift Assignments>> CA :: 56.844 CB :: 33.177 CG :: 24.734 CD :: 29.029 CE :: 41.812 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 :: 8.097 HA :: 4.175 HB2 :: 1.787 HB3 :: 1.787 HG2 :: 1.374 HG3 :: 1.448 HD2 :: 1.714 HD3 :: 1.714 HE2 :: 2.989 HE3 :: 2.989 HZ1 :: 7.685(U) HZ2 :: 7.685(U) HZ3 :: 7.685(U) 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 :: 121.117 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.V5 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> V 0.99 C Shift Assignments>> CA :: 62.453 CB :: 33.007 CG1 :: 20.741 CG2 :: 20.817 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 :: 8.033 HA :: 3.960 HB :: 1.876 HG11 :: 0.863 HG12 :: 0.863 HG13 :: 0.863 HG21 :: 0.637 HG22 :: 0.637 HG23 :: 0.637 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 :: 120.607 Ave N Shift Values>> N :: 121.14(4.54) 1.I6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> I 0.99 C Shift Assignments>> CA :: 61.123 CB :: 37.469 CG1 :: 27.143 CG2 :: 17.614 CD1 :: 12.546 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 :: 8.170 HA :: 4.152 HB :: 1.938 HG12 :: 1.454 HG13 :: 1.189 HG21 :: 0.873 HG22 :: 0.873 HG23 :: 0.873 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 :: 123.761 Ave N Shift Values>> N :: 121.46(4.28) 1.W7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> W 1 C Shift Assignments>> CA :: 58.826 CB :: 29.256 CD1 :: 127.048 CE3 :: 120.072 CZ2 :: 114.336 CZ3 :: 121.184 CH2 :: 123.728 Ave C Shift Values>> C :: 176.12(2.01) CA :: 57.66(2.58) CB :: 30.01(2.01) CG :: 110.59(1.88) CD1 :: 126.51(1.83) CD2 :: 127.57(1.55) CE2 :: 138.31(6.98) CE3 :: 120.43(1.79) CZ2 :: 114.26(1.12) CZ3 :: 121.35(1.53) CH2 :: 123.86(1.42) H Shift Assignments>> H :: 7.947 HA :: 4.454 HB2 :: 3.305 HB3 :: 3.305 HD1 :: 7.366 HE1 :: 10.610 HE3 :: 7.517 HZ2 :: 7.485 HZ3 :: 6.981 HH2 :: 7.136 Ave H Shift Values>> H :: 8.29(0.79) HA :: 4.68(0.53) HB2 :: 3.19(0.35) HB3 :: 3.12(0.36) HD1 :: 7.14(0.36) HE1 :: 10.08(0.66) HE3 :: 7.31(0.41) HZ2 :: 7.28(0.33) HZ3 :: 6.86(0.4) HH2 :: 6.98(0.39) N Shift Assignments>> N :: 123.696 NE1 :: 130.513 Ave N Shift Values>> N :: 121.68(4.18) NE1 :: 129.32(2.11) 1.K8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Unknown N Shifts: Consistent PRTL>> K 0.99 C Shift Assignments>> CA :: 58.089 CB :: 32.266 CG :: 24.729 CD :: 29.005 CE :: 41.818 Ave C Shift Values>> C :: 176.64(2) CA :: 56.95(2.2) CB :: 32.79(1.78) CG :: 24.89(1.13) CD :: 28.96(1.08) CE :: 41.89(0.82) H Shift Assignments>> H :: 7.989 HA :: 4.017 HB2 :: 1.749 HB3 :: 1.749 HG2 :: 1.198 HG3 :: 1.198 HD2 :: 1.667 HD3 :: 1.667 HE2 :: 2.922 HE3 :: 2.922 HZ1 :: 7.687(U) HZ2 :: 7.687(U) HZ3 :: 7.687(U) Ave H Shift Values>> H :: 8.19(0.6) HA :: 4.27(0.44) HB2 :: 1.78(0.25) HB3 :: 1.74(0.27) HG2 :: 1.37(0.26) HG3 :: 1.35(0.28) HD2 :: 1.61(0.22) HD3 :: 1.6(0.22) HE2 :: 2.92(0.19) HE3 :: 2.91(0.2) HZ :: 7.42(0.67) N Shift Assignments>> N :: 118.542 Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.S9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> S 1 C Shift Assignments>> CA :: 59.989 CB :: 63.053 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 7.915 HA :: 4.266 HB2 :: 3.812 HB3 :: 3.812 Ave H Shift Values>> H :: 8.28(0.59) HA :: 4.48(0.4) HB2 :: 3.88(0.25) HB3 :: 3.85(0.27) HG :: 5.36(1.03) N Shift Assignments>> N :: 114.268 Ave N Shift Values>> N :: 116.28(3.52) 1.F10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> F 0.99 C Shift Assignments>> CA :: 58.856 CB :: 39.571 CD1 :: 131.633 CE1 :: 130.939 CZ :: 129.173 Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 7.825 HA :: 4.530 HB2 :: 3.154 HB3 :: 3.154 HD1 :: 7.349 HD2 :: 7.349 HE1 :: 7.347 HE2 :: 7.347 HZ :: 7.246 Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 119.674 Ave N Shift Values>> N :: 120.45(4.18) 1.L11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.99 C Shift Assignments>> CA :: 54.643 CB :: 42.386 CG :: 26.965 CD1 :: 25.511 CD2 :: 25.504 Ave C Shift Values>> C :: 176.99(1.98) CA :: 55.62(2.13) CB :: 42.31(1.88) CG :: 26.78(1.1) CD1 :: 24.72(1.59) CD2 :: 24.05(1.7) H Shift Assignments>> H :: 7.672 HA :: 4.282 HB2 :: 1.718 HB3 :: 1.682 HG :: 1.642 HD11 :: 0.963 HD12 :: 0.963 HD13 :: 0.963 HD21 :: 0.916 HD22 :: 0.916 HD23 :: 0.916 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 117.985 Ave N Shift Values>> N :: 121.86(3.9) ########################################################################### Overall Results: #Consistent: 8 #Clerical: 3 #Suspicious: 0 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 11 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 11 #Suspicious: 0 C Shift Results: #Consistent: 50 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 102 #Duplicate: 0 #Unknown: 9 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 11 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.K3 HZ1 = 7.701(U) 1.K3 HZ2 = 7.701(U) 1.K3 HZ3 = 7.701(U) 1.K4 HZ1 = 7.685(U) 1.K4 HZ2 = 7.685(U) 1.K4 HZ3 = 7.685(U) 1.K8 HZ1 = 7.687(U) 1.K8 HZ2 = 7.687(U) 1.K8 HZ3 = 7.687(U)