Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.G1 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> R 0.42 L 0.29 D 0.06 G 0.06 F 0.05 K 0.04 Y 0.03 I 0.01 C Shift Assignments>> CA :: 43.32244 Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) 1.S2 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> Y 0.15 F 0.14 S 0.12 E 0.1 K 0.08 R 0.08 H 0.07 Q 0.06 M 0.05 L 0.03 I 0.03 T 0.01 D 0.01 C Shift Assignments>> CA :: 58.2537 Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.494 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 :: 116.78 Ave N Shift Values>> N :: 116.28(3.52) 1.H3 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Consistent N Shifts: Consistent PRTL>> L 0.14 D 0.12 M 0.11 H 0.09 Q 0.09 R 0.08 K 0.07 E 0.05 N 0.05 F 0.04 Y 0.04 A 0.04 S 0.01 C Shift Assignments>> CA :: 55.34199 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 :: 8.56 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 :: 121.816 Ave N Shift Values>> N :: 119.69(4) ND1 :: 195.02(18.51) NE2 :: 182.41(14.4) 1.M4 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.14 L 0.13 M 0.11 H 0.09 Q 0.08 R 0.08 K 0.06 N 0.06 A 0.05 E 0.05 F 0.04 Y 0.03 S 0.01 HN Overlap>> 1.K13 1.K13 C Shift Assignments>> CA :: 55.11147(D) Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 8.313(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 123.176(D) Ave N Shift Values>> N :: 120.09(3.57) 1.N5 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.31 N 0.25 D 0.13 L 0.07 M 0.05 H 0.04 R 0.03 Q 0.03 K 0.02 F 0.01 Y 0.01 E 0.01 C Shift Assignments>> CA :: 52.97075(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.469(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 121.892(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.T6 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.32 T 0.25 S 0.08 F 0.08 Y 0.08 P 0.06 E 0.02 R 0.02 K 0.01 H 0.01 Q 0.01 C Shift Assignments>> CA :: 61.20434(D) 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 :: 8.064(D) 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 :: 115.726(D) Ave N Shift Values>> N :: 115.42(4.75) 1.S7 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.14 Y 0.13 E 0.11 S 0.1 K 0.09 R 0.08 H 0.07 Q 0.07 M 0.06 L 0.04 I 0.02 D 0.01 T 0.01 C Shift Assignments>> CA :: 57.95821(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.135(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 :: 119.074(D) Ave N Shift Values>> N :: 116.28(3.52) 1.S8 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.13 Y 0.13 E 0.11 K 0.09 S 0.09 R 0.09 H 0.08 Q 0.07 M 0.06 L 0.04 I 0.02 D 0.01 T 0.01 C Shift Assignments>> CA :: 57.85863(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.195(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 :: 118.953(D) Ave N Shift Values>> N :: 116.28(3.52) 1.S9 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.13 L 0.11 H 0.11 Q 0.1 R 0.1 K 0.09 E 0.07 D 0.06 F 0.05 Y 0.05 S 0.02 N 0.02 A 0.01 C Shift Assignments>> CA :: 56.04787(D) Ave C Shift Values>> C :: 174.62(1.72) CA :: 58.72(2.07) CB :: 63.8(1.48) H Shift Assignments>> H :: 8.117(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 :: 120.146(D) Ave N Shift Values>> N :: 116.28(3.52) 1.P10 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> P 0.3 T 0.24 S 0.22 I 0.19 F 0.01 Y 0.01 C Shift Assignments>> CA :: 63.13255(D) 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) 1.Q11 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.32 N 0.25 D 0.13 L 0.06 M 0.05 H 0.03 R 0.03 Q 0.02 K 0.02 F 0.01 Y 0.01 E 0.01 C Shift Assignments>> CA :: 52.77706(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.934(D) 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 :: 120.431(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.P12 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> T 0.28 P 0.25 I 0.22 S 0.17 F 0.02 Y 0.02 C Shift Assignments>> CA :: 62.80736(D) 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) 1.K13 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.12 H 0.11 Q 0.11 R 0.1 L 0.09 K 0.09 E 0.08 F 0.06 Y 0.05 D 0.05 S 0.03 N 0.01 A 0.01 HN Overlap>> 1.M4 1.M4 C Shift Assignments>> CA :: 56.26735(D) 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 :: 8.27(D) 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 :: 123.212(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K14 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.13 L 0.11 H 0.11 Q 0.1 R 0.1 K 0.09 E 0.07 D 0.07 F 0.05 Y 0.05 N 0.02 S 0.02 A 0.02 C Shift Assignments>> CA :: 56(D) 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 :: 8.181(D) 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 :: 124.416(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.K15 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.19 D 0.16 A 0.16 L 0.1 M 0.07 H 0.06 R 0.05 Q 0.05 K 0.04 F 0.02 E 0.02 Y 0.02 C Shift Assignments>> CA :: 53.94794(D) 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 :: 8.281(D) 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 :: 126.174(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.P16 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> T 0.28 P 0.25 I 0.22 S 0.17 F 0.02 Y 0.02 C Shift Assignments>> CA :: 62.80927(D) 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) 1.L17 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.17 L 0.12 M 0.1 N 0.09 H 0.08 Q 0.07 A 0.07 R 0.07 K 0.06 E 0.04 F 0.03 Y 0.03 S 0.01 C Shift Assignments>> CA :: 54.79747(D) 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 :: 8.22(D) 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 :: 123.325(D) Ave N Shift Values>> N :: 121.86(3.9) 1.D18 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.21 A 0.17 D 0.16 L 0.09 M 0.07 H 0.06 R 0.05 Q 0.04 K 0.03 F 0.02 E 0.02 Y 0.02 C Shift Assignments>> CA :: 53.85928(D) 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 :: 8.13(D) 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 :: 122.758(D) Ave N Shift Values>> N :: 120.65(3.86) 1.G19 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.6 L 0.22 R 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> CA :: 44.61739(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.086(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 110.413(D) Ave N Shift Values>> N :: 109.67(3.87) 1.E20 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> R 0.12 Q 0.11 H 0.11 K 0.11 M 0.09 E 0.09 L 0.07 F 0.07 Y 0.07 D 0.04 S 0.04 N 0.01 C Shift Assignments>> CA :: 56.67536(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.84(D) 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 :: 122.063(D) Ave N Shift Values>> N :: 120.67(3.48) 1.Y21 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.12 R 0.11 E 0.11 Q 0.1 H 0.1 F 0.08 M 0.08 Y 0.08 L 0.06 S 0.05 D 0.03 I 0.01 C Shift Assignments>> CA :: 57.03203(D) Ave C Shift Values>> C :: 175.4(1.99) CA :: 58.13(2.51) CB :: 39.32(2.16) CG :: 129.75(4.96) CD1 :: 132.77(1.17) CD2 :: 132.73(1.3) CE1 :: 117.93(1.19) CE2 :: 117.9(1.18) CZ :: 156.76(1.99) H Shift Assignments>> H :: 7.911(D) Ave H Shift Values>> H :: 8.32(0.73) HA :: 4.63(0.56) HB2 :: 2.91(0.37) HB3 :: 2.84(0.39) HD1 :: 6.93(0.3) HD2 :: 6.93(0.3) HE1 :: 6.7(0.23) HE2 :: 6.71(0.23) HH :: 9.3(1.36) N Shift Assignments>> N :: 121.631(D) Ave N Shift Values>> N :: 120.52(4.2) 1.F22 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.12 H 0.11 Q 0.11 R 0.1 L 0.1 K 0.09 E 0.07 F 0.06 Y 0.05 D 0.05 S 0.03 N 0.01 A 0.01 C Shift Assignments>> CA :: 56.24717(D) 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 :: 9.067(D) 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 :: 122.586(D) Ave N Shift Values>> N :: 120.45(4.18) 1.T23 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.31 T 0.25 S 0.09 F 0.08 Y 0.08 P 0.05 E 0.02 R 0.02 K 0.02 H 0.01 Q 0.01 C Shift Assignments>> CA :: 61.1375(D) 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 :: 8.324(D) 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 :: 116.38(D) Ave N Shift Values>> N :: 115.42(4.75) 1.L24 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.3 N 0.25 D 0.13 L 0.07 M 0.05 H 0.04 R 0.03 Q 0.03 K 0.02 F 0.01 Y 0.01 E 0.01 C Shift Assignments>> CA :: 53.01972(D) 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 :: 8.812(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 128.06(D) Ave N Shift Values>> N :: 121.86(3.9) 1.Q25 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.18 L 0.12 N 0.11 M 0.09 A 0.08 H 0.07 Q 0.07 R 0.06 K 0.05 E 0.03 F 0.03 Y 0.03 C Shift Assignments>> CA :: 54.6095(D) 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 :: 8.502(D) 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 :: 125.88(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.I26 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.18 Y 0.14 F 0.14 E 0.08 I 0.07 K 0.07 R 0.06 H 0.05 Q 0.05 T 0.04 M 0.03 L 0.02 C Shift Assignments>> CA :: 59.0805(D) Ave C Shift Values>> C :: 175.85(1.92) CA :: 61.61(2.68) CB :: 38.63(2.02) CG1 :: 27.71(1.68) CG2 :: 17.53(1.36) CD1 :: 13.43(1.67) H Shift Assignments>> H :: 9.29(D) Ave H Shift Values>> H :: 8.28(0.68) HA :: 4.18(0.56) HB :: 1.78(0.29) HG2 :: 0.77(0.27) HG12 :: 1.28(0.4) HG13 :: 1.19(0.41) HD1 :: 0.68(0.29) N Shift Assignments>> N :: 127.644(D) Ave N Shift Values>> N :: 121.46(4.28) 1.R27 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.13 M 0.12 H 0.1 Q 0.1 R 0.09 K 0.08 D 0.08 E 0.06 F 0.05 Y 0.05 N 0.03 A 0.02 S 0.02 C Shift Assignments>> CA :: 55.81449(D) Ave C Shift Values>> C :: 176.41(2.03) CA :: 56.77(2.31) CB :: 30.7(1.83) CG :: 27.21(1.2) CD :: 43.16(0.88) CZ :: 159.97(2.95) H Shift Assignments>> H :: 9.513(D) 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 :: 130.477(D) 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.G28 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.6 L 0.22 R 0.1 F 0.02 D 0.02 Y 0.01 C Shift Assignments>> CA :: 44.61617(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.842(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 118.23(D) Ave N Shift Values>> N :: 109.67(3.87) 1.R29 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.16 Y 0.14 F 0.14 E 0.09 K 0.07 R 0.07 H 0.06 Q 0.05 I 0.04 M 0.04 T 0.02 L 0.02 C Shift Assignments>> CA :: 58.61677(D) 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 :: 8.627(D) 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 :: 125.516(D) 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.E30 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.17 S 0.15 Y 0.13 F 0.13 T 0.12 E 0.05 K 0.04 R 0.04 H 0.03 Q 0.03 M 0.02 L 0.01 P 0.01 C Shift Assignments>> CA :: 60.10957(D) 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 :: 8.702(D) 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 :: 120.007(D) Ave N Shift Values>> N :: 120.67(3.48) 1.R31 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.13 L 0.12 H 0.11 Q 0.1 R 0.09 K 0.08 D 0.07 E 0.06 F 0.05 Y 0.05 N 0.02 S 0.02 A 0.02 C Shift Assignments>> CA :: 55.90561(D) 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 :: 8.918(D) 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 :: 118.612(D) 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.F32 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.35 T 0.3 P 0.1 F 0.05 Y 0.05 S 0.05 E 0.01 R 0.01 K 0.01 C Shift Assignments>> CA :: 61.6898(D) Ave C Shift Values>> C :: 175.42(1.99) CA :: 58.08(2.57) CB :: 39.99(2.09) CG :: 138.41(2.04) CD1 :: 131.58(1.18) CD2 :: 131.63(1.12) CE1 :: 130.71(1.3) CE2 :: 130.76(1.13) CZ :: 129.21(1.43) H Shift Assignments>> H :: 8.058(D) 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 :: 122.598(D) Ave N Shift Values>> N :: 120.45(4.18) 1.E33 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.18 Y 0.14 F 0.14 E 0.09 K 0.07 R 0.07 H 0.06 Q 0.05 I 0.05 M 0.04 T 0.03 L 0.02 C Shift Assignments>> CA :: 58.7117(D) 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 :: 8.47(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 118.893(D) Ave N Shift Values>> N :: 120.67(3.48) 1.M34 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.17 Y 0.14 F 0.14 E 0.09 K 0.07 R 0.07 H 0.06 Q 0.05 I 0.04 M 0.04 T 0.03 L 0.02 C Shift Assignments>> CA :: 58.66151(D) Ave C Shift Values>> C :: 176.18(2.09) CA :: 56.11(2.23) CB :: 32.99(2.24) CG :: 32.01(1.24) CE :: 17.07(1.58) H Shift Assignments>> H :: 7.246(D) Ave H Shift Values>> H :: 8.26(0.6) HA :: 4.41(0.48) HB2 :: 2.03(0.34) HB3 :: 1.99(0.34) HG2 :: 2.42(0.35) HG3 :: 2.39(0.38) HE :: 1.89(0.46) N Shift Assignments>> N :: 121.086(D) Ave N Shift Values>> N :: 120.09(3.57) 1.F35 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> I 0.23 T 0.17 S 0.13 F 0.12 Y 0.12 E 0.04 K 0.03 R 0.03 H 0.02 Q 0.02 P 0.02 M 0.01 C Shift Assignments>> CA :: 60.47758(D) 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 :: 7.822(D) Ave H Shift Values>> H :: 8.36(0.72) HA :: 4.63(0.57) HB2 :: 3(0.37) HB3 :: 2.93(0.4) HD1 :: 7.06(0.31) HD2 :: 7.06(0.31) HE1 :: 7.08(0.31) HE2 :: 7.08(0.32) HZ :: 7(0.42) N Shift Assignments>> N :: 118.118(D) Ave N Shift Values>> N :: 120.45(4.18) 1.R36 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.17 Y 0.14 F 0.14 I 0.11 T 0.07 E 0.07 K 0.06 R 0.05 H 0.04 Q 0.04 M 0.03 L 0.01 C Shift Assignments>> CA :: 59.54486(D) 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 :: 8.938(D) 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 :: 122.555(D) 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.E37 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.18 Y 0.14 F 0.14 E 0.08 I 0.08 K 0.06 R 0.06 H 0.05 T 0.05 Q 0.04 M 0.03 L 0.02 C Shift Assignments>> CA :: 59.17438(D) Ave C Shift Values>> C :: 176.87(1.95) CA :: 57.32(2.09) CB :: 30.01(1.72) CG :: 36.11(1.19) CD :: 182.4(1.78) H Shift Assignments>> H :: 7.438(D) 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 :: 121.298(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L38 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> F 0.12 E 0.12 Y 0.12 K 0.1 R 0.09 S 0.08 H 0.08 Q 0.08 M 0.06 L 0.04 I 0.02 D 0.01 T 0.01 C Shift Assignments>> CA :: 57.68349(D) 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 :: 7.699(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 118.892(D) Ave N Shift Values>> N :: 121.86(3.9) 1.N39 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> K 0.12 R 0.11 Q 0.1 H 0.1 E 0.1 M 0.08 F 0.08 Y 0.07 L 0.06 S 0.04 D 0.03 I 0.01 C Shift Assignments>> CA :: 56.933(D) Ave C Shift Values>> C :: 175.27(1.79) CA :: 53.54(1.88) CB :: 38.69(1.69) CG :: 176.76(1.38) H Shift Assignments>> H :: 8.78(D) Ave H Shift Values>> H :: 8.34(0.63) HA :: 4.67(0.36) HB2 :: 2.81(0.31) HB3 :: 2.75(0.33) HD21 :: 7.35(0.48) HD22 :: 7.14(0.49) N Shift Assignments>> N :: 119.109(D) Ave N Shift Values>> N :: 118.93(4.03) ND2 :: 112.75(2.23) 1.E40 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.18 Y 0.14 F 0.14 E 0.08 K 0.07 R 0.06 I 0.06 H 0.05 Q 0.05 T 0.04 M 0.04 L 0.02 C Shift Assignments>> CA :: 58.99051(D) 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 :: 8.259(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.582(D) Ave N Shift Values>> N :: 120.67(3.48) 1.A41 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> D 0.15 L 0.13 M 0.1 H 0.08 Q 0.08 N 0.07 R 0.07 K 0.06 A 0.06 E 0.04 F 0.04 Y 0.03 S 0.01 C Shift Assignments>> CA :: 54.97206(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.946(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 122.503(D) Ave N Shift Values>> N :: 123.23(3.54) 1.L42 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> E 0.12 F 0.12 Y 0.11 K 0.1 R 0.09 H 0.08 Q 0.08 S 0.08 M 0.06 L 0.04 D 0.02 I 0.01 T 0.01 C Shift Assignments>> CA :: 57.63275(D) 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 :: 8.192(D) Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 120.827(D) Ave N Shift Values>> N :: 121.86(3.9) 1.E43 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.17 Y 0.14 F 0.14 I 0.1 E 0.07 T 0.07 K 0.06 R 0.06 H 0.04 Q 0.04 M 0.03 L 0.01 C Shift Assignments>> CA :: 59.48402(D) 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 :: 8.209(D) Ave H Shift Values>> H :: 8.33(0.59) HA :: 4.25(0.41) HB2 :: 2.02(0.21) HB3 :: 1.99(0.23) HG2 :: 2.27(0.21) HG3 :: 2.25(0.22) N Shift Assignments>> N :: 119.756(D) Ave N Shift Values>> N :: 120.67(3.48) 1.L44 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Consistent N Shifts: Consistent PRTL>> E 0.12 K 0.11 F 0.1 Y 0.1 R 0.1 H 0.09 Q 0.09 M 0.07 S 0.07 L 0.05 D 0.02 I 0.01 C Shift Assignments>> CA :: 57.43578(D) 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 :: 7.655 Ave H Shift Values>> H :: 8.23(0.65) HA :: 4.32(0.47) HB2 :: 1.61(0.34) HB3 :: 1.52(0.36) HG :: 1.51(0.33) HD1 :: 0.75(0.28) HD2 :: 0.73(0.29) N Shift Assignments>> N :: 122.912 Ave N Shift Values>> N :: 121.86(3.9) 1.K45 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> S 0.18 Y 0.14 F 0.14 E 0.08 I 0.08 K 0.06 R 0.06 H 0.05 T 0.05 Q 0.04 M 0.03 L 0.02 C Shift Assignments>> CA :: 59.17493(D) 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 :: 7.986(D) 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 :: 122.187(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.D46 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> H 0.12 Q 0.12 R 0.11 M 0.11 K 0.1 L 0.08 E 0.08 F 0.06 Y 0.06 D 0.04 S 0.03 N 0.01 A 0.01 C Shift Assignments>> CA :: 56.46623(D) 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 :: 8.309(D) Ave H Shift Values>> H :: 8.31(0.58) HA :: 4.59(0.32) HB2 :: 2.72(0.26) HB3 :: 2.66(0.28) HD2 :: 5.25(0.58) N Shift Assignments>> N :: 121.246(D) Ave N Shift Values>> N :: 120.65(3.86) 1.A47 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.24 A 0.2 D 0.15 L 0.08 M 0.06 H 0.05 R 0.04 Q 0.04 K 0.03 F 0.02 E 0.01 Y 0.01 C Shift Assignments>> CA :: 53.60693(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.749(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.27(D) Ave N Shift Values>> N :: 123.23(3.54) 1.Q48 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> M 0.12 H 0.11 Q 0.11 R 0.1 L 0.1 K 0.09 E 0.07 F 0.06 Y 0.05 D 0.05 S 0.03 N 0.01 A 0.01 C Shift Assignments>> CA :: 56.23407(D) Ave C Shift Values>> C :: 176.31(1.95) CA :: 56.57(2.14) CB :: 29.19(1.82) CG :: 33.76(1.11) CD :: 179.69(1.29) H Shift Assignments>> H :: 7.725(D) Ave H Shift Values>> H :: 8.22(0.59) HA :: 4.27(0.44) HB2 :: 2.05(0.25) HB3 :: 2.02(0.28) HG2 :: 2.32(0.27) HG3 :: 2.29(0.29) HE21 :: 7.24(0.45) HE22 :: 7.02(0.44) N Shift Assignments>> N :: 118.02(D) Ave N Shift Values>> N :: 119.89(3.6) NE2 :: 111.87(1.72) 1.A49 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> A 0.32 N 0.25 D 0.13 L 0.06 M 0.05 H 0.04 R 0.03 Q 0.02 K 0.02 F 0.01 Y 0.01 E 0.01 C Shift Assignments>> CA :: 52.82521(D) Ave C Shift Values>> C :: 177.74(2.13) CA :: 53.14(1.98) CB :: 19.01(1.83) H Shift Assignments>> H :: 7.69(D) Ave H Shift Values>> H :: 8.2(0.6) HA :: 4.26(0.44) HB :: 1.35(0.26) N Shift Assignments>> N :: 123.99(D) Ave N Shift Values>> N :: 123.23(3.54) 1.G50 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.8 L 0.13 R 0.02 F 0.01 C Shift Assignments>> CA :: 45.08553(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.061(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 108.675(D) Ave N Shift Values>> N :: 109.67(3.87) 1.K51 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> L 0.14 M 0.12 D 0.1 H 0.1 Q 0.09 R 0.09 K 0.07 E 0.06 F 0.04 Y 0.04 N 0.04 A 0.03 S 0.01 C Shift Assignments>> CA :: 55.54168(D) 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 :: 7.772(D) 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 :: 121.654(D) Ave N Shift Values>> N :: 121.05(3.77) NZ :: 33.81(2.81) 1.E52 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> N 0.18 D 0.17 A 0.15 L 0.1 M 0.08 H 0.06 R 0.05 Q 0.05 K 0.04 E 0.02 F 0.02 Y 0.02 C Shift Assignments>> CA :: 54.04124(D) 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 :: 8.325(D) 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 :: 125.135(D) Ave N Shift Values>> N :: 120.67(3.48) 1.P53 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Indeterminable N Shifts: Indeterminable PRTL>> T 0.27 P 0.26 I 0.21 S 0.18 F 0.02 Y 0.01 C Shift Assignments>> CA :: 62.90543(D) 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) 1.G54 Overall: Clerical Typing: Consistent SRO: Consistent C Shifts: Duplicate H Shifts: Duplicate N Shifts: Duplicate PRTL>> G 0.91 L 0.07 C Shift Assignments>> CA :: 46.0188(D) Ave C Shift Values>> C :: 173.87(1.88) CA :: 45.35(1.34) H Shift Assignments>> H :: 8.025(D) Ave H Shift Values>> H :: 8.33(0.65) HA2 :: 3.97(0.37) HA3 :: 3.9(0.37) N Shift Assignments>> N :: 118.225(D) Ave N Shift Values>> N :: 109.67(3.87) ########################################################################### Overall Results: #Consistent: 3 #Clerical: 51 #Suspicious: 0 #Anomalous: 0 #Mistyped: 0 #Indeterminable: 0 Typing Results: #Consistent: 54 #Suspicious: 0 #Mistyped: 0 #Indeterminable: 0 Shift Relative Order (SRO) Results: #Consistent: 54 #Suspicious: 0 C Shift Results: #Consistent: 3 #Duplicate: 51 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 H Shift Results: #Consistent: 3 #Duplicate: 46 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 3 #Duplicate: 46 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 Error Summary: 1.M4 CA = 55.11147(D), Expected = 56.11, Std = 2.2300, ChiSquare = 6.5432e-01 1.M4 H = 8.313(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.2961e-01 1.M4 N = 123.176(D), Expected = 120.09, Std = 3.5700, ChiSquare = 3.8735e-01 1.N5 CA = 52.97075(D), Expected = 53.54, Std = 1.8800, ChiSquare = 7.6205e-01 1.N5 H = 8.469(D), Expected = 8.34, Std = 0.6300, ChiSquare = 8.3776e-01 1.N5 N = 121.892(D), Expected = 118.93, Std = 4.0300, ChiSquare = 4.6235e-01 1.T6 CA = 61.20434(D), Expected = 62.22, Std = 2.5900, ChiSquare = 6.9495e-01 1.T6 H = 8.064(D), Expected = 8.24, Std = 0.6200, ChiSquare = 7.7651e-01 1.T6 N = 115.726(D), Expected = 115.42, Std = 4.7500, ChiSquare = 9.4864e-01 1.S7 CA = 57.95821(D), Expected = 58.72, Std = 2.0700, ChiSquare = 7.1286e-01 1.S7 H = 8.135(D), Expected = 8.28, Std = 0.5900, ChiSquare = 8.0587e-01 1.S7 N = 119.074(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.2734e-01 1.S8 CA = 57.85863(D), Expected = 58.72, Std = 2.0700, ChiSquare = 6.7732e-01 1.S8 H = 8.195(D), Expected = 8.28, Std = 0.5900, ChiSquare = 8.8545e-01 1.S8 N = 118.953(D), Expected = 116.28, Std = 3.5200, ChiSquare = 4.4763e-01 1.S9 CA = 56.04787(D), Expected = 58.72, Std = 2.0700, ChiSquare = 1.9674e-01 1.S9 H = 8.117(D), Expected = 8.28, Std = 0.5900, ChiSquare = 7.8234e-01 1.S9 N = 120.146(D), Expected = 116.28, Std = 3.5200, ChiSquare = 2.7208e-01 1.P10 CA = 63.13255(D), Expected = 63.33, Std = 1.5200, ChiSquare = 8.9664e-01 1.Q11 CA = 52.77706(D), Expected = 56.57, Std = 2.1400, ChiSquare = 7.6328e-02 1.Q11 H = 7.934(D), Expected = 8.22, Std = 0.5900, ChiSquare = 6.2786e-01 1.Q11 N = 120.431(D), Expected = 119.89, Std = 3.6000, ChiSquare = 8.8055e-01 1.P12 CA = 62.80736(D), Expected = 63.33, Std = 1.5200, ChiSquare = 7.3096e-01 1.K13 CA = 56.26735(D), Expected = 56.95, Std = 2.2000, ChiSquare = 7.5634e-01 1.K13 H = 8.27(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.9393e-01 1.K13 N = 123.212(D), Expected = 121.05, Std = 3.7700, ChiSquare = 5.6632e-01 1.K14 CA = 56(D), Expected = 56.95, Std = 2.2000, ChiSquare = 6.6587e-01 1.K14 H = 8.181(D), Expected = 8.19, Std = 0.6000, ChiSquare = 9.8803e-01 1.K14 N = 124.416(D), Expected = 121.05, Std = 3.7700, ChiSquare = 3.7194e-01 1.K15 CA = 53.94794(D), Expected = 56.95, Std = 2.2000, ChiSquare = 1.7239e-01 1.K15 H = 8.281(D), Expected = 8.19, Std = 0.6000, ChiSquare = 8.7945e-01 1.K15 N = 126.174(D), Expected = 121.05, Std = 3.7700, ChiSquare = 1.7410e-01 1.P16 CA = 62.80927(D), Expected = 63.33, Std = 1.5200, ChiSquare = 7.3191e-01 1.L17 CA = 54.79747(D), Expected = 55.62, Std = 2.1300, ChiSquare = 6.9937e-01 1.L17 H = 8.22(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.8773e-01 1.L17 N = 123.325(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.0718e-01 1.D18 CA = 53.85928(D), Expected = 54.69, Std = 2.0300, ChiSquare = 6.8238e-01 1.D18 H = 8.13(D), Expected = 8.31, Std = 0.5800, ChiSquare = 7.5630e-01 1.D18 N = 122.758(D), Expected = 120.65, Std = 3.8600, ChiSquare = 5.8499e-01 1.G19 CA = 44.61739(D), Expected = 45.35, Std = 1.3400, ChiSquare = 5.8457e-01 1.G19 H = 8.086(D), Expected = 8.33, Std = 0.6500, ChiSquare = 7.0737e-01 1.G19 N = 110.413(D), Expected = 109.67, Std = 3.8700, ChiSquare = 8.4775e-01 1.E20 CA = 56.67536(D), Expected = 57.32, Std = 2.0900, ChiSquare = 7.5775e-01 1.E20 H = 7.84(D), Expected = 8.33, Std = 0.5900, ChiSquare = 4.0625e-01 1.E20 N = 122.063(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.8894e-01 1.Y21 CA = 57.03203(D), Expected = 58.13, Std = 2.5100, ChiSquare = 6.6179e-01 1.Y21 H = 7.911(D), Expected = 8.32, Std = 0.7300, ChiSquare = 5.7529e-01 1.Y21 N = 121.631(D), Expected = 120.52, Std = 4.2000, ChiSquare = 7.9138e-01 1.F22 CA = 56.24717(D), Expected = 58.08, Std = 2.5700, ChiSquare = 4.7574e-01 1.F22 H = 9.067(D), Expected = 8.36, Std = 0.7200, ChiSquare = 3.2613e-01 1.F22 N = 122.586(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.0935e-01 1.T23 CA = 61.1375(D), Expected = 62.22, Std = 2.5900, ChiSquare = 6.7598e-01 1.T23 H = 8.324(D), Expected = 8.24, Std = 0.6200, ChiSquare = 8.9223e-01 1.T23 N = 116.38(D), Expected = 115.42, Std = 4.7500, ChiSquare = 8.3983e-01 1.L24 CA = 53.01972(D), Expected = 55.62, Std = 2.1300, ChiSquare = 2.2217e-01 1.L24 H = 8.812(D), Expected = 8.23, Std = 0.6500, ChiSquare = 3.7058e-01 1.L24 N = 128.06(D), Expected = 121.86, Std = 3.9000, ChiSquare = 1.1189e-01 1.Q25 CA = 54.6095(D), Expected = 56.57, Std = 2.1400, ChiSquare = 3.5960e-01 1.Q25 H = 8.502(D), Expected = 8.22, Std = 0.5900, ChiSquare = 6.3267e-01 1.Q25 N = 125.88(D), Expected = 119.89, Std = 3.6000, ChiSquare = 9.6135e-02 1.I26 CA = 59.0805(D), Expected = 61.61, Std = 2.6800, ChiSquare = 3.4525e-01 1.I26 H = 9.29(D), Expected = 8.28, Std = 0.6800, ChiSquare = 1.3747e-01 1.I26 N = 127.644(D), Expected = 121.46, Std = 4.2800, ChiSquare = 1.4850e-01 1.R27 CA = 55.81449(D), Expected = 56.77, Std = 2.3100, ChiSquare = 6.7914e-01 1.R27 H = 9.513(D), Expected = 8.24, Std = 0.6100, ChiSquare = 3.6899e-02 1.R27 N = 130.477(D), Expected = 120.80, Std = 3.6800, ChiSquare = 8.5480e-03 1.G28 CA = 44.61617(D), Expected = 45.35, Std = 1.3400, ChiSquare = 5.8394e-01 1.G28 H = 8.842(D), Expected = 8.33, Std = 0.6500, ChiSquare = 4.3088e-01 1.G28 N = 118.23(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.6975e-02 1.R29 CA = 58.61677(D), Expected = 56.77, Std = 2.3100, ChiSquare = 4.2402e-01 1.R29 H = 8.627(D), Expected = 8.24, Std = 0.6100, ChiSquare = 5.2580e-01 1.R29 N = 125.516(D), Expected = 120.80, Std = 3.6800, ChiSquare = 2.0001e-01 1.E30 CA = 60.10957(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.8197e-01 1.E30 H = 8.702(D), Expected = 8.33, Std = 0.5900, ChiSquare = 5.2836e-01 1.E30 N = 120.007(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.4890e-01 1.R31 CA = 55.90561(D), Expected = 56.77, Std = 2.3100, ChiSquare = 7.0826e-01 1.R31 H = 8.918(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.6636e-01 1.R31 N = 118.612(D), Expected = 120.80, Std = 3.6800, ChiSquare = 5.5213e-01 1.F32 CA = 61.6898(D), Expected = 58.08, Std = 2.5700, ChiSquare = 1.6014e-01 1.F32 H = 8.058(D), Expected = 8.36, Std = 0.7200, ChiSquare = 6.7489e-01 1.F32 N = 122.598(D), Expected = 120.45, Std = 4.1800, ChiSquare = 6.0734e-01 1.E33 CA = 58.7117(D), Expected = 57.32, Std = 2.0900, ChiSquare = 5.0548e-01 1.E33 H = 8.47(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.1243e-01 1.E33 N = 118.893(D), Expected = 120.67, Std = 3.4800, ChiSquare = 6.0961e-01 1.M34 CA = 58.66151(D), Expected = 56.11, Std = 2.2300, ChiSquare = 2.5255e-01 1.M34 H = 7.246(D), Expected = 8.26, Std = 0.6000, ChiSquare = 9.1028e-02 1.M34 N = 121.086(D), Expected = 120.09, Std = 3.5700, ChiSquare = 7.8025e-01 1.F35 CA = 60.47758(D), Expected = 58.08, Std = 2.5700, ChiSquare = 3.5087e-01 1.F35 H = 7.822(D), Expected = 8.36, Std = 0.7200, ChiSquare = 4.5493e-01 1.F35 N = 118.118(D), Expected = 120.45, Std = 4.1800, ChiSquare = 5.7692e-01 1.R36 CA = 59.54486(D), Expected = 56.77, Std = 2.3100, ChiSquare = 2.2966e-01 1.R36 H = 8.938(D), Expected = 8.24, Std = 0.6100, ChiSquare = 2.5251e-01 1.R36 N = 122.555(D), Expected = 120.80, Std = 3.6800, ChiSquare = 6.3343e-01 1.E37 CA = 59.17438(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.7494e-01 1.E37 H = 7.438(D), Expected = 8.33, Std = 0.5900, ChiSquare = 1.3057e-01 1.E37 N = 121.298(D), Expected = 120.67, Std = 3.4800, ChiSquare = 8.5679e-01 1.L38 CA = 57.68349(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.3266e-01 1.L38 H = 7.699(D), Expected = 8.23, Std = 0.6500, ChiSquare = 4.1397e-01 1.L38 N = 118.892(D), Expected = 121.86, Std = 3.9000, ChiSquare = 4.4664e-01 1.N39 CA = 56.933(D), Expected = 53.54, Std = 1.8800, ChiSquare = 7.1108e-02 1.N39 H = 8.78(D), Expected = 8.34, Std = 0.6300, ChiSquare = 4.8492e-01 1.N39 N = 119.109(D), Expected = 118.93, Std = 4.0300, ChiSquare = 9.6457e-01 1.E40 CA = 58.99051(D), Expected = 57.32, Std = 2.0900, ChiSquare = 4.2412e-01 1.E40 H = 8.259(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.0421e-01 1.E40 N = 119.582(D), Expected = 120.67, Std = 3.4800, ChiSquare = 7.5455e-01 1.A41 CA = 54.97206(D), Expected = 53.14, Std = 1.9800, ChiSquare = 3.5482e-01 1.A41 H = 7.946(D), Expected = 8.20, Std = 0.6000, ChiSquare = 6.7205e-01 1.A41 N = 122.503(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.3729e-01 1.L42 CA = 57.63275(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.4468e-01 1.L42 H = 8.192(D), Expected = 8.23, Std = 0.6500, ChiSquare = 9.5338e-01 1.L42 N = 120.827(D), Expected = 121.86, Std = 3.9000, ChiSquare = 7.9111e-01 1.E43 CA = 59.48402(D), Expected = 57.32, Std = 2.0900, ChiSquare = 3.0047e-01 1.E43 H = 8.209(D), Expected = 8.33, Std = 0.5900, ChiSquare = 8.3751e-01 1.E43 N = 119.756(D), Expected = 120.67, Std = 3.4800, ChiSquare = 7.9283e-01 1.L44 CA = 57.43578(D), Expected = 55.62, Std = 2.1300, ChiSquare = 3.9395e-01 1.K45 CA = 59.17493(D), Expected = 56.95, Std = 2.2000, ChiSquare = 3.1186e-01 1.K45 H = 7.986(D), Expected = 8.19, Std = 0.6000, ChiSquare = 7.3386e-01 1.K45 N = 122.187(D), Expected = 121.05, Std = 3.7700, ChiSquare = 7.6296e-01 1.D46 CA = 56.46623(D), Expected = 54.69, Std = 2.0300, ChiSquare = 3.8158e-01 1.D46 H = 8.309(D), Expected = 8.31, Std = 0.5800, ChiSquare = 9.9862e-01 1.D46 N = 121.246(D), Expected = 120.65, Std = 3.8600, ChiSquare = 8.7729e-01 1.A47 CA = 53.60693(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.1357e-01 1.A47 H = 7.749(D), Expected = 8.20, Std = 0.6000, ChiSquare = 4.5225e-01 1.A47 N = 123.27(D), Expected = 123.23, Std = 3.5400, ChiSquare = 9.9098e-01 1.Q48 CA = 56.23407(D), Expected = 56.57, Std = 2.1400, ChiSquare = 8.7526e-01 1.Q48 H = 7.725(D), Expected = 8.22, Std = 0.5900, ChiSquare = 4.0148e-01 1.Q48 N = 118.02(D), Expected = 119.89, Std = 3.6000, ChiSquare = 6.0345e-01 1.A49 CA = 52.82521(D), Expected = 53.14, Std = 1.9800, ChiSquare = 8.7368e-01 1.A49 H = 7.69(D), Expected = 8.20, Std = 0.6000, ChiSquare = 3.9533e-01 1.A49 N = 123.99(D), Expected = 123.23, Std = 3.5400, ChiSquare = 8.3001e-01 1.G50 CA = 45.08553(D), Expected = 45.35, Std = 1.3400, ChiSquare = 8.4354e-01 1.G50 H = 8.061(D), Expected = 8.33, Std = 0.6500, ChiSquare = 6.7899e-01 1.G50 N = 108.675(D), Expected = 109.67, Std = 3.8700, ChiSquare = 7.9710e-01 1.K51 CA = 55.54168(D), Expected = 56.95, Std = 2.2000, ChiSquare = 5.2208e-01 1.K51 H = 7.772(D), Expected = 8.19, Std = 0.6000, ChiSquare = 4.8601e-01 1.K51 N = 121.654(D), Expected = 121.05, Std = 3.7700, ChiSquare = 8.7271e-01 1.E52 CA = 54.04124(D), Expected = 57.32, Std = 2.0900, ChiSquare = 1.1670e-01 1.E52 H = 8.325(D), Expected = 8.33, Std = 0.5900, ChiSquare = 9.9324e-01 1.E52 N = 125.135(D), Expected = 120.67, Std = 3.4800, ChiSquare = 1.9948e-01 1.P53 CA = 62.90543(D), Expected = 63.33, Std = 1.5200, ChiSquare = 7.8000e-01 1.G54 CA = 46.0188(D), Expected = 45.35, Std = 1.3400, ChiSquare = 6.1771e-01 1.G54 H = 8.025(D), Expected = 8.33, Std = 0.6500, ChiSquare = 6.3890e-01 1.G54 N = 118.225(D), Expected = 109.67, Std = 3.8700, ChiSquare = 2.7064e-02