Assignment Validation Software (AVS) (c) Hunter Moseley and Gaetano Montelione, 2004 1.M1 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N2 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L3 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E4 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S5 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L6 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.55 C 0.3 R 0.07 G 0.05 C Shift Assignments>> C :: 176.8 CA :: 57.4 CB :: 43.0 CG :: 26.6 CD1 :: 25.2 CD2 :: 24.4 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) N Shift Assignments>> N :: 117.1 Ave N Shift Values>> N :: 121.98(4.07) 1.L7 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.24 L 0.24 I 0.18 K 0.17 R 0.14 C Shift Assignments>> C :: 178.3 CA :: 58.6 CB :: 41.2 CG :: 26.8 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) N Shift Assignments>> N :: 117.4 Ave N Shift Values>> N :: 121.98(4.07) 1.H8 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.54 W 0.43 H 0.02 C Shift Assignments>> C :: 177.9 CA :: 63.4 CB :: 28.6 CG :: 129.2 CD2 :: 127.1 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) N Shift Assignments>> N :: 115.8 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.W9 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.5 W 0.47 H 0.02 C Shift Assignments>> C :: 179.6 CA :: 61.0 CB :: 30.5 CG :: 111.9 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 119.8 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.I10 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.91 C 0.08 C Shift Assignments>> C :: 177.6 CA :: 66.0 CB :: 37.4 CG1 :: 29.8 CG2 :: 18.1 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) N Shift Assignments>> N :: 119.9 Ave N Shift Values>> N :: 121.6(4.72) 1.Y11 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.66 C 0.13 F 0.09 Y 0.08 C Shift Assignments>> C :: 177.3 CA :: 63.6 CB :: 38.5 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) N Shift Assignments>> N :: 121.2 Ave N Shift Values>> N :: 120.79(4.69) 1.V12 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.98 C 0.01 C Shift Assignments>> C :: 179.8 CA :: 68.1 CB :: 31.9 CG1 :: 22.6 CG2 :: 21.7 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) N Shift Assignments>> N :: 121.5 Ave N Shift Values>> N :: 121.02(4.96) 1.A13 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.63 A 0.24 I 0.07 C 0.03 V 0.01 C Shift Assignments>> C :: 179.2 CA :: 55.9 CB :: 18.0 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 124.2 Ave N Shift Values>> N :: 123.23(3.7) 1.G14 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.29 G 0.27 C 0.24 A 0.1 N 0.04 D 0.01 L 0.01 C Shift Assignments>> C :: 175.6 CA :: 48.2 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 106.6 Ave N Shift Values>> N :: 109.91(4.29) 1.M15 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.53 M 0.27 E 0.14 Q 0.03 C Shift Assignments>> C :: 178.1 CA :: 56.9 CB :: 35.3 CG :: 33.6 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) N Shift Assignments>> N :: 121.0 Ave N Shift Values>> N :: 120.1(3.88) 1.T16 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.65 T 0.32 I 0.01 C Shift Assignments>> C :: 176.1 CA :: 68.1 CG2 :: 21.1 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 116.7 Ave N Shift Values>> N :: 115.7(5.05) 1.I17 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.91 C 0.08 C Shift Assignments>> C :: 177.8 CA :: 65.6 CB :: 38.0 CG2 :: 17.6 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) N Shift Assignments>> N :: 119.5 Ave N Shift Values>> N :: 121.6(4.72) 1.G18 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.39 C 0.26 P 0.18 A 0.08 N 0.03 L 0.01 D 0.01 C Shift Assignments>> C :: 172.7 CA :: 48.0 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 105.1 Ave N Shift Values>> N :: 109.91(4.29) 1.A19 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.64 A 0.14 I 0.12 C 0.04 V 0.02 C Shift Assignments>> C :: 179.8 CA :: 56.7 CB :: 18.2 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 122.2 Ave N Shift Values>> N :: 123.23(3.7) 1.L20 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> R 0.32 L 0.25 C 0.19 K 0.15 I 0.04 G 0.02 C Shift Assignments>> C :: 179.4 CA :: 58.1 CB :: 42.7 CG :: 27.1 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) N Shift Assignments>> N :: 115.9 Ave N Shift Values>> N :: 121.98(4.07) 1.H21 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.F22 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.W23 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S24 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L25 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S26 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R27 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N28 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P29 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R30 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G31 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V32 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.P33 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Q34 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Y35 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.E36 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Y37 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L38 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V39 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.68 V 0.31 C Shift Assignments>> C :: 176.5 CA :: 68.6 CB :: 32.9 CG1 :: 26.4 CG2 :: 23.8 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) N Shift Assignments>> N :: 118.2 Ave N Shift Values>> N :: 121.02(4.96) 1.A40 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.51 A 0.37 C 0.04 I 0.02 V 0.01 L 0.01 C Shift Assignments>> C :: 178.0 CA :: 55.3 CB :: 19.1 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 118.6 Ave N Shift Values>> N :: 123.23(3.7) 1.M41 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.26 Q 0.13 K 0.12 V 0.11 E 0.11 M 0.1 W 0.04 I 0.02 Y 0.02 R 0.02 H 0.01 C Shift Assignments>> C :: 176.6 CA :: 59.2 CB :: 34.3 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) N Shift Assignments>> N :: 110.7 Ave N Shift Values>> N :: 120.1(3.88) 1.F42 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.54 F 0.17 C 0.14 Y 0.11 C Shift Assignments>> C :: 177.4 CA :: 63.2 CB :: 40.4 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) N Shift Assignments>> N :: 119.5 Ave N Shift Values>> N :: 120.69(4.18) 1.I43 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.95 C 0.04 C Shift Assignments>> C :: 174.7 CA :: 67.9 CB :: 36.8 CG2 :: 17.6 CD1 :: 14.8 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) N Shift Assignments>> N :: 115.1 Ave N Shift Values>> N :: 121.6(4.72) 1.P44 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.69 C 0.3 C Shift Assignments>> C :: 178.5 CA :: 65.5 CB :: 32.6 CG :: 27.8 CD :: 51.4 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) N Shift Assignments>> N :: 132.2 Ave N Shift Values>> N :: 127.4(10.05) 1.I45 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.87 C 0.12 C Shift Assignments>> C :: 176.0 CA :: 64.6 CB :: 37.1 CG1 :: 29.0 CG2 :: 16.8 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) N Shift Assignments>> N :: 119.6 Ave N Shift Values>> N :: 121.6(4.72) 1.W46 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Indeterminable N Shifts: Consistent PRTL>> W 0.55 C 0.42 H 0.02 C Shift Assignments>> C :: 177.1 CA :: 60.9 CB :: 29.4 CG :: 112.0 CD1 :: 125.8 CE2 :: 139.7(A) Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 120.1 NE1 :: 126.6 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.S47 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.87 T 0.12 C Shift Assignments>> C :: 177.7 CA :: 60.2 CB :: 65.7 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 106.4 Ave N Shift Values>> N :: 116.3(3.95) 1.G48 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.63 C 0.24 P 0.03 A 0.03 L 0.02 N 0.01 C Shift Assignments>> C :: 174.9 CA :: 47.5 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 106.4 Ave N Shift Values>> N :: 109.91(4.29) 1.L49 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.44 C 0.42 R 0.11 K 0.01 C Shift Assignments>> C :: 178.4 CA :: 58.3 CB :: 41.4 CG :: 27.2 CD1 :: 26.7 CD2 :: 22.9 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) N Shift Assignments>> N :: 121.5 Ave N Shift Values>> N :: 121.98(4.07) 1.A50 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.56 A 0.34 I 0.04 C 0.03 C Shift Assignments>> C :: 178.7 CA :: 55.3 CB :: 18.2 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 121.1 Ave N Shift Values>> N :: 123.23(3.7) 1.Y51 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> Y 0.58 C 0.41 C Shift Assignments>> C :: 178.3 CA :: 60.7 CB :: 38.5 CZ :: 157.4 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) N Shift Assignments>> N :: 119.1 Ave N Shift Values>> N :: 120.79(4.69) 1.M52 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.51 M 0.45 I 0.02 C Shift Assignments>> C :: 177.5 CA :: 59.2 CB :: 33.2 CG :: 31.6 CE :: 17.6 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) N Shift Assignments>> N :: 126.2 Ave N Shift Values>> N :: 120.1(3.88) 1.A53 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.56 A 0.36 I 0.03 C 0.02 C Shift Assignments>> C :: 179.2 CA :: 54.8 CB :: 17.5 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 118.4 Ave N Shift Values>> N :: 123.23(3.7) 1.M54 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.52 M 0.45 I 0.02 C Shift Assignments>> C :: 180.7 CA :: 58.8 CB :: 33.2 CG :: 31.2 CE :: 16.5 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) N Shift Assignments>> N :: 114.0 Ave N Shift Values>> N :: 120.1(3.88) 1.A55 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.82 A 0.1 I 0.05 C 0.01 C Shift Assignments>> C :: 179.4 CA :: 55.6 CB :: 15.7 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 127.1 Ave N Shift Values>> N :: 123.23(3.7) 1.I56 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.63 I 0.27 V 0.08 C Shift Assignments>> C :: 174.4 CA :: 60.5 CB :: 36.2 CG1 :: 23.6 CG2 :: 18.7 CD1 :: 15.4 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) N Shift Assignments>> N :: 111.2 Ave N Shift Values>> N :: 121.6(4.72) 1.D57 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.63 E 0.28 D 0.08 C Shift Assignments>> C :: 175.0 CA :: 56.6 CB :: 38.7 CG :: 182.0(A) Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) N Shift Assignments>> N :: 115.3 Ave N Shift Values>> N :: 120.73(4.2) 1.Q58 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.36 M 0.31 E 0.23 Q 0.06 K 0.01 C Shift Assignments>> C :: 175.2 CA :: 54.8 CB :: 32.0 CG :: 35.6 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) N Shift Assignments>> N :: 117.4 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.G59 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.81 C 0.1 L 0.06 R 0.01 C Shift Assignments>> C :: 172.3 CA :: 46.0 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 101.7 Ave N Shift Values>> N :: 109.91(4.29) 1.K60 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.53 K 0.23 R 0.16 M 0.04 G 0.01 A 0.01 C Shift Assignments>> C :: 175.4 CA :: 54.0 CB :: 36.6 CG :: 24.2 CD :: 30.0 CE :: 41.9 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) N Shift Assignments>> N :: 114.1 NZ :: 33.4 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.V61 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.6 V 0.38 C Shift Assignments>> C :: 171.6 CA :: 60.1 CB :: 35.9 CG1 :: 21.4 CG2 :: 20.7 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) N Shift Assignments>> N :: 120.5 Ave N Shift Values>> N :: 121.02(4.96) 1.E62 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.5 E 0.49 C Shift Assignments>> C :: 175.9 CA :: 56.7 CB :: 29.9 CG :: 36.3 CD :: 183.6 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) N Shift Assignments>> N :: 128.1 Ave N Shift Values>> N :: 120.68(3.68) 1.A63 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> A 0.48 L 0.21 M 0.18 C 0.09 K 0.01 C Shift Assignments>> C :: 176.6 CA :: 52.3 CB :: 21.7 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 128.8 Ave N Shift Values>> N :: 123.23(3.7) 1.A64 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> A 0.68 M 0.29 C 0.01 C Shift Assignments>> C :: 177.7 CA :: 53.0 CB :: 18.1 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 127.2 Ave N Shift Values>> N :: 123.23(3.7) 1.G65 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.81 C 0.1 L 0.06 C Shift Assignments>> C :: 173.2 CA :: 46.1 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 103.8 Ave N Shift Values>> N :: 109.91(4.29) 1.Q66 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> Q 0.46 C 0.41 E 0.12 C Shift Assignments>> C :: 172.4 CA :: 53.0 CB :: 29.9 CD :: 179.3 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) N Shift Assignments>> N :: 117.9 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.I67 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.7 I 0.27 A 0.01 C Shift Assignments>> C :: 176.5 CA :: 59.2 CB :: 36.2 CG1 :: 26.2 CG2 :: 18.3 CD1 :: 10.1 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) N Shift Assignments>> N :: 119.1 Ave N Shift Values>> N :: 121.6(4.72) 1.A68 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> A 0.82 M 0.15 C 0.01 C Shift Assignments>> C :: 177.3 CA :: 51.0 CB :: 17.7 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 134.2 Ave N Shift Values>> N :: 123.23(3.7) 1.H69 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.59 H 0.27 W 0.12 C Shift Assignments>> C :: 176.2 CA :: 55.3 CB :: 25.3 CG :: 128.8 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) N Shift Assignments>> N :: 129.4 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.Y70 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.26 I 0.24 Y 0.17 E 0.15 F 0.1 V 0.02 M 0.01 K 0.01 C Shift Assignments>> C :: 177.4 CA :: 60.0 CB :: 37.0 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) N Shift Assignments>> N :: 121.5 Ave N Shift Values>> N :: 120.79(4.69) 1.A71 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.64 A 0.27 I 0.05 C 0.02 C Shift Assignments>> C :: 178.8 CA :: 55.3 CB :: 17.3 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 124.8 Ave N Shift Values>> N :: 123.23(3.7) 1.R72 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Anomalous PRTL>> R 0.42 C 0.37 G 0.19 C Shift Assignments>> C :: 176.0 CA :: 59.5 CB :: 28.8 CG :: 27.7 CD :: 43.9 CZ :: 159.5 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) N Shift Assignments>> N :: 113.9 NE :: 83.3 NH1 :: 77.3 NH2 :: 69.7(A) Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.Y73 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> Y 0.54 C 0.45 C Shift Assignments>> C :: 177.3 CA :: 59.8 CB :: 37.9 CG :: 128.6 CZ :: 158.1 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) N Shift Assignments>> N :: 112.6 Ave N Shift Values>> N :: 120.79(4.69) 1.I74 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.94 C 0.05 C Shift Assignments>> C :: 177.1 CA :: 66.0 CB :: 37.7 CG1 :: 29.4 CG2 :: 17.6 CD1 :: 14.6 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) N Shift Assignments>> N :: 119.8 Ave N Shift Values>> N :: 121.6(4.72) 1.D75 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> D 0.56 C 0.35 N 0.07 C Shift Assignments>> C :: 178.3 CA :: 56.1 CB :: 40.9 CG :: 178.7 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) N Shift Assignments>> N :: 116.1 Ave N Shift Values>> N :: 120.73(4.2) 1.W76 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.68 W 0.18 H 0.12 C Shift Assignments>> C :: 179.6 CA :: 56.6 CB :: 30.1 CG :: 113.7 CD1 :: 124.5 CE2 :: 139.2 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 114.7 NE1 :: 128.1 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.M77 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.38 M 0.34 Q 0.12 K 0.08 E 0.03 R 0.01 C Shift Assignments>> C :: 172.8 CA :: 58.1 CB :: 32.4 CG :: 31.6 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) N Shift Assignments>> N :: 125.4 Ave N Shift Values>> N :: 120.1(3.88) 1.V78 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.79 C 0.2 C Shift Assignments>> C :: 178.7 CA :: 63.4 CB :: 34.5 CG1 :: 22.4 CG2 :: 21.2 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) N Shift Assignments>> N :: 109.6 Ave N Shift Values>> N :: 121.02(4.96) 1.T79 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.82 C 0.17 C Shift Assignments>> C :: 177.6 CA :: 66.1 CB :: 70.5 CG2 :: 24.5 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 107.3 Ave N Shift Values>> N :: 115.7(5.05) 1.T80 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.93 C 0.06 C Shift Assignments>> C :: 176.6 CA :: 67.0 CB :: 68.1 CG2 :: 23.7 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 112.7 Ave N Shift Values>> N :: 115.7(5.05) 1.P81 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.61 P 0.38 C Shift Assignments>> C :: 178.9 CA :: 66.9 CB :: 31.9 CG :: 29.0 CD :: 51.0 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) N Shift Assignments>> N :: 137.6 Ave N Shift Values>> N :: 127.4(10.05) 1.L82 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.46 C 0.43 R 0.08 A 0.01 C Shift Assignments>> C :: 177.7 CA :: 57.8 CB :: 41.1 CG :: 27.2 CD1 :: 26.4 CD2 :: 22.3 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) N Shift Assignments>> N :: 113.6 Ave N Shift Values>> N :: 121.98(4.07) 1.L83 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.34 R 0.32 L 0.21 G 0.07 K 0.03 C Shift Assignments>> C :: 179.4 CA :: 58.2 CB :: 43.2 CG :: 27.9 CD1 :: 27.6 CD2 :: 24.4 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) N Shift Assignments>> N :: 120.8 Ave N Shift Values>> N :: 121.98(4.07) 1.L84 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> K 0.36 L 0.32 C 0.26 R 0.03 C Shift Assignments>> C :: 179.4 CA :: 57.9 CB :: 41.9 CG :: 27.8 CD2 :: 24.0 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) N Shift Assignments>> N :: 118.4 Ave N Shift Values>> N :: 121.98(4.07) 1.L85 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.34 L 0.32 K 0.31 R 0.01 C Shift Assignments>> C :: 176.9 CA :: 58.2 CB :: 40.5 CG :: 27.5 CD2 :: 24.9 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) N Shift Assignments>> N :: 126.9 Ave N Shift Values>> N :: 121.98(4.07) 1.S86 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.75 T 0.24 C Shift Assignments>> C :: 178.5 CA :: 64.4 CB :: 63.6 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 116.1 Ave N Shift Values>> N :: 116.3(3.95) 1.L87 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.58 C 0.36 R 0.03 G 0.01 C Shift Assignments>> C :: 178.4 CA :: 58.1 CB :: 42.0 CG :: 26.4 CD1 :: 24.7 CD2 :: 22.5 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) N Shift Assignments>> N :: 122.0 Ave N Shift Values>> N :: 121.98(4.07) 1.S88 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.25 P 0.22 T 0.22 I 0.18 C 0.03 F 0.02 Y 0.01 W 0.01 S 0.01 C Shift Assignments>> C :: 176.5 CA :: 62.9 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 117.0 Ave N Shift Values>> N :: 116.3(3.95) 1.W89 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.62 H 0.36 C Shift Assignments>> C :: 180.0 CA :: 58.6 CB :: 28.3 CG :: 115.6(A) Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 122.8 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.T90 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.82 C 0.17 C Shift Assignments>> C :: 175.3 CA :: 69.2(A) CB :: 66.7 CG2 :: 21.7 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 118.8 Ave N Shift Values>> N :: 115.7(5.05) 1.A91 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> A 0.55 M 0.39 C 0.03 I 0.01 C Shift Assignments>> C :: 177.3 CA :: 54.2 CB :: 18.9 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 120.2 Ave N Shift Values>> N :: 123.23(3.7) 1.M92 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.44 C 0.43 Q 0.07 E 0.04 C Shift Assignments>> C :: 176.8 CA :: 53.4 CB :: 34.2 CG :: 33.2 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) N Shift Assignments>> N :: 108.9 Ave N Shift Values>> N :: 120.1(3.88) 1.Q93 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.F94 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I95 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K96 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K97 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D98 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.W99 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T100 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L101 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I102 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.91 C 0.08 C Shift Assignments>> C :: 177.8 CA :: 66.5 CB :: 38.3 CG1 :: 29.6 CG2 :: 19.2 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) N Shift Assignments>> N :: 117.1 Ave N Shift Values>> N :: 121.6(4.72) 1.G103 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.59 C 0.25 P 0.05 A 0.03 L 0.02 N 0.01 C Shift Assignments>> C :: 176.3 CA :: 47.6 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 107.5 Ave N Shift Values>> N :: 109.91(4.29) 1.F104 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> F 0.11 S 0.11 Y 0.1 C 0.09 I 0.09 W 0.08 T 0.07 V 0.06 E 0.05 R 0.04 K 0.03 H 0.03 Q 0.03 M 0.02 L 0.01 C Shift Assignments>> CA :: 59.7 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) N Shift Assignments>> N :: 125.3 Ave N Shift Values>> N :: 120.69(4.18) 1.L105 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.M106 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.47 E 0.22 I 0.12 M 0.1 Q 0.04 K 0.02 C Shift Assignments>> C :: 177.3 CA :: 61.3 CB :: 35.2 CG :: 31.6 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) N Shift Assignments>> N :: 113.9 Ave N Shift Values>> N :: 120.1(3.88) 1.S107 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.25 T 0.23 I 0.19 P 0.15 C 0.03 F 0.03 Y 0.02 W 0.01 S 0.01 C Shift Assignments>> C :: 176.7 CA :: 62.4 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 111.8 Ave N Shift Values>> N :: 116.3(3.95) 1.T108 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.93 C 0.06 C Shift Assignments>> C :: 177.0 CA :: 68.4 CB :: 67.6 CG2 :: 23.1 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 121.1 Ave N Shift Values>> N :: 115.7(5.05) 1.Q109 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Indeterminable N Shifts: Suspicious PRTL>> C 0.99 C Shift Assignments>> C :: 178.4 CA :: 57.3 CB :: 26.7 CG :: 31.3 CD :: 175.0(S) 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) N Shift Assignments>> N :: 122.0 NE2 :: 98.3(S) Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.I110 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.84 C 0.15 C Shift Assignments>> C :: 180.4 CA :: 64.1 CB :: 36.6 CG1 :: 28.9 CG2 :: 17.5 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) N Shift Assignments>> N :: 120.2 Ave N Shift Values>> N :: 121.6(4.72) 1.V111 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.97 C 0.02 C Shift Assignments>> C :: 178.5 CA :: 67.8 CB :: 30.9 CG1 :: 22.7 CG2 :: 21.4 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) N Shift Assignments>> N :: 123.4 Ave N Shift Values>> N :: 121.02(4.96) 1.V112 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.97 C 0.02 C Shift Assignments>> C :: 177.1 CA :: 67.5 CB :: 31.8 CG1 :: 22.1 CG2 :: 21.8 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) N Shift Assignments>> N :: 121.5 Ave N Shift Values>> N :: 121.02(4.96) 1.I113 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.78 V 0.19 I 0.02 C Shift Assignments>> C :: 178.3 CA :: 61.6 CB :: 34.7 CG1 :: 25.6 CG2 :: 20.7 CD1 :: 8.9 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) N Shift Assignments>> N :: 113.3 Ave N Shift Values>> N :: 121.6(4.72) 1.T114 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.97 C 0.02 C Shift Assignments>> C :: 175.9 CA :: 68.8 CB :: 68.0 CG2 :: 22.2 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 118.1 Ave N Shift Values>> N :: 115.7(5.05) 1.S115 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.89 T 0.1 C Shift Assignments>> C :: 175.7 CA :: 63.9 CB :: 62.4 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 116.4 Ave N Shift Values>> N :: 116.3(3.95) 1.G116 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.5 C 0.27 P 0.1 A 0.05 N 0.02 L 0.02 C Shift Assignments>> C :: 173.1 CA :: 47.8 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 106.7 Ave N Shift Values>> N :: 109.91(4.29) 1.L117 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.48 C 0.4 R 0.08 K 0.01 C Shift Assignments>> C :: 176.7 CA :: 57.4 CB :: 41.0 CG :: 27.5 CD1 :: 26.4 CD2 :: 23.2 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) N Shift Assignments>> N :: 123.2 Ave N Shift Values>> N :: 121.98(4.07) 1.I118 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.86 C 0.13 C Shift Assignments>> C :: 180.1 CA :: 65.3 CB :: 36.9 CG1 :: 27.6 CG2 :: 19.5 CD1 :: 15.0 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) N Shift Assignments>> N :: 116.5 Ave N Shift Values>> N :: 121.6(4.72) 1.A119 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.55 A 0.23 C 0.06 V 0.04 I 0.03 L 0.02 T 0.02 C Shift Assignments>> C :: 179.4 CA :: 56.1 CB :: 19.6 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 122.8 Ave N Shift Values>> N :: 123.23(3.7) 1.D120 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> D 0.57 C 0.41 C Shift Assignments>> C :: 179.0 CA :: 54.1 CB :: 40.7 CG :: 181.1 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) N Shift Assignments>> N :: 112.9 Ave N Shift Values>> N :: 120.73(4.2) 1.L121 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.49 C 0.22 A 0.17 G 0.08 R 0.03 C Shift Assignments>> C :: 176.6 CA :: 54.4 CB :: 43.1 CG :: 25.8 CD1 :: 25.5 CD2 :: 21.8 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) N Shift Assignments>> N :: 115.2 Ave N Shift Values>> N :: 121.98(4.07) 1.S122 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 174.3 CA :: 61.7 CB :: 63.8 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 115.2 Ave N Shift Values>> N :: 116.3(3.95) 1.E123 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.12 M 0.1 H 0.09 D 0.09 Q 0.07 C 0.07 K 0.07 R 0.07 W 0.05 E 0.04 Y 0.04 N 0.04 F 0.04 A 0.03 S 0.01 C Shift Assignments>> CA :: 55.4 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) N Shift Assignments>> N :: 122.3 Ave N Shift Values>> N :: 120.68(3.68) 1.R124 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D125 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.W126 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.52 W 0.45 H 0.02 C Shift Assignments>> C :: 176.3 CA :: 60.0 CB :: 27.4 CG :: 111.6 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 115.8 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.V127 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.93 C 0.06 C Shift Assignments>> C :: 176.9 CA :: 65.8 CB :: 31.7 CG1 :: 22.6 CG2 :: 20.4 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) N Shift Assignments>> N :: 122.2 Ave N Shift Values>> N :: 121.02(4.96) 1.R128 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.16 W 0.16 V 0.13 I 0.1 E 0.1 R 0.09 H 0.06 Q 0.04 P 0.04 K 0.04 M 0.03 C Shift Assignments>> C :: 178.8 CA :: 60.4 CB :: 30.7 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) N Shift Assignments>> N :: 119.7 Ave N Shift Values>> N :: 120.61(3.9) NE :: 89.8(12.83) NH1 :: 74.78(11.38) NH2 :: 75.84(11.44) 1.Y129 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L130 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.44 R 0.29 L 0.17 K 0.05 G 0.02 C Shift Assignments>> C :: 178.5 CA :: 59.4 CB :: 42.3 CG :: 27.7 CD1 :: 27.5 CD2 :: 25.9 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) N Shift Assignments>> N :: 123.1 Ave N Shift Values>> N :: 121.98(4.07) 1.W131 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.58 W 0.37 H 0.04 C Shift Assignments>> C :: 178.9 CA :: 61.4 CB :: 29.5 CG :: 111.6 CD1 :: 129.0 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 119.5 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.Y132 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> Y 0.62 C 0.37 C Shift Assignments>> C :: 176.7 CA :: 62.4 CB :: 38.4 CG :: 129.1 CZ :: 158.3 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) N Shift Assignments>> N :: 119.6 Ave N Shift Values>> N :: 120.79(4.69) 1.I133 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.73 C 0.12 V 0.07 Y 0.03 F 0.02 C Shift Assignments>> C :: 178.5 CA :: 65.5 CB :: 37.3 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) N Shift Assignments>> N :: 119.8 Ave N Shift Values>> N :: 121.6(4.72) 1.C134 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.51 P 0.38 C 0.05 V 0.03 C Shift Assignments>> C :: 176.9 CA :: 65.8 CB :: 25.9 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) N Shift Assignments>> N :: 121.5 Ave N Shift Values>> N :: 119.95(4.79) 1.G135 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.34 C 0.22 G 0.22 A 0.11 N 0.04 D 0.01 C Shift Assignments>> C :: 176.1 CA :: 48.3 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 105.7 Ave N Shift Values>> N :: 109.91(4.29) 1.V136 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.91 C 0.08 C Shift Assignments>> C :: 177.6 CA :: 67.6 CB :: 31.3 CG1 :: 24.4 CG2 :: 22.1 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) N Shift Assignments>> N :: 123.6 Ave N Shift Values>> N :: 121.02(4.96) 1.C137 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.47 I 0.46 C 0.04 C Shift Assignments>> C :: 176.2 CA :: 65.8 CB :: 26.8 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) N Shift Assignments>> N :: 118.6 Ave N Shift Values>> N :: 119.95(4.79) 1.A138 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.57 A 0.33 I 0.04 C 0.03 C Shift Assignments>> C :: 177.9 CA :: 55.3 CB :: 18.1 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 119.1 Ave N Shift Values>> N :: 123.23(3.7) 1.F139 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> F 0.28 Y 0.24 I 0.18 C 0.18 K 0.03 L 0.03 D 0.01 C Shift Assignments>> C :: 176.7 CA :: 59.5 CB :: 40.1 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) N Shift Assignments>> N :: 119.8 Ave N Shift Values>> N :: 120.69(4.18) 1.L140 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I141 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.I142 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L143 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.W144 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.G145 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.75 C 0.18 L 0.04 C Shift Assignments>> C :: 175.6 CA :: 47.0 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 108.4 Ave N Shift Values>> N :: 109.91(4.29) 1.I146 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.73 C 0.23 V 0.02 C Shift Assignments>> C :: 178.4 CA :: 64.4 CB :: 35.6 CG1 :: 24.2 CG2 :: 16.9 CD1 :: 13.3 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) N Shift Assignments>> N :: 114.7 Ave N Shift Values>> N :: 121.6(4.72) 1.W147 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.66 H 0.19 W 0.13 C Shift Assignments>> C :: 175.5 CA :: 60.0 CB :: 30.0 CG :: 114.2 CD1 :: 127.1 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 120.8 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.N148 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> N 0.41 C 0.29 D 0.29 C Shift Assignments>> C :: 172.0 CA :: 55.1 CB :: 39.1 CG :: 176.7 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) N Shift Assignments>> N :: 116.9 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.P149 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L150 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R151 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.A152 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.K153 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T154 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R155 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.T156 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.99 C Shift Assignments>> C :: 174.9 CA :: 61.8 CB :: 69.3 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 104.7 Ave N Shift Values>> N :: 115.7(5.05) 1.Q157 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> D 0.12 L 0.11 M 0.09 H 0.08 C 0.07 Q 0.07 R 0.06 N 0.06 K 0.06 A 0.05 W 0.04 E 0.04 Y 0.03 F 0.03 S 0.01 C Shift Assignments>> C :: 173.3 CA :: 55.0 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) N Shift Assignments>> N :: 120.5 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.S158 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.98 T 0.01 C Shift Assignments>> C :: 174.8 CA :: 57.8 CB :: 65.3 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 113.0 Ave N Shift Values>> N :: 116.3(3.95) 1.S159 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 176.7 CA :: 61.8 CB :: 62.7 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 118.2 Ave N Shift Values>> N :: 116.3(3.95) 1.E160 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.18 W 0.16 C 0.15 E 0.11 R 0.08 K 0.07 H 0.07 Q 0.06 V 0.05 M 0.01 P 0.01 C Shift Assignments>> C :: 179.6 CA :: 60.3 CB :: 29.4 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) N Shift Assignments>> N :: 119.5 Ave N Shift Values>> N :: 120.68(3.68) 1.L161 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.38 L 0.3 K 0.28 A 0.01 C Shift Assignments>> C :: 178.9 CA :: 56.8 CB :: 41.0 CG :: 28.1 CD1 :: 22.8 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) N Shift Assignments>> N :: 124.9 Ave N Shift Values>> N :: 121.98(4.07) 1.A162 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> M 0.65 A 0.2 I 0.09 C 0.03 V 0.01 C Shift Assignments>> C :: 179.9 CA :: 56.2 CB :: 18.0 Ave C Shift Values>> C :: 177.8(2.18) CA :: 53.16(2.06) CB :: 18.9(1.85) N Shift Assignments>> N :: 123.1 Ave N Shift Values>> N :: 123.23(3.7) 1.N163 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.45 N 0.37 D 0.16 C Shift Assignments>> C :: 178.1 CA :: 55.9 CB :: 38.3 CG :: 176.2 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) N Shift Assignments>> N :: 115.7 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.L164 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.46 C 0.44 R 0.07 C Shift Assignments>> C :: 178.0 CA :: 58.3 CB :: 41.0 CG :: 27.5 CD1 :: 26.1 CD2 :: 22.8 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) N Shift Assignments>> N :: 123.5 Ave N Shift Values>> N :: 121.98(4.07) 1.Y165 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.67 C 0.13 F 0.1 Y 0.08 C Shift Assignments>> C :: 176.1 CA :: 63.7 CB :: 38.7 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) N Shift Assignments>> N :: 118.9 Ave N Shift Values>> N :: 120.79(4.69) 1.D166 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.55 D 0.38 E 0.04 N 0.01 C Shift Assignments>> C :: 179.4 CA :: 56.9 CB :: 39.8 CG :: 180.1 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) N Shift Assignments>> N :: 118.9 Ave N Shift Values>> N :: 120.73(4.2) 1.K167 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.2 V 0.2 W 0.11 K 0.1 R 0.07 M 0.07 E 0.06 H 0.04 Q 0.04 P 0.03 I 0.02 C Shift Assignments>> C :: 178.4 CA :: 60.0 CB :: 32.4 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) N Shift Assignments>> N :: 123.2 Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.L168 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.V169 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.77 C 0.22 C Shift Assignments>> C :: 178.8 CA :: 64.7 CB :: 30.1 CG1 :: 22.9 CG2 :: 19.1 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) N Shift Assignments>> N :: 119.8 Ave N Shift Values>> N :: 121.02(4.96) 1.T170 Overall: Anomalous Typing: Consistent SRO: Consistent C Shifts: Anomalous H Shifts: Indeterminable N Shifts: Consistent PRTL>> T 0.96 C 0.03 C Shift Assignments>> C :: 174.4 CA :: 69.5(A) CB :: 68.0 CG2 :: 21.7 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 125.1 Ave N Shift Values>> N :: 115.7(5.05) 1.Y171 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.22 T 0.19 P 0.18 I 0.16 S 0.12 C 0.02 F 0.02 Y 0.01 W 0.01 C Shift Assignments>> C :: 175.4 CA :: 62.8 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) N Shift Assignments>> N :: 123.1 Ave N Shift Values>> N :: 120.79(4.69) 1.F172 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> F 0.23 C 0.18 Y 0.15 I 0.15 K 0.12 R 0.09 L 0.03 C Shift Assignments>> C :: 176.8 CA :: 60.7 CB :: 41.9 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) N Shift Assignments>> N :: 118.1 Ave N Shift Values>> N :: 120.69(4.18) 1.T173 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.7 T 0.28 C Shift Assignments>> C :: 174.9 CA :: 69.1 CG2 :: 21.5 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 113.1 Ave N Shift Values>> N :: 115.7(5.05) 1.V174 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.96 C 0.03 C Shift Assignments>> C :: 175.8 CA :: 67.4 CB :: 31.8 CG1 :: 23.3 CG2 :: 22.0 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) N Shift Assignments>> N :: 117.8 Ave N Shift Values>> N :: 121.02(4.96) 1.L175 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.39 C 0.35 R 0.2 K 0.03 C Shift Assignments>> C :: 179.9 CA :: 57.5 CB :: 41.8 CG :: 27.8 CD1 :: 26.7 CD2 :: 23.5 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) N Shift Assignments>> N :: 112.8 Ave N Shift Values>> N :: 121.98(4.07) 1.W176 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.41 I 0.4 C 0.08 W 0.03 R 0.02 C Shift Assignments>> C :: 179.6 CA :: 62.6 CB :: 27.1 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 117.7 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.I177 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.9 C 0.08 C Shift Assignments>> C :: 175.7 CA :: 65.5 CB :: 38.2 CG2 :: 18.0 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) N Shift Assignments>> N :: 118.2 Ave N Shift Values>> N :: 121.6(4.72) 1.G178 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.59 C 0.25 P 0.05 A 0.03 L 0.02 N 0.01 C Shift Assignments>> C :: 174.8 CA :: 47.6 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 102.1 Ave N Shift Values>> N :: 109.91(4.29) 1.Y179 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.36 I 0.26 C 0.21 P 0.07 Y 0.03 E 0.02 F 0.01 C Shift Assignments>> C :: 175.2 CA :: 63.5 CB :: 35.4 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) N Shift Assignments>> N :: 115.7 Ave N Shift Values>> N :: 120.79(4.69) 1.P180 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.81 C 0.17 C Shift Assignments>> C :: 180.0 CA :: 65.1 CB :: 29.0 CG :: 27.7 CD :: 49.7 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) N Shift Assignments>> N :: 132.2 Ave N Shift Values>> N :: 127.4(10.05) 1.I181 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.93 C 0.06 C Shift Assignments>> C :: 175.4 CA :: 65.5 CB :: 37.6 CG1 :: 28.7 CG2 :: 17.0 CD1 :: 13.8 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) N Shift Assignments>> N :: 121.4 Ave N Shift Values>> N :: 121.6(4.72) 1.V182 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.85 C 0.14 C Shift Assignments>> C :: 177.3 CA :: 67.1 CB :: 30.7 CG1 :: 24.2 CG2 :: 23.2 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) N Shift Assignments>> N :: 118.8 Ave N Shift Values>> N :: 121.02(4.96) 1.W183 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.67 W 0.31 C Shift Assignments>> C :: 179.0 CA :: 62.8 CB :: 32.5 CG :: 112.2 CD1 :: 127.6 CD2 :: 129.1 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 116.5 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.I184 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.32 F 0.25 Y 0.22 C 0.17 C Shift Assignments>> C :: 175.0 CA :: 60.7 CB :: 39.6 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) N Shift Assignments>> N :: 113.1 Ave N Shift Values>> N :: 121.6(4.72) 1.I185 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.81 C 0.18 C Shift Assignments>> C :: 176.5 CA :: 63.0 CB :: 38.7 CG2 :: 18.0 CD1 :: 14.7 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) N Shift Assignments>> N :: 112.8 Ave N Shift Values>> N :: 121.6(4.72) 1.G186 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.74 L 0.1 C 0.08 R 0.04 C Shift Assignments>> C :: 173.8 CA :: 45.2 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 109.8 Ave N Shift Values>> N :: 109.91(4.29) 1.P187 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.89 C 0.1 C Shift Assignments>> C :: 176.9 CA :: 64.9 CB :: 33.1 CG :: 27.3 CD :: 49.8 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) N Shift Assignments>> N :: 133.4 Ave N Shift Values>> N :: 127.4(10.05) 1.S188 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 172.6 CA :: 61.8 CB :: 60.7 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 109.1 Ave N Shift Values>> N :: 116.3(3.95) 1.G189 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.32 L 0.24 R 0.23 C 0.1 F 0.02 D 0.02 Y 0.01 K 0.01 C Shift Assignments>> C :: 173.9 CA :: 44.2 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 109.0 Ave N Shift Values>> N :: 109.91(4.29) 1.F190 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> H 0.1 Q 0.1 M 0.09 K 0.09 R 0.08 C 0.08 L 0.07 E 0.07 W 0.06 Y 0.05 F 0.05 D 0.03 S 0.03 N 0.01 A 0.01 C Shift Assignments>> C :: 177.2 CA :: 56.5 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) N Shift Assignments>> N :: 125.3 Ave N Shift Values>> N :: 120.69(4.18) 1.G191 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.78 C 0.15 L 0.04 C Shift Assignments>> C :: 174.7 CA :: 46.7 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 105.6 Ave N Shift Values>> N :: 109.91(4.29) 1.W192 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> K 0.14 Q 0.14 W 0.13 E 0.13 H 0.12 C 0.11 R 0.09 I 0.04 M 0.02 L 0.02 C Shift Assignments>> C :: 177.1 CA :: 57.5 CB :: 29.0 Ave C Shift Values>> C :: 176.1(1.89) CA :: 57.71(2.65) CB :: 30.16(2.19) CG :: 110.37(1.55) CD1 :: 126.16(1.76) CD2 :: 127.4(1.33) CE2 :: 137.38(2.86) CE3 :: 120.38(1.5) CZ2 :: 114.19(1.09) CZ3 :: 121.57(1.76) CH2 :: 123.75(1.34) N Shift Assignments>> N :: 121.0 Ave N Shift Values>> N :: 121.87(4.58) NE1 :: 129.48(2.56) 1.I193 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.54 C 0.43 A 0.02 C Shift Assignments>> C :: 175.1 CA :: 58.6 CB :: 40.2 CG1 :: 27.2 CG2 :: 18.5 CD1 :: 13.2 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) N Shift Assignments>> N :: 106.5 Ave N Shift Values>> N :: 121.6(4.72) 1.N194 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> N 0.5 D 0.21 C 0.14 Y 0.04 F 0.03 L 0.03 C Shift Assignments>> C :: 175.7 CA :: 51.4 CB :: 39.3 Ave C Shift Values>> C :: 175.16(1.76) CA :: 53.43(1.94) CB :: 38.66(1.78) CG :: 176.61(1.33) N Shift Assignments>> N :: 118.5 Ave N Shift Values>> N :: 119.13(4.42) ND2 :: 112.83(2.6) 1.Q195 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.38 Q 0.32 E 0.29 C Shift Assignments>> C :: 176.8 CA :: 57.7 CB :: 29.3 CG :: 34.4 CD :: 180.7 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) N Shift Assignments>> N :: 116.2 Ave N Shift Values>> N :: 119.92(4.01) NE2 :: 111.81(2.2) 1.T196 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.63 T 0.26 I 0.07 C 0.01 C Shift Assignments>> C :: 175.9 CA :: 67.8 CG2 :: 23.3 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 117.7 Ave N Shift Values>> N :: 115.7(5.05) 1.I197 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.81 C 0.18 C Shift Assignments>> C :: 177.5 CA :: 63.6 CB :: 37.2 CG1 :: 27.4 CG2 :: 18.8 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) N Shift Assignments>> N :: 119.6 Ave N Shift Values>> N :: 121.6(4.72) 1.D198 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.5 C 0.44 D 0.05 C Shift Assignments>> C :: 177.0 CA :: 59.0 CB :: 44.0 CG :: 177.8 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) N Shift Assignments>> N :: 123.5 Ave N Shift Values>> N :: 120.73(4.2) 1.T199 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.63 T 0.22 I 0.11 C 0.01 C Shift Assignments>> C :: 175.8 CA :: 68.1 CG2 :: 23.6 Ave C Shift Values>> C :: 174.6(1.8) CA :: 62.15(2.72) CB :: 69.64(1.7) CG2 :: 21.44(1.39) N Shift Assignments>> N :: 116.6 Ave N Shift Values>> N :: 115.7(5.05) 1.F200 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.49 F 0.17 Y 0.15 C 0.15 C Shift Assignments>> C :: 178.4 CA :: 62.1 CB :: 39.1 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) N Shift Assignments>> N :: 120.3 Ave N Shift Values>> N :: 120.69(4.18) 1.L201 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.4 L 0.36 R 0.2 K 0.01 G 0.01 C Shift Assignments>> C :: 178.5 CA :: 58.4 CB :: 41.9 CG :: 27.4 CD1 :: 26.9 CD2 :: 22.6 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) N Shift Assignments>> N :: 120.4 Ave N Shift Values>> N :: 121.98(4.07) 1.F202 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.86 F 0.1 H 0.02 C Shift Assignments>> C :: 174.6 CA :: 60.9 CB :: 35.8 CG :: 140.4 CE1 :: 131.1 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) N Shift Assignments>> N :: 115.3 Ave N Shift Values>> N :: 120.69(4.18) 1.C203 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.44 P 0.2 C 0.11 W 0.07 V 0.06 E 0.02 R 0.02 K 0.01 H 0.01 Q 0.01 C Shift Assignments>> C :: 175.3 CA :: 62.7 CB :: 28.7 Ave C Shift Values>> C :: 174.78(1.99) CA :: 57.43(3.41) CB :: 34.15(6.77) N Shift Assignments>> N :: 117.7 Ave N Shift Values>> N :: 119.95(4.79) 1.L204 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.35 C 0.32 G 0.2 R 0.11 C Shift Assignments>> C :: 178.4 CA :: 59.1 CB :: 43.9 CG :: 27.0 CD1 :: 25.9 CD2 :: 25.1 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) N Shift Assignments>> N :: 121.6 Ave N Shift Values>> N :: 121.98(4.07) 1.L205 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.86 L 0.09 V 0.04 C Shift Assignments>> C :: 180.0 CA :: 60.0 CB :: 38.2 CG :: 27.6 CD1 :: 24.0 CD2 :: 22.5 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) N Shift Assignments>> N :: 115.0 Ave N Shift Values>> N :: 121.98(4.07) 1.P206 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.67 P 0.32 C Shift Assignments>> C :: 177.4 CA :: 66.6 CB :: 29.5 CG :: 28.6 CD :: 51.2 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) N Shift Assignments>> N :: 139.3 Ave N Shift Values>> N :: 127.4(10.05) 1.F207 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Consistent N Shift Assignments>> N :: 121.6 Ave N Shift Values>> N :: 120.69(4.18) 1.F208 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S209 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> S 0.99 C Shift Assignments>> C :: 171.3 CA :: 60.7 CB :: 63.5 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 115.5 Ave N Shift Values>> N :: 116.3(3.95) 1.K210 Overall: Mistyped Typing: Mistyped SRO: Consistent C Shifts: Suspicious H Shifts: Indeterminable N Shifts: Anomalous PRTL>> C 0.99 C Shift Assignments>> C :: 173.0 CA :: 57.3 CB :: 33.3 CG :: 29.4(S) CD :: 30.3 CE :: 55.7(S) Ave C Shift Values>> C :: 176.46(2.05) CA :: 56.84(2.25) CB :: 32.83(1.88) CG :: 24.91(1.31) CD :: 28.78(1.39) CE :: 41.78(0.98) N Shift Assignments>> N :: 117.5 NZ :: 177.2(A) Ave N Shift Values>> N :: 121.16(4.11) NZ :: 71.86(52.41) 1.V211 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.89 C 0.1 C Shift Assignments>> C :: 177.8 CA :: 65.6 CB :: 31.7 CG1 :: 23.6 CG2 :: 22.1 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) N Shift Assignments>> N :: 116.9 Ave N Shift Values>> N :: 121.02(4.96) 1.G212 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> P 0.34 C 0.22 G 0.22 A 0.11 N 0.04 D 0.01 C Shift Assignments>> C :: 173.3 CA :: 48.3 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 101.7 Ave N Shift Values>> N :: 109.91(4.29) 1.F213 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.41 F 0.22 Y 0.16 C 0.16 K 0.01 C Shift Assignments>> C :: 175.6 CA :: 62.1 CB :: 40.5 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) N Shift Assignments>> N :: 119.9 Ave N Shift Values>> N :: 120.69(4.18) 1.S214 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> V 0.25 P 0.22 T 0.22 I 0.18 C 0.03 F 0.02 Y 0.01 W 0.01 S 0.01 C Shift Assignments>> C :: 175.2 CA :: 62.9 Ave C Shift Values>> C :: 174.53(1.73) CA :: 58.57(2.12) CB :: 63.8(1.57) N Shift Assignments>> N :: 116.4 Ave N Shift Values>> N :: 116.3(3.95) 1.F215 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L216 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> L 0.53 C 0.32 K 0.09 G 0.03 C Shift Assignments>> C :: 179.9 CA :: 57.8 CB :: 42.5 CG :: 26.1 CD2 :: 22.9 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) N Shift Assignments>> N :: 119.1 Ave N Shift Values>> N :: 121.98(4.07) 1.D217 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.68 D 0.24 G 0.03 N 0.03 C Shift Assignments>> C :: 177.1 CA :: 57.9 CB :: 42.2 CG :: 176.1 Ave C Shift Values>> C :: 176.41(1.77) CA :: 54.52(2.1) CB :: 40.7(1.67) CG :: 178.41(1.84) N Shift Assignments>> N :: 121.0 Ave N Shift Values>> N :: 120.73(4.2) 1.L218 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> C 0.46 L 0.44 K 0.03 A 0.02 G 0.01 I 0.01 C Shift Assignments>> C :: 180.8 CA :: 58.0 CB :: 42.0 CG :: 26.1 CD2 :: 21.6 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) N Shift Assignments>> N :: 114.8 Ave N Shift Values>> N :: 121.98(4.07) 1.H219 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> I 0.23 T 0.19 V 0.17 F 0.06 P 0.06 C 0.06 Y 0.04 S 0.04 W 0.04 E 0.01 R 0.01 K 0.01 C Shift Assignments>> C :: 178.4 CA :: 61.4 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) N Shift Assignments>> N :: 114.1 Ave N Shift Values>> N :: 119.44(4.52) ND1 :: 190.74(22.84) NE2 :: 179.81(13.86) 1.G220 Overall: Consistent Typing: Consistent SRO: Consistent C Shifts: Consistent H Shifts: Indeterminable N Shifts: Consistent PRTL>> G 0.63 C 0.24 P 0.03 A 0.03 L 0.02 N 0.01 C Shift Assignments>> C :: 176.6 CA :: 47.5 Ave C Shift Values>> C :: 174.04(1.94) CA :: 45.33(1.42) N Shift Assignments>> N :: 109.5 Ave N Shift Values>> N :: 109.91(4.29) 1.L221 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R222 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N223 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.L224 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.N225 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.D226 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.S227 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.R228 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.Q229 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H230 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H231 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H232 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H233 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H234 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 1.H235 Overall: Consistent Typing: Indeterminable SRO: Consistent C Shifts: Indeterminable H Shifts: Indeterminable N Shifts: Indeterminable 2.RET1 Overall Status: Residue type RET not supported. ########################################################################### Overall Results: #Consistent: 227 #Clerical: 0 #Suspicious: 0 #Anomalous: 6 #Mistyped: 2 #Indeterminable: 0 Typing Results: #Consistent: 166 #Suspicious: 0 #Mistyped: 2 #Indeterminable: 67 Shift Relative Order (SRO) Results: #Consistent: 235 #Suspicious: 0 C Shift Results: #Consistent: 660 #Duplicate: 0 #Unknown: 0 #Suspicious: 3 #Anomalous: 5 H Shift Results: #Consistent: 0 #Duplicate: 0 #Unknown: 0 #Suspicious: 0 #Anomalous: 0 N Shift Results: #Consistent: 174 #Duplicate: 0 #Unknown: 0 #Suspicious: 1 #Anomalous: 2 Error Summary: 1.W46 CE2 = 139.7(A), Expected = 137.38, Std = 2.8600, ChiSquare = 4.1726e-01 1.D57 CG = 182.0(A), Expected = 178.41, Std = 1.8400, ChiSquare = 5.1047e-02 1.R72 NH2 = 69.7(A), Expected = 75.84, Std = 11.4400, ChiSquare = 5.9147e-01 1.W89 CG = 115.6(A), Expected = 110.37, Std = 1.5500, ChiSquare = 7.4032e-04 1.T90 CA = 69.2(A), Expected = 62.15, Std = 2.7200, ChiSquare = 9.5444e-03 1.Q109 Typing: Mistyped 1.Q109 CD = 175.0(S), Expected = 179.68, Std = 1.1700, ChiSquare = 6.3342e-05 1.Q109 NE2 = 98.3(S), Expected = 111.81, Std = 2.2000, ChiSquare = 8.2051e-10 1.T170 CA = 69.5(A), Expected = 62.15, Std = 2.7200, ChiSquare = 6.8881e-03 1.K210 Typing: Mistyped 1.K210 CG = 29.4(S), Expected = 24.91, Std = 1.3100, ChiSquare = 6.0921e-04 1.K210 CE = 55.7(S), Expected = 41.78, Std = 0.9800, ChiSquare = 8.6428e-46 1.K210 NZ = 177.2(A), Expected = 71.86, Std = 52.4100, ChiSquare = 4.4440e-02