#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kfo n ILE 947 N 0.00 0.27 -1.50 3.15 2.08 -1.26 -4.90 119.36 117.20 3kfo n ILE 947 Ca 0.00 -0.07 -0.11 0.00 0.56 0.00 0.00 62.75 63.13 3kfo n ILE 947 Cb 0.00 -1.30 0.17 0.00 -0.75 0.00 0.00 39.64 37.76 3kfo n ILE 947 CO 0.00 0.00 0.00 1.67 0.56 0.00 0.00 176.55 178.78 3kfo n GLN 948 N 2.78 2.15 -4.03 0.38 7.27 -1.26 -4.89 117.38 119.78 3kfo n GLN 948 Ca 0.16 -3.31 -0.10 0.00 0.07 0.00 0.00 57.00 53.83 3kfo n GLN 948 Cb 0.27 -1.95 -0.08 0.00 2.41 0.00 0.00 30.24 30.89 3kfo n GLN 948 CO 0.00 0.00 0.00 1.52 0.07 0.00 0.00 177.06 178.65 3kfo s TYR 949 N -3.36 0.56 0.12 3.69 -0.85 -1.26 -0.54 117.35 115.72 3kfo s TYR 949 Ca 0.48 -0.91 -0.03 0.00 -0.52 0.00 0.00 57.07 56.09 3kfo s TYR 949 Cb 0.42 -0.15 0.01 0.00 0.38 0.00 0.00 41.96 42.63 3kfo s TYR 949 CO 0.01 -0.72 0.21 0.27 -1.52 0.00 0.00 175.55 173.81 3kfo n ASN 950 N -0.23 -0.62 -0.28 -0.18 0.23 -1.26 -5.00 115.26 107.92 3kfo n ASN 950 Ca -0.05 -1.52 0.00 0.00 -0.53 0.00 0.00 54.58 52.48 3kfo n ASN 950 Cb 0.63 1.06 0.20 0.00 -2.08 0.00 0.00 39.78 39.59 3kfo n ASN 950 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3kfo h LEU 951 N 0.00 0.96 -0.17 -4.53 3.38 -2.03 -1.38 115.31 111.55 3kfo h LEU 951 Ca -0.10 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.89 3kfo h LEU 951 Cb 0.38 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 3kfo h LEU 951 CO 0.13 0.69 -0.11 0.44 0.09 0.00 0.00 178.44 179.67 3kfo h ASP 952 N 1.13 -0.36 0.19 -0.43 5.19 -1.99 -1.56 116.42 118.59 3kfo h ASP 952 Ca 0.32 0.08 -0.15 0.00 -0.62 0.00 0.00 57.03 56.66 3kfo h ASP 952 Cb -0.08 0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.61 3kfo h ASP 952 CO -0.08 -0.15 -0.55 0.71 -3.12 0.00 0.00 179.24 176.05 3kfo h THR 953 N -0.11 1.35 -0.80 0.35 1.35 -1.84 -2.07 112.91 111.13 3kfo h THR 953 Ca 0.10 -1.84 -0.01 0.00 -0.55 0.00 0.00 66.41 64.11 3kfo h THR 953 Cb 0.26 1.86 -0.04 0.00 -1.73 0.00 0.00 68.15 68.50 3kfo h THR 953 CO -0.24 0.56 0.46 0.40 -0.25 0.00 0.00 175.52 176.45 3kfo h ILE 954 N 0.29 1.23 -0.34 6.82 2.04 -1.17 0.15 117.51 126.53 3kfo h ILE 954 Ca 0.00 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.32 3kfo h ILE 954 Cb 1.06 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3kfo h ILE 954 CO 0.09 0.25 0.18 -0.78 0.00 0.00 0.00 178.15 177.89 3kfo h ASP 955 N 1.10 0.43 -0.47 1.72 3.58 -1.03 -1.46 116.42 120.28 3kfo h ASP 955 Ca 0.28 -0.10 -0.03 0.00 0.42 0.00 0.00 57.03 57.60 3kfo h ASP 955 Cb -0.01 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 3kfo h ASP 955 CO -0.05 0.41 0.21 0.00 -2.88 0.00 0.00 179.24 176.93 3kfo h ALA 956 N 1.04 1.40 -0.27 -0.78 0.00 -1.07 -1.50 119.26 118.07 3kfo h ALA 956 Ca 0.12 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3kfo h ALA 956 Cb 0.08 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3kfo h ALA 956 CO -0.02 0.46 -0.14 1.49 0.00 0.00 0.00 179.25 181.04 3kfo h GLU 957 N 0.74 0.57 -0.56 0.00 4.81 -0.74 -2.26 114.58 117.14 3kfo h GLU 957 Ca 0.18 -0.26 0.01 0.00 -0.13 0.00 0.00 59.36 59.17 3kfo h GLU 957 Cb 0.14 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 3kfo h GLU 957 CO -0.02 0.83 0.36 0.87 -0.73 0.00 0.00 179.01 180.31 3kfo h LYS 958 N 0.31 0.70 -0.10 1.92 1.57 -1.04 -0.06 116.57 119.87 3kfo h LYS 958 Ca 0.06 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3kfo h LYS 958 Cb 0.66 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 3kfo h LYS 958 CO 0.04 0.46 0.05 -0.91 -0.57 0.00 0.00 179.45 178.53 3kfo h ASN 959 N 0.72 0.13 0.22 0.86 2.35 -1.18 -1.11 115.58 117.58 3kfo h ASN 959 Ca 0.21 -0.10 -0.14 0.00 -0.55 0.00 0.00 56.30 55.72 3kfo h ASN 959 Cb -0.04 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 3kfo h ASN 959 CO -0.07 0.20 -0.53 -0.29 -1.65 0.00 0.00 177.43 175.10 3kfo h ILE 960 N 0.06 1.35 -0.49 2.81 6.09 -1.26 -1.64 117.51 124.42 3kfo h ILE 960 Ca 0.04 -1.79 -0.03 0.00 -1.37 0.00 0.00 64.86 61.71 3kfo h ILE 960 Cb 0.10 1.83 -0.02 0.00 0.47 0.00 0.00 36.82 39.20 3kfo h ILE 960 CO -0.01 0.54 0.21 -1.28 -3.07 0.00 0.00 178.15 174.54 3kfo h SER 961 N 0.26 0.67 -0.61 2.19 0.87 -0.94 0.12 113.55 116.11 3kfo h SER 961 Ca 0.01 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 60.35 3kfo h SER 961 Cb 1.01 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 62.77 3kfo h SER 961 CO 0.09 0.65 0.18 0.78 -0.53 0.00 0.00 176.83 177.99 3kfo h ASN 962 N 0.65 0.91 -0.55 6.23 2.35 -0.97 -1.78 115.58 122.42 3kfo h ASN 962 Ca 0.17 -0.22 -0.11 0.00 -0.55 0.00 0.00 56.30 55.58 3kfo h ASN 962 Cb 0.18 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 3kfo h ASN 962 CO -0.02 0.89 -0.10 0.11 -1.65 0.00 0.00 177.43 176.66 3kfo h LYS 963 N 0.88 1.05 -0.40 0.81 1.57 -1.07 -2.20 116.57 117.21 3kfo h LYS 963 Ca 0.20 -0.39 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 3kfo h LYS 963 Cb 0.31 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 3kfo h LYS 963 CO -0.00 1.08 0.16 -0.07 -0.57 0.00 0.00 179.45 180.05 3kfo h LEU 964 N 0.93 0.56 -2.31 2.94 3.38 -0.62 0.23 115.31 120.42 3kfo h LEU 964 Ca 0.14 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3kfo h LEU 964 Cb 0.68 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 3kfo h LEU 964 CO 0.05 0.57 -0.04 0.11 0.09 0.00 0.00 178.44 179.22 3kfo h LYS 965 N 0.51 0.00 -0.02 1.13 1.57 -1.14 -1.62 116.57 117.00 3kfo h LYS 965 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3kfo h LYS 965 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3kfo h LYS 965 CO -0.01 0.04 -0.16 1.63 -0.57 0.00 0.00 179.45 180.38 3kfo n LYS 966 N -3.76 1.69 -2.28 3.15 5.02 -0.84 -4.94 118.16 116.20 3kfo n LYS 966 Ca -0.03 -1.28 -0.16 0.00 -2.02 0.00 0.00 58.31 54.82 3kfo n LYS 966 Cb 0.13 -1.47 -0.01 0.00 -0.02 0.00 0.00 35.03 33.66 3kfo n LYS 966 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kfo n GLY 967 N 1.33 -0.23 0.08 0.72 0.00 -0.53 -4.91 105.19 101.64 3kfo n GLY 967 Ca 0.14 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 46.07 3kfo n GLY 967 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kfo h GLU 968 N 0.00 0.00 -5.29 1.61 5.08 -0.83 -3.46 114.58 111.69 3kfo h GLU 968 Ca -0.38 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.60 3kfo h GLU 968 Cb 1.28 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.38 3kfo h GLU 968 CO 0.45 0.00 -0.72 0.14 -1.00 0.00 0.00 179.01 177.88 3kfo s VAL 969 N -3.17 1.42 0.05 3.13 -7.23 -1.24 -5.02 120.40 108.36 3kfo s VAL 969 Ca 0.07 -2.13 -0.17 0.00 -1.81 0.00 0.00 61.98 57.94 3kfo s VAL 969 Cb 0.13 -1.94 0.03 0.00 0.56 0.00 0.00 36.38 35.16 3kfo s VAL 969 CO 0.70 -0.68 0.38 0.00 -0.31 0.00 0.00 175.10 175.19 3kfo s GLN 970 N -3.70 0.91 0.35 4.82 -2.07 -1.26 -4.77 119.66 113.94 3kfo s GLN 970 Ca 0.19 -0.45 -0.29 0.00 -1.82 0.00 0.00 55.36 52.99 3kfo s GLN 970 Cb 0.01 0.40 -0.11 0.00 -1.09 0.00 0.00 33.01 32.22 3kfo s GLN 970 CO 0.03 -0.31 1.48 -1.50 -1.32 0.00 0.00 175.29 173.67 3kfo s ILE 971 N -2.69 2.15 0.28 3.63 2.07 -1.26 -1.78 121.20 123.60 3kfo s ILE 971 Ca -0.04 0.14 -0.29 0.00 -1.41 0.00 0.00 60.65 59.05 3kfo s ILE 971 Cb -0.00 -3.09 -0.10 0.00 0.13 0.00 0.00 42.46 39.40 3kfo s ILE 971 CO -0.04 0.03 1.32 0.00 -1.91 0.00 0.00 174.94 174.34 3kfo h LYS 973 N 4.19 0.11 -1.01 0.00 1.79 -1.96 0.02 116.57 119.71 3kfo h LYS 973 Ca -0.47 -0.01 0.24 0.00 -2.18 0.00 0.00 60.65 58.23 3kfo h LYS 973 Cb 1.22 -0.03 -0.11 0.00 -1.58 0.00 0.00 32.23 31.74 3kfo h LYS 973 CO 0.71 0.07 0.62 -0.09 -1.08 0.00 0.00 179.45 179.68 3kfo h ARG 974 N 0.11 0.54 -0.33 3.15 2.43 -2.01 -3.10 114.38 115.17 3kfo h ARG 974 Ca 0.77 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.90 3kfo h ARG 974 Cb 2.52 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 31.95 3kfo h ARG 974 CO -0.29 0.36 0.00 1.19 -1.51 0.00 0.00 179.97 179.72 3kfo n PHE 975 N -4.78 1.15 0.19 2.20 3.72 -0.01 -4.69 117.46 115.25 3kfo n PHE 975 Ca 0.26 -0.83 0.07 0.00 -0.05 0.00 0.00 57.45 56.90 3kfo n PHE 975 Cb 0.75 -0.34 0.33 0.00 -0.94 0.00 0.00 39.48 39.29 3kfo n PHE 975 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3kfo h LYS 976 N 2.28 0.00 -5.28 -1.08 6.56 -1.61 -3.24 116.57 114.20 3kfo h LYS 976 Ca 0.00 0.00 -0.53 0.00 -1.06 0.00 0.00 60.65 59.06 3kfo h LYS 976 Cb 1.52 0.00 -0.14 0.00 -0.57 0.00 0.00 32.23 33.05 3kfo h LYS 976 CO 0.27 0.33 -0.59 -0.80 -2.06 0.00 0.00 179.45 176.60 3kfo s ASN 977 N -6.35 2.82 0.00 0.86 0.02 -1.26 -4.81 114.94 106.22 3kfo s ASN 977 Ca 0.01 -1.43 0.00 0.00 -1.02 0.00 0.00 52.86 50.41 3kfo s ASN 977 Cb 0.10 -0.02 0.00 0.00 0.02 0.00 0.00 41.25 41.35 3kfo s ASN 977 CO 0.68 -0.64 0.00 0.61 0.02 0.00 0.00 177.10 177.77 3kfo n GLY 978 N -0.81 -1.75 0.20 0.66 0.00 -1.26 -3.23 105.19 99.00 3kfo n GLY 978 Ca -0.04 -1.55 -0.03 0.00 0.00 0.00 0.00 46.02 44.40 3kfo n GLY 978 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3kfo h SER 979 N 0.00 0.29 0.09 1.61 0.02 -1.97 -2.67 113.55 110.92 3kfo h SER 979 Ca 0.00 -0.12 -0.09 0.00 -0.84 0.00 0.00 61.79 60.74 3kfo h SER 979 Cb 0.00 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 3kfo h SER 979 CO 0.00 0.68 -0.28 -0.29 -1.14 0.00 0.00 176.83 175.80 3kfo h ILE 980 N 0.23 1.26 -0.69 3.27 6.09 -1.90 -1.93 117.51 123.83 3kfo h ILE 980 Ca 0.02 -1.23 -0.02 0.00 -1.37 0.00 0.00 64.86 62.26 3kfo h ILE 980 Cb 0.84 1.45 -0.03 0.00 0.47 0.00 0.00 36.82 39.54 3kfo h ILE 980 CO 0.07 0.38 0.36 -0.09 -3.07 0.00 0.00 178.15 175.79 3kfo h ARG 981 N 0.27 0.97 -0.25 2.19 9.65 -1.45 -2.30 114.38 123.46 3kfo h ARG 981 Ca 0.04 -0.11 -0.13 0.00 -1.10 0.00 0.00 59.98 58.68 3kfo h ARG 981 Cb 0.64 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 29.02 3kfo h ARG 981 CO 0.05 0.73 -0.38 1.49 2.80 0.00 0.00 179.97 184.65 3kfo h GLU 982 N 0.97 0.57 -0.07 0.20 4.57 -1.18 0.33 114.58 119.97 3kfo h GLU 982 Ca 0.24 -0.28 0.03 0.00 -1.18 0.00 0.00 59.36 58.18 3kfo h GLU 982 Cb 0.06 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 3kfo h GLU 982 CO -0.04 0.86 -0.16 0.28 -1.18 0.00 0.00 179.01 178.78 3kfo h VAL 983 N 0.47 0.60 -0.37 0.32 2.07 -1.05 -0.82 116.25 117.47 3kfo h VAL 983 Ca 0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.63 3kfo h VAL 983 Cb 0.88 0.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.19 3kfo h VAL 983 CO 0.08 0.00 -0.03 0.15 0.02 0.00 0.00 177.57 177.79 3kfo h PHE 984 N -0.22 -0.08 -0.80 1.57 3.57 -1.02 -0.32 116.94 119.63 3kfo h PHE 984 Ca 0.07 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 3kfo h PHE 984 Cb 0.33 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.12 3kfo h PHE 984 CO -0.24 -0.10 0.49 -0.91 -2.23 0.00 0.00 178.31 175.32 3kfo h ASN 985 N 0.06 0.96 -0.52 0.41 2.35 -0.54 -0.04 115.58 118.27 3kfo h ASN 985 Ca 0.18 -0.06 -0.10 0.00 -0.55 0.00 0.00 56.30 55.78 3kfo h ASN 985 Cb 0.26 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3kfo h ASN 985 CO -0.33 0.73 -0.05 0.40 -1.65 0.00 0.00 177.43 176.53 3kfo h ILE 986 N 1.10 1.27 -0.39 2.81 1.08 -0.64 -2.63 117.51 120.10 3kfo h ILE 986 Ca 0.29 -1.17 -0.13 0.00 -0.39 0.00 0.00 64.86 63.46 3kfo h ILE 986 Cb -0.06 0.98 -0.01 0.00 -3.07 0.00 0.00 36.82 34.66 3kfo h ILE 986 CO -0.06 0.41 -0.27 -0.07 -0.69 0.00 0.00 178.15 177.47 3kfo h LEU 987 N 0.81 0.86 -1.22 1.44 3.38 -0.45 -0.66 115.31 119.47 3kfo h LEU 987 Ca 0.14 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3kfo h LEU 987 Cb 0.59 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3kfo h LEU 987 CO 0.04 1.08 0.36 0.58 0.09 0.00 0.00 178.44 180.59 3kfo h VAL 988 N 0.71 1.20 -0.30 1.22 2.07 -0.91 -0.25 116.25 119.98 3kfo h VAL 988 Ca 0.09 -0.49 -0.14 0.00 0.82 0.00 0.00 66.70 66.98 3kfo h VAL 988 Cb 0.81 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 3kfo h VAL 988 CO 0.07 0.22 -0.38 -0.33 0.02 0.00 0.00 177.57 177.17 3kfo h GLU 989 N 0.91 0.70 -0.85 1.57 4.39 -1.04 -2.29 114.58 117.96 3kfo h GLU 989 Ca 0.23 -0.35 0.02 0.00 0.34 0.00 0.00 59.36 59.60 3kfo h GLU 989 Cb 0.02 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.63 3kfo h GLU 989 CO -0.04 0.96 0.56 0.93 -1.16 0.00 0.00 179.01 180.26 3kfo h GLU 990 N 0.58 1.08 -0.55 2.33 5.08 -0.58 -1.31 114.58 121.22 3kfo h GLU 990 Ca 0.05 -0.07 0.10 0.00 -1.00 0.00 0.00 59.36 58.45 3kfo h GLU 990 Cb 0.91 -0.24 -0.08 0.00 0.50 0.00 0.00 28.75 29.84 3kfo h GLU 990 CO 0.08 0.72 0.08 -0.07 -1.00 0.00 0.00 179.01 178.82 3kfo h LEU 991 N 1.11 -0.06 -0.55 1.33 3.38 -0.85 -2.36 115.31 117.32 3kfo h LEU 991 Ca 0.33 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.37 3kfo h LEU 991 Cb -0.07 0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3kfo h LEU 991 CO -0.09 -0.01 -0.16 0.11 0.09 0.00 0.00 178.44 178.38 3kfo h LYS 992 N 0.21 0.00 -7.40 1.13 1.57 -1.05 -3.45 116.57 107.58 3kfo h LYS 992 Ca 0.28 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.57 3kfo h LYS 992 Cb 0.41 0.00 0.12 0.00 0.08 0.00 0.00 32.23 32.84 3kfo h LYS 992 CO -0.39 0.16 0.32 -1.54 -0.57 0.00 0.00 179.45 177.43 3kfo s SER 993 N -6.16 4.26 0.42 0.86 1.04 -0.52 -4.95 113.70 108.65 3kfo s SER 993 Ca 0.04 1.34 0.29 0.00 0.48 0.00 0.00 55.95 58.09 3kfo s SER 993 Cb 0.08 -2.06 1.10 0.00 0.10 0.00 0.00 66.02 65.24 3kfo s SER 993 CO 0.65 -2.12 1.84 0.71 0.98 0.00 0.00 173.24 175.31 3kfo h THR 994 N -1.19 0.00 -3.36 2.02 1.35 -1.88 -3.44 112.91 106.41 3kfo h THR 994 Ca -0.48 -0.47 -0.53 0.00 -0.55 0.00 0.00 66.41 64.39 3kfo h THR 994 Cb 1.27 1.38 -0.00 0.00 -1.73 0.00 0.00 68.15 69.08 3kfo h THR 994 CO 0.58 0.00 0.50 -0.89 -0.25 0.00 0.00 175.52 175.46 3kfo s THR 995 N -3.47 4.13 0.44 6.82 2.01 -1.26 -5.01 115.64 119.30 3kfo s THR 995 Ca 0.03 1.62 -0.24 0.00 0.31 0.00 0.00 61.69 63.41 3kfo s THR 995 Cb 0.09 -4.04 -0.08 0.00 0.01 0.00 0.00 72.50 68.48 3kfo s THR 995 CO 0.51 0.18 1.26 0.68 -0.69 0.00 0.00 174.62 176.56 3kfo s VAL 996 N 0.61 2.73 -0.06 3.82 -7.23 -1.26 -4.84 120.40 114.17 3kfo s VAL 996 Ca 0.54 0.60 -0.22 0.00 -1.81 0.00 0.00 61.98 61.09 3kfo s VAL 996 Cb -0.28 -3.33 -0.04 0.00 0.56 0.00 0.00 36.38 33.29 3kfo s VAL 996 CO 0.31 0.05 0.66 -0.69 -0.31 0.00 0.00 175.10 175.11 3kfo s VAL 997 N -1.36 5.03 0.56 1.32 1.01 -1.26 -5.04 120.40 120.66 3kfo s VAL 997 Ca 0.61 1.36 -0.20 0.00 0.00 0.00 0.00 61.98 63.75 3kfo s VAL 997 Cb -0.35 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 3kfo s VAL 997 CO 0.44 0.30 1.21 0.20 0.00 0.00 0.00 175.10 177.24 3kfo s ASN 998 N 0.56 5.41 0.32 3.32 0.01 -1.26 -4.78 114.94 118.52 3kfo s ASN 998 Ca 0.35 2.39 0.05 0.00 -0.71 0.00 0.00 52.86 54.93 3kfo s ASN 998 Cb -0.18 -2.60 0.67 0.00 0.41 0.00 0.00 41.25 39.55 3kfo s ASN 998 CO 0.17 -1.44 1.87 0.25 -1.51 0.00 0.00 177.10 176.44 3kfo h LEU 999 N 1.15 0.80 -0.86 0.60 5.85 -1.22 -0.90 115.31 120.74 3kfo h LEU 999 Ca -0.50 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.21 3kfo h LEU 999 Cb 1.29 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 3kfo h LEU 999 CO 0.56 0.43 0.29 0.77 -0.34 0.00 0.00 178.44 180.16 3kfo h SER 1000N 0.86 1.04 -0.09 1.25 4.64 -1.92 -0.18 113.55 119.16 3kfo h SER 1000Ca 0.45 -0.16 -0.20 0.00 -0.47 0.00 0.00 61.79 61.40 3kfo h SER 1000Cb 0.53 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3kfo h SER 1000CO -0.22 0.93 -0.70 0.44 -0.87 0.00 0.00 176.83 176.41 3kfo h ASP 1001N 1.10 0.84 -0.43 4.97 3.32 -1.77 -2.06 116.42 122.39 3kfo h ASP 1001Ca 0.25 -0.52 -0.05 0.00 0.02 0.00 0.00 57.03 56.73 3kfo h ASP 1001Cb 0.23 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 3kfo h ASP 1001CO -0.02 1.30 0.08 0.25 -1.72 0.00 0.00 179.24 179.13 3kfo h LEU 1002N 0.51 0.67 -0.65 1.55 5.85 -0.90 -1.95 115.31 120.39 3kfo h LEU 1002Ca -0.03 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 3kfo h LEU 1002Cb 1.31 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 3kfo h LEU 1002CO 0.14 0.75 0.40 0.58 -0.34 0.00 0.00 178.44 179.97 3kfo h VAL 1003N 0.56 1.19 -0.74 1.05 2.07 -0.99 -1.23 116.25 118.16 3kfo h VAL 1003Ca 0.13 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 3kfo h VAL 1003Cb 0.36 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 3kfo h VAL 1003CO 0.01 0.19 0.26 -0.08 0.02 0.00 0.00 177.57 177.97 3kfo h GLU 1004N 0.89 1.12 -0.03 1.57 4.81 -1.12 -1.43 114.58 120.39 3kfo h GLU 1004Ca 0.23 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3kfo h GLU 1004Cb -0.04 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.17 3kfo h GLU 1004CO -0.05 0.93 0.01 1.25 -0.73 0.00 0.00 179.01 180.42 3kfo h LEU 1005N 1.08 0.05 -1.04 1.64 5.85 -1.09 -2.73 115.31 119.06 3kfo h LEU 1005Ca 0.24 -0.23 0.14 0.00 0.84 0.00 0.00 57.88 58.87 3kfo h LEU 1005Cb 0.26 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.18 3kfo h LEU 1005CO -0.01 0.27 0.62 1.88 -0.34 0.00 0.00 178.44 180.86 3kfo h TYR 1006N -0.17 1.09 0.00 1.25 -1.99 -1.06 -3.31 116.97 112.78 3kfo h TYR 1006Ca 0.01 0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 3kfo h TYR 1006Cb 0.24 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 38.61 3kfo h TYR 1006CO 0.01 0.38 0.03 -1.13 -0.00 0.00 0.00 178.16 177.45 3kfo n SER 1007N -4.64 2.57 -0.78 3.88 3.41 -0.55 -4.48 113.62 113.02 3kfo n SER 1007Ca 0.20 -1.83 0.07 0.00 -0.26 0.00 0.00 58.87 57.05 3kfo n SER 1007Cb 0.42 -0.62 -0.02 0.00 -0.26 0.00 0.00 64.21 63.73 3kfo n SER 1007CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kfo n LEU 1009N 2.27 -0.33 -0.07 1.04 4.77 -1.25 -4.89 117.00 118.55 3kfo n LEU 1009Ca 0.11 0.74 0.08 0.00 -0.03 0.00 0.00 56.01 56.90 3kfo n LEU 1009Cb 0.35 -2.54 0.11 0.00 -2.33 0.00 0.00 43.42 39.02 3kfo n LEU 1009CO 0.10 -1.30 0.56 -0.90 -1.33 0.00 0.00 177.39 174.52 3kfo n ASP 1010N -4.23 2.31 -4.40 -1.43 5.75 -0.73 -4.40 116.55 109.41 3kfo n ASP 1010Ca -0.01 -2.88 -0.25 0.00 -0.01 0.00 0.00 54.79 51.65 3kfo n ASP 1010Cb 0.57 -0.35 -0.11 0.00 -1.03 0.00 0.00 41.12 40.20 3kfo n ASP 1010CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 3kfo s ASP 1011N -2.50 3.22 0.20 -1.12 -4.77 -1.26 -5.01 116.67 105.43 3kfo s ASP 1011Ca 0.26 -0.90 -0.10 0.00 -3.30 0.00 0.00 52.55 48.50 3kfo s ASP 1011Cb 0.23 -0.23 0.19 0.00 -1.09 0.00 0.00 42.92 42.02 3kfo s ASP 1011CO 0.03 0.05 1.82 -0.08 0.70 0.00 0.00 175.17 177.69 3kfo h GLU 1012N 3.02 0.69 -0.44 2.11 4.81 -1.96 -2.13 114.58 120.68 3kfo h GLU 1012Ca -0.44 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 3kfo h GLU 1012Cb 1.22 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.42 3kfo h GLU 1012CO 0.51 0.46 0.22 1.49 -0.73 0.00 0.00 179.01 180.96 3kfo h GLU 1013N 0.71 0.64 -0.23 1.92 4.81 -1.99 -1.64 114.58 118.81 3kfo h GLU 1013Ca 0.27 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 3kfo h GLU 1013Cb 0.10 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 3kfo h GLU 1013CO -0.14 0.54 -0.05 0.77 -0.73 0.00 0.00 179.01 179.40 3kfo h SER 1014N 0.57 0.33 1.65 1.04 0.02 -1.83 -1.58 113.55 113.75 3kfo h SER 1014Ca 0.15 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 3kfo h SER 1014Cb 0.11 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 3kfo h SER 1014CO -0.02 0.43 -0.35 -0.07 -1.14 0.00 0.00 176.83 175.68 3kfo h LEU 1015N 0.34 0.00 -0.03 5.07 3.38 -1.21 -3.31 115.31 119.55 3kfo h LEU 1015Ca 0.07 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.78 3kfo h LEU 1015Cb 0.32 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.08 3kfo h LEU 1015CO 0.01 0.24 -1.05 0.15 0.09 0.00 0.00 178.44 177.88 3kfo h PHE 1016N 0.00 0.89 -0.67 1.13 3.57 -0.68 -3.37 116.94 117.82 3kfo h PHE 1016Ca -0.01 -0.50 0.11 0.00 3.53 0.00 0.00 57.97 61.10 3kfo h PHE 1016Cb 1.19 -0.09 -0.08 0.00 2.79 0.00 0.00 35.95 39.75 3kfo h PHE 1016CO 0.00 1.34 0.26 0.82 -2.23 0.00 0.00 178.31 178.50 3kfo h ILE 1017N 0.32 0.74 0.00 1.41 2.04 -1.39 -1.04 117.51 119.58 3kfo h ILE 1017Ca -0.12 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 3kfo h ILE 1017Cb 1.70 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 3kfo h ILE 1017CO 0.20 0.08 -0.18 1.55 0.00 0.00 0.00 178.15 179.80 3kfo h PRO 1018N 0.44 0.00 -0.78 2.37 0.13 -1.73 0.20 132.00 132.64 3kfo h PRO 1018Ca 0.34 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.43 3kfo h PRO 1018Cb 0.45 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.55 3kfo h PRO 1018CO -0.33 0.18 0.31 -0.07 -0.23 0.00 0.00 178.00 177.85 3kfo h LEU 1019N 0.00 1.07 0.10 1.56 3.38 -1.36 -0.91 115.31 119.16 3kfo h LEU 1019Ca -0.00 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 3kfo h LEU 1019Cb 0.33 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.80 3kfo h LEU 1019CO 0.02 0.95 -0.05 -0.09 0.09 0.00 0.00 178.44 179.37 3kfo h ARG 1020N 1.13 -0.13 -0.87 1.13 2.43 -1.00 -1.52 114.38 115.54 3kfo h ARG 1020Ca 0.26 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.53 3kfo h ARG 1020Cb 0.22 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.73 3kfo h ARG 1020CO -0.02 0.09 0.52 -0.07 -1.51 0.00 0.00 179.97 178.98 3kfo h LEU 1021N -0.33 0.77 -0.78 3.80 3.38 -0.87 0.43 115.31 121.70 3kfo h LEU 1021Ca -0.01 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 3kfo h LEU 1021Cb 0.27 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3kfo h LEU 1021CO 0.02 0.45 -0.35 -0.07 0.09 0.00 0.00 178.44 178.58 3kfo h LEU 1022N 0.88 0.53 -0.05 1.67 3.38 -1.08 0.28 115.31 120.92 3kfo h LEU 1022Ca 0.41 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 58.11 3kfo h LEU 1022Cb 0.33 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3kfo h LEU 1022CO -0.23 0.84 -0.18 -1.28 0.09 0.00 0.00 178.44 177.68 3kfo h SER 1023N 0.43 0.25 0.19 -0.43 0.87 -0.19 -2.02 113.55 112.65 3kfo h SER 1023Ca 0.05 -0.63 -0.34 0.00 -1.23 0.00 0.00 61.79 59.63 3kfo h SER 1023Cb 0.82 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.72 3kfo h SER 1023CO 0.07 0.84 -1.67 0.58 -0.53 0.00 0.00 176.83 176.11 3kfo h VAL 1024N -0.33 1.00 -0.25 2.23 2.07 -0.18 -3.38 116.25 117.41 3kfo h VAL 1024Ca -0.01 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.98 3kfo h VAL 1024Cb 0.82 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.40 3kfo h VAL 1024CO 0.04 0.84 0.00 0.47 0.02 0.00 0.00 177.57 178.94 3kfo n ASP 1025N -3.65 3.19 0.24 0.57 8.00 0.97 -4.70 116.55 121.17 3kfo n ASP 1025Ca -0.24 -2.52 0.17 0.00 0.71 0.00 0.00 54.79 52.91 3kfo n ASP 1025Cb 1.06 -0.36 0.86 0.00 -0.02 0.00 0.00 41.12 42.67 3kfo n ASP 1025CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3kfo h GLY 1026N 1.57 0.00 2.00 0.44 0.00 -1.15 -1.77 103.07 104.16 3kfo h GLY 1026Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3kfo h GLY 1026CO 0.09 0.00 0.00 3.45 0.00 0.00 0.00 176.54 180.08 3kfo h ASN 1027N 0.00 0.00 0.68 0.19 -1.07 -1.84 -1.43 115.58 112.11 3kfo h ASN 1027Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 3kfo h ASN 1027Cb 0.05 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.30 3kfo h ASN 1027CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.43 177.43 3kfo h LEU 1028N 0.00 0.00 -9.26 6.14 3.38 -1.66 -3.45 115.31 110.46 3kfo h LEU 1028Ca 0.00 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.34 3kfo h LEU 1028Cb 0.11 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.71 3kfo h LEU 1028CO 0.00 0.00 -0.75 -0.76 0.09 0.00 0.00 178.44 177.02 3kfo s LEU 1029N -4.85 2.84 0.53 1.67 1.43 -0.54 -4.74 118.68 115.02 3kfo s LEU 1029Ca 0.03 -0.66 -0.19 0.00 -1.03 0.00 0.00 54.13 52.27 3kfo s LEU 1029Cb 0.09 -1.53 -0.07 0.00 0.03 0.00 0.00 46.19 44.72 3kfo s LEU 1029CO 0.40 0.10 1.08 0.54 0.23 0.00 0.00 176.35 178.70 3kfo s ASN 1030N -2.83 5.98 0.28 2.29 2.20 -1.26 -4.83 114.94 116.76 3kfo s ASN 1030Ca 0.24 2.03 0.02 0.00 -0.94 0.00 0.00 52.86 54.20 3kfo s ASN 1030Cb -0.08 -2.57 0.63 0.00 -2.00 0.00 0.00 41.25 37.23 3kfo s ASN 1030CO 0.14 -1.03 1.74 0.15 -2.94 0.00 0.00 177.10 175.15 3kfo h PHE 1031N 1.25 0.75 -0.95 1.54 3.57 -1.99 -0.90 116.94 120.21 3kfo h PHE 1031Ca -0.49 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.04 3kfo h PHE 1031Cb 1.24 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 39.74 3kfo h PHE 1031CO 0.54 0.09 0.56 0.93 -2.23 0.00 0.00 178.31 178.21 3kfo h GLU 1032N 0.54 1.29 -0.10 1.11 3.07 -1.99 0.19 114.58 118.69 3kfo h GLU 1032Ca 0.51 -0.12 -0.13 0.00 -0.50 0.00 0.00 59.36 59.12 3kfo h GLU 1032Cb 0.84 -0.27 0.01 0.00 -0.84 0.00 0.00 28.75 28.49 3kfo h GLU 1032CO -0.43 0.91 -0.44 0.28 -1.40 0.00 0.00 179.01 177.93 3kfo h VAL 1033N 1.31 1.38 -0.41 3.13 2.07 -1.75 -1.75 116.25 120.23 3kfo h VAL 1033Ca 0.34 -1.78 0.04 0.00 0.82 0.00 0.00 66.70 66.12 3kfo h VAL 1033Cb -0.04 2.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 3kfo h VAL 1033CO -0.06 0.53 0.16 0.50 0.02 0.00 0.00 177.57 178.72 3kfo h LYS 1034N 0.05 0.33 -0.08 1.57 3.64 -0.99 -0.90 116.57 120.18 3kfo h LYS 1034Ca -0.03 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 3kfo h LYS 1034Cb 1.08 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.79 3kfo h LYS 1034CO 0.09 0.22 -0.12 -0.22 -2.27 0.00 0.00 179.45 177.15 3kfo h LYS 1035N 0.34 -0.15 -0.34 1.90 3.64 -0.97 0.56 116.57 121.54 3kfo h LYS 1035Ca 0.18 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3kfo h LYS 1035Cb 0.15 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 3kfo h LYS 1035CO -0.17 -0.10 0.21 0.35 -2.27 0.00 0.00 179.45 177.46 3kfo h PHE 1036N -0.16 0.39 -0.52 1.91 3.57 -1.09 -2.09 116.94 118.96 3kfo h PHE 1036Ca 0.07 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 3kfo h PHE 1036Cb 0.26 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 3kfo h PHE 1036CO -0.22 0.23 0.10 -0.07 -2.23 0.00 0.00 178.31 176.12 3kfo h LEU 1037N 0.42 0.75 -0.45 0.59 3.38 -1.04 0.12 115.31 119.08 3kfo h LEU 1037Ca 0.13 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 3kfo h LEU 1037Cb -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3kfo h LEU 1037CO -0.05 0.76 0.04 -1.13 0.09 0.00 0.00 178.44 178.14 3kfo h ASN 1038N 0.77 0.75 -0.67 -0.43 -1.24 -0.66 -0.80 115.58 113.31 3kfo h ASN 1038Ca 0.17 -0.29 -0.07 0.00 0.71 0.00 0.00 56.30 56.82 3kfo h ASN 1038Cb 0.33 -0.20 -0.03 0.00 0.73 0.00 0.00 38.32 39.15 3kfo h ASN 1038CO 0.00 0.85 0.14 0.00 -1.29 0.00 0.00 177.43 177.14 3kfo h ALA 1039N 0.93 0.97 -0.17 1.57 0.00 -1.03 -1.89 119.26 119.63 3kfo h ALA 1039Ca 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3kfo h ALA 1039Cb 0.44 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3kfo h ALA 1039CO 0.02 0.66 0.08 1.25 0.00 0.00 0.00 179.25 181.26 3kfo h LEU 1040N 1.03 0.22 0.06 0.00 5.85 -0.31 0.13 115.31 122.30 3kfo h LEU 1040Ca 0.21 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3kfo h LEU 1040Cb 0.39 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.37 3kfo h LEU 1040CO 0.01 0.28 -0.03 0.58 -0.34 0.00 0.00 178.44 178.94 3kfo h VAL 1041N 0.15 1.13 -0.70 1.05 2.07 -1.11 -2.42 116.25 116.42 3kfo h VAL 1041Ca 0.06 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.91 3kfo h VAL 1041Cb 0.11 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3kfo h VAL 1041CO -0.01 0.16 0.37 -0.50 0.02 0.00 0.00 177.57 177.62 3kfo h TRP 1042N -0.38 0.96 -0.92 1.57 4.06 -1.29 -0.86 115.95 119.09 3kfo h TRP 1042Ca -0.01 -0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.95 3kfo h TRP 1042Cb 0.33 -0.31 -0.05 0.00 -1.00 0.00 0.00 29.16 28.13 3kfo h TRP 1042CO 0.02 0.68 0.60 0.00 -3.56 0.00 0.00 178.44 176.18 3kfo h ARG 1043N 0.98 1.13 -0.13 0.49 3.08 -0.89 0.83 114.38 119.88 3kfo h ARG 1043Ca 0.25 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 3kfo h ARG 1043Cb 0.04 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 3kfo h ARG 1043CO -0.04 0.75 -0.53 0.00 -1.07 0.00 0.00 179.97 179.08 3kfo h ARG 1044N 1.17 0.37 -0.34 0.04 3.08 -0.89 -0.64 114.38 117.17 3kfo h ARG 1044Ca 0.36 -0.22 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 3kfo h ARG 1044Cb -0.01 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3kfo h ARG 1044CO -0.11 0.81 0.02 0.82 -1.07 0.00 0.00 179.97 180.43 3kfo h ILE 1045N 0.29 1.25 -0.66 2.04 2.04 -0.92 -1.00 117.51 120.55 3kfo h ILE 1045Ca 0.01 -0.93 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 3kfo h ILE 1045Cb 1.03 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.28 3kfo h ILE 1045CO 0.09 0.31 0.36 0.58 0.00 0.00 0.00 178.15 179.49 3kfo h VAL 1046N 0.40 1.21 -0.35 1.67 2.07 -0.52 0.11 116.25 120.82 3kfo h VAL 1046Ca 0.10 -0.51 -0.16 0.00 0.82 0.00 0.00 66.70 66.94 3kfo h VAL 1046Cb 0.42 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3kfo h VAL 1046CO 0.01 0.22 -0.42 -0.07 0.02 0.00 0.00 177.57 177.33 3kfo h LEU 1047N 0.90 0.97 -0.42 2.57 3.38 -1.04 -1.21 115.31 120.46 3kfo h LEU 1047Ca 0.23 -0.46 -0.12 0.00 0.09 0.00 0.00 57.88 57.62 3kfo h LEU 1047Cb 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3kfo h LEU 1047CO -0.04 1.25 -0.21 0.25 0.09 0.00 0.00 178.44 179.78 3kfo h LEU 1048N 0.72 0.91 -1.36 1.67 5.85 -1.03 -2.97 115.31 119.10 3kfo h LEU 1048Ca 0.05 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.40 3kfo h LEU 1048Cb 1.02 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.76 3kfo h LEU 1048CO 0.10 1.11 0.46 -1.13 -0.34 0.00 0.00 178.44 178.64 3kfo h ASN 1049N 0.70 0.72 0.41 1.25 -1.24 -0.54 -0.60 115.58 116.28 3kfo h ASN 1049Ca 0.09 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.09 3kfo h ASN 1049Cb 0.77 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 39.66 3kfo h ASN 1049CO 0.06 0.49 0.00 0.00 -1.29 0.00 0.00 177.43 176.70 3kfo h ALA 1050N 1.60 1.00 0.00 1.57 0.00 -1.06 -2.82 119.26 119.55 3kfo h ALA 1050Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3kfo h ALA 1050Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3kfo h ALA 1050CO -0.08 0.00 0.00 0.77 0.00 0.00 0.00 179.25 179.94 3kfo h SER 1051N 0.00 0.00 -4.46 0.00 0.02 -1.06 -3.43 113.55 104.61 3kfo h SER 1051Ca 0.00 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.54 3kfo h SER 1051Cb 0.21 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 62.53 3kfo h SER 1051CO 0.00 0.00 -0.78 0.20 -1.14 0.00 0.00 176.83 175.11 3kfo s ASN 1052N -4.91 1.65 0.54 3.07 0.01 -1.06 -5.14 114.94 109.10 3kfo s ASN 1052Ca -0.00 -0.59 -0.20 0.00 -0.71 0.00 0.00 52.86 51.35 3kfo s ASN 1052Cb 0.10 -0.05 -0.05 0.00 0.41 0.00 0.00 41.25 41.65 3kfo s ASN 1052CO 0.41 -0.06 1.19 -1.83 -1.51 0.00 0.00 177.10 175.30 3kfo s GLU 1053N -1.65 3.28 0.00 -0.60 -1.05 -1.26 -4.08 118.70 113.34 3kfo s GLU 1053Ca -0.02 1.79 0.00 0.00 -0.15 0.00 0.00 54.97 56.59 3kfo s GLU 1053Cb -0.10 -2.09 0.00 0.00 -0.44 0.00 0.00 34.13 31.50 3kfo s GLU 1053CO 0.02 -0.95 0.00 0.41 0.95 0.00 0.00 175.26 175.69 3kfo n GLY 1054N 0.41 2.65 2.27 -3.83 0.00 -1.26 -4.65 105.19 100.78 3kfo n GLY 1054Ca 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.99 3kfo n GLY 1054CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kfo n ASP 1055N 0.00 -4.38 -0.21 1.61 8.00 -1.26 -4.95 116.55 115.36 3kfo n ASP 1055Ca 0.00 -0.01 -0.07 0.00 0.71 0.00 0.00 54.79 55.42 3kfo n ASP 1055Cb 0.00 -3.54 0.07 0.00 -0.02 0.00 0.00 41.12 37.64 3kfo n ASP 1055CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3kfo h LYS 1056N 0.00 1.05 -0.48 -1.24 1.79 -1.88 -1.72 116.57 114.10 3kfo h LYS 1056Ca -0.34 -0.28 -0.03 0.00 -2.18 0.00 0.00 60.65 57.83 3kfo h LYS 1056Cb 1.25 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 31.75 3kfo h LYS 1056CO 0.40 0.97 0.20 1.25 -1.08 0.00 0.00 179.45 181.19 3kfo h LEU 1057N 0.99 0.66 0.08 2.94 5.85 -1.92 0.15 115.31 124.07 3kfo h LEU 1057Ca 0.20 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 3kfo h LEU 1057Cb 0.43 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.29 3kfo h LEU 1057CO 0.01 0.64 -0.04 0.25 -0.34 0.00 0.00 178.44 178.97 3kfo h LEU 1058N 0.64 -0.10 -0.54 2.25 5.85 -1.87 -1.55 115.31 120.00 3kfo h LEU 1058Ca 0.16 -0.15 0.07 0.00 0.84 0.00 0.00 57.88 58.80 3kfo h LEU 1058Cb 0.18 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 3kfo h LEU 1058CO -0.01 0.09 0.21 1.56 -0.34 0.00 0.00 178.44 179.95 3kfo h GLN 1059N -0.28 0.39 -0.68 1.25 4.20 -1.17 -0.42 115.11 118.40 3kfo h GLN 1059Ca -0.01 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.65 3kfo h GLN 1059Cb 0.24 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.90 3kfo h GLN 1059CO 0.02 0.26 0.32 0.45 -0.67 0.00 0.00 178.83 179.21 3kfo h HIS 1060N 0.41 0.99 -0.30 2.96 3.86 -0.50 -0.75 115.15 121.81 3kfo h HIS 1060Ca 0.26 -0.05 -0.07 0.00 -1.16 0.00 0.00 60.37 59.35 3kfo h HIS 1060Cb 0.28 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 3kfo h HIS 1060CO -0.15 0.74 -0.10 0.82 0.86 0.00 0.00 177.93 180.10 3kfo h ILE 1061N 0.95 1.29 -0.66 2.45 2.04 -1.02 -1.84 117.51 120.71 3kfo h ILE 1061Ca 0.23 -1.16 -0.04 0.00 1.00 0.00 0.00 64.86 64.89 3kfo h ILE 1061Cb 0.14 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 3kfo h ILE 1061CO -0.03 0.37 0.26 0.58 0.00 0.00 0.00 178.15 179.34 3kfo h VAL 1062N 0.36 1.24 -0.55 1.67 2.07 -0.91 -1.57 116.25 118.57 3kfo h VAL 1062Ca 0.07 -0.75 0.04 0.00 0.82 0.00 0.00 66.70 66.88 3kfo h VAL 1062Cb 0.60 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 3kfo h VAL 1062CO 0.03 0.30 0.31 0.11 0.02 0.00 0.00 177.57 178.34 3kfo h LYS 1063N 0.94 0.59 -0.34 1.57 6.56 -1.07 -2.51 116.57 122.31 3kfo h LYS 1063Ca 0.22 -0.04 -0.07 0.00 -1.06 0.00 0.00 60.65 59.71 3kfo h LYS 1063Cb 0.21 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 31.72 3kfo h LYS 1063CO -0.02 0.39 -0.07 -0.09 -2.06 0.00 0.00 179.45 177.60 3kfo h ARG 1064N 0.60 0.56 -1.00 3.15 2.43 -0.83 0.14 114.38 119.44 3kfo h ARG 1064Ca 0.23 -0.15 0.14 0.00 -0.81 0.00 0.00 59.98 59.39 3kfo h ARG 1064Cb 0.08 -0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 29.47 3kfo h ARG 1064CO -0.13 0.64 0.62 0.28 -1.51 0.00 0.00 179.97 179.87 3kfo h VAL 1065N 0.52 0.87 0.15 0.20 2.07 -0.86 -0.46 116.25 118.74 3kfo h VAL 1065Ca 0.10 -0.32 -0.24 0.00 0.82 0.00 0.00 66.70 67.06 3kfo h VAL 1065Cb 0.45 -0.15 0.02 0.00 -1.52 0.00 0.00 31.29 30.08 3kfo h VAL 1065CO 0.02 0.17 -1.11 -0.26 0.02 0.00 0.00 177.57 176.42 3kfo h PHE 1066N 0.93 0.57 -0.27 1.57 0.04 -1.04 -2.04 116.94 116.71 3kfo h PHE 1066Ca 0.52 -0.42 0.08 0.00 2.80 0.00 0.00 57.97 60.95 3kfo h PHE 1066Cb 0.59 -0.02 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 3kfo h PHE 1066CO -0.01 1.43 0.20 -0.44 -0.60 0.00 0.00 178.31 178.89 3kfo h ASP 1067N -0.28 0.01 -0.51 2.17 3.32 -0.51 0.15 116.42 120.77 3kfo h ASP 1067Ca -0.21 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.84 3kfo h ASP 1067Cb 1.76 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.30 3kfo h ASP 1067CO 0.14 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 177.04 3kfo n GLU 1068N -4.46 2.35 -3.02 3.56 1.02 -0.21 -4.92 120.64 114.97 3kfo n GLU 1068Ca 0.04 -2.09 -0.22 0.00 -0.02 0.00 0.00 57.16 54.87 3kfo n GLU 1068Cb 0.35 -1.47 0.02 0.00 -0.02 0.00 0.00 31.44 30.32 3kfo n GLU 1068CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3kfo n GLU 1069N 1.22 -4.34 -0.26 3.49 1.02 0.54 -4.84 120.64 117.47 3kfo n GLU 1069Ca 0.20 0.83 0.02 0.00 -0.02 0.00 0.00 57.16 58.19 3kfo n GLU 1069Cb 0.51 -5.65 0.15 0.00 -0.02 0.00 0.00 31.44 26.44 3kfo n GLU 1069CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3kfo h LEU 1070N -1.18 0.52 -1.00 -4.62 3.38 -1.58 0.78 115.31 111.60 3kfo h LEU 1070Ca -0.50 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.53 3kfo h LEU 1070Cb 1.35 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.07 3kfo h LEU 1070CO 0.56 0.29 0.00 -0.65 0.09 0.00 0.00 178.44 178.72 3kfo h PRO 1071N 0.65 0.00 -0.56 1.13 0.11 -1.77 -2.86 132.00 128.69 3kfo h PRO 1071Ca 0.38 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.40 3kfo h PRO 1071Cb 0.40 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 3kfo h PRO 1071CO -0.28 0.00 0.02 0.87 -0.21 0.00 0.00 178.00 178.40 3kfo h LYS 1072N 0.00 0.96 0.00 1.05 1.57 -1.20 -3.25 116.57 115.70 3kfo h LYS 1072Ca 0.00 -0.28 -0.22 0.00 -1.87 0.00 0.00 60.65 58.28 3kfo h LYS 1072Cb 0.39 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 3kfo h LYS 1072CO 0.00 0.93 -1.54 0.27 -0.57 0.00 0.00 179.45 178.55 3kfo n ASN 1073N -4.20 0.88 -3.66 0.86 2.04 -1.18 -4.90 115.26 105.10 3kfo n ASN 1073Ca 0.03 0.40 -0.14 0.00 -0.44 0.00 0.00 54.58 54.43 3kfo n ASN 1073Cb 0.32 0.04 -0.08 0.00 -2.53 0.00 0.00 39.78 37.52 3kfo n ASN 1073CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 3kfo s ASN 1074N -5.93 -0.52 0.11 0.53 3.84 -1.09 -5.10 114.94 106.79 3kfo s ASN 1074Ca -0.04 0.83 -0.36 0.00 0.21 0.00 0.00 52.86 53.51 3kfo s ASN 1074Cb 0.08 0.84 -0.15 0.00 -0.55 0.00 0.00 41.25 41.47 3kfo s ASN 1074CO 0.82 -0.33 1.45 0.47 -2.79 0.00 0.00 177.10 176.71 3kfo n ASP 1075N 2.08 2.26 -4.44 -4.21 9.92 -1.25 -3.92 116.55 116.99 3kfo n ASP 1075Ca -0.16 1.10 -0.36 0.00 -0.53 0.00 0.00 54.79 54.84 3kfo n ASP 1075Cb 0.56 -1.29 -0.13 0.00 -0.64 0.00 0.00 41.12 39.63 3kfo n ASP 1075CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 3kfo s PHE 1076N 0.70 3.07 0.15 1.24 5.36 -1.07 -4.94 117.98 122.50 3kfo s PHE 1076Ca 0.82 -0.45 -0.30 0.00 -0.96 0.00 0.00 56.93 56.04 3kfo s PHE 1076Cb -0.84 -2.17 -0.08 0.00 -0.34 0.00 0.00 43.02 39.59 3kfo s PHE 1076CO 0.43 -0.31 1.26 -1.25 -1.46 0.00 0.00 175.22 173.89 3kfo s PRO 1077N 1.35 4.42 0.38 10.12 0.04 -1.26 -1.84 135.00 148.21 3kfo s PRO 1077Ca 0.05 1.94 -0.04 0.00 0.04 0.00 0.00 61.00 62.99 3kfo s PRO 1077Cb -0.15 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.10 3kfo s PRO 1077CO 0.02 -0.23 0.64 -0.51 0.04 0.00 0.00 177.00 176.97 3kfo s LEU 1078N 0.27 3.89 0.57 -3.56 1.43 -1.10 -4.95 118.68 115.24 3kfo s LEU 1078Ca 0.57 0.75 -0.18 0.00 -1.03 0.00 0.00 54.13 54.23 3kfo s LEU 1078Cb -0.34 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.21 3kfo s LEU 1078CO 0.35 -0.36 1.13 -2.16 0.23 0.00 0.00 176.35 175.54 3kfo s PRO 1079N -4.16 3.19 0.04 1.29 0.04 -1.26 -4.95 135.00 129.19 3kfo s PRO 1079Ca 0.45 1.58 -0.07 0.00 0.04 0.00 0.00 61.00 63.00 3kfo s PRO 1079Cb -0.10 -1.99 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 3kfo s PRO 1079CO 0.36 -0.97 0.13 -1.54 0.04 0.00 0.00 177.00 175.02 3kfo s SER 1080N -1.93 0.14 0.33 6.66 1.04 -1.26 -5.02 113.70 113.65 3kfo s SER 1080Ca 0.72 -0.50 0.08 0.00 0.48 0.00 0.00 55.95 56.73 3kfo s SER 1080Cb -0.24 0.25 0.56 0.00 0.10 0.00 0.00 66.02 66.70 3kfo s SER 1080CO 0.31 -0.54 1.77 -0.37 0.98 0.00 0.00 173.24 175.39 3kfo h VAL 1081N 3.55 1.27 -0.42 5.02 -1.51 -1.96 -0.16 116.25 122.04 3kfo h VAL 1081Ca -0.32 -1.29 0.01 0.00 -1.23 0.00 0.00 66.70 63.86 3kfo h VAL 1081Cb 1.19 1.54 -0.02 0.00 -2.13 0.00 0.00 31.29 31.87 3kfo h VAL 1081CO 0.50 0.39 0.27 0.44 -1.23 0.00 0.00 177.57 177.94 3kfo h ASP 1082N 0.20 0.47 -0.12 4.19 3.32 -1.96 -0.61 116.42 121.91 3kfo h ASP 1082Ca 0.03 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3kfo h ASP 1082Cb 0.68 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 3kfo h ASP 1082CO 0.05 0.34 0.06 -0.07 -1.72 0.00 0.00 179.24 177.89 3kfo h LEU 1083N 0.56 0.16 -1.02 1.55 4.07 -1.78 -2.32 115.31 116.53 3kfo h LEU 1083Ca 0.16 -0.14 -0.07 0.00 0.08 0.00 0.00 57.88 57.91 3kfo h LEU 1083Cb -0.05 -0.04 -0.02 0.00 1.08 0.00 0.00 40.66 41.63 3kfo h LEU 1083CO -0.04 0.26 -0.00 -0.07 -1.08 0.00 0.00 178.44 177.50 3kfo h LEU 1084N 0.06 0.66 -3.20 1.67 3.38 -0.81 -2.69 115.31 114.39 3kfo h LEU 1084Ca 0.04 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3kfo h LEU 1084Cb 0.14 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3kfo h LEU 1084CO -0.00 0.74 0.00 0.00 0.09 0.00 0.00 178.44 179.26 3kfo s ASP 1086N -0.91 5.49 0.35 0.00 2.15 -0.88 -4.72 116.67 118.15 3kfo s ASP 1086Ca 0.52 -1.26 0.24 0.00 0.43 0.00 0.00 52.55 52.48 3kfo s ASP 1086Cb 0.34 -2.57 1.26 0.00 -0.30 0.00 0.00 42.92 41.65 3kfo s ASP 1086CO 0.24 -2.50 1.74 0.11 -0.17 0.00 0.00 175.17 174.59 3kfo h LYS 1087N 10.24 0.00 -0.00 4.34 1.57 -1.90 -2.68 116.57 128.14 3kfo h LYS 1087Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3kfo h LYS 1087Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.28 3kfo h LYS 1087CO 1.27 0.00 -0.02 -1.13 -0.57 0.00 0.00 179.45 179.00 3kfo n SER 1088N -2.35 0.09 0.21 0.86 3.41 -1.26 -2.76 113.62 111.82 3kfo n SER 1088Ca -0.01 -0.37 0.14 0.00 -0.26 0.00 0.00 58.87 58.37 3kfo n SER 1088Cb 0.07 -0.20 0.42 0.00 -0.26 0.00 0.00 64.21 64.24 3kfo n SER 1088CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3kfo h LEU 1089N 0.11 0.00 -5.88 1.04 3.38 -1.88 -3.38 115.31 108.71 3kfo h LEU 1089Ca 0.00 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.26 3kfo h LEU 1089Cb 0.25 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 3kfo h LEU 1089CO 0.00 0.00 3.02 0.18 0.09 0.00 0.00 178.44 181.73 3kfo n LEU 1090N -2.88 7.24 -4.83 1.67 4.77 -1.11 -4.87 117.00 116.99 3kfo n LEU 1090Ca 0.03 -4.32 -0.33 0.00 -0.03 0.00 0.00 56.01 51.36 3kfo n LEU 1090Cb 0.41 -1.59 -0.07 0.00 -2.33 0.00 0.00 43.42 39.84 3kfo n LEU 1090CO 0.30 1.39 0.58 0.42 -1.33 0.00 0.00 177.39 178.74 3kfo s THR 1091N 2.24 4.49 0.55 -5.08 -4.23 -1.26 -4.94 115.64 107.42 3kfo s THR 1091Ca 0.50 1.30 0.23 0.00 -1.18 0.00 0.00 61.69 62.55 3kfo s THR 1091Cb 0.14 -3.61 0.33 0.00 1.34 0.00 0.00 72.50 70.70 3kfo s THR 1091CO -0.07 -0.29 2.15 1.55 -0.54 0.00 0.00 174.62 177.42 3kfo h PRO 1092N 1.98 0.00 -0.35 3.99 0.13 -1.97 -2.16 132.00 133.63 3kfo h PRO 1092Ca -0.49 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 3kfo h PRO 1092Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 3kfo h PRO 1092CO 0.62 0.00 0.04 0.93 -0.23 0.00 0.00 178.00 179.36 3kfo h GLU 1093N 0.00 0.59 -0.11 0.86 3.07 -1.97 -1.71 114.58 115.30 3kfo h GLU 1093Ca 0.05 -0.17 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 3kfo h GLU 1093Cb 0.21 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.05 3kfo h GLU 1093CO -0.00 0.68 0.06 -0.92 -1.40 0.00 0.00 179.01 177.42 3kfo h TYR 1094N 0.41 0.11 -0.30 4.33 3.20 -1.77 -1.14 116.97 121.81 3kfo h TYR 1094Ca 0.10 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.92 3kfo h TYR 1094Cb 0.39 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 3kfo h TYR 1094CO 0.03 0.06 -0.05 0.82 -1.64 0.00 0.00 178.16 177.39 3kfo h ILE 1095N 0.12 1.27 -0.34 1.81 1.08 -1.42 0.17 117.51 120.21 3kfo h ILE 1095Ca 0.04 -1.05 0.00 0.00 -0.39 0.00 0.00 64.86 63.46 3kfo h ILE 1095Cb 0.00 1.35 -0.02 0.00 -3.07 0.00 0.00 36.82 35.08 3kfo h ILE 1095CO -0.02 0.34 0.22 0.28 -0.69 0.00 0.00 178.15 178.27 3kfo h SER 1096N 0.34 0.40 -0.01 1.72 0.02 -1.31 0.40 113.55 115.11 3kfo h SER 1096Ca 0.08 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3kfo h SER 1096Cb 0.51 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.95 3kfo h SER 1096CO 0.02 0.30 0.01 -0.33 -1.14 0.00 0.00 176.83 175.69 3kfo h GLU 1097N 0.46 0.02 -0.03 3.45 3.07 -1.04 0.16 114.58 120.68 3kfo h GLU 1097Ca 0.12 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.97 3kfo h GLU 1097Cb -0.04 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 3kfo h GLU 1097CO -0.03 0.19 -0.01 1.15 -1.40 0.00 0.00 179.01 178.92 3kfo h THR 1098N -0.15 1.30 -0.00 1.13 2.02 -0.60 -3.38 112.91 113.22 3kfo h THR 1098Ca 0.00 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.26 3kfo h THR 1098Cb 0.18 1.87 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 3kfo h THR 1098CO -0.00 0.25 -0.57 -1.22 0.37 0.00 0.00 175.52 174.35 3kfo n TYR 1099N -4.86 0.00 -0.34 3.16 4.01 0.13 -4.66 117.16 114.59 3kfo n TYR 1099Ca -0.08 0.00 0.22 0.00 -0.16 0.00 0.00 57.90 57.88 3kfo n TYR 1099Cb 0.21 0.00 0.45 0.00 -0.31 0.00 0.00 39.34 39.69 3kfo n TYR 1099CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3kfo h GLY 1100N 3.02 1.99 1.01 2.72 0.00 -0.66 -0.22 103.07 110.93 3kfo h GLY 1100Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3kfo h GLY 1100CO 0.00 -0.39 -0.01 -0.96 0.00 0.00 0.00 176.54 175.18 3kfo n ARG 1101N -4.98 0.91 -3.43 4.80 1.85 -1.26 -4.84 116.66 109.71 3kfo n ARG 1101Ca 0.30 -0.09 -0.34 0.00 -1.00 0.00 0.00 57.85 56.72 3kfo n ARG 1101Cb 0.90 -1.50 -0.06 0.00 -1.05 0.00 0.00 32.46 30.76 3kfo n ARG 1101CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3kfo s PHE 1102N -2.16 3.54 -1.41 2.89 0.08 -0.09 -4.98 117.98 115.85 3kfo s PHE 1102Ca 0.42 0.93 -0.11 0.00 0.12 0.00 0.00 56.93 58.28 3kfo s PHE 1102Cb 0.21 -2.28 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 3kfo s PHE 1102CO 0.39 0.39 2.55 -0.35 -0.10 0.00 0.00 175.22 178.11 3kfo n PRO 1103N 0.48 3.05 -3.92 0.24 -0.04 -1.26 -4.82 135.00 128.74 3kfo n PRO 1103Ca -0.04 -2.17 -0.10 0.00 -0.04 0.00 0.00 63.50 61.15 3kfo n PRO 1103Cb 0.52 -2.89 -0.11 0.00 -0.04 0.00 0.00 33.50 30.98 3kfo n PRO 1103CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3kfo s ILE 1104N 2.86 0.09 -0.27 0.52 1.01 -1.26 -5.07 121.20 119.08 3kfo s ILE 1104Ca 0.58 -0.75 -0.29 0.00 0.00 0.00 0.00 60.65 60.20 3kfo s ILE 1104Cb 0.15 -0.33 -0.02 0.00 0.01 0.00 0.00 42.46 42.28 3kfo s ILE 1104CO -0.05 -0.41 1.67 -0.62 0.00 0.00 0.00 174.94 175.53 3kfo s ASP 1105N -1.32 6.20 0.48 3.58 -1.08 -1.26 -4.87 116.67 118.39 3kfo s ASP 1105Ca -0.14 1.46 0.18 0.00 -0.52 0.00 0.00 52.55 53.53 3kfo s ASP 1105Cb -0.08 -2.53 1.15 0.00 -1.46 0.00 0.00 42.92 40.00 3kfo s ASP 1105CO 0.00 -1.43 2.04 1.56 0.52 0.00 0.00 175.17 177.86 3kfo h GLN 1106N 11.51 0.00 0.00 4.34 4.20 -1.93 -1.49 115.11 131.74 3kfo h GLN 1106Ca -0.33 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.26 3kfo h GLN 1106Cb 1.16 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.92 3kfo h GLN 1106CO 1.02 0.14 -0.57 -0.97 -0.67 0.00 0.00 178.83 177.78 3kfo h ASN 1107N 0.00 0.00 0.30 1.46 -1.24 -1.99 -1.42 115.58 112.69 3kfo h ASN 1107Ca -0.00 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.87 3kfo h ASN 1107Cb 0.27 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 3kfo h ASN 1107CO 0.02 0.57 -0.54 0.00 -1.29 0.00 0.00 177.43 176.19 3kfo h ALA 1108N 1.43 0.92 -0.09 1.57 0.00 -1.67 -0.85 119.26 120.56 3kfo h ALA 1108Ca -0.01 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 3kfo h ALA 1108Cb 1.10 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 3kfo h ALA 1108CO 0.07 0.68 0.05 0.82 0.00 0.00 0.00 179.25 180.88 3kfo h ILE 1109N 0.20 1.08 -0.56 0.00 2.04 -1.31 -2.02 117.51 116.95 3kfo h ILE 1109Ca 0.00 -0.23 0.06 0.00 1.00 0.00 0.00 64.86 65.69 3kfo h ILE 1109Cb 1.02 1.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.11 3kfo h ILE 1109CO 0.08 0.07 0.27 -0.09 0.00 0.00 0.00 178.15 178.49 3kfo h ARG 1110N 0.06 0.50 -0.40 2.37 2.43 -1.08 -1.62 114.38 116.65 3kfo h ARG 1110Ca 0.03 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.09 3kfo h ARG 1110Cb 0.07 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3kfo h ARG 1110CO -0.01 0.33 -0.10 0.93 -1.51 0.00 0.00 179.97 179.62 3kfo h GLU 1111N 0.52 0.70 -0.50 0.20 5.08 -1.10 0.12 114.58 119.60 3kfo h GLU 1111Ca 0.25 -0.22 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 3kfo h GLU 1111Cb 0.19 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3kfo h GLU 1111CO -0.19 0.78 -0.16 1.49 -1.00 0.00 0.00 179.01 179.93 3kfo h GLU 1112N 0.64 0.98 -0.45 2.33 4.22 -0.98 0.09 114.58 121.40 3kfo h GLU 1112Ca 0.11 -0.38 -0.14 0.00 0.08 0.00 0.00 59.36 59.03 3kfo h GLU 1112Cb 0.55 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3kfo h GLU 1112CO 0.03 1.06 -0.26 0.82 -2.18 0.00 0.00 179.01 178.48 3kfo h ILE 1113N 0.86 1.27 -0.78 2.32 2.04 -0.89 -1.79 117.51 120.54 3kfo h ILE 1113Ca 0.12 -1.43 0.10 0.00 1.00 0.00 0.00 64.86 64.65 3kfo h ILE 1113Cb 0.72 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 37.93 3kfo h ILE 1113CO 0.06 0.49 0.42 0.22 0.00 0.00 0.00 178.15 179.34 3kfo h TYR 1114N 0.82 0.76 -0.50 1.37 3.20 -0.66 -0.26 116.97 121.70 3kfo h TYR 1114Ca 0.10 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.02 3kfo h TYR 1114Cb 0.85 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.86 3kfo h TYR 1114CO 0.06 0.29 0.30 1.49 -1.64 0.00 0.00 178.16 178.65 3kfo h GLU 1115N 0.70 0.57 -0.60 1.82 4.81 -0.56 0.13 114.58 121.45 3kfo h GLU 1115Ca 0.39 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.62 3kfo h GLU 1115Cb 0.39 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3kfo h GLU 1115CO -0.27 0.38 0.36 0.93 -0.73 0.00 0.00 179.01 179.68 3kfo h GLU 1116N 0.59 0.67 -0.50 1.92 5.08 -0.56 0.05 114.58 121.82 3kfo h GLU 1116Ca 0.20 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 3kfo h GLU 1116Cb 0.02 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 3kfo h GLU 1116CO -0.09 0.44 0.24 0.82 -1.00 0.00 0.00 179.01 179.43 3kfo h ILE 1117N 0.69 1.19 -0.56 3.13 2.04 -0.73 -1.61 117.51 121.66 3kfo h ILE 1117Ca 0.25 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3kfo h ILE 1117Cb 0.07 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 3kfo h ILE 1117CO -0.12 0.22 0.36 0.28 0.00 0.00 0.00 178.15 178.88 3kfo h SER 1118N 0.67 0.65 -0.76 1.72 0.02 -0.49 -1.12 113.55 114.25 3kfo h SER 1118Ca 0.17 -0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 3kfo h SER 1118Cb 0.12 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 3kfo h SER 1118CO -0.02 0.49 0.42 1.56 -1.14 0.00 0.00 176.83 178.14 3kfo h GLN 1119N 0.76 1.05 -0.78 3.45 4.20 -0.80 -2.39 115.11 120.60 3kfo h GLN 1119Ca 0.20 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 3kfo h GLN 1119Cb -0.06 -0.21 -0.03 0.00 0.30 0.00 0.00 27.48 27.47 3kfo h GLN 1119CO -0.04 0.77 0.30 0.28 -0.67 0.00 0.00 178.83 179.47 3kfo h VAL 1120N 1.04 1.26 -0.85 -0.54 2.07 -0.86 -1.59 116.25 116.77 3kfo h VAL 1120Ca 0.27 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 67.02 3kfo h VAL 1120Cb 0.02 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.07 3kfo h VAL 1120CO -0.04 0.34 0.54 -0.33 0.02 0.00 0.00 177.57 178.09 3kfo h GLU 1121N 1.13 0.97 -0.25 1.57 5.08 -0.98 -1.99 114.58 120.12 3kfo h GLU 1121Ca 0.26 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.51 3kfo h GLU 1121Cb 0.22 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3kfo h GLU 1121CO -0.02 0.64 -0.06 1.79 -1.00 0.00 0.00 179.01 180.36 3kfo h THR 1122N 1.00 1.19 0.00 1.13 1.35 -0.80 -1.34 112.91 115.44 3kfo h THR 1122Ca 0.36 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 3kfo h THR 1122Cb 0.12 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.61 3kfo h THR 1122CO -0.16 0.25 0.00 -0.07 -0.25 0.00 0.00 175.52 175.30 3kfo h LEU 1123N 0.37 0.00 -3.09 3.87 3.38 -0.74 -2.92 115.31 116.18 3kfo h LEU 1123Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 3kfo h LEU 1123Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3kfo h LEU 1123CO 0.02 0.00 0.00 -3.20 0.09 0.00 0.00 178.44 175.35 3kfo n ASN 1124N -3.03 4.83 -4.64 -0.43 5.15 -0.51 -3.61 115.26 113.01 3kfo n ASN 1124Ca 0.00 -2.57 -0.45 0.00 -0.60 0.00 0.00 54.58 50.96 3kfo n ASN 1124Cb 0.28 -0.60 -0.02 0.00 -0.53 0.00 0.00 39.78 38.90 3kfo n ASN 1124CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3kfo n SER 1125N 0.90 2.18 -2.24 1.20 7.64 -1.10 -1.29 113.62 120.91 3kfo n SER 1125Ca 0.25 1.16 -0.16 0.00 1.01 0.00 0.00 58.87 61.12 3kfo n SER 1125Cb 0.95 -1.36 -0.02 0.00 -1.01 0.00 0.00 64.21 62.76 3kfo n SER 1125CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3kfo n ASP 1126N 1.77 -4.73 -1.28 6.43 3.85 -1.26 -2.39 116.55 118.95 3kfo n ASP 1126Ca 0.11 0.16 -0.17 0.00 -0.71 0.00 0.00 54.79 54.18 3kfo n ASP 1126Cb 0.31 -4.03 -0.07 0.00 -1.35 0.00 0.00 41.12 35.98 3kfo n ASP 1126CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 3kfo n ASN 1127N -1.70 -5.37 0.01 -1.12 4.13 -0.41 -4.89 115.26 105.91 3kfo n ASN 1127Ca -0.19 0.41 0.01 0.00 1.68 0.00 0.00 54.58 56.49 3kfo n ASN 1127Cb 0.63 -4.34 0.32 0.00 -1.54 0.00 0.00 39.78 34.84 3kfo n ASN 1127CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 3kfo h SER 1128N 0.00 0.46 0.01 6.41 4.64 -1.60 -1.37 113.55 122.10 3kfo h SER 1128Ca -0.34 -0.08 -0.21 0.00 -0.47 0.00 0.00 61.79 60.69 3kfo h SER 1128Cb 1.21 -0.12 0.02 0.00 -0.31 0.00 0.00 62.40 63.20 3kfo h SER 1128CO 0.50 0.52 -0.81 0.25 -0.87 0.00 0.00 176.83 176.42 3kfo h LEU 1129N 0.48 0.70 -0.65 5.97 5.85 -1.83 -1.44 115.31 124.38 3kfo h LEU 1129Ca 0.11 -0.76 0.07 0.00 0.84 0.00 0.00 57.88 58.14 3kfo h LEU 1129Cb 0.29 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 3kfo h LEU 1129CO 0.01 1.37 0.33 -0.08 -0.34 0.00 0.00 178.44 179.73 3kfo h GLU 1130N 0.11 0.58 -0.18 1.25 4.81 -1.80 0.11 114.58 119.46 3kfo h GLU 1130Ca -0.10 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.08 3kfo h GLU 1130Cb 1.50 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.74 3kfo h GLU 1130CO 0.16 0.38 0.07 0.82 -0.73 0.00 0.00 179.01 179.71 3kfo h ILE 1131N 0.59 1.16 -0.11 2.32 2.04 -1.27 -1.14 117.51 121.10 3kfo h ILE 1131Ca 0.31 -0.47 -0.12 0.00 1.00 0.00 0.00 64.86 65.57 3kfo h ILE 1131Cb 0.27 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 3kfo h ILE 1131CO -0.23 0.15 -0.48 0.07 0.00 0.00 0.00 178.15 177.66 3kfo h LYS 1132N 0.13 0.28 -0.28 2.37 2.10 -0.98 0.96 116.57 121.16 3kfo h LYS 1132Ca 0.06 -0.15 -0.02 0.00 -2.00 0.00 0.00 60.65 58.54 3kfo h LYS 1132Cb 0.17 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.50 3kfo h LYS 1132CO -0.00 0.70 0.09 -0.07 -2.00 0.00 0.00 179.45 178.17 3kfo h LEU 1133N 0.22 0.40 -0.09 7.07 3.38 -0.68 -1.81 115.31 123.80 3kfo h LEU 1133Ca 0.01 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 3kfo h LEU 1133Cb 0.93 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 3kfo h LEU 1133CO 0.08 0.49 0.03 -0.74 0.09 0.00 0.00 178.44 178.38 3kfo h HIS 1134N 0.28 0.14 -0.29 1.13 2.76 -0.86 -1.87 115.15 116.45 3kfo h HIS 1134Ca 0.09 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.21 3kfo h HIS 1134Cb 0.23 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 3kfo h HIS 1134CO 0.00 0.29 0.03 0.66 -1.30 0.00 0.00 177.93 177.61 3kfo h SER 1135N -0.05 0.47 0.30 3.26 4.64 -0.86 0.27 113.55 121.59 3kfo h SER 1135Ca 0.03 -0.28 -0.01 0.00 -0.47 0.00 0.00 61.79 61.06 3kfo h SER 1135Cb 0.22 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3kfo h SER 1135CO -0.00 0.64 -0.22 0.74 -0.87 0.00 0.00 176.83 177.11 3kfo h THR 1136N 0.29 0.53 -0.36 2.95 2.02 -1.26 0.68 112.91 117.76 3kfo h THR 1136Ca 0.08 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 3kfo h THR 1136Cb 0.38 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 3kfo h THR 1136CO 0.01 0.00 0.18 0.40 0.37 0.00 0.00 175.52 176.48 3kfo h ILE 1137N -0.52 1.15 -0.71 3.11 2.04 -1.29 -1.16 117.51 120.13 3kfo h ILE 1137Ca -0.02 -0.42 0.09 0.00 1.00 0.00 0.00 64.86 65.50 3kfo h ILE 1137Cb 0.45 0.78 -0.07 0.00 -0.74 0.00 0.00 36.82 37.24 3kfo h ILE 1137CO 0.00 0.16 0.35 1.23 0.00 0.00 0.00 178.15 179.90 3kfo h GLY 1138N 0.45 1.06 1.20 5.37 0.00 -0.33 -1.20 103.07 109.61 3kfo h GLY 1138Ca 0.13 -0.22 -0.25 0.00 0.00 0.00 0.00 47.33 46.98 3kfo h GLY 1138CO -0.02 0.06 -0.96 1.76 0.00 0.00 0.00 176.54 177.38 3kfo h SER 1139N 0.61 0.93 -0.41 0.19 0.02 -0.51 -1.58 113.55 112.80 3kfo h SER 1139Ca 0.35 -0.70 -0.08 0.00 -0.84 0.00 0.00 61.79 60.52 3kfo h SER 1139Cb 0.36 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3kfo h SER 1139CO -0.26 1.50 -0.01 0.58 -1.14 0.00 0.00 176.83 177.50 3kfo h VAL 1140N 0.44 1.24 0.00 2.27 2.07 -1.14 -3.17 116.25 117.97 3kfo h VAL 1140Ca -0.11 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3kfo h VAL 1140Cb 1.61 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.26 3kfo h VAL 1140CO 0.19 0.36 -0.01 0.00 0.02 0.00 0.00 177.57 178.13 3kfo h ALA 1141N 1.24 0.99 0.01 1.67 0.00 -1.07 -3.41 119.26 118.69 3kfo h ALA 1141Ca 0.14 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.08 3kfo h ALA 1141Cb 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 3kfo h ALA 1141CO 0.02 0.00 -0.40 -0.22 0.00 0.00 0.00 179.25 178.65 3kfo h LYS 1142N 0.00 -0.54 -0.18 0.00 3.64 -1.26 -2.25 116.57 115.98 3kfo h LYS 1142Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3kfo h LYS 1142Cb 0.81 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 3kfo h LYS 1142CO 0.00 -0.36 0.00 0.39 -2.27 0.00 0.00 179.45 177.21 3kfo n GLU 1143N -5.45 2.35 -1.94 1.90 -0.58 -1.26 -4.94 120.64 110.72 3kfo n GLU 1143Ca -0.06 -2.06 -0.30 0.00 -0.42 0.00 0.00 57.16 54.32 3kfo n GLU 1143Cb 0.36 -1.47 0.02 0.00 -0.57 0.00 0.00 31.44 29.78 3kfo n GLU 1143CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 3kfo s LYS 1144N -1.74 3.38 -0.94 3.49 3.01 -0.85 -4.97 119.74 121.13 3kfo s LYS 1144Ca 0.32 0.61 -0.06 0.00 -1.01 0.00 0.00 55.97 55.83 3kfo s LYS 1144Cb 0.21 -2.09 -0.02 0.00 -1.01 0.00 0.00 37.83 34.92 3kfo s LYS 1144CO 0.30 -0.67 2.85 -1.71 0.51 0.00 0.00 175.35 176.63 3kfo n ASN 1145N -2.78 7.32 -3.83 2.83 5.15 -1.26 -4.81 115.26 117.88 3kfo n ASN 1145Ca 0.06 -2.90 -0.12 0.00 -0.60 0.00 0.00 54.58 51.02 3kfo n ASN 1145Cb 0.55 -1.39 -0.10 0.00 -0.53 0.00 0.00 39.78 38.32 3kfo n ASN 1145CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 3kfo s TYR 1146N -0.09 -0.05 0.08 1.20 2.02 -1.26 -0.97 117.35 118.28 3kfo s TYR 1146Ca 0.62 0.05 0.09 0.00 -0.37 0.00 0.00 57.07 57.46 3kfo s TYR 1146Cb 0.26 0.01 -0.04 0.00 -0.40 0.00 0.00 41.96 41.79 3kfo s TYR 1146CO -0.10 -0.31 -0.22 -0.08 -1.57 0.00 0.00 175.55 173.27 3kfo s THR 1147N -1.26 2.56 -0.29 -0.71 -1.32 -0.05 -4.86 115.64 109.71 3kfo s THR 1147Ca -0.13 -1.43 -0.21 0.00 -1.21 0.00 0.00 61.69 58.71 3kfo s THR 1147Cb -0.06 -2.10 -0.01 0.00 -1.51 0.00 0.00 72.50 68.82 3kfo s THR 1147CO 0.02 0.23 0.66 -0.63 -2.21 0.00 0.00 174.62 172.69 3kfo s ILE 1148N -0.98 4.93 -1.14 5.08 -1.09 -1.26 -1.00 121.20 125.73 3kfo s ILE 1148Ca 0.15 1.00 -0.18 0.00 -2.23 0.00 0.00 60.65 59.39 3kfo s ILE 1148Cb -0.10 -4.00 0.11 0.00 -1.58 0.00 0.00 42.46 36.88 3kfo s ILE 1148CO 0.06 -0.10 1.45 0.21 -1.23 0.00 0.00 174.94 175.33 3kfo s ASN 1149N 1.58 6.80 0.64 3.58 3.84 0.14 -4.86 114.94 126.65 3kfo s ASN 1149Ca 0.27 -2.34 0.30 0.00 0.21 0.00 0.00 52.86 51.29 3kfo s ASN 1149Cb -0.15 -2.48 1.63 0.00 -0.55 0.00 0.00 41.25 39.69 3kfo s ASN 1149CO 0.11 -1.08 1.91 0.10 -2.79 0.00 0.00 177.10 175.35 3kfo h TYR 1150N 8.14 0.00 0.85 0.43 -0.00 -1.94 -0.14 116.97 124.32 3kfo h TYR 1150Ca 0.30 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 58.98 3kfo h TYR 1150Cb 0.93 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.67 3kfo h TYR 1150CO 1.24 0.00 -0.41 1.05 -0.00 0.00 0.00 178.16 180.04 3kfo h GLU 1151N 0.00 -1.10 -0.64 0.10 9.09 -1.94 -3.23 114.58 116.86 3kfo h GLU 1151Ca 0.00 0.07 0.00 0.00 0.05 0.00 0.00 59.36 59.48 3kfo h GLU 1151Cb 0.59 0.25 0.00 0.00 -1.65 0.00 0.00 28.75 27.94 3kfo h GLU 1151CO 0.00 -0.73 0.00 0.25 0.05 0.00 0.00 179.01 178.58 3kfo n THR 1152N -5.55 2.03 -3.38 -1.06 -2.24 -0.79 -4.95 114.28 98.35 3kfo n THR 1152Ca -0.15 -1.19 -0.16 0.00 -2.27 0.00 0.00 64.05 60.28 3kfo n THR 1152Cb 0.45 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 3kfo n THR 1152CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3kfo n ASN 1153N 0.92 -2.44 -4.03 3.42 5.15 -0.13 -4.87 115.26 113.28 3kfo n ASN 1153Ca 0.25 -0.57 -0.08 0.00 -0.60 0.00 0.00 54.58 53.58 3kfo n ASN 1153Cb 0.96 -0.84 -0.10 0.00 -0.53 0.00 0.00 39.78 39.26 3kfo n ASN 1153CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 3kfo s THR 1154N -2.95 0.16 -0.17 -0.44 -1.32 -0.90 -2.71 115.64 107.31 3kfo s THR 1154Ca 0.07 -1.33 -0.10 0.00 -1.21 0.00 0.00 61.69 59.11 3kfo s THR 1154Cb -0.04 -0.86 -0.05 0.00 -1.51 0.00 0.00 72.50 70.04 3kfo s THR 1154CO 0.49 -0.74 0.17 -0.69 -2.21 0.00 0.00 174.62 171.64 3kfo s VAL 1155N -2.64 5.40 0.01 5.08 1.01 -0.76 0.26 120.40 128.76 3kfo s VAL 1155Ca -0.05 0.27 0.07 0.00 0.00 0.00 0.00 61.98 62.27 3kfo s VAL 1155Cb -0.01 -3.49 -0.02 0.00 0.00 0.00 0.00 36.38 32.86 3kfo s VAL 1155CO -0.05 0.47 -0.21 -1.83 0.00 0.00 0.00 175.10 173.48 3kfo s GLU 1156N 0.04 1.56 0.19 2.72 -1.05 -0.17 -2.59 118.70 119.40 3kfo s GLU 1156Ca 0.11 -0.84 -0.31 0.00 -0.15 0.00 0.00 54.97 53.79 3kfo s GLU 1156Cb -0.12 -1.58 -0.10 0.00 -0.44 0.00 0.00 34.13 31.89 3kfo s GLU 1156CO 0.01 0.42 1.47 -0.47 0.95 0.00 0.00 175.26 177.64 3kfo s TYR 1157N -0.63 3.09 -2.89 4.83 5.04 -1.26 -0.87 117.35 124.66 3kfo s TYR 1157Ca 0.08 0.88 0.25 0.00 -2.44 0.00 0.00 57.07 55.83 3kfo s TYR 1157Cb -0.08 -3.82 0.38 0.00 0.35 0.00 0.00 41.96 38.78 3kfo s TYR 1157CO 0.00 -2.85 1.37 0.39 -1.34 0.00 0.00 175.55 173.12