#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3aaf s TRP 957 N 0.00 -0.19 -0.50 1.43 -0.11 -1.03 -4.97 118.94 113.58 3aaf s TRP 957 Ca 0.00 0.43 -0.24 0.00 1.22 0.00 0.00 56.10 57.51 3aaf s TRP 957 Cb 0.00 0.06 0.03 0.00 -1.50 0.00 0.00 33.47 32.07 3aaf s TRP 957 CO 0.00 -0.18 0.89 0.34 -4.62 0.00 0.00 176.95 173.38 3aaf s ASP 958 N -0.32 6.39 -0.20 5.86 2.15 -1.26 -1.34 116.67 127.96 3aaf s ASP 958 Ca -0.04 -0.19 0.14 0.00 0.43 0.00 0.00 52.55 52.88 3aaf s ASP 958 Cb -0.03 -2.42 0.74 0.00 -0.30 0.00 0.00 42.92 40.91 3aaf s ASP 958 CO 0.01 -1.09 1.63 0.49 -0.17 0.00 0.00 175.17 176.04 3aaf n PHE 959 N 7.15 1.82 -0.18 -5.34 3.72 0.39 -4.69 117.46 120.33 3aaf n PHE 959 Ca 0.03 -0.64 -0.01 0.00 -0.05 0.00 0.00 57.45 56.77 3aaf n PHE 959 Cb 0.48 -0.43 0.06 0.00 -0.94 0.00 0.00 39.48 38.65 3aaf n PHE 959 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3aaf h GLY 960 N 4.16 0.49 0.71 1.37 0.00 -1.78 0.79 103.07 108.81 3aaf h GLY 960 Ca 0.00 0.13 0.06 0.00 0.00 0.00 0.00 47.33 47.52 3aaf h GLY 960 CO 0.41 -0.19 0.50 -2.55 0.00 0.00 0.00 176.54 174.70 3aaf h PRO 961 N 0.05 0.88 -0.15 4.80 0.11 -1.84 0.16 132.00 136.02 3aaf h PRO 961 Ca 0.28 -0.05 -0.22 0.00 0.11 0.00 0.00 66.00 66.11 3aaf h PRO 961 Cb 0.43 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 31.35 3aaf h PRO 961 CO -0.52 0.58 -0.77 1.96 -0.21 0.00 0.00 178.00 179.04 3aaf h GLN 962 N 0.91 0.75 -0.93 1.05 7.50 -1.77 -2.97 115.11 119.64 3aaf h GLN 962 Ca 0.36 -0.61 -0.00 0.00 0.50 0.00 0.00 58.65 58.90 3aaf h GLN 962 Cb 0.17 0.13 -0.05 0.00 0.05 0.00 0.00 27.48 27.78 3aaf h GLN 962 CO -0.17 1.22 0.57 0.00 -1.50 0.00 0.00 178.83 178.94 3aaf h ALA 963 N 0.61 1.19 -0.44 3.87 0.00 -0.62 -1.57 119.26 122.30 3aaf h ALA 963 Ca -0.05 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.82 3aaf h ALA 963 Cb 1.39 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 3aaf h ALA 963 CO 0.16 0.64 0.16 0.35 0.00 0.00 0.00 179.25 180.55 3aaf h PHE 964 N 1.28 0.29 -0.13 0.00 3.57 -0.65 0.96 116.94 122.26 3aaf h PHE 964 Ca 0.34 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.85 3aaf h PHE 964 Cb -0.07 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 3aaf h PHE 964 CO 0.00 0.11 0.07 0.87 -2.23 0.00 0.00 178.31 177.13 3aaf h LYS 965 N 0.34 0.18 -0.06 1.11 1.57 -1.29 -0.97 116.57 117.45 3aaf h LYS 965 Ca 0.20 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.91 3aaf h LYS 965 Cb 0.19 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3aaf h LYS 965 CO -0.20 0.21 -0.16 1.25 -0.57 0.00 0.00 179.45 179.98 3aaf h LEU 966 N 0.10 0.24 -0.96 2.94 5.85 -1.03 0.07 115.31 122.53 3aaf h LEU 966 Ca 0.04 -0.59 -0.06 0.00 0.84 0.00 0.00 57.88 58.11 3aaf h LEU 966 Cb 0.08 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3aaf h LEU 966 CO -0.01 0.79 0.10 -0.07 -0.34 0.00 0.00 178.44 178.92 3aaf h LEU 967 N -0.29 0.81 -0.58 2.25 3.38 -0.88 -1.08 115.31 118.91 3aaf h LEU 967 Ca -0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 3aaf h LEU 967 Cb 0.76 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 3aaf h LEU 967 CO 0.03 0.81 0.34 0.28 0.09 0.00 0.00 178.44 179.99 3aaf h SER 968 N 0.82 0.71 -0.70 -0.43 0.02 -1.08 -1.88 113.55 111.01 3aaf h SER 968 Ca 0.17 -0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.06 3aaf h SER 968 Cb 0.34 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.67 3aaf h SER 968 CO 0.00 0.58 0.46 0.00 -1.14 0.00 0.00 176.83 176.74 3aaf h ALA 969 N 1.16 0.89 -0.22 3.77 0.00 -0.25 0.13 119.26 124.74 3aaf h ALA 969 Ca 0.21 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.08 3aaf h ALA 969 Cb 0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3aaf h ALA 969 CO -0.04 0.30 0.10 0.28 0.00 0.00 0.00 179.25 179.90 3aaf h VAL 970 N 0.94 0.99 0.02 0.00 2.07 -1.12 -1.75 116.25 117.39 3aaf h VAL 970 Ca 0.26 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.72 3aaf h VAL 970 Cb -0.10 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 3aaf h VAL 970 CO -0.06 0.04 -0.13 -0.78 0.02 0.00 0.00 177.57 176.66 3aaf h ASP 971 N 0.22 -0.37 -0.99 0.57 3.58 -0.86 -2.95 116.42 115.63 3aaf h ASP 971 Ca 0.09 0.05 0.02 0.00 0.42 0.00 0.00 57.03 57.62 3aaf h ASP 971 Cb 0.03 0.15 -0.05 0.00 1.72 0.00 0.00 39.33 41.18 3aaf h ASP 971 CO -0.07 -0.18 0.65 0.40 -2.88 0.00 0.00 179.24 177.16 3aaf h ILE 972 N -0.23 1.21 -0.00 2.25 2.04 -0.57 -1.85 117.51 120.36 3aaf h ILE 972 Ca 0.04 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.46 3aaf h ILE 972 Cb 0.28 -0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.16 3aaf h ILE 972 CO -0.12 0.24 -0.03 0.18 0.00 0.00 0.00 178.15 178.42 3aaf n LEU 973 N -4.41 0.39 0.00 1.44 4.32 -0.68 -4.93 117.00 113.13 3aaf n LEU 973 Ca 0.13 -0.05 0.00 0.00 -0.02 0.00 0.00 56.01 56.06 3aaf n LEU 973 Cb 0.06 -0.08 0.00 0.00 -1.62 0.00 0.00 43.42 41.77 3aaf n LEU 973 CO 0.36 0.07 0.00 0.61 -1.22 0.00 0.00 177.39 177.20 3aaf n GLY 974 N 1.14 0.47 3.89 -0.72 0.00 -0.70 -4.06 105.19 105.20 3aaf n GLY 974 Ca 0.19 -0.41 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 3aaf n GLY 974 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3aaf n GLU 975 N -2.97 -5.35 0.00 1.61 1.02 -1.18 -4.86 120.64 108.90 3aaf n GLU 975 Ca 0.00 0.59 0.06 0.00 -0.02 0.00 0.00 57.16 57.79 3aaf n GLU 975 Cb 0.00 -5.41 -0.03 0.00 -0.02 0.00 0.00 31.44 25.98 3aaf n GLU 975 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3aaf n LYS 976 N -4.61 2.48 -4.42 3.49 5.02 -1.26 -4.80 118.16 114.06 3aaf n LYS 976 Ca -0.02 -0.35 -0.21 0.00 -2.02 0.00 0.00 58.31 55.71 3aaf n LYS 976 Cb 0.55 -1.11 -0.10 0.00 -0.02 0.00 0.00 35.03 34.35 3aaf n LYS 976 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3aaf s PHE 977 N -1.86 1.89 1.15 2.13 0.08 -1.26 -4.92 117.98 115.19 3aaf s PHE 977 Ca 0.08 -0.84 -0.19 0.00 0.12 0.00 0.00 56.93 56.09 3aaf s PHE 977 Cb 0.10 -1.15 0.28 0.00 -0.57 0.00 0.00 43.02 41.68 3aaf s PHE 977 CO 0.40 0.12 1.20 0.41 -0.10 0.00 0.00 175.22 177.25 3aaf n GLY 978 N -0.59 -2.29 0.22 4.36 0.00 -1.25 -1.71 105.19 103.93 3aaf n GLY 978 Ca -0.04 -1.58 0.15 0.00 0.00 0.00 0.00 46.02 44.55 3aaf n GLY 978 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3aaf h ILE 979 N -2.38 0.00 -0.43 -0.61 6.09 -1.91 -3.02 117.51 115.25 3aaf h ILE 979 Ca -0.43 -0.38 -0.01 0.00 -1.37 0.00 0.00 64.86 62.68 3aaf h ILE 979 Cb 1.25 1.27 -0.02 0.00 0.47 0.00 0.00 36.82 39.78 3aaf h ILE 979 CO 0.29 0.00 0.23 1.23 -3.07 0.00 0.00 178.15 176.83 3aaf h GLY 980 N 2.06 0.63 0.49 8.18 0.00 -1.99 -2.30 103.07 110.13 3aaf h GLY 980 Ca 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 3aaf h GLY 980 CO 0.00 0.26 -0.02 1.41 0.00 0.00 0.00 176.54 178.19 3aaf h LEU 981 N 0.60 0.03 -1.00 3.11 3.38 -1.90 -0.19 115.31 119.33 3aaf h LEU 981 Ca 0.15 -0.53 0.23 0.00 0.09 0.00 0.00 57.88 57.82 3aaf h LEU 981 Cb 0.03 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 40.65 3aaf h LEU 981 CO -0.02 0.56 0.59 -0.65 0.09 0.00 0.00 178.44 179.01 3aaf h PRO 982 N -0.50 0.61 -0.21 1.13 0.11 -1.71 -0.76 132.00 130.67 3aaf h PRO 982 Ca 0.00 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.04 3aaf h PRO 982 Cb 0.55 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 3aaf h PRO 982 CO 0.00 0.40 0.01 0.82 -0.21 0.00 0.00 178.00 179.03 3aaf h ILE 983 N 0.63 1.25 -0.71 4.15 2.04 -1.20 -1.26 117.51 122.41 3aaf h ILE 983 Ca 0.62 -0.84 0.10 0.00 1.00 0.00 0.00 64.86 65.74 3aaf h ILE 983 Cb 1.13 1.39 -0.07 0.00 -0.74 0.00 0.00 36.82 38.52 3aaf h ILE 983 CO -0.45 0.26 0.34 -0.07 0.00 0.00 0.00 178.15 178.23 3aaf h LEU 984 N 0.13 0.43 0.05 1.44 3.38 -0.59 0.24 115.31 120.38 3aaf h LEU 984 Ca 0.06 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.12 3aaf h LEU 984 Cb 0.37 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3aaf h LEU 984 CO 0.01 0.24 -0.23 0.15 0.09 0.00 0.00 178.44 178.70 3aaf h PHE 985 N 0.57 -0.60 -0.31 1.13 3.57 -0.94 -0.63 116.94 119.73 3aaf h PHE 985 Ca 0.35 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.81 3aaf h PHE 985 Cb 0.40 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 3aaf h PHE 985 CO -0.12 -0.32 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.53 3aaf h LEU 986 N -0.39 0.47 -0.40 0.59 3.38 -0.86 -0.37 115.31 117.74 3aaf h LEU 986 Ca 0.05 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3aaf h LEU 986 Cb 0.44 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3aaf h LEU 986 CO -0.17 0.58 0.00 0.54 0.09 0.00 0.00 178.44 179.48 3aaf n ARG 987 N -4.25 1.27 -2.82 1.13 1.74 0.04 -0.19 116.66 113.57 3aaf n ARG 987 Ca 0.01 -0.40 -0.10 0.00 -0.77 0.00 0.00 57.85 56.59 3aaf n ARG 987 Cb 0.27 -1.41 0.03 0.00 -1.02 0.00 0.00 32.46 30.33 3aaf n ARG 987 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3aaf n GLY 988 N 1.00 0.22 3.77 -0.13 0.00 -0.86 -4.71 105.19 104.48 3aaf n GLY 988 Ca 0.19 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 3aaf n GLY 988 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3aaf s SER 989 N -3.03 6.45 -0.08 1.61 0.15 -0.30 -4.90 113.70 113.61 3aaf s SER 989 Ca 0.21 2.33 0.13 0.00 0.70 0.00 0.00 55.95 59.32 3aaf s SER 989 Cb -0.09 -2.61 0.52 0.00 -1.71 0.00 0.00 66.02 62.13 3aaf s SER 989 CO 0.26 -0.72 1.39 0.59 1.20 0.00 0.00 173.24 175.95 3aaf n ASN 990 N -0.05 3.56 -4.64 5.45 3.02 -1.26 -4.91 115.26 116.43 3aaf n ASN 990 Ca 0.05 -2.31 -0.42 0.00 -0.03 0.00 0.00 54.58 51.86 3aaf n ASN 990 Cb 0.47 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 39.15 3aaf n ASN 990 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3aaf n SER 991 N 0.76 1.76 0.29 6.41 2.88 -1.26 -4.90 113.62 119.56 3aaf n SER 991 Ca 0.19 1.11 0.17 0.00 -1.33 0.00 0.00 58.87 59.01 3aaf n SER 991 Cb 0.67 -1.39 0.83 0.00 -0.75 0.00 0.00 64.21 63.58 3aaf n SER 991 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 3aaf h GLN 992 N 1.93 0.00 -0.15 -1.46 3.07 -2.03 -2.90 115.11 113.58 3aaf h GLN 992 Ca -0.44 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.26 3aaf h GLN 992 Cb 1.32 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.87 3aaf h GLN 992 CO 0.59 0.04 -0.08 0.00 0.09 0.00 0.00 178.83 179.48 3aaf h ARG 993 N 0.00 0.22 -5.22 0.06 3.08 -2.00 -3.41 114.38 107.10 3aaf h ARG 993 Ca -0.00 -0.04 -0.61 0.00 0.07 0.00 0.00 59.98 59.40 3aaf h ARG 993 Cb 0.34 -0.04 -0.13 0.00 0.08 0.00 0.00 29.97 30.22 3aaf h ARG 993 CO 0.01 0.31 -0.35 -1.17 -1.07 0.00 0.00 179.97 177.70 3aaf s LEU 994 N -8.87 4.12 0.49 3.04 2.96 -1.10 -5.07 118.68 114.25 3aaf s LEU 994 Ca -0.06 0.29 -0.22 0.00 -0.22 0.00 0.00 54.13 53.92 3aaf s LEU 994 Cb 0.16 -2.31 -0.06 0.00 0.50 0.00 0.00 46.19 44.47 3aaf s LEU 994 CO 0.72 -0.03 1.21 0.00 -1.32 0.00 0.00 176.35 176.93 3aaf s ALA 995 N 1.33 2.90 0.35 5.97 0.00 -1.26 -4.88 121.76 126.17 3aaf s ALA 995 Ca 0.13 1.03 0.02 0.00 0.00 0.00 0.00 51.96 53.15 3aaf s ALA 995 Cb -0.14 -3.43 0.63 0.00 0.00 0.00 0.00 23.12 20.18 3aaf s ALA 995 CO 0.07 -0.86 1.99 -0.44 0.00 0.00 0.00 175.76 176.52 3aaf h ASP 996 N 1.80 0.70 -0.93 0.00 3.45 -1.95 -2.68 116.42 116.80 3aaf h ASP 996 Ca -0.50 -0.03 0.26 0.00 0.43 0.00 0.00 57.03 57.19 3aaf h ASP 996 Cb 1.26 -0.18 -0.05 0.00 -0.56 0.00 0.00 39.33 39.81 3aaf h ASP 996 CO 0.59 0.53 0.65 0.06 -1.57 0.00 0.00 179.24 179.51 3aaf h GLN 997 N 0.81 0.11 0.00 3.56 3.07 -2.03 -0.82 115.11 119.81 3aaf h GLN 997 Ca 0.21 -0.01 -0.06 0.00 0.09 0.00 0.00 58.65 58.89 3aaf h GLN 997 Cb -0.04 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 27.48 3aaf h GLN 997 CO -0.04 0.07 -0.30 1.88 0.09 0.00 0.00 178.83 180.53 3aaf h TYR 998 N 0.11 0.00 0.00 0.06 0.05 -1.87 -3.05 116.97 112.28 3aaf h TYR 998 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.24 3aaf h TYR 998 Cb 1.63 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.37 3aaf h TYR 998 CO -0.00 0.30 0.00 0.54 -1.05 0.00 0.00 178.16 177.95 3aaf n ARG 999 N -3.21 0.02 0.14 4.88 1.74 -0.31 -1.73 116.66 118.18 3aaf n ARG 999 Ca 0.02 0.27 0.08 0.00 -0.77 0.00 0.00 57.85 57.45 3aaf n ARG 999 Cb 0.61 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.61 3aaf n ARG 999 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3aaf h ARG 1000N 0.00 0.00 -6.93 5.56 3.08 -1.63 -3.47 114.38 110.99 3aaf h ARG 1000Ca 0.00 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.53 3aaf h ARG 1000Cb 0.21 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.33 3aaf h ARG 1000CO 0.00 0.17 0.59 -1.58 -1.07 0.00 0.00 179.97 178.08 3aaf s HIS 1001N -3.15 2.92 0.51 3.04 2.46 -0.71 -4.91 115.29 115.46 3aaf s HIS 1001Ca 0.03 1.44 0.30 0.00 0.47 0.00 0.00 55.06 57.30 3aaf s HIS 1001Cb 0.07 -3.62 1.72 0.00 -0.13 0.00 0.00 32.58 30.63 3aaf s HIS 1001CO 0.74 -1.88 2.19 0.66 -2.47 0.00 0.00 174.74 173.98 3aaf h SER 1002N 2.83 0.00 0.85 9.88 4.64 -1.91 -2.14 113.55 127.70 3aaf h SER 1002Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3aaf h SER 1002Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3aaf h SER 1002CO 0.63 0.05 -0.24 0.18 -0.87 0.00 0.00 176.83 176.58 3aaf n LEU 1003N -3.67 0.32 -4.69 5.97 4.77 -1.26 -4.80 117.00 113.63 3aaf n LEU 1003Ca -0.02 0.30 -0.42 0.00 -0.03 0.00 0.00 56.01 55.84 3aaf n LEU 1003Cb 0.15 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.84 3aaf n LEU 1003CO 0.28 0.02 1.47 0.12 -1.33 0.00 0.00 177.39 177.95 3aaf s PHE 1004N -3.02 2.22 0.00 -1.77 5.36 -0.81 -1.80 117.98 118.16 3aaf s PHE 1004Ca 0.12 0.00 0.00 0.00 -0.96 0.00 0.00 56.93 56.09 3aaf s PHE 1004Cb 0.17 -4.18 0.00 0.00 -0.34 0.00 0.00 43.02 38.67 3aaf s PHE 1004CO 0.61 -4.84 0.00 0.41 -1.46 0.00 0.00 175.22 169.94 3aaf n GLY 1005N 4.22 0.42 0.37 13.12 0.00 -0.17 -4.85 105.19 118.30 3aaf n GLY 1005Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 3aaf n GLY 1005CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3aaf n THR 1006N -2.68 0.05 -1.13 2.61 -2.24 -0.75 -3.67 114.28 106.46 3aaf n THR 1006Ca 0.00 -0.21 0.06 0.00 -2.27 0.00 0.00 64.05 61.63 3aaf n THR 1006Cb 0.10 0.23 0.22 0.00 -2.10 0.00 0.00 70.33 68.78 3aaf n THR 1006CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3aaf n GLY 1007N 1.11 4.47 0.28 3.38 0.00 0.74 -4.70 105.19 110.46 3aaf n GLY 1007Ca 0.19 -1.12 0.15 0.00 0.00 0.00 0.00 46.02 45.24 3aaf n GLY 1007CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3aaf h LYS 1008N 1.17 0.00 -0.51 1.61 1.57 -1.62 -2.99 116.57 115.80 3aaf h LYS 1008Ca 0.05 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.89 3aaf h LYS 1008Cb 1.37 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.65 3aaf h LYS 1008CO 0.20 0.08 0.34 -0.44 -0.57 0.00 0.00 179.45 179.06 3aaf h ASP 1009N 0.00 0.37 -3.26 0.86 3.32 -1.90 -3.42 116.42 112.39 3aaf h ASP 1009Ca -0.00 0.00 -0.66 0.00 0.02 0.00 0.00 57.03 56.39 3aaf h ASP 1009Cb 0.30 -0.08 -0.12 0.00 0.22 0.00 0.00 39.33 39.65 3aaf h ASP 1009CO 0.01 0.24 -0.62 -1.10 -1.72 0.00 0.00 179.24 176.05 3aaf s GLN 1010N -5.40 2.85 0.76 3.56 1.11 -1.13 -5.11 119.66 116.30 3aaf s GLN 1010Ca -0.08 -0.62 -0.11 0.00 0.01 0.00 0.00 55.36 54.57 3aaf s GLN 1010Cb 0.19 -2.71 0.05 0.00 -1.01 0.00 0.00 33.01 29.52 3aaf s GLN 1010CO 0.74 0.61 1.08 0.95 0.01 0.00 0.00 175.29 178.68 3aaf s THR 1011N -1.19 3.50 0.28 -0.19 -4.23 -1.26 -4.86 115.64 107.68 3aaf s THR 1011Ca 0.23 0.49 -0.03 0.00 -1.18 0.00 0.00 61.69 61.20 3aaf s THR 1011Cb -0.12 -3.14 0.27 0.00 1.34 0.00 0.00 72.50 70.85 3aaf s THR 1011CO 0.14 -0.63 1.93 -0.08 -0.54 0.00 0.00 174.62 175.44 3aaf h GLU 1012N -0.99 1.14 -0.60 3.99 4.81 -1.96 -1.74 114.58 119.23 3aaf h GLU 1012Ca -0.45 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 3aaf h GLU 1012Cb 1.24 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.33 3aaf h GLU 1012CO 0.56 0.76 0.35 1.03 -0.73 0.00 0.00 179.01 180.97 3aaf h SER 1013N 1.18 0.74 -0.07 1.04 0.87 -1.99 -1.45 113.55 113.86 3aaf h SER 1013Ca 0.36 -0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.85 3aaf h SER 1013Cb -0.01 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.75 3aaf h SER 1013CO -0.10 0.60 0.04 -0.25 -0.53 0.00 0.00 176.83 176.59 3aaf h TRP 1014N 0.82 0.09 -0.72 2.24 7.01 -1.75 -1.25 115.95 122.40 3aaf h TRP 1014Ca 0.21 0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.23 3aaf h TRP 1014Cb 0.01 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.00 3aaf h TRP 1014CO -0.02 0.09 0.48 -1.49 -2.79 0.00 0.00 178.44 174.71 3aaf h TRP 1015N 0.07 0.90 -0.12 2.65 4.06 -1.15 0.11 115.95 122.46 3aaf h TRP 1015Ca 0.03 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.99 3aaf h TRP 1015Cb 0.02 -0.30 -0.00 0.00 -1.00 0.00 0.00 29.16 27.88 3aaf h TRP 1015CO -0.06 0.56 0.04 0.87 -3.56 0.00 0.00 178.44 176.29 3aaf h LYS 1016N 0.96 0.18 -0.73 0.49 1.79 -0.99 -0.13 116.57 118.15 3aaf h LYS 1016Ca 0.27 -0.04 0.05 0.00 -2.18 0.00 0.00 60.65 58.75 3aaf h LYS 1016Cb -0.09 -0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 30.48 3aaf h LYS 1016CO -0.06 0.32 0.44 0.00 -1.08 0.00 0.00 179.45 179.07 3aaf h ALA 1017N 0.85 0.97 -0.46 3.86 0.00 -0.61 -1.57 119.26 122.31 3aaf h ALA 1017Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3aaf h ALA 1017Cb 0.21 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3aaf h ALA 1017CO -0.00 0.17 0.25 0.35 0.00 0.00 0.00 179.25 180.02 3aaf h PHE 1018N 0.82 0.63 -0.74 0.00 3.57 -0.65 -2.56 116.94 118.02 3aaf h PHE 1018Ca 0.31 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 3aaf h PHE 1018Cb 0.11 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 3aaf h PHE 1018CO -0.05 0.48 0.43 0.66 -2.23 0.00 0.00 178.31 177.60 3aaf h SER 1019N 0.60 0.90 -0.63 0.41 4.64 -0.47 -1.72 113.55 117.29 3aaf h SER 1019Ca 0.16 -0.06 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 3aaf h SER 1019Cb 0.06 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.89 3aaf h SER 1019CO -0.03 0.71 0.36 0.03 -0.87 0.00 0.00 176.83 177.03 3aaf h ARG 1020N 1.03 0.86 -0.63 4.77 3.08 -0.96 -1.06 114.38 121.47 3aaf h ARG 1020Ca 0.27 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 3aaf h ARG 1020Cb -0.01 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 3aaf h ARG 1020CO -0.05 0.64 0.28 1.96 -1.07 0.00 0.00 179.97 181.73 3aaf h GLN 1021N 0.85 0.92 -0.03 0.04 1.08 -1.07 -1.33 115.11 115.56 3aaf h GLN 1021Ca 0.22 -0.15 -0.04 0.00 -1.45 0.00 0.00 58.65 57.23 3aaf h GLN 1021Cb 0.01 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.27 3aaf h GLN 1021CO -0.04 0.75 -0.18 -0.07 -0.95 0.00 0.00 178.83 178.34 3aaf h LEU 1022N 0.87 0.05 0.07 1.46 3.38 -0.94 0.15 115.31 120.34 3aaf h LEU 1022Ca 0.21 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 3aaf h LEU 1022Cb 0.15 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3aaf h LEU 1022CO -0.02 0.24 -0.03 0.40 0.09 0.00 0.00 178.44 179.11 3aaf h ILE 1023N 0.05 1.20 -0.66 1.22 2.04 -0.93 0.36 117.51 120.78 3aaf h ILE 1023Ca 0.01 -1.01 0.13 0.00 1.00 0.00 0.00 64.86 65.00 3aaf h ILE 1023Cb 0.35 1.84 -0.10 0.00 -0.74 0.00 0.00 36.82 38.18 3aaf h ILE 1023CO 0.02 0.25 0.14 0.74 0.00 0.00 0.00 178.15 179.30 3aaf h THR 1024N -0.55 0.57 0.00 -0.27 2.02 -0.71 -0.68 112.91 113.28 3aaf h THR 1024Ca -0.01 -0.09 0.00 0.00 0.77 0.00 0.00 66.41 67.08 3aaf h THR 1024Cb 0.47 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 3aaf h THR 1024CO 0.02 0.05 0.00 -0.62 0.37 0.00 0.00 175.52 175.33 3aaf n GLU 1025N -5.15 0.49 -1.26 6.66 -0.58 0.46 -4.91 120.64 116.34 3aaf n GLU 1025Ca 0.11 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.89 3aaf n GLU 1025Cb 0.38 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 3aaf n GLU 1025CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3aaf n GLY 1026N 0.70 0.44 0.09 0.62 0.00 -0.26 -4.95 105.19 101.83 3aaf n GLY 1026Ca 0.14 -0.96 -0.02 0.00 0.00 0.00 0.00 46.02 45.18 3aaf n GLY 1026CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3aaf n PHE 1027N -3.24 1.00 -4.23 1.61 3.72 0.08 -4.32 117.46 112.07 3aaf n PHE 1027Ca 0.00 0.34 -0.15 0.00 -0.05 0.00 0.00 57.45 57.58 3aaf n PHE 1027Cb 0.16 -1.11 -0.11 0.00 -0.94 0.00 0.00 39.48 37.48 3aaf n PHE 1027CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3aaf s LEU 1028N -5.85 2.47 0.02 4.37 1.43 -1.10 -2.23 118.68 117.78 3aaf s LEU 1028Ca -0.03 -0.91 -0.04 0.00 -1.03 0.00 0.00 54.13 52.13 3aaf s LEU 1028Cb 0.08 -0.41 -0.01 0.00 0.03 0.00 0.00 46.19 45.88 3aaf s LEU 1028CO 0.81 -0.25 0.05 -0.69 0.23 0.00 0.00 176.35 176.50 3aaf s VAL 1029N -2.75 0.12 -0.12 -1.59 1.01 -0.15 -4.28 120.40 112.63 3aaf s VAL 1029Ca 0.12 -0.99 -0.04 0.00 0.00 0.00 0.00 61.98 61.06 3aaf s VAL 1029Cb -0.01 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 3aaf s VAL 1029CO 0.01 -0.55 0.04 -1.61 0.00 0.00 0.00 175.10 173.00 3aaf s GLU 1030N -2.01 3.37 -0.01 2.72 2.02 -1.26 -0.78 118.70 122.75 3aaf s GLU 1030Ca -0.10 -0.35 -0.03 0.00 0.02 0.00 0.00 54.97 54.51 3aaf s GLU 1030Cb -0.05 -2.98 -0.00 0.00 0.10 0.00 0.00 34.13 31.19 3aaf s GLU 1030CO -0.02 0.58 0.07 0.14 0.02 0.00 0.00 175.26 176.05 3aaf s VAL 1031N -0.51 0.05 0.35 2.63 -7.23 -0.40 -4.96 120.40 110.32 3aaf s VAL 1031Ca 0.10 -0.43 -0.28 0.00 -1.81 0.00 0.00 61.98 59.56 3aaf s VAL 1031Cb -0.12 -0.25 -0.12 0.00 0.56 0.00 0.00 36.38 36.45 3aaf s VAL 1031CO 0.02 -0.23 1.34 -0.24 -0.31 0.00 0.00 175.10 175.67 3aaf n SER 1032N 2.22 2.99 -3.68 4.85 2.88 -1.26 -0.79 113.62 120.83 3aaf n SER 1032Ca -0.18 1.21 -0.12 0.00 -1.33 0.00 0.00 58.87 58.44 3aaf n SER 1032Cb 0.57 -1.51 -0.06 0.00 -0.75 0.00 0.00 64.21 62.46 3aaf n SER 1032CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 3aaf s ARG 1033N -1.87 0.91 0.00 -1.46 3.52 -1.00 -4.83 118.95 114.23 3aaf s ARG 1033Ca 0.55 -0.42 0.00 0.00 -0.13 0.00 0.00 55.73 55.74 3aaf s ARG 1033Cb -0.55 0.41 0.00 0.00 -1.56 0.00 0.00 34.95 33.24 3aaf s ARG 1033CO 0.62 -0.31 0.00 0.66 -0.81 0.00 0.00 175.30 175.46 3aaf n TYR 1034N 0.46 0.00 -3.68 5.12 4.01 -1.26 -4.07 117.16 117.74 3aaf n TYR 1034Ca -0.18 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.48 3aaf n TYR 1034Cb 0.60 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.64 3aaf n TYR 1034CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 3aaf n ASN 1035N 2.47 -1.61 0.23 7.72 0.23 -1.26 -5.03 115.26 118.01 3aaf n ASN 1035Ca 0.00 -2.27 0.16 0.00 -0.53 0.00 0.00 54.58 51.94 3aaf n ASN 1035Cb 0.00 2.72 0.78 0.00 -2.08 0.00 0.00 39.78 41.20 3aaf n ASN 1035CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 3aaf h LYS 1036N 0.00 0.00 0.05 -3.83 1.57 -2.03 -3.00 116.57 109.32 3aaf h LYS 1036Ca -0.25 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.22 3aaf h LYS 1036Cb 0.94 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.21 3aaf h LYS 1036CO 0.32 0.00 -1.80 1.19 -0.57 0.00 0.00 179.45 178.58 3aaf n PHE 1037N -2.63 1.12 -3.68 -1.35 3.72 -1.26 -5.02 117.46 108.35 3aaf n PHE 1037Ca -0.01 0.33 -0.31 0.00 -0.05 0.00 0.00 57.45 57.42 3aaf n PHE 1037Cb 0.12 -1.18 -0.04 0.00 -0.94 0.00 0.00 39.48 37.44 3aaf n PHE 1037CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 3aaf s MET 1038N -2.59 3.59 0.05 -1.08 -1.94 -1.14 -5.05 119.30 111.16 3aaf s MET 1038Ca -0.11 -0.14 -0.00 0.00 -1.71 0.00 0.00 55.69 53.73 3aaf s MET 1038Cb 0.07 -2.85 -0.04 0.00 2.01 0.00 0.00 34.83 34.03 3aaf s MET 1038CO 0.81 0.46 -0.04 -1.59 -0.01 0.00 0.00 175.02 174.65 3aaf s LYS 1039N -2.76 0.61 0.30 2.03 -2.85 -1.26 -2.38 119.74 113.43 3aaf s LYS 1039Ca 0.40 -1.14 0.07 0.00 -1.00 0.00 0.00 55.97 54.30 3aaf s LYS 1039Cb -0.12 0.09 -0.06 0.00 -2.06 0.00 0.00 37.83 35.68 3aaf s LYS 1039CO 0.26 -0.08 -0.04 0.96 0.10 0.00 0.00 175.35 176.55 3aaf s ILE 1040N -3.40 1.68 -0.13 3.79 -5.25 0.03 -3.74 121.20 114.19 3aaf s ILE 1040Ca 0.04 -2.11 0.01 0.00 -0.99 0.00 0.00 60.65 57.60 3aaf s ILE 1040Cb 0.04 -2.56 -0.01 0.00 2.95 0.00 0.00 42.46 42.88 3aaf s ILE 1040CO -0.07 -0.23 -0.16 0.00 -1.79 0.00 0.00 174.94 172.69 3aaf s ALA 1042N 0.45 1.75 0.25 0.00 0.00 0.04 -4.66 121.76 119.59 3aaf s ALA 1042Ca -0.12 -1.39 -0.30 0.00 0.00 0.00 0.00 51.96 50.15 3aaf s ALA 1042Cb -0.16 -0.13 -0.09 0.00 0.00 0.00 0.00 23.12 22.74 3aaf s ALA 1042CO 0.05 0.17 1.27 -0.51 0.00 0.00 0.00 175.76 176.74 3aaf s LEU 1043N -2.56 4.44 0.89 0.00 1.43 -1.26 -0.98 118.68 120.64 3aaf s LEU 1043Ca 0.12 2.47 -0.14 0.00 -1.03 0.00 0.00 54.13 55.55 3aaf s LEU 1043Cb -0.05 -3.62 0.14 0.00 0.03 0.00 0.00 46.19 42.69 3aaf s LEU 1043CO 0.05 -0.47 1.25 0.42 0.23 0.00 0.00 176.35 177.83 3aaf s THR 1044N -0.48 2.00 0.24 5.49 -4.23 -0.95 -4.83 115.64 112.88 3aaf s THR 1044Ca 0.52 -0.01 -0.06 0.00 -1.18 0.00 0.00 61.69 60.97 3aaf s THR 1044Cb -0.37 -3.00 0.21 0.00 1.34 0.00 0.00 72.50 70.69 3aaf s THR 1044CO 0.43 0.00 1.85 0.11 -0.54 0.00 0.00 174.62 176.47 3aaf h LYS 1045N -1.35 0.91 -0.66 3.99 1.57 -1.90 0.18 116.57 119.31 3aaf h LYS 1045Ca -0.45 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.33 3aaf h LYS 1045Cb 1.28 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.33 3aaf h LYS 1045CO 0.51 0.60 0.38 -0.22 -0.57 0.00 0.00 179.45 180.16 3aaf h LYS 1046N 0.94 0.69 -0.68 3.15 3.64 -1.91 -0.06 116.57 122.34 3aaf h LYS 1046Ca 0.37 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.64 3aaf h LYS 1046Cb 0.18 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.82 3aaf h LYS 1046CO -0.18 0.46 0.15 0.78 -2.27 0.00 0.00 179.45 178.39 3aaf h GLY 1047N 0.71 1.19 1.35 5.01 0.00 -1.39 -1.78 103.07 108.17 3aaf h GLY 1047Ca 0.29 -0.76 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 3aaf h GLY 1047CO -0.16 0.71 -0.07 3.21 0.00 0.00 0.00 176.54 180.23 3aaf h ARG 1048N 1.03 0.77 -0.45 4.80 3.08 -0.61 -0.87 114.38 122.14 3aaf h ARG 1048Ca 0.21 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 3aaf h ARG 1048Cb 0.39 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 3aaf h ARG 1048CO 0.01 0.83 0.12 -0.91 -1.07 0.00 0.00 179.97 178.95 3aaf h ASN 1049N 0.71 0.67 -0.09 7.04 2.35 -0.81 -0.18 115.58 125.26 3aaf h ASN 1049Ca 0.13 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 3aaf h ASN 1049Cb 0.53 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.72 3aaf h ASN 1049CO 0.03 0.71 0.03 -0.25 -1.65 0.00 0.00 177.43 176.30 3aaf h TRP 1050N 0.59 0.15 -0.84 1.19 7.01 -1.14 -2.52 115.95 120.38 3aaf h TRP 1050Ca 0.14 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.10 3aaf h TRP 1050Cb 0.30 -0.04 -0.04 0.00 -2.10 0.00 0.00 29.16 27.28 3aaf h TRP 1050CO 0.02 0.29 0.44 1.25 -2.79 0.00 0.00 178.44 177.64 3aaf h LEU 1051N -0.04 1.07 -0.78 0.65 5.85 -1.08 0.17 115.31 121.16 3aaf h LEU 1051Ca 0.03 -0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.69 3aaf h LEU 1051Cb 0.21 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 3aaf h LEU 1051CO -0.00 0.88 0.47 -0.74 -0.34 0.00 0.00 178.44 178.71 3aaf h HIS 1052N 1.18 0.87 -0.14 1.25 2.76 -0.93 0.36 115.15 120.51 3aaf h HIS 1052Ca 0.29 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.37 3aaf h HIS 1052Cb 0.07 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.75 3aaf h HIS 1052CO 0.01 0.45 -0.37 0.87 -1.30 0.00 0.00 177.93 177.59 3aaf h LYS 1053N 0.87 0.50 -0.18 5.26 1.57 -0.99 -3.19 116.57 120.41 3aaf h LYS 1053Ca 0.34 -0.35 0.05 0.00 -1.87 0.00 0.00 60.65 58.82 3aaf h LYS 1053Cb 0.15 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 3aaf h LYS 1053CO -0.16 0.97 0.14 0.00 -0.57 0.00 0.00 179.45 179.82 3aaf h ALA 1054N 0.53 2.10 0.00 3.86 0.00 -0.25 -0.98 119.26 124.52 3aaf h ALA 1054Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3aaf h ALA 1054Cb 0.99 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 3aaf h ALA 1054CO 0.08 -0.23 0.00 0.09 0.00 0.00 0.00 179.25 179.19 3aaf n ASN 1055N -4.38 0.36 -0.01 0.00 3.02 0.08 -3.50 115.26 110.83 3aaf n ASN 1055Ca 0.01 0.61 -0.00 0.00 -0.03 0.00 0.00 54.58 55.17 3aaf n ASN 1055Cb 0.27 -0.68 -0.03 0.00 -0.61 0.00 0.00 39.78 38.73 3aaf n ASN 1055CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3aaf n THR 1056N -1.92 0.16 -3.57 3.41 -2.24 -0.43 -5.06 114.28 104.63 3aaf n THR 1056Ca 0.02 -0.13 -0.17 0.00 -2.27 0.00 0.00 64.05 61.50 3aaf n THR 1056Cb 0.14 -0.43 -0.07 0.00 -2.10 0.00 0.00 70.33 67.88 3aaf n THR 1056CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3aaf s GLU 1057N -2.15 0.96 0.21 -0.78 -1.05 -0.88 -5.14 118.70 109.87 3aaf s GLU 1057Ca -0.02 0.25 -0.31 0.00 -0.15 0.00 0.00 54.97 54.74 3aaf s GLU 1057Cb 0.02 0.45 -0.15 0.00 -0.44 0.00 0.00 34.13 34.01 3aaf s GLU 1057CO 0.15 -0.28 1.15 0.43 0.95 0.00 0.00 175.26 177.66 3aaf n SER 1058N 1.15 1.52 -4.40 0.83 7.64 -1.26 -3.83 113.62 115.26 3aaf n SER 1058Ca -0.19 1.15 -0.30 0.00 1.01 0.00 0.00 58.87 60.54 3aaf n SER 1058Cb 0.57 -1.26 -0.13 0.00 -1.01 0.00 0.00 64.21 62.37 3aaf n SER 1058CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3aaf s GLN 1059N -0.70 1.83 0.45 1.43 -1.52 -1.26 -4.95 119.66 114.94 3aaf s GLN 1059Ca 0.68 -1.11 -0.15 0.00 -1.95 0.00 0.00 55.36 52.83 3aaf s GLN 1059Cb -0.78 -2.05 -0.08 0.00 -0.22 0.00 0.00 33.01 29.88 3aaf s GLN 1059CO 0.54 0.51 0.89 -1.54 -0.25 0.00 0.00 175.29 175.44 3aaf s SER 1060N -1.53 6.64 -0.33 5.90 1.04 -1.26 -4.46 113.70 119.71 3aaf s SER 1060Ca 0.14 1.43 0.00 0.00 0.48 0.00 0.00 55.95 58.00 3aaf s SER 1060Cb -0.10 -2.45 0.14 0.00 0.10 0.00 0.00 66.02 63.71 3aaf s SER 1060CO 0.05 -0.47 0.28 -0.22 0.98 0.00 0.00 173.24 173.85 3aaf s LEU 1061N -3.80 0.24 -0.00 2.42 0.20 -1.26 -4.81 118.68 111.66 3aaf s LEU 1061Ca 0.57 -1.47 -0.22 0.00 0.69 0.00 0.00 54.13 53.69 3aaf s LEU 1061Cb -0.10 0.17 -0.05 0.00 -0.43 0.00 0.00 46.19 45.78 3aaf s LEU 1061CO 0.28 -0.33 0.66 -0.63 -0.29 0.00 0.00 176.35 176.03 3aaf s ILE 1062N 1.69 4.89 0.04 6.68 1.01 -1.26 -0.46 121.20 133.78 3aaf s ILE 1062Ca 0.14 1.38 0.08 0.00 0.00 0.00 0.00 60.65 62.25 3aaf s ILE 1062Cb -0.17 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 3aaf s ILE 1062CO -0.15 0.37 -0.24 -0.76 0.00 0.00 0.00 174.94 174.17 3aaf s LEU 1063N 0.02 2.16 0.00 2.97 1.43 -0.45 -4.94 118.68 119.87 3aaf s LEU 1063Ca 0.34 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 3aaf s LEU 1063Cb -0.19 -1.15 0.00 0.00 0.03 0.00 0.00 46.19 44.89 3aaf s LEU 1063CO 0.19 0.22 0.00 0.00 0.23 0.00 0.00 176.35 176.99