#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j59 h ALA 932 N 0.00 0.37 -2.55 0.00 0.00 -1.79 -3.46 119.26 111.82 2j59 h ALA 932 Ca 0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 2j59 h ALA 932 Cb 0.00 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 17.49 2j59 h ALA 932 CO 0.00 0.19 -0.24 0.21 0.00 0.00 0.00 179.25 179.41 2j59 s LYS 933 N -4.73 0.64 -0.09 0.00 2.20 -1.24 -5.03 119.74 111.50 2j59 s LYS 933 Ca -0.13 0.01 -0.14 0.00 -0.36 0.00 0.00 55.97 55.34 2j59 s LYS 933 Cb 0.08 0.29 0.03 0.00 -1.51 0.00 0.00 37.83 36.72 2j59 s LYS 933 CO 0.77 -0.16 0.36 -1.83 -0.36 0.00 0.00 175.35 174.13 2j59 s GLU 934 N -0.95 0.55 0.00 4.03 -1.05 -1.26 -0.46 118.70 119.56 2j59 s GLU 934 Ca -0.10 0.22 0.00 0.00 -0.15 0.00 0.00 54.97 54.94 2j59 s GLU 934 Cb -0.04 0.25 0.00 0.00 -0.44 0.00 0.00 34.13 33.90 2j59 s GLU 934 CO 0.04 -0.11 0.00 0.41 0.95 0.00 0.00 175.26 176.54 2j59 n GLY 935 N 2.17 0.54 3.74 -3.83 0.00 -0.10 -5.00 105.19 102.71 2j59 n GLY 935 Ca -0.17 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 2j59 n GLY 935 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2j59 s TRP 936 N -2.00 3.48 -0.03 1.61 0.52 -1.26 -0.94 118.94 120.32 2j59 s TRP 936 Ca 0.00 1.50 -0.05 0.00 0.02 0.00 0.00 56.10 57.57 2j59 s TRP 936 Cb 0.00 -3.38 0.01 0.00 -1.15 0.00 0.00 33.47 28.95 2j59 s TRP 936 CO 0.00 -0.98 0.12 -0.51 0.02 0.00 0.00 176.95 175.60 2j59 s LEU 937 N -0.41 1.58 0.33 2.99 1.43 -0.35 -4.74 118.68 119.52 2j59 s LEU 937 Ca 0.51 0.04 -0.24 0.00 -1.03 0.00 0.00 54.13 53.41 2j59 s LEU 937 Cb -0.32 0.49 -0.10 0.00 0.03 0.00 0.00 46.19 46.30 2j59 s LEU 937 CO 0.37 -0.17 0.91 -1.00 0.23 0.00 0.00 176.35 176.68 2j59 s HIS 938 N -0.54 3.61 -0.01 0.29 3.76 -0.77 -0.40 115.29 121.22 2j59 s HIS 938 Ca -0.06 1.68 0.01 0.00 -0.15 0.00 0.00 55.06 56.54 2j59 s HIS 938 Cb -0.04 -2.85 0.01 0.00 1.11 0.00 0.00 32.58 30.81 2j59 s HIS 938 CO 0.01 0.17 -0.02 0.12 -0.85 0.00 0.00 174.74 174.16 2j59 s PHE 939 N -1.71 0.35 -0.13 1.40 5.36 0.13 -0.57 117.98 122.80 2j59 s PHE 939 Ca 0.51 -0.05 -0.09 0.00 -0.96 0.00 0.00 56.93 56.34 2j59 s PHE 939 Cb -0.16 -0.31 0.04 0.00 -0.34 0.00 0.00 43.02 42.25 2j59 s PHE 939 CO 0.21 -0.06 0.33 -0.98 -1.46 0.00 0.00 175.22 173.26 2j59 s ARG 940 N 0.37 0.34 0.35 10.12 1.70 -0.66 -0.93 118.95 130.24 2j59 s ARG 940 Ca -0.04 0.58 -0.25 0.00 -0.47 0.00 0.00 55.73 55.56 2j59 s ARG 940 Cb -0.07 0.04 -0.10 0.00 -0.57 0.00 0.00 34.95 34.25 2j59 s ARG 940 CO -0.01 -0.11 0.95 -1.25 -1.08 0.00 0.00 175.30 173.80 2j59 s PRO 941 N 0.85 4.48 -0.23 3.89 0.05 -1.26 -0.36 135.00 142.42 2j59 s PRO 941 Ca -0.05 1.29 0.09 0.00 0.05 0.00 0.00 61.00 62.37 2j59 s PRO 941 Cb -0.06 -2.64 -0.20 0.00 0.05 0.00 0.00 34.50 31.65 2j59 s PRO 941 CO -0.06 0.19 -0.09 1.28 0.05 0.00 0.00 177.00 178.37 2j59 n LEU 942 N 0.24 1.60 -2.73 -3.56 4.77 0.27 -4.88 117.00 112.70 2j59 n LEU 942 Ca 0.03 -0.07 -0.05 0.00 -0.03 0.00 0.00 56.01 55.89 2j59 n LEU 942 Cb 0.51 -0.25 0.05 0.00 -2.33 0.00 0.00 43.42 41.40 2j59 n LEU 942 CO 0.43 0.73 0.05 0.52 -1.33 0.00 0.00 177.39 177.78 2j59 n VAL 943 N -3.01 0.92 -0.89 4.08 0.31 0.29 -4.96 118.33 115.07 2j59 n VAL 943 Ca -0.39 -2.68 -0.34 0.00 -0.01 0.00 0.00 64.34 60.92 2j59 n VAL 943 Cb 1.06 0.98 0.10 0.00 -0.91 0.00 0.00 33.84 35.06 2j59 n VAL 943 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2j59 n PRO 956 N -0.45 -0.16 -1.76 5.55 -0.04 -1.26 -2.82 135.00 134.06 2j59 n PRO 956 Ca 0.05 -0.02 -0.41 0.00 -0.04 0.00 0.00 63.50 63.08 2j59 n PRO 956 Cb 0.82 -1.65 -0.01 0.00 -0.04 0.00 0.00 33.50 32.62 2j59 n PRO 956 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2j59 s TRP 957 N -2.26 2.66 -0.01 0.54 0.52 -1.26 -4.73 118.94 114.41 2j59 s TRP 957 Ca 0.54 0.89 0.04 0.00 0.02 0.00 0.00 56.10 57.58 2j59 s TRP 957 Cb -0.22 -4.08 -0.01 0.00 -1.15 0.00 0.00 33.47 28.01 2j59 s TRP 957 CO 0.70 -3.49 -0.13 0.15 0.02 0.00 0.00 176.95 174.21 2j59 s LYS 958 N -1.06 1.02 -0.01 4.98 1.02 -0.10 -4.92 119.74 120.67 2j59 s LYS 958 Ca 0.60 -0.45 -0.29 0.00 0.02 0.00 0.00 55.97 55.85 2j59 s LYS 958 Cb -0.48 -0.99 -0.03 0.00 -0.52 0.00 0.00 37.83 35.81 2j59 s LYS 958 CO 0.54 0.27 0.94 -1.14 -0.92 0.00 0.00 175.35 175.03 2j59 s GLN 959 N -0.31 4.54 0.06 1.68 0.74 -1.26 0.18 119.66 125.29 2j59 s GLN 959 Ca 0.05 1.34 0.05 0.00 0.05 0.00 0.00 55.36 56.84 2j59 s GLN 959 Cb -0.05 -3.46 -0.03 0.00 1.10 0.00 0.00 33.01 30.58 2j59 s GLN 959 CO -0.00 -0.02 -0.14 -1.64 -0.55 0.00 0.00 175.29 172.93 2j59 s MET 960 N 0.95 0.86 -0.29 1.67 -1.94 0.46 -4.83 119.30 116.19 2j59 s MET 960 Ca 0.50 -0.89 -0.21 0.00 -1.71 0.00 0.00 55.69 53.38 2j59 s MET 960 Cb -0.21 -0.87 -0.01 0.00 2.01 0.00 0.00 34.83 35.75 2j59 s MET 960 CO 0.26 0.20 0.65 -0.47 -0.01 0.00 0.00 175.02 175.66 2j59 s TYR 961 N -1.12 3.24 -0.09 -0.03 6.14 0.19 -1.21 117.35 124.47 2j59 s TYR 961 Ca -0.01 0.70 0.01 0.00 0.64 0.00 0.00 57.07 58.41 2j59 s TYR 961 Cb -0.09 -2.96 -0.02 0.00 0.42 0.00 0.00 41.96 39.30 2j59 s TYR 961 CO 0.02 -0.43 -0.10 0.08 0.64 0.00 0.00 175.55 175.76 2j59 s VAL 962 N 2.61 3.38 -0.07 3.14 1.01 -0.12 -0.25 120.40 130.09 2j59 s VAL 962 Ca 0.26 -0.58 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 2j59 s VAL 962 Cb -0.15 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.86 2j59 s VAL 962 CO 0.11 0.56 -0.02 -0.69 0.00 0.00 0.00 175.10 175.05 2j59 s VAL 963 N -0.29 0.53 -0.24 2.92 1.01 0.05 -0.92 120.40 123.45 2j59 s VAL 963 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.84 2j59 s VAL 963 Cb -0.13 -0.64 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 2j59 s VAL 963 CO 0.03 0.28 0.50 -0.22 0.00 0.00 0.00 175.10 175.68 2j59 s LEU 964 N 1.74 4.09 -0.16 3.92 2.96 0.40 0.32 118.68 131.94 2j59 s LEU 964 Ca 0.02 0.56 -0.00 0.00 -0.22 0.00 0.00 54.13 54.49 2j59 s LEU 964 Cb -0.13 -2.66 0.04 0.00 0.50 0.00 0.00 46.19 43.95 2j59 s LEU 964 CO -0.05 -0.24 -0.07 -0.13 -1.32 0.00 0.00 176.35 174.55 2j59 s ARG 965 N 2.03 1.60 7.79 1.98 0.52 0.74 -2.00 118.95 131.61 2j59 s ARG 965 Ca 0.22 -0.54 0.00 0.00 -0.52 0.00 0.00 55.73 54.88 2j59 s ARG 965 Cb -0.15 -2.03 0.00 0.00 0.52 0.00 0.00 34.95 33.28 2j59 s ARG 965 CO 0.09 -0.40 0.00 0.41 0.02 0.00 0.00 175.30 175.42 2j59 n GLY 966 N 4.84 3.43 1.40 -3.53 0.00 -1.26 -1.18 105.19 108.90 2j59 n GLY 966 Ca -0.13 -0.10 -0.06 0.00 0.00 0.00 0.00 46.02 45.74 2j59 n GLY 966 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2j59 n HIS 967 N 13.56 1.58 -4.69 1.61 1.44 -1.26 -4.74 115.22 122.73 2j59 n HIS 967 Ca 0.00 -1.46 -0.33 0.00 -2.01 0.00 0.00 57.72 53.92 2j59 n HIS 967 Cb 0.00 -0.56 -0.15 0.00 0.12 0.00 0.00 29.99 29.39 2j59 n HIS 967 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2j59 s SER 968 N -2.02 3.70 -0.30 4.39 0.01 -0.33 -0.17 113.70 118.99 2j59 s SER 968 Ca 0.48 -0.44 -0.07 0.00 1.31 0.00 0.00 55.95 57.23 2j59 s SER 968 Cb 0.41 -1.56 0.01 0.00 0.21 0.00 0.00 66.02 65.09 2j59 s SER 968 CO 0.05 0.12 0.09 -0.22 0.41 0.00 0.00 173.24 173.69 2j59 s LEU 969 N 0.62 3.88 -0.25 2.44 2.96 0.10 -0.19 118.68 128.25 2j59 s LEU 969 Ca -0.09 -0.69 -0.10 0.00 -0.22 0.00 0.00 54.13 53.04 2j59 s LEU 969 Cb -0.16 -1.90 -0.05 0.00 0.50 0.00 0.00 46.19 44.59 2j59 s LEU 969 CO 0.03 -0.19 0.15 -0.31 -1.32 0.00 0.00 176.35 174.71 2j59 s TYR 970 N 1.51 3.27 -0.30 5.38 1.51 0.15 -0.50 117.35 128.37 2j59 s TYR 970 Ca 0.03 0.13 -0.08 0.00 -1.01 0.00 0.00 57.07 56.14 2j59 s TYR 970 Cb -0.17 -2.28 0.00 0.00 -0.11 0.00 0.00 41.96 39.40 2j59 s TYR 970 CO 0.03 -0.02 0.11 -0.51 -1.11 0.00 0.00 175.55 174.05 2j59 s LEU 971 N 1.21 3.93 -0.11 -1.29 1.43 -1.26 -0.77 118.68 121.82 2j59 s LEU 971 Ca 0.07 -0.62 -0.00 0.00 -1.03 0.00 0.00 54.13 52.54 2j59 s LEU 971 Cb -0.14 -1.93 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2j59 s LEU 971 CO 0.06 -0.19 -0.09 -0.31 0.23 0.00 0.00 176.35 176.05 2j59 s TYR 972 N 1.55 2.89 0.38 0.29 1.51 0.65 -4.96 117.35 119.66 2j59 s TYR 972 Ca 0.03 -0.27 0.19 0.00 -1.01 0.00 0.00 57.07 56.01 2j59 s TYR 972 Cb -0.17 -1.80 1.03 0.00 -0.11 0.00 0.00 41.96 40.91 2j59 s TYR 972 CO 0.04 0.07 1.94 0.87 -1.11 0.00 0.00 175.55 177.35 2j59 h LYS 973 N 6.05 0.00 -3.69 -0.62 1.57 -1.88 0.54 116.57 118.54 2j59 h LYS 973 Ca -0.37 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 57.96 2j59 h LYS 973 Cb 1.19 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 33.11 2j59 h LYS 973 CO 0.56 0.24 -0.77 0.34 -0.57 0.00 0.00 179.45 179.25 2j59 s ASP 974 N -6.64 1.72 0.38 0.86 3.68 -1.26 -4.69 116.67 110.72 2j59 s ASP 974 Ca -0.03 -0.16 0.16 0.00 2.13 0.00 0.00 52.55 54.65 2j59 s ASP 974 Cb 0.14 -0.46 1.02 0.00 -1.45 0.00 0.00 42.92 42.18 2j59 s ASP 974 CO 0.67 -0.20 1.78 0.50 0.13 0.00 0.00 175.17 178.04 2j59 h LYS 975 N 8.32 0.46 -0.24 4.34 3.64 -1.92 -2.19 116.57 128.97 2j59 h LYS 975 Ca -0.19 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2j59 h LYS 975 Cb 1.12 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2j59 h LYS 975 CO 0.27 0.30 0.00 2.89 -2.27 0.00 0.00 179.45 180.64 2j59 n ARG 976 N -4.66 1.68 0.00 1.90 0.00 -1.26 -5.11 116.66 109.21 2j59 n ARG 976 Ca 0.25 -1.04 0.00 0.00 -0.00 0.00 0.00 57.85 57.05 2j59 n ARG 976 Cb 0.80 -1.30 0.00 0.00 -0.00 0.00 0.00 32.46 31.96 2j59 n ARG 976 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2j59 n GLU 977 N 0.31 0.00 -1.74 2.89 4.07 -0.83 -5.25 120.64 120.09 2j59 n GLU 977 Ca 0.13 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.80 2j59 n GLU 977 Cb 0.27 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.62 2j59 n GLU 977 CO 0.00 0.00 0.00 -0.65 -0.06 0.00 0.00 177.13 176.42 2j59 s GLN 986 N 3.74 4.14 0.99 5.31 -0.21 -1.26 -4.91 119.66 127.46 2j59 s GLN 986 Ca 0.00 2.56 -0.11 0.00 0.02 0.00 0.00 55.36 57.83 2j59 s GLN 986 Cb 0.00 -3.61 0.19 0.00 1.00 0.00 0.00 33.01 30.59 2j59 s GLN 986 CO 0.00 -0.83 1.09 -1.25 -2.12 0.00 0.00 175.29 172.17 2j59 s PRO 987 N 2.77 0.45 -0.20 2.91 0.04 -1.26 -4.94 135.00 134.76 2j59 s PRO 987 Ca 0.80 1.08 -0.22 0.00 0.04 0.00 0.00 61.00 62.70 2j59 s PRO 987 Cb -0.45 -1.70 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 2j59 s PRO 987 CO 0.36 -2.87 0.70 0.42 0.04 0.00 0.00 177.00 175.65 2j59 s ILE 988 N -2.68 4.97 -0.09 0.56 1.01 0.35 -4.82 121.20 120.49 2j59 s ILE 988 Ca 0.66 1.33 -0.30 0.00 0.00 0.00 0.00 60.65 62.34 2j59 s ILE 988 Cb -0.22 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.21 2j59 s ILE 988 CO 0.60 0.07 1.24 -0.55 0.00 0.00 0.00 174.94 176.29 2j59 s SER 989 N 1.22 7.00 -0.14 3.58 0.15 -1.26 0.02 113.70 124.26 2j59 s SER 989 Ca 0.32 1.80 0.16 0.00 0.70 0.00 0.00 55.95 58.92 2j59 s SER 989 Cb -0.16 -2.55 0.41 0.00 -1.71 0.00 0.00 66.02 62.01 2j59 s SER 989 CO 0.11 -0.65 1.30 1.33 1.20 0.00 0.00 173.24 176.53 2j59 n VAL 990 N 4.87 2.01 -0.23 4.45 0.24 0.76 -4.64 118.33 125.78 2j59 n VAL 990 Ca 0.12 -1.90 -0.04 0.00 -2.04 0.00 0.00 64.34 60.48 2j59 n VAL 990 Cb 0.46 -0.16 0.07 0.00 -1.47 0.00 0.00 33.84 32.73 2j59 n VAL 990 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2j59 h ASN 991 N 1.16 0.68 -3.76 -1.34 -1.24 -1.90 -3.36 115.58 105.83 2j59 h ASN 991 Ca 0.00 -0.00 -0.66 0.00 0.71 0.00 0.00 56.30 56.35 2j59 h ASN 991 Cb 1.21 -0.15 -0.38 0.00 0.73 0.00 0.00 38.32 39.73 2j59 h ASN 991 CO 0.13 0.48 -0.77 0.00 -1.29 0.00 0.00 177.43 175.98 2j59 s ALA 992 N -6.12 2.62 0.07 1.57 0.00 -1.26 -4.65 121.76 113.99 2j59 s ALA 992 Ca -0.13 -2.04 -0.18 0.00 0.00 0.00 0.00 51.96 49.61 2j59 s ALA 992 Cb 0.15 -1.73 0.04 0.00 0.00 0.00 0.00 23.12 21.58 2j59 s ALA 992 CO 0.76 -1.41 0.43 0.00 0.00 0.00 0.00 175.76 175.55 2j59 s LEU 994 N -2.26 4.38 -0.10 0.00 1.43 0.72 -4.96 118.68 117.89 2j59 s LEU 994 Ca -0.03 0.59 -0.04 0.00 -1.03 0.00 0.00 54.13 53.62 2j59 s LEU 994 Cb 0.00 -2.60 0.05 0.00 0.03 0.00 0.00 46.19 43.67 2j59 s LEU 994 CO -0.05 0.28 0.21 -0.51 0.23 0.00 0.00 176.35 176.50 2j59 s ILE 995 N -1.25 -0.18 0.24 -0.59 2.07 -1.26 -0.14 121.20 120.09 2j59 s ILE 995 Ca 0.26 0.23 -0.05 0.00 -1.41 0.00 0.00 60.65 59.68 2j59 s ILE 995 Cb -0.13 -0.35 -0.02 0.00 0.13 0.00 0.00 42.46 42.09 2j59 s ILE 995 CO 0.14 0.10 0.30 -0.62 -1.91 0.00 0.00 174.94 172.95 2j59 s ASP 996 N 1.75 0.26 0.17 4.50 3.68 -0.89 -4.99 116.67 121.16 2j59 s ASP 996 Ca -0.04 -1.27 -0.31 0.00 2.13 0.00 0.00 52.55 53.06 2j59 s ASP 996 Cb -0.11 0.50 -0.09 0.00 -1.45 0.00 0.00 42.92 41.77 2j59 s ASP 996 CO -0.07 -1.01 1.40 -0.63 0.13 0.00 0.00 175.17 174.98 2j59 s ILE 997 N -3.93 3.07 -0.28 4.11 1.01 -1.26 -0.27 121.20 123.66 2j59 s ILE 997 Ca 0.32 0.82 -0.29 0.00 0.00 0.00 0.00 60.65 61.51 2j59 s ILE 997 Cb 0.03 -3.53 0.01 0.00 0.01 0.00 0.00 42.46 38.99 2j59 s ILE 997 CO 0.13 0.09 1.06 -0.55 0.00 0.00 0.00 174.94 175.68 2j59 s SER 998 N 0.76 7.01 -0.24 3.58 0.15 0.11 -4.77 113.70 120.30 2j59 s SER 998 Ca 0.62 1.21 0.01 0.00 0.70 0.00 0.00 55.95 58.49 2j59 s SER 998 Cb -0.38 -2.54 -0.19 0.00 -1.71 0.00 0.00 66.02 61.20 2j59 s SER 998 CO 0.35 -0.78 -0.13 -1.22 1.20 0.00 0.00 173.24 172.65 2j59 n TYR 999 N 6.62 0.21 -0.72 3.44 4.02 -1.26 -4.74 117.16 124.73 2j59 n TYR 999 Ca 0.12 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 58.05 2j59 n TYR 999 Cb 0.47 -1.03 0.00 0.00 -0.02 0.00 0.00 39.34 38.76 2j59 n TYR 999 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2j59 n SER 1000N -3.29 0.40 0.23 7.72 3.41 -1.26 -4.68 113.62 116.15 2j59 n SER 1000Ca -0.44 -1.12 0.14 0.00 -0.26 0.00 0.00 58.87 57.20 2j59 n SER 1000Cb 1.00 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 65.37 2j59 n SER 1000CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2j59 h GLU 1001N 0.00 0.00 -3.82 4.33 3.07 -1.98 -3.46 114.58 112.72 2j59 h GLU 1001Ca 0.00 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.75 2j59 h GLU 1001Cb 0.57 0.00 -0.16 0.00 -0.84 0.00 0.00 28.75 28.32 2j59 h GLU 1001CO 0.00 0.00 -0.46 -0.08 -1.40 0.00 0.00 179.01 177.07 2j59 s THR 1002N -3.40 0.14 -2.07 1.13 -1.32 -1.26 -5.03 115.64 103.84 2j59 s THR 1002Ca 0.05 -1.19 0.27 0.00 -1.21 0.00 0.00 61.69 59.61 2j59 s THR 1002Cb 0.07 -1.16 0.40 0.00 -1.51 0.00 0.00 72.50 70.30 2j59 s THR 1002CO 0.60 -0.66 1.66 2.29 -2.21 0.00 0.00 174.62 176.30 2j59 n LYS 1003N 0.34 1.18 -2.96 7.08 2.85 -1.26 -4.88 118.16 120.51 2j59 n LYS 1003Ca -0.17 -0.68 -0.35 0.00 -1.05 0.00 0.00 58.31 56.06 2j59 n LYS 1003Cb 0.60 -1.49 -0.06 0.00 -0.65 0.00 0.00 35.03 33.43 2j59 n LYS 1003CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2j59 s ARG 1004N -2.28 4.30 0.60 -1.58 0.52 -1.26 -5.08 118.95 114.16 2j59 s ARG 1004Ca 0.30 1.01 -0.07 0.00 -0.52 0.00 0.00 55.73 56.46 2j59 s ARG 1004Cb 0.20 -2.64 0.01 0.00 0.52 0.00 0.00 34.95 33.04 2j59 s ARG 1004CO 0.44 0.23 0.93 0.15 0.02 0.00 0.00 175.30 177.07 2j59 s LYS 1005N -2.42 2.96 -1.42 3.54 1.02 -1.26 -4.48 119.74 117.67 2j59 s LYS 1005Ca 0.51 0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.59 2j59 s LYS 1005Cb -0.14 -2.24 0.00 0.00 -0.52 0.00 0.00 37.83 34.93 2j59 s LYS 1005CO 0.20 -0.72 0.00 0.09 -0.92 0.00 0.00 175.35 174.00 2j59 n ASN 1006N -2.63 -4.72 -4.68 2.83 3.02 -1.26 -4.78 115.26 103.03 2j59 n ASN 1006Ca 0.05 0.10 -0.35 0.00 -0.03 0.00 0.00 54.58 54.34 2j59 n ASN 1006Cb 0.57 -3.78 -0.09 0.00 -0.61 0.00 0.00 39.78 35.87 2j59 n ASN 1006CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2j59 s VAL 1007N -2.72 5.10 0.05 2.41 1.01 -1.26 -1.29 120.40 123.70 2j59 s VAL 1007Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2j59 s VAL 1007Cb 0.00 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2j59 s VAL 1007CO 0.00 0.45 0.01 0.72 0.00 0.00 0.00 175.10 176.28 2j59 s PHE 1008N 0.34 3.05 -0.25 5.22 -0.71 0.64 -0.71 117.98 125.57 2j59 s PHE 1008Ca 0.06 0.03 -0.06 0.00 -1.04 0.00 0.00 56.93 55.92 2j59 s PHE 1008Cb -0.12 -1.61 -0.02 0.00 -1.21 0.00 0.00 43.02 40.07 2j59 s PHE 1008CO -0.01 0.48 0.04 0.50 -1.34 0.00 0.00 175.22 174.89 2j59 s ARG 1009N -1.98 3.51 -0.18 1.99 3.52 0.63 -0.89 118.95 125.55 2j59 s ARG 1009Ca 0.23 -0.56 -0.07 0.00 -0.13 0.00 0.00 55.73 55.21 2j59 s ARG 1009Cb -0.12 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 30.00 2j59 s ARG 1009CO 0.15 -0.22 0.04 -1.17 -0.81 0.00 0.00 175.30 173.30 2j59 s LEU 1010N 1.56 3.69 -0.11 -0.88 2.96 0.07 -2.10 118.68 123.88 2j59 s LEU 1010Ca 0.06 0.03 0.01 0.00 -0.22 0.00 0.00 54.13 54.01 2j59 s LEU 1010Cb -0.15 -1.93 0.02 0.00 0.50 0.00 0.00 46.19 44.63 2j59 s LEU 1010CO 0.02 0.16 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.18 2j59 s THR 1011N 0.44 1.40 0.44 3.68 2.01 0.81 -1.40 115.64 123.01 2j59 s THR 1011Ca 0.02 -0.58 0.03 0.00 0.31 0.00 0.00 61.69 61.47 2j59 s THR 1011Cb -0.13 -1.29 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 2j59 s THR 1011CO 0.01 0.42 0.12 0.35 -0.69 0.00 0.00 174.62 174.83 2j59 n THR 1012N 4.26 0.00 -0.37 -0.82 -2.24 0.41 -0.20 114.28 115.32 2j59 n THR 1012Ca -0.19 -2.46 0.05 0.00 -2.27 0.00 0.00 64.05 59.18 2j59 n THR 1012Cb 0.51 0.80 0.20 0.00 -2.10 0.00 0.00 70.33 69.74 2j59 n THR 1012CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2j59 h SER 1013N 1.59 0.99 -0.01 3.42 4.64 -1.94 -3.21 113.55 119.03 2j59 h SER 1013Ca -0.35 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2j59 h SER 1013Cb 1.27 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2j59 h SER 1013CO 0.56 0.58 -0.65 -0.90 -0.87 0.00 0.00 176.83 175.56 2j59 n ASP 1014N -4.56 1.56 -3.46 4.97 3.85 -1.26 -5.02 116.55 112.63 2j59 n ASP 1014Ca 0.17 -1.28 -0.12 0.00 -0.71 0.00 0.00 54.79 52.85 2j59 n ASP 1014Cb 0.26 0.69 -0.03 0.00 -1.35 0.00 0.00 41.12 40.69 2j59 n ASP 1014CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2j59 s GLU 1016N -3.09 -0.01 0.22 0.00 2.12 -1.13 -0.44 118.70 116.37 2j59 s GLU 1016Ca -0.00 0.17 -0.15 0.00 0.36 0.00 0.00 54.97 55.35 2j59 s GLU 1016Cb -0.01 -0.26 0.01 0.00 0.26 0.00 0.00 34.13 34.13 2j59 s GLU 1016CO -0.08 -0.16 0.49 0.00 -0.54 0.00 0.00 175.26 174.98 2j59 s LEU 1018N -2.94 2.63 -0.10 0.00 1.43 0.52 -0.75 118.68 119.46 2j59 s LEU 1018Ca 0.15 -0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.03 2j59 s LEU 1018Cb -0.01 -1.53 0.01 0.00 0.03 0.00 0.00 46.19 44.69 2j59 s LEU 1018CO 0.03 0.33 -0.19 -0.36 0.23 0.00 0.00 176.35 176.38 2j59 s PHE 1019N -0.62 2.16 -0.23 0.29 0.40 -0.07 -1.65 117.98 118.26 2j59 s PHE 1019Ca 0.09 -0.92 -0.09 0.00 -0.60 0.00 0.00 56.93 55.41 2j59 s PHE 1019Cb -0.11 -1.49 -0.04 0.00 0.51 0.00 0.00 43.02 41.88 2j59 s PHE 1019CO 0.01 -0.41 0.12 -1.14 0.70 0.00 0.00 175.22 174.50 2j59 s GLN 1020N 0.60 3.94 0.71 0.44 0.74 0.27 -0.26 119.66 126.10 2j59 s GLN 1020Ca -0.14 -0.34 -0.00 0.00 0.05 0.00 0.00 55.36 54.92 2j59 s GLN 1020Cb -0.17 -3.43 0.12 0.00 1.10 0.00 0.00 33.01 30.64 2j59 s GLN 1020CO 0.04 0.02 0.98 0.00 -0.55 0.00 0.00 175.29 175.79 2j59 s ALA 1021N 1.11 3.75 0.21 1.58 0.00 -0.41 -1.84 121.76 126.16 2j59 s ALA 1021Ca 0.06 -1.73 -0.02 0.00 0.00 0.00 0.00 51.96 50.27 2j59 s ALA 1021Cb -0.14 -1.99 0.18 0.00 0.00 0.00 0.00 23.12 21.18 2j59 s ALA 1021CO 0.04 -1.42 1.56 1.49 0.00 0.00 0.00 175.76 177.44 2j59 h GLU 1022N -0.48 0.56 0.00 0.00 4.57 -1.86 -3.46 114.58 113.90 2j59 h GLU 1022Ca -0.36 -0.30 0.00 0.00 -1.18 0.00 0.00 59.36 57.52 2j59 h GLU 1022Cb 1.27 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.88 2j59 h GLU 1022CO 0.41 0.90 0.23 -0.40 -1.18 0.00 0.00 179.01 178.96 2j59 n ASP 1023N -4.00 -1.49 -0.12 1.04 3.85 -1.26 -5.04 116.55 109.53 2j59 n ASP 1023Ca -0.02 -1.99 -0.08 0.00 -0.71 0.00 0.00 54.79 51.98 2j59 n ASP 1023Cb 0.54 2.47 -0.00 0.00 -1.35 0.00 0.00 41.12 42.78 2j59 n ASP 1023CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.20 176.10 2j59 h ARG 1024N 0.00 0.53 -0.77 0.11 1.12 -1.93 -2.09 114.38 111.35 2j59 h ARG 1024Ca -0.22 -0.05 -0.05 0.00 -1.11 0.00 0.00 59.98 58.55 2j59 h ARG 1024Cb 0.83 -0.11 -0.03 0.00 -0.01 0.00 0.00 29.97 30.65 2j59 h ARG 1024CO 0.28 0.41 0.28 -0.44 -3.11 0.00 0.00 179.97 177.38 2j59 h ASP 1025N 0.51 1.09 -0.53 -3.80 3.45 -1.99 -1.58 116.42 113.57 2j59 h ASP 1025Ca 0.14 -0.19 -0.02 0.00 0.43 0.00 0.00 57.03 57.39 2j59 h ASP 1025Cb 0.02 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.48 2j59 h ASP 1025CO -0.03 0.98 0.26 -0.78 -1.57 0.00 0.00 179.24 178.11 2j59 h ASP 1026N 1.13 0.69 -0.06 6.45 -0.00 -1.92 0.28 116.42 122.99 2j59 h ASP 1026Ca 0.25 -0.12 0.01 0.00 -0.00 0.00 0.00 57.03 57.17 2j59 h ASP 1026Cb 0.26 -0.18 -0.01 0.00 -0.00 0.00 0.00 39.33 39.40 2j59 h ASP 1026CO -0.02 0.62 0.01 -0.03 -0.00 0.00 0.00 179.24 179.82 2j59 h MET 1027N 0.72 0.03 -0.65 0.28 4.05 -1.15 -1.41 114.93 116.79 2j59 h MET 1027Ca 0.18 -0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.54 2j59 h MET 1027Cb 0.11 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.87 2j59 h MET 1027CO -0.02 0.02 0.16 -0.07 0.23 0.00 0.00 176.91 177.23 2j59 h LEU 1028N 0.03 0.98 -0.71 3.39 3.38 -1.12 -1.54 115.31 119.73 2j59 h LEU 1028Ca 0.03 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2j59 h LEU 1028Cb 0.03 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 2j59 h LEU 1028CO -0.04 0.96 0.46 0.00 0.09 0.00 0.00 178.44 179.91 2j59 h ALA 1029N 1.06 0.90 -0.47 1.53 0.00 -0.81 -1.13 119.26 120.34 2j59 h ALA 1029Ca 0.20 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2j59 h ALA 1029Cb 0.36 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2j59 h ALA 1029CO 0.00 0.33 0.21 -1.49 0.00 0.00 0.00 179.25 178.30 2j59 h TRP 1030N 0.96 0.70 -0.10 0.00 4.06 -1.02 -1.77 115.95 118.79 2j59 h TRP 1030Ca 0.26 -0.04 0.01 0.00 2.06 0.00 0.00 58.89 61.17 2j59 h TRP 1030Cb -0.10 -0.21 -0.01 0.00 -1.00 0.00 0.00 29.16 27.84 2j59 h TRP 1030CO -0.02 0.58 0.05 0.82 -3.56 0.00 0.00 178.44 176.30 2j59 h ILE 1031N 0.62 0.99 -0.68 1.49 2.04 -1.05 -1.30 117.51 119.62 2j59 h ILE 1031Ca 0.16 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 66.01 2j59 h ILE 1031Cb 0.16 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 2j59 h ILE 1031CO -0.02 0.02 0.44 0.50 0.00 0.00 0.00 178.15 179.09 2j59 h LYS 1032N 0.10 0.85 -0.38 2.37 3.64 -1.12 -0.54 116.57 121.49 2j59 h LYS 1032Ca 0.04 -0.05 -0.14 0.00 -1.27 0.00 0.00 60.65 59.23 2j59 h LYS 1032Cb 0.01 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2j59 h LYS 1032CO -0.03 0.56 -0.32 1.15 -2.27 0.00 0.00 179.45 178.54 2j59 h THR 1033N 0.88 1.28 -0.51 1.00 2.02 -1.16 -1.69 112.91 114.73 2j59 h THR 1033Ca 0.26 -1.48 -0.02 0.00 0.77 0.00 0.00 66.41 65.94 2j59 h THR 1033Cb -0.03 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2j59 h THR 1033CO -0.08 0.50 0.23 0.40 0.37 0.00 0.00 175.52 176.93 2j59 h ILE 1034N 0.70 1.20 -0.26 3.11 2.04 -0.90 -2.51 117.51 120.89 2j59 h ILE 1034Ca 0.07 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.35 2j59 h ILE 1034Cb 0.90 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 2j59 h ILE 1034CO 0.08 0.23 0.11 1.56 0.00 0.00 0.00 178.15 180.13 2j59 h GLN 1035N 0.68 0.23 0.00 2.37 4.20 -1.00 -2.53 115.11 119.06 2j59 h GLN 1035Ca 0.17 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.87 2j59 h GLN 1035Cb 0.15 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.88 2j59 h GLN 1035CO -0.02 0.15 0.00 0.93 -0.67 0.00 0.00 178.83 179.23 2j59 h GLU 1036N 0.24 0.00 0.00 1.46 5.08 -1.18 -3.13 114.58 117.05 2j59 h GLU 1036Ca 0.11 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 2j59 h GLU 1036Cb 0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2j59 h GLU 1036CO -0.10 0.00 -0.33 0.66 -1.00 0.00 0.00 179.01 178.24 2j59 h SER 1037N 0.00 0.00 -3.57 1.42 4.64 -0.99 -3.45 113.55 111.60 2j59 h SER 1037Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 2j59 h SER 1037Cb 0.21 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.34 2j59 h SER 1037CO 0.00 0.33 0.63 -0.55 -0.87 0.00 0.00 176.83 176.37 2j59 s SER 1038N -6.34 6.90 0.00 4.97 0.15 -1.19 -4.19 113.70 114.00 2j59 s SER 1038Ca 0.01 2.47 0.17 0.00 0.70 0.00 0.00 55.95 59.30 2j59 s SER 1038Cb 0.10 -2.62 0.32 0.00 -1.71 0.00 0.00 66.02 62.11 2j59 s SER 1038CO 0.68 -0.49 1.23 -0.46 1.20 0.00 0.00 173.24 175.40 2j59 n ASN 1039N 1.96 2.97 -4.74 5.45 0.23 -1.26 -5.03 115.26 114.84 2j59 n ASN 1039Ca 0.04 -1.87 -0.42 0.00 -0.53 0.00 0.00 54.58 51.80 2j59 n ASN 1039Cb 0.43 -0.19 -0.02 0.00 -2.08 0.00 0.00 39.78 37.91 2j59 n ASN 1039CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 2j59 s LEU 1040N -1.20 4.38 1.08 -4.53 1.43 -1.26 -5.02 118.68 113.56 2j59 s LEU 1040Ca 0.29 2.69 -0.17 0.00 -1.03 0.00 0.00 54.13 55.90 2j59 s LEU 1040Cb 0.17 -3.62 0.24 0.00 0.03 0.00 0.00 46.19 43.01 2j59 s LEU 1040CO 0.23 -0.75 1.18 0.54 0.23 0.00 0.00 176.35 177.78 2j59 s ASN 1041N 0.54 1.98 0.17 2.29 2.20 -1.26 -4.63 114.94 116.24 2j59 s ASN 1041Ca 0.62 0.58 -0.14 0.00 -0.94 0.00 0.00 52.86 52.98 2j59 s ASN 1041Cb -0.43 -0.82 0.14 0.00 -2.00 0.00 0.00 41.25 38.14 2j59 s ASN 1041CO 0.41 -3.46 1.74 -0.08 -2.94 0.00 0.00 177.10 172.77 2j59 h GLU 1042N -2.13 0.28 0.17 3.55 4.81 -1.98 0.37 114.58 119.66 2j59 h GLU 1042Ca -0.46 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.75 2j59 h GLU 1042Cb 1.28 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2j59 h GLU 1042CO 0.40 0.19 -0.08 1.49 -0.73 0.00 0.00 179.01 180.27 2j59 h GLU 1043N 0.29 -0.22 -0.38 1.92 4.81 -1.98 0.22 114.58 119.25 2j59 h GLU 1043Ca 0.21 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.44 2j59 h GLU 1043Cb 0.23 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 2j59 h GLU 1043CO -0.24 -0.10 0.17 -0.44 -0.73 0.00 0.00 179.01 177.66 2j59 h ASP 1044N -0.28 0.50 -0.40 1.04 3.32 -1.89 0.17 116.42 118.88 2j59 h ASP 1044Ca -0.02 -0.15 0.06 0.00 0.02 0.00 0.00 57.03 56.94 2j59 h ASP 1044Cb 0.22 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.59 2j59 h ASP 1044CO 0.04 0.51 0.07 0.74 -1.72 0.00 0.00 179.24 178.88 2j59 h THR 1045N 0.46 0.78 -0.80 0.35 2.02 -0.16 -0.63 112.91 114.94 2j59 h THR 1045Ca 0.13 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 2j59 h THR 1045Cb 0.15 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.09 2j59 h THR 1045CO -0.01 0.04 0.33 1.23 0.37 0.00 0.00 175.52 177.48 2j59 h GLY 1046N 0.20 1.28 0.72 2.16 0.00 -0.19 0.18 103.07 107.41 2j59 h GLY 1046Ca 0.19 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 2j59 h GLY 1046CO -0.26 0.65 -0.06 -2.08 0.00 0.00 0.00 176.54 174.79 2j59 h VAL 1047N 1.16 1.31 -0.38 4.60 2.07 -0.78 -2.28 116.25 121.96 2j59 h VAL 1047Ca 0.27 -1.07 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 2j59 h VAL 1047Cb 0.20 1.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2j59 h VAL 1047CO -0.02 0.31 0.06 0.71 0.02 0.00 0.00 177.57 178.65 2j59 h THR 1048N -0.09 1.24 -0.08 2.57 1.35 -0.95 -1.56 112.91 115.38 2j59 h THR 1048Ca 0.03 -0.84 0.04 0.00 -0.55 0.00 0.00 66.41 65.08 2j59 h THR 1048Cb 0.51 1.06 -0.04 0.00 -1.73 0.00 0.00 68.15 67.95 2j59 h THR 1048CO 0.02 0.29 -0.16 0.78 -0.25 0.00 0.00 175.52 176.19 2j59 h ASN 1049N 0.46 -0.50 -0.62 5.36 2.35 -0.71 0.44 115.58 122.37 2j59 h ASN 1049Ca 0.11 0.08 0.08 0.00 -0.55 0.00 0.00 56.30 56.03 2j59 h ASN 1049Cb 0.36 0.23 -0.06 0.00 0.05 0.00 0.00 38.32 38.89 2j59 h ASN 1049CO 0.01 -0.22 0.28 -0.09 -1.65 0.00 0.00 177.43 175.76 2j59 h ARG 1050N -0.23 0.49 -0.15 0.81 2.43 -1.31 0.32 114.38 116.74 2j59 h ARG 1050Ca 0.08 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.07 2j59 h ARG 1050Cb 0.34 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2j59 h ARG 1050CO -0.22 0.32 -0.49 -0.44 -1.51 0.00 0.00 179.97 177.64 2j59 h ASP 1051N 0.50 0.69 -0.35 -3.80 3.32 -1.02 0.13 116.42 115.89 2j59 h ASP 1051Ca 0.30 -0.60 -0.05 0.00 0.02 0.00 0.00 57.03 56.70 2j59 h ASP 1051Cb 0.31 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2j59 h ASP 1051CO -0.25 1.17 0.03 -0.07 -1.72 0.00 0.00 179.24 178.40 2j59 h LEU 1052N 0.24 0.57 -0.09 1.55 3.38 -0.72 -2.31 115.31 117.93 2j59 h LEU 1052Ca -0.02 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.66 2j59 h LEU 1052Cb 1.11 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 2j59 h LEU 1052CO 0.10 0.71 0.01 0.40 0.09 0.00 0.00 178.44 179.75 2j59 h ILE 1053N 0.41 1.24 -0.69 1.22 2.04 -0.39 -2.12 117.51 119.21 2j59 h ILE 1053Ca 0.10 -0.74 0.09 0.00 1.00 0.00 0.00 64.86 65.31 2j59 h ILE 1053Cb 0.40 1.56 -0.04 0.00 -0.74 0.00 0.00 36.82 37.99 2j59 h ILE 1053CO 0.01 0.21 0.46 0.28 0.00 0.00 0.00 178.15 179.11 2j59 h SER 1054N -0.11 0.54 -0.17 1.72 0.02 -0.76 0.16 113.55 114.95 2j59 h SER 1054Ca 0.03 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 60.92 2j59 h SER 1054Cb 0.32 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 2j59 h SER 1054CO 0.00 0.33 -0.15 -0.09 -1.14 0.00 0.00 176.83 175.78 2j59 h ARG 1055N 0.60 0.41 -0.62 3.45 2.43 -1.35 -1.91 114.38 117.39 2j59 h ARG 1055Ca 0.32 -0.21 0.07 0.00 -0.81 0.00 0.00 59.98 59.35 2j59 h ARG 1055Cb 0.44 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.93 2j59 h ARG 1055CO -0.11 0.77 0.30 0.00 -1.51 0.00 0.00 179.97 179.42 2j59 h ARG 1056N 0.07 0.52 -0.32 0.20 3.08 -0.58 -0.21 114.38 117.14 2j59 h ARG 1056Ca 0.03 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.07 2j59 h ARG 1056Cb 0.68 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.58 2j59 h ARG 1056CO 0.04 0.35 0.16 0.82 -1.07 0.00 0.00 179.97 180.26 2j59 h ILE 1057N 0.54 0.98 -0.60 2.04 2.04 -0.68 -1.90 117.51 119.93 2j59 h ILE 1057Ca 0.30 -0.11 0.03 0.00 1.00 0.00 0.00 64.86 66.08 2j59 h ILE 1057Cb 0.27 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 2j59 h ILE 1057CO -0.23 0.06 0.35 0.50 0.00 0.00 0.00 178.15 178.83 2j59 h LYS 1058N 0.33 0.66 -0.39 2.37 3.64 -0.82 -1.15 116.57 121.21 2j59 h LYS 1058Ca 0.14 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 2j59 h LYS 1058Cb 0.06 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 2j59 h LYS 1058CO -0.10 0.44 0.11 0.93 -2.27 0.00 0.00 179.45 178.56 2j59 h GLU 1059N 0.68 0.57 0.00 1.90 5.08 -0.60 -0.82 114.58 121.40 2j59 h GLU 1059Ca 0.25 -0.09 -0.14 0.00 -1.00 0.00 0.00 59.36 58.38 2j59 h GLU 1059Cb 0.07 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2j59 h GLU 1059CO -0.12 0.51 -1.18 1.88 -1.00 0.00 0.00 179.01 179.10 2j59 h TYR 1060N 0.56 0.00 -0.19 4.33 0.05 -1.10 -2.68 116.97 117.93 2j59 h TYR 1060Ca 0.13 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.80 2j59 h TYR 1060Cb 0.19 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 2j59 h TYR 1060CO 0.01 0.53 -0.38 -0.91 -1.05 0.00 0.00 178.16 176.35 2j59 h ASN 1061N 0.00 0.44 0.80 3.88 2.35 -1.04 -2.98 115.58 119.03 2j59 h ASN 1061Ca -0.12 -0.18 -0.06 0.00 -0.55 0.00 0.00 56.30 55.39 2j59 h ASN 1061Cb 1.50 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.74 2j59 h ASN 1061CO 0.05 0.78 -0.29 0.78 -1.65 0.00 0.00 177.43 177.11 2j59 h ASN 1062N 0.35 0.00 -0.03 5.81 4.21 -1.15 -3.51 115.58 121.26 2j59 h ASN 1062Ca 0.04 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.55 2j59 h ASN 1062Cb 0.83 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.03 2j59 h ASN 1062CO 0.07 0.29 0.00 0.18 -1.29 0.00 0.00 177.43 176.68