#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2o s ASP 919 N 0.00 6.18 0.58 7.28 2.15 -1.26 -5.06 116.67 126.53 2k2o s ASP 919 Ca 0.00 -1.00 0.07 0.00 0.43 0.00 0.00 52.55 52.05 2k2o s ASP 919 Cb 0.00 -2.22 0.10 0.00 -0.30 0.00 0.00 42.92 40.50 2k2o s ASP 919 CO 0.00 -0.67 0.79 -0.81 -0.17 0.00 0.00 175.17 174.30 2k2o n PRO 920 N 5.56 0.46 -0.03 4.34 -0.04 -1.26 -5.03 135.00 139.01 2k2o n PRO 920 Ca -0.09 -2.80 0.05 0.00 -0.04 0.00 0.00 63.50 60.62 2k2o n PRO 920 Cb 0.45 -0.32 -0.16 0.00 -0.04 0.00 0.00 33.50 33.44 2k2o n PRO 920 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2k2o n PHE 921 N -2.32 0.08 -2.48 0.54 3.72 -1.26 -4.67 117.46 111.08 2k2o n PHE 921 Ca 0.15 0.03 -0.39 0.00 -0.05 0.00 0.00 57.45 57.18 2k2o n PHE 921 Cb 0.55 -0.68 -0.02 0.00 -0.94 0.00 0.00 39.48 38.39 2k2o n PHE 921 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2k2o s THR 922 N -3.21 3.94 -0.04 4.37 2.01 -1.26 -4.88 115.64 116.57 2k2o s THR 922 Ca -0.08 -1.30 -0.02 0.00 0.31 0.00 0.00 61.69 60.60 2k2o s THR 922 Cb 0.11 -5.00 0.03 0.00 0.01 0.00 0.00 72.50 67.65 2k2o s THR 922 CO 0.88 -1.81 0.10 0.00 -0.69 0.00 0.00 174.62 173.10 2k2o s ALA 923 N 5.66 -0.17 0.03 7.40 0.00 -1.26 -5.16 121.76 128.26 2k2o s ALA 923 Ca 0.54 0.44 0.01 0.00 0.00 0.00 0.00 51.96 52.94 2k2o s ALA 923 Cb 0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2k2o s ALA 923 CO 0.02 -0.10 -0.05 0.16 0.00 0.00 0.00 175.76 175.78 2k2o s ASP 924 N 0.74 0.52 -0.08 0.00 -4.77 -1.26 -4.99 116.67 106.83 2k2o s ASP 924 Ca -0.06 -0.54 0.09 0.00 -3.30 0.00 0.00 52.55 48.74 2k2o s ASP 924 Cb -0.08 0.08 -0.24 0.00 -1.09 0.00 0.00 42.92 41.59 2k2o s ASP 924 CO -0.03 -0.27 0.54 0.00 0.70 0.00 0.00 175.17 176.10 2k2o n ALA 925 N 1.47 1.37 -2.60 2.11 0.00 -1.26 -4.81 120.51 116.78 2k2o n ALA 925 Ca -0.23 -0.78 -0.02 0.00 0.00 0.00 0.00 53.44 52.40 2k2o n ALA 925 Cb 0.55 -0.75 -0.02 0.00 0.00 0.00 0.00 19.45 19.24 2k2o n ALA 925 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k2o n GLY 926 N 1.68 -0.90 3.39 0.00 0.00 -1.26 -5.15 105.19 102.95 2k2o n GLY 926 Ca -0.22 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 2k2o n GLY 926 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k2o s HIS 927 N 0.01 2.50 -0.22 1.61 3.76 -1.26 -4.45 115.29 117.24 2k2o s HIS 927 Ca 0.01 -0.31 -0.18 0.00 -0.15 0.00 0.00 55.06 54.43 2k2o s HIS 927 Cb 0.03 -1.55 -0.03 0.00 1.11 0.00 0.00 32.58 32.14 2k2o s HIS 927 CO -0.01 0.08 0.48 0.99 -0.85 0.00 0.00 174.74 175.43 2k2o s THR 928 N -0.69 5.12 -0.01 1.30 2.01 -1.26 -4.82 115.64 117.30 2k2o s THR 928 Ca 0.11 0.86 0.00 0.00 0.31 0.00 0.00 61.69 62.97 2k2o s THR 928 Cb -0.10 -3.81 0.01 0.00 0.01 0.00 0.00 72.50 68.61 2k2o s THR 928 CO 0.00 0.16 -0.00 -1.83 -0.69 0.00 0.00 174.62 172.26 2k2o s GLU 929 N 1.80 0.09 -0.00 4.92 1.03 -1.26 0.50 118.70 125.77 2k2o s GLU 929 Ca 0.22 0.00 0.02 0.00 0.03 0.00 0.00 54.97 55.23 2k2o s GLU 929 Cb -0.15 -0.14 -0.01 0.00 -0.80 0.00 0.00 34.13 33.04 2k2o s GLU 929 CO 0.09 -0.02 -0.05 0.12 -1.33 0.00 0.00 175.26 174.07 2k2o s PHE 930 N 0.20 0.46 0.07 4.83 5.36 0.19 -4.95 117.98 124.14 2k2o s PHE 930 Ca -0.02 -0.11 -0.31 0.00 -0.96 0.00 0.00 56.93 55.54 2k2o s PHE 930 Cb -0.03 -0.29 -0.06 0.00 -0.34 0.00 0.00 43.02 42.29 2k2o s PHE 930 CO -0.01 -0.01 1.28 0.99 -1.46 0.00 0.00 175.22 176.01 2k2o s THR 931 N -0.20 3.76 0.25 0.12 2.01 -1.26 -1.27 115.64 119.06 2k2o s THR 931 Ca 0.01 1.26 0.05 0.00 0.31 0.00 0.00 61.69 63.32 2k2o s THR 931 Cb -0.02 -3.81 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2k2o s THR 931 CO -0.00 0.09 0.37 -0.62 -0.69 0.00 0.00 174.62 173.77 2k2o s ASP 932 N 1.13 6.26 -0.15 3.53 -1.08 -0.42 -4.91 116.67 121.02 2k2o s ASP 932 Ca 0.61 0.03 -0.27 0.00 -0.52 0.00 0.00 52.55 52.41 2k2o s ASP 932 Cb -0.32 -1.78 0.07 0.00 -1.46 0.00 0.00 42.92 39.43 2k2o s ASP 932 CO 0.29 -0.11 0.66 -1.83 0.52 0.00 0.00 175.17 174.71 2k2o s GLU 933 N -4.00 0.91 0.22 4.34 -1.05 -1.26 -1.53 118.70 116.34 2k2o s GLU 933 Ca 0.35 0.56 -0.01 0.00 -0.15 0.00 0.00 54.97 55.73 2k2o s GLU 933 Cb -0.09 0.44 -0.04 0.00 -0.44 0.00 0.00 34.13 34.00 2k2o s GLU 933 CO 0.29 -0.21 0.18 0.54 0.95 0.00 0.00 175.26 177.01 2k2o s VAL 934 N -0.46 0.00 0.02 1.83 0.11 -0.33 -4.99 120.40 116.58 2k2o s VAL 934 Ca -0.06 -1.95 0.05 0.00 -2.93 0.00 0.00 61.98 57.10 2k2o s VAL 934 Cb -0.03 -2.48 -0.02 0.00 -1.53 0.00 0.00 36.38 32.32 2k2o s VAL 934 CO 0.05 0.00 -0.16 -0.31 -3.33 0.00 0.00 175.10 171.35 2k2o s TYR 935 N -4.03 1.44 -0.21 1.54 1.51 -1.11 -1.11 117.35 115.38 2k2o s TYR 935 Ca 0.38 -0.32 -0.00 0.00 -1.01 0.00 0.00 57.07 56.12 2k2o s TYR 935 Cb 0.06 -0.88 0.02 0.00 -0.11 0.00 0.00 41.96 41.04 2k2o s TYR 935 CO 0.14 0.02 -0.14 -1.14 -1.11 0.00 0.00 175.55 173.33 2k2o s GLN 936 N -0.82 2.96 -0.20 -0.62 0.74 -0.42 -2.51 119.66 118.78 2k2o s GLN 936 Ca 0.05 -0.87 -0.14 0.00 0.05 0.00 0.00 55.36 54.45 2k2o s GLN 936 Cb -0.07 -2.76 -0.04 0.00 1.10 0.00 0.00 33.01 31.24 2k2o s GLN 936 CO 0.01 -0.28 0.33 -0.80 -0.55 0.00 0.00 175.29 174.00 2k2o s ASN 937 N 1.31 6.37 0.19 6.67 0.01 -0.26 -2.38 114.94 126.85 2k2o s ASN 937 Ca 0.03 0.43 0.11 0.00 -0.71 0.00 0.00 52.86 52.72 2k2o s ASN 937 Cb -0.15 -2.20 -0.04 0.00 0.41 0.00 0.00 41.25 39.28 2k2o s ASN 937 CO -0.09 -0.01 -0.23 -1.61 -1.51 0.00 0.00 177.10 173.65 2k2o s GLU 938 N 1.09 1.45 0.06 -0.60 2.02 -0.36 -2.56 118.70 119.82 2k2o s GLU 938 Ca 0.16 -1.49 -0.07 0.00 0.02 0.00 0.00 54.97 53.59 2k2o s GLU 938 Cb -0.14 -1.72 -0.01 0.00 0.10 0.00 0.00 34.13 32.36 2k2o s GLU 938 CO 0.06 0.37 0.13 -1.12 0.02 0.00 0.00 175.26 174.72 2k2o s SER 939 N -2.66 0.20 0.11 -0.19 0.01 -0.35 -1.84 113.70 108.98 2k2o s SER 939 Ca 0.19 -0.66 -0.14 0.00 1.31 0.00 0.00 55.95 56.66 2k2o s SER 939 Cb -0.07 0.28 0.02 0.00 0.21 0.00 0.00 66.02 66.46 2k2o s SER 939 CO 0.09 -0.63 0.34 0.00 0.41 0.00 0.00 173.24 173.45 2k2o s ARG 940 N -3.43 0.99 0.81 12.44 1.70 -0.91 -1.67 118.95 128.88 2k2o s ARG 940 Ca 0.02 -0.76 -0.12 0.00 -0.47 0.00 0.00 55.73 54.41 2k2o s ARG 940 Cb 0.03 0.43 0.08 0.00 -0.57 0.00 0.00 34.95 34.92 2k2o s ARG 940 CO -0.08 -0.37 1.12 0.71 -1.08 0.00 0.00 175.30 175.60 2k2o s TYR 941 N -3.72 2.84 -0.92 5.89 1.51 -1.26 -4.23 117.35 117.46 2k2o s TYR 941 Ca 0.03 1.00 -0.23 0.00 -1.01 0.00 0.00 57.07 56.86 2k2o s TYR 941 Cb 0.02 -3.24 -0.14 0.00 -0.11 0.00 0.00 41.96 38.50 2k2o s TYR 941 CO -0.11 -1.84 1.92 -2.30 -1.11 0.00 0.00 175.55 172.11 2k2o n PRO 942 N -3.44 1.48 0.00 -1.71 -0.02 -1.26 -0.68 135.00 129.37 2k2o n PRO 942 Ca 0.07 -2.08 0.00 0.00 -2.02 0.00 0.00 63.50 59.47 2k2o n PRO 942 Cb 0.58 -3.26 0.00 0.00 -0.02 0.00 0.00 33.50 30.80 2k2o n PRO 942 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k2o n GLY 943 N 5.09 -0.98 0.00 -1.23 0.00 -1.25 -4.94 105.19 101.87 2k2o n GLY 943 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 2k2o n GLY 943 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k2o n GLY 944 N 0.00 2.18 3.36 -0.02 0.00 0.14 -5.15 105.19 105.71 2k2o n GLY 944 Ca 0.00 -2.10 -0.19 0.00 0.00 0.00 0.00 46.02 43.73 2k2o n GLY 944 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k2o s ASP 945 N -0.95 2.72 0.06 1.61 2.15 -1.26 -4.77 116.67 116.24 2k2o s ASP 945 Ca 0.00 -1.02 -0.31 0.00 0.43 0.00 0.00 52.55 51.66 2k2o s ASP 945 Cb 0.00 -0.16 -0.06 0.00 -0.30 0.00 0.00 42.92 42.40 2k2o s ASP 945 CO 0.00 -0.14 1.23 0.26 -0.17 0.00 0.00 175.17 176.35 2k2o s TRP 946 N -2.89 3.40 -0.09 -5.34 0.52 -1.26 -4.24 118.94 109.04 2k2o s TRP 946 Ca 0.23 1.25 -0.08 0.00 0.02 0.00 0.00 56.10 57.52 2k2o s TRP 946 Cb -0.01 -3.46 0.03 0.00 -1.15 0.00 0.00 33.47 28.88 2k2o s TRP 946 CO 0.08 -1.44 0.23 -1.59 0.02 0.00 0.00 176.95 174.26 2k2o s LYS 947 N 1.13 0.26 -0.08 4.98 -2.85 -0.67 -4.85 119.74 117.65 2k2o s LYS 947 Ca 0.59 0.35 -0.37 0.00 -1.00 0.00 0.00 55.97 55.54 2k2o s LYS 947 Cb -0.30 0.09 -0.15 0.00 -2.06 0.00 0.00 37.83 35.41 2k2o s LYS 947 CO 0.29 -0.05 1.61 -2.30 0.10 0.00 0.00 175.35 175.00 2k2o n PRO 948 N 3.15 1.41 -0.32 1.78 -0.02 -1.26 -1.21 135.00 138.53 2k2o n PRO 948 Ca -0.15 0.51 -0.14 0.00 -2.02 0.00 0.00 63.50 61.70 2k2o n PRO 948 Cb 0.58 -2.21 0.14 0.00 -0.02 0.00 0.00 33.50 31.98 2k2o n PRO 948 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2k2o n ALA 949 N 4.36 -2.50 0.87 3.55 0.00 -1.06 -4.77 120.51 120.97 2k2o n ALA 949 Ca 0.22 -0.73 0.10 0.00 0.00 0.00 0.00 53.44 53.04 2k2o n ALA 949 Cb 0.19 -0.07 0.09 0.00 0.00 0.00 0.00 19.45 19.66 2k2o n ALA 949 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2k2o n GLU 950 N -2.21 1.89 -3.60 0.00 2.13 -1.26 -3.86 120.64 113.73 2k2o n GLU 950 Ca 0.07 -1.73 -0.28 0.00 0.66 0.00 0.00 57.16 55.88 2k2o n GLU 950 Cb 0.28 -1.40 -0.11 0.00 0.27 0.00 0.00 31.44 30.48 2k2o n GLU 950 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2k2o s ASP 951 N -1.75 2.90 0.20 4.31 1.01 -1.26 -5.02 116.67 117.06 2k2o s ASP 951 Ca 0.24 -3.11 -0.04 0.00 0.71 0.00 0.00 52.55 50.35 2k2o s ASP 951 Cb 0.17 -0.87 0.15 0.00 1.01 0.00 0.00 42.92 43.39 2k2o s ASP 951 CO 0.26 -0.18 1.57 0.74 0.21 0.00 0.00 175.17 177.78 2k2o h THR 952 N 4.73 1.29 -3.33 -1.27 2.02 -1.84 -3.44 112.91 111.07 2k2o h THR 952 Ca 0.16 -1.53 -0.64 0.00 0.77 0.00 0.00 66.41 65.17 2k2o h THR 952 Cb 0.88 1.46 -0.21 0.00 -1.74 0.00 0.00 68.15 68.54 2k2o h THR 952 CO 0.48 0.49 -0.67 -0.31 0.37 0.00 0.00 175.52 175.88 2k2o s TYR 953 N -4.33 3.02 0.34 3.16 2.02 -1.26 -1.10 117.35 119.21 2k2o s TYR 953 Ca -0.08 -0.26 0.01 0.00 -0.37 0.00 0.00 57.07 56.36 2k2o s TYR 953 Cb 0.12 -1.93 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 2k2o s TYR 953 CO 0.84 0.01 0.41 0.95 -1.57 0.00 0.00 175.55 176.19 2k2o s THR 954 N 0.23 0.00 0.46 -0.71 -4.23 -1.05 -0.75 115.64 109.60 2k2o s THR 954 Ca -0.03 -1.72 0.07 0.00 -1.18 0.00 0.00 61.69 58.84 2k2o s THR 954 Cb -0.14 -2.61 0.03 0.00 1.34 0.00 0.00 72.50 71.12 2k2o s THR 954 CO 0.03 0.00 0.63 -0.62 -0.54 0.00 0.00 174.62 174.12 2k2o s ASP 955 N -3.28 5.51 0.49 3.99 2.15 -0.08 -2.77 116.67 122.68 2k2o s ASP 955 Ca 0.34 -0.45 0.25 0.00 0.43 0.00 0.00 52.55 53.12 2k2o s ASP 955 Cb 0.00 -0.52 1.32 0.00 -0.30 0.00 0.00 42.92 43.43 2k2o s ASP 955 CO 0.23 -0.91 1.89 0.00 -0.17 0.00 0.00 175.17 176.21 2k2o h ALA 956 N 0.49 2.55 0.00 3.66 0.00 -1.94 0.28 119.26 124.30 2k2o h ALA 956 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2k2o h ALA 956 Cb 1.28 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2k2o h ALA 956 CO 0.45 -0.80 -0.09 -0.91 0.00 0.00 0.00 179.25 177.90 2k2o h ASN 957 N 0.15 0.00 0.00 0.00 2.35 -2.01 -3.47 115.58 112.60 2k2o h ASN 957 Ca 0.41 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 56.13 2k2o h ASN 957 Cb 1.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.76 2k2o h ASN 957 CO -0.07 0.01 0.00 0.61 -1.65 0.00 0.00 177.43 176.33 2k2o n GLY 958 N 1.30 0.36 3.54 2.83 0.00 1.00 -5.01 105.19 109.21 2k2o n GLY 958 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 2k2o n GLY 958 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k2o n ASP 959 N 0.00 2.22 -4.63 1.61 9.92 -1.26 -4.53 116.55 119.88 2k2o n ASP 959 Ca 0.00 -0.24 -0.49 0.00 -0.53 0.00 0.00 54.79 53.53 2k2o n ASP 959 Cb 0.00 -1.48 -0.05 0.00 -0.64 0.00 0.00 41.12 38.95 2k2o n ASP 959 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2k2o n LYS 960 N 8.84 1.63 -4.47 -1.24 0.00 -1.26 -0.90 118.16 120.75 2k2o n LYS 960 Ca 0.40 0.59 -0.24 0.00 0.00 0.00 0.00 58.31 59.06 2k2o n LYS 960 Cb 0.44 -2.27 -0.09 0.00 0.00 0.00 0.00 35.03 33.12 2k2o n LYS 960 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k2o s ALA 961 N 0.57 2.65 0.46 3.14 0.00 0.07 -4.89 121.76 123.76 2k2o s ALA 961 Ca 0.80 -1.49 -0.24 0.00 0.00 0.00 0.00 51.96 51.03 2k2o s ALA 961 Cb -0.81 0.80 -0.07 0.00 0.00 0.00 0.00 23.12 23.03 2k2o s ALA 961 CO 0.44 -0.36 1.31 0.00 0.00 0.00 0.00 175.76 177.15 2k2o s ALA 962 N -3.30 3.08 0.77 0.00 0.00 -1.26 -4.62 121.76 116.43 2k2o s ALA 962 Ca 0.28 1.24 -0.11 0.00 0.00 0.00 0.00 51.96 53.38 2k2o s ALA 962 Cb 0.04 -3.51 0.06 0.00 0.00 0.00 0.00 23.12 19.71 2k2o s ALA 962 CO 0.15 -1.01 1.10 -1.12 0.00 0.00 0.00 175.76 174.88 2k2o s SER 963 N -0.88 4.42 0.64 0.00 0.01 -1.26 -4.59 113.70 112.05 2k2o s SER 963 Ca 0.63 1.88 0.29 0.00 1.31 0.00 0.00 55.95 60.05 2k2o s SER 963 Cb -0.38 -2.53 1.53 0.00 0.21 0.00 0.00 66.02 64.85 2k2o s SER 963 CO 0.47 -2.09 1.88 -0.65 0.41 0.00 0.00 173.24 173.26 2k2o h PRO 964 N -1.06 0.00 0.16 12.44 0.11 -1.94 0.35 132.00 142.05 2k2o h PRO 964 Ca -0.44 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2k2o h PRO 964 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2k2o h PRO 964 CO 0.51 0.00 -0.08 0.66 -0.21 0.00 0.00 178.00 178.88 2k2o h SER 965 N 0.00 -0.18 0.67 -2.05 4.64 -2.03 -3.18 113.55 111.42 2k2o h SER 965 Ca 0.06 -0.35 -0.04 0.00 -0.47 0.00 0.00 61.79 60.98 2k2o h SER 965 Cb 0.85 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.98 2k2o h SER 965 CO -0.00 0.32 -0.21 -0.33 -0.87 0.00 0.00 176.83 175.74 2k2o h GLU 966 N -0.76 0.00 -6.14 4.77 3.07 -1.36 -3.41 114.58 110.75 2k2o h GLU 966 Ca -0.02 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.26 2k2o h GLU 966 Cb 0.52 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 2k2o h GLU 966 CO 0.04 0.21 1.37 -0.51 -1.40 0.00 0.00 179.01 178.71 2k2o s LEU 967 N -7.06 3.59 0.30 1.33 1.43 0.10 -4.92 118.68 113.44 2k2o s LEU 967 Ca -0.01 1.75 0.03 0.00 -1.03 0.00 0.00 54.13 54.87 2k2o s LEU 967 Cb 0.12 -3.52 -0.06 0.00 0.03 0.00 0.00 46.19 42.76 2k2o s LEU 967 CO 0.63 -1.73 0.06 0.42 0.23 0.00 0.00 176.35 175.95 2k2o s THR 968 N 7.22 1.01 0.17 5.49 -4.23 -1.26 -4.90 115.64 119.14 2k2o s THR 968 Ca 0.90 -2.01 -0.19 0.00 -1.18 0.00 0.00 61.69 59.21 2k2o s THR 968 Cb -0.30 -2.71 -0.08 0.00 1.34 0.00 0.00 72.50 70.76 2k2o s THR 968 CO 0.35 -0.03 0.66 0.00 -0.54 0.00 0.00 174.62 175.06 2k2o s PRO 970 N -1.68 0.15 0.21 0.00 0.04 -1.26 -4.95 135.00 127.51 2k2o s PRO 970 Ca 0.38 -0.09 -0.09 0.00 0.04 0.00 0.00 61.00 61.24 2k2o s PRO 970 Cb -0.18 -1.76 0.30 0.00 0.04 0.00 0.00 34.50 32.91 2k2o s PRO 970 CO 0.21 -2.79 1.74 -1.35 0.04 0.00 0.00 177.00 174.85 2k2o h PRO 971 N -1.92 0.42 0.02 0.56 0.11 -2.01 -3.08 132.00 126.10 2k2o h PRO 971 Ca -0.46 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.49 2k2o h PRO 971 Cb 1.28 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.31 2k2o h PRO 971 CO 0.44 0.28 -0.51 0.78 -0.21 0.00 0.00 178.00 178.77 2k2o h GLY 972 N 0.43 0.35 -2.90 -0.55 0.00 -1.93 -3.41 103.07 95.06 2k2o h GLY 972 Ca 0.32 -0.65 -0.48 0.00 0.00 0.00 0.00 47.33 46.52 2k2o h GLY 972 CO -0.32 0.58 0.39 -0.98 0.00 0.00 0.00 176.54 176.22 2k2o s TRP 973 N -3.04 3.43 0.10 5.60 0.52 -1.16 -4.63 118.94 119.75 2k2o s TRP 973 Ca -0.14 1.69 0.08 0.00 0.02 0.00 0.00 56.10 57.75 2k2o s TRP 973 Cb 0.02 -3.07 -0.03 0.00 -1.15 0.00 0.00 33.47 29.24 2k2o s TRP 973 CO 0.80 -0.34 -0.20 -2.00 0.02 0.00 0.00 176.95 175.22 2k2o s GLU 974 N -2.30 1.10 0.44 4.98 2.56 -0.27 -4.00 118.70 121.21 2k2o s GLU 974 Ca 0.54 -1.13 -0.09 0.00 0.00 0.00 0.00 54.97 54.29 2k2o s GLU 974 Cb -0.21 -1.34 -0.06 0.00 2.00 0.00 0.00 34.13 34.52 2k2o s GLU 974 CO 0.27 0.31 0.79 -1.58 -0.56 0.00 0.00 175.26 174.49 2k2o s TRP 975 N -1.16 3.50 0.00 5.30 0.52 -1.26 -0.62 118.94 125.23 2k2o s TRP 975 Ca 0.06 1.00 0.00 0.00 0.02 0.00 0.00 56.10 57.18 2k2o s TRP 975 Cb -0.10 -2.43 0.00 0.00 -1.15 0.00 0.00 33.47 29.80 2k2o s TRP 975 CO 0.04 -0.18 0.00 -1.91 0.02 0.00 0.00 176.95 174.92 2k2o n GLU 976 N -1.61 0.00 -2.07 4.98 2.13 -1.06 -4.68 120.64 118.33 2k2o n GLU 976 Ca 0.02 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.53 2k2o n GLU 976 Cb 0.54 -0.74 -0.00 0.00 0.27 0.00 0.00 31.44 31.51 2k2o n GLU 976 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2k2o s ASP 977 N -4.49 6.24 -0.45 4.31 1.11 -1.16 -5.00 116.67 117.23 2k2o s ASP 977 Ca 0.00 1.55 -0.23 0.00 0.18 0.00 0.00 52.55 54.05 2k2o s ASP 977 Cb 0.00 -2.50 0.03 0.00 1.07 0.00 0.00 42.92 41.52 2k2o s ASP 977 CO 0.00 -0.86 0.78 -1.81 1.18 0.00 0.00 175.17 174.46 2k2o s ASP 978 N -3.53 6.41 0.34 0.27 1.01 -1.26 -4.89 116.67 115.03 2k2o s ASP 978 Ca 0.58 -0.12 0.00 0.00 0.71 0.00 0.00 52.55 53.72 2k2o s ASP 978 Cb -0.11 -2.38 0.00 0.00 1.01 0.00 0.00 42.92 41.43 2k2o s ASP 978 CO 0.43 -0.91 0.00 0.00 0.21 0.00 0.00 175.17 174.90 2k2o n ALA 979 N 6.69 -3.59 -2.63 5.23 0.00 -1.26 -4.64 120.51 120.31 2k2o n ALA 979 Ca 0.02 0.48 -0.40 0.00 0.00 0.00 0.00 53.44 53.53 2k2o n ALA 979 Cb 0.48 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 2k2o n ALA 979 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2k2o s TRP 980 N -2.47 3.30 0.05 0.00 0.52 -1.25 -4.50 118.94 114.59 2k2o s TRP 980 Ca 0.00 0.84 0.07 0.00 0.02 0.00 0.00 56.10 57.03 2k2o s TRP 980 Cb 0.00 -2.83 -0.02 0.00 -1.15 0.00 0.00 33.47 29.46 2k2o s TRP 980 CO 0.00 -0.30 -0.19 -1.12 0.02 0.00 0.00 176.95 175.36 2k2o s SER 981 N 1.42 2.33 0.18 2.95 0.01 -0.68 -4.77 113.70 115.13 2k2o s SER 981 Ca 0.27 -0.52 -0.30 0.00 1.31 0.00 0.00 55.95 56.71 2k2o s SER 981 Cb -0.16 -0.18 -0.08 0.00 0.21 0.00 0.00 66.02 65.81 2k2o s SER 981 CO 0.09 0.13 1.18 -0.72 0.41 0.00 0.00 173.24 174.33 2k2o s TYR 982 N -0.83 3.45 0.01 2.43 1.13 -1.26 -0.64 117.35 121.64 2k2o s TYR 982 Ca 0.06 1.45 -0.24 0.00 -1.41 0.00 0.00 57.07 56.93 2k2o s TYR 982 Cb -0.09 -3.41 -0.05 0.00 -1.10 0.00 0.00 41.96 37.32 2k2o s TYR 982 CO 0.02 -1.11 0.73 0.34 -2.51 0.00 0.00 175.55 173.01 2k2o s ASP 983 N 0.12 7.12 -0.18 -0.18 2.15 0.15 -4.90 116.67 120.94 2k2o s ASP 983 Ca 0.52 1.34 0.16 0.00 0.43 0.00 0.00 52.55 55.01 2k2o s ASP 983 Cb -0.32 -2.44 0.45 0.00 -0.30 0.00 0.00 42.92 40.31 2k2o s ASP 983 CO 0.36 -0.01 1.34 2.30 -0.17 0.00 0.00 175.17 178.99 2k2o n ILE 984 N 3.07 2.21 -1.32 4.11 -6.64 -1.26 -4.60 119.36 114.93 2k2o n ILE 984 Ca -0.03 -2.18 -0.18 0.00 -1.77 0.00 0.00 62.75 58.59 2k2o n ILE 984 Cb 0.51 -0.26 0.18 0.00 -1.44 0.00 0.00 39.64 38.63 2k2o n ILE 984 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 2k2o n ASN 985 N -0.89 3.49 -3.41 7.28 3.02 -1.26 -4.90 115.26 118.58 2k2o n ASN 985 Ca 0.22 -3.68 -0.21 0.00 -0.03 0.00 0.00 54.58 50.87 2k2o n ASN 985 Cb 0.84 -0.78 -0.07 0.00 -0.61 0.00 0.00 39.78 39.16 2k2o n ASN 985 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2k2o n ARG 986 N -1.13 0.46 -2.62 3.52 1.74 -1.26 -5.05 116.66 112.32 2k2o n ARG 986 Ca 0.51 -3.32 -0.42 0.00 -0.77 0.00 0.00 57.85 53.85 2k2o n ARG 986 Cb 1.43 2.41 -0.01 0.00 -1.02 0.00 0.00 32.46 35.26 2k2o n ARG 986 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2k2o s ALA 987 N -3.25 3.16 0.48 7.54 0.00 -1.26 -4.93 121.76 123.50 2k2o s ALA 987 Ca 0.33 -2.71 0.02 0.00 0.00 0.00 0.00 51.96 49.60 2k2o s ALA 987 Cb 0.02 -4.53 0.02 0.00 0.00 0.00 0.00 23.12 18.63 2k2o s ALA 987 CO 0.23 -3.35 0.16 1.33 0.00 0.00 0.00 175.76 174.13 2k2o n VAL 988 N 6.38 0.00 -1.44 0.00 0.24 -1.26 -4.17 118.33 118.07 2k2o n VAL 988 Ca 0.41 -2.10 -0.30 0.00 -2.04 0.00 0.00 64.34 60.31 2k2o n VAL 988 Cb 0.48 0.21 0.23 0.00 -1.47 0.00 0.00 33.84 33.29 2k2o n VAL 988 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2k2o s ASP 989 N -3.71 1.62 0.48 -1.34 -1.08 -0.48 -4.82 116.67 107.34 2k2o s ASP 989 Ca 0.12 0.39 0.13 0.00 -0.52 0.00 0.00 52.55 52.68 2k2o s ASP 989 Cb -0.01 -0.48 1.13 0.00 -1.46 0.00 0.00 42.92 42.09 2k2o s ASP 989 CO 0.08 -3.67 2.10 -0.33 0.52 0.00 0.00 175.17 173.87 2k2o h GLU 990 N -2.28 0.20 0.00 4.34 5.08 -1.92 -3.18 114.58 116.83 2k2o h GLU 990 Ca -0.44 -0.01 -0.38 0.00 -1.00 0.00 0.00 59.36 57.53 2k2o h GLU 990 Cb 1.26 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 2k2o h GLU 990 CO 0.32 0.13 -2.36 1.63 -1.00 0.00 0.00 179.01 177.73 2k2o n LYS 991 N -4.51 0.56 0.00 2.33 4.76 -1.26 -5.03 118.16 115.01 2k2o n LYS 991 Ca 0.00 0.18 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 2k2o n LYS 991 Cb 0.12 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.88 2k2o n LYS 991 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k2o n GLY 992 N 1.94 0.06 3.30 0.72 0.00 -1.20 -4.81 105.19 105.20 2k2o n GLY 992 Ca -0.45 -0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.31 2k2o n GLY 992 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2k2o s TRP 993 N 0.00 1.79 0.03 1.61 0.52 -1.26 -4.60 118.94 117.02 2k2o s TRP 993 Ca 0.00 -1.66 -0.05 0.00 0.02 0.00 0.00 56.10 54.41 2k2o s TRP 993 Cb 0.00 -0.75 -0.01 0.00 -1.15 0.00 0.00 33.47 31.56 2k2o s TRP 993 CO 0.00 -0.85 0.08 -1.83 0.02 0.00 0.00 176.95 174.37 2k2o s GLU 994 N -3.43 0.53 -0.61 4.98 -1.05 0.24 -1.38 118.70 117.98 2k2o s GLU 994 Ca 0.40 -0.70 -0.27 0.00 -0.15 0.00 0.00 54.97 54.26 2k2o s GLU 994 Cb 0.02 0.21 0.04 0.00 -0.44 0.00 0.00 34.13 33.95 2k2o s GLU 994 CO 0.28 -0.12 1.14 -0.47 0.95 0.00 0.00 175.26 177.03 2k2o s TYR 995 N -2.29 2.59 -0.15 4.83 6.14 -1.21 -3.34 117.35 123.91 2k2o s TYR 995 Ca -0.08 0.16 -0.00 0.00 0.64 0.00 0.00 57.07 57.79 2k2o s TYR 995 Cb -0.03 -4.42 0.04 0.00 0.42 0.00 0.00 41.96 37.96 2k2o s TYR 995 CO -0.03 -1.64 -0.07 0.20 0.64 0.00 0.00 175.55 174.66 2k2o s GLY 996 N 3.13 0.94 0.09 8.97 0.00 -1.18 -2.54 107.32 116.73 2k2o s GLY 996 Ca 0.37 -0.77 0.05 0.00 0.00 0.00 0.00 44.72 44.37 2k2o s GLY 996 CO 0.21 0.87 -0.01 -0.26 0.00 0.00 0.00 173.10 173.91 2k2o s ILE 997 N 1.64 3.95 -0.10 0.90 -4.36 -1.26 -2.36 121.20 119.60 2k2o s ILE 997 Ca 0.02 -0.99 -0.03 0.00 -0.26 0.00 0.00 60.65 59.39 2k2o s ILE 997 Cb -0.14 -2.87 0.04 0.00 1.25 0.00 0.00 42.46 40.74 2k2o s ILE 997 CO -0.08 0.14 0.05 -0.89 0.24 0.00 0.00 174.94 174.40 2k2o s THR 998 N -1.29 0.09 -0.43 8.37 2.01 -1.26 -3.84 115.64 119.30 2k2o s THR 998 Ca 0.25 0.06 -0.15 0.00 0.31 0.00 0.00 61.69 62.16 2k2o s THR 998 Cb -0.12 -0.47 0.04 0.00 0.01 0.00 0.00 72.50 71.96 2k2o s THR 998 CO 0.17 0.02 0.33 -0.63 -0.69 0.00 0.00 174.62 173.82 2k2o s ILE 999 N 2.08 5.19 0.57 1.82 1.09 -1.26 -4.62 121.20 126.06 2k2o s ILE 999 Ca 0.03 -0.84 -0.19 0.00 -1.10 0.00 0.00 60.65 58.56 2k2o s ILE 999 Cb -0.14 -3.97 -0.05 0.00 -1.06 0.00 0.00 42.46 37.24 2k2o s ILE 999 CO -0.06 -0.41 1.15 -2.84 -0.10 0.00 0.00 174.94 172.69 2k2o s PRO 1000N 1.65 3.20 0.23 2.79 0.02 -1.26 -4.21 135.00 137.42 2k2o s PRO 1000Ca 0.04 1.67 -0.13 0.00 0.02 0.00 0.00 61.00 62.61 2k2o s PRO 1000Cb -0.21 -1.98 -0.08 0.00 0.02 0.00 0.00 34.50 32.26 2k2o s PRO 1000CO 0.08 -0.98 0.60 -1.25 -0.33 0.00 0.00 177.00 175.12 2k2o s PRO 1001N -3.34 3.92 0.00 5.54 0.05 -1.26 -5.13 135.00 134.77 2k2o s PRO 1001Ca 0.74 0.45 0.00 0.00 0.05 0.00 0.00 61.00 62.24 2k2o s PRO 1001Cb -0.26 -2.69 0.00 0.00 0.05 0.00 0.00 34.50 31.60 2k2o s PRO 1001CO 0.30 0.33 0.00 -3.47 0.05 0.00 0.00 177.00 174.21 2k2o n ASP 1002N 0.12 0.00 0.00 6.66 -0.08 -1.26 -5.12 116.55 116.87 2k2o n ASP 1002Ca -0.01 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 2k2o n ASP 1002Cb 0.52 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.98 2k2o n ASP 1002CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2k2o n HIS 1003N -0.08 0.00 -4.26 -0.67 8.25 -1.26 -5.15 115.22 112.05 2k2o n HIS 1003Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 2k2o n HIS 1003Cb 0.00 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 30.99 2k2o n HIS 1003CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2k2o s LYS 1004N 0.00 1.07 0.53 -0.41 1.02 -1.26 -5.01 119.74 115.68 2k2o s LYS 1004Ca 0.00 -1.14 -0.21 0.00 0.02 0.00 0.00 55.97 54.63 2k2o s LYS 1004Cb 0.00 -1.25 -0.05 0.00 -0.52 0.00 0.00 37.83 36.01 2k2o s LYS 1004CO 0.00 0.28 1.28 -2.14 -0.92 0.00 0.00 175.35 173.85 2k2o s PRO 1005N -1.97 3.26 -0.23 -1.68 0.02 -1.25 -4.93 135.00 128.22 2k2o s PRO 1005Ca 0.05 2.04 -0.18 0.00 0.02 0.00 0.00 61.00 62.93 2k2o s PRO 1005Cb -0.09 -2.23 -0.15 0.00 0.02 0.00 0.00 34.50 32.04 2k2o s PRO 1005CO 0.04 -1.03 -0.03 1.63 -0.33 0.00 0.00 177.00 177.28 2k2o n LYS 1006N -1.00 0.57 -3.98 5.54 4.76 -1.26 -4.98 118.16 117.81 2k2o n LYS 1006Ca 0.10 0.45 -0.29 0.00 -2.87 0.00 0.00 58.31 55.70 2k2o n LYS 1006Cb 0.47 -1.64 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 2k2o n LYS 1006CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2k2o s SER 1007N -7.02 6.04 -0.01 4.39 0.01 -1.26 -5.11 113.70 110.74 2k2o s SER 1007Ca -0.32 0.12 0.02 0.00 1.31 0.00 0.00 55.95 57.08 2k2o s SER 1007Cb 0.09 -1.76 0.00 0.00 0.21 0.00 0.00 66.02 64.56 2k2o s SER 1007CO 0.53 0.12 -0.05 0.26 0.41 0.00 0.00 173.24 174.51 2k2o s TRP 1008N -1.59 0.58 0.00 2.43 0.52 -1.22 -4.35 118.94 115.31 2k2o s TRP 1008Ca 0.33 -0.12 0.00 0.00 0.02 0.00 0.00 56.10 56.33 2k2o s TRP 1008Cb -0.12 -0.43 0.00 0.00 -1.15 0.00 0.00 33.47 31.78 2k2o s TRP 1008CO 0.26 -0.06 0.00 0.28 0.02 0.00 0.00 176.95 177.46 2k2o n VAL 1009N 3.25 0.00 0.00 4.03 0.31 -1.05 -4.81 118.33 120.06 2k2o n VAL 1009Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2k2o n VAL 1009Cb 0.56 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.49 2k2o n VAL 1009CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k2o n ALA 1010N -3.00 0.00 -1.00 3.52 0.00 -1.26 -3.31 120.51 115.47 2k2o n ALA 1010Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k2o n ALA 1010Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2k2o n ALA 1010CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k2o n ALA 1011N -0.44 0.00 -3.37 0.00 0.00 -1.26 -4.15 120.51 111.29 2k2o n ALA 1011Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2k2o n ALA 1011Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2k2o n ALA 1011CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2k2o s GLU 1012N -2.83 0.34 -0.05 0.00 2.56 -1.26 -4.51 118.70 112.95 2k2o s GLU 1012Ca 0.00 0.28 0.04 0.00 0.00 0.00 0.00 54.97 55.29 2k2o s GLU 1012Cb 0.00 -0.56 -0.02 0.00 2.00 0.00 0.00 34.13 35.54 2k2o s GLU 1012CO 0.00 -0.80 -0.16 0.15 -0.56 0.00 0.00 175.26 173.89 2k2o s LYS 1013N 2.49 2.52 0.49 4.30 1.02 -1.26 -5.04 119.74 124.26 2k2o s LYS 1013Ca 0.11 -0.73 0.34 0.00 0.02 0.00 0.00 55.97 55.70 2k2o s LYS 1013Cb -0.14 -2.35 1.46 0.00 -0.52 0.00 0.00 37.83 36.28 2k2o s LYS 1013CO -0.22 0.58 1.73 1.98 -0.92 0.00 0.00 175.35 178.50 2k2o h MET 1014N 5.48 0.10 0.00 1.68 1.85 -2.00 0.29 114.93 122.33 2k2o h MET 1014Ca -0.44 -0.01 0.00 0.00 -0.61 0.00 0.00 59.70 58.64 2k2o h MET 1014Cb 1.15 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 33.16 2k2o h MET 1014CO 0.50 0.07 0.00 2.48 -0.40 0.00 0.00 176.91 179.56 2k2o n TYR 1015N -4.34 0.00 -1.65 1.39 0.18 -1.26 -3.97 117.16 107.51 2k2o n TYR 1015Ca 0.31 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.66 2k2o n TYR 1015Cb 1.32 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 40.25 2k2o n TYR 1015CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 2k2o s HIS 1016N -2.00 1.24 -0.33 -3.48 3.76 0.10 -4.49 115.29 110.09 2k2o s HIS 1016Ca 0.17 -0.32 0.10 0.00 -0.15 0.00 0.00 55.06 54.86 2k2o s HIS 1016Cb 0.08 -4.20 -0.13 0.00 1.11 0.00 0.00 32.58 29.44 2k2o s HIS 1016CO 0.13 -5.39 0.37 0.25 -0.85 0.00 0.00 174.74 169.25 2k2o n THR 1017N 5.93 0.00 -3.94 1.30 -2.24 -1.26 -4.41 114.28 109.65 2k2o n THR 1017Ca 0.22 -0.25 -0.10 0.00 -2.27 0.00 0.00 64.05 61.64 2k2o n THR 1017Cb 0.42 0.78 -0.12 0.00 -2.10 0.00 0.00 70.33 69.31 2k2o n THR 1017CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2k2o s HIS 1018N -2.18 0.17 -0.09 4.78 3.76 -1.00 -2.15 115.29 118.58 2k2o s HIS 1018Ca 0.01 -0.36 -0.16 0.00 -0.15 0.00 0.00 55.06 54.41 2k2o s HIS 1018Cb 0.07 -0.13 0.04 0.00 1.11 0.00 0.00 32.58 33.67 2k2o s HIS 1018CO 0.42 -0.15 0.40 0.50 -0.85 0.00 0.00 174.74 175.05 2k2o s ARG 1019N -1.09 0.61 0.20 1.40 3.52 -0.77 -3.08 118.95 119.74 2k2o s ARG 1019Ca -0.12 0.24 -0.00 0.00 -0.13 0.00 0.00 55.73 55.72 2k2o s ARG 1019Cb -0.07 0.28 -0.04 0.00 -1.56 0.00 0.00 34.95 33.56 2k2o s ARG 1019CO -0.01 -0.13 0.10 1.03 -0.81 0.00 0.00 175.30 175.48 2k2o s ARG 1020N -0.52 1.20 0.03 5.12 0.52 -1.21 -1.22 118.95 122.86 2k2o s ARG 1020Ca -0.06 -1.62 -0.20 0.00 -0.52 0.00 0.00 55.73 53.32 2k2o s ARG 1020Cb -0.04 0.10 0.04 0.00 0.52 0.00 0.00 34.95 35.57 2k2o s ARG 1020CO 0.03 -0.33 0.45 -0.98 0.02 0.00 0.00 175.30 174.50 2k2o s ARG 1021N -4.09 0.93 -0.34 3.54 1.70 -1.00 -0.59 118.95 119.10 2k2o s ARG 1021Ca 0.35 -0.25 -0.20 0.00 -0.47 0.00 0.00 55.73 55.17 2k2o s ARG 1021Cb 0.07 0.42 -0.00 0.00 -0.57 0.00 0.00 34.95 34.87 2k2o s ARG 1021CO 0.10 -0.31 0.60 0.50 -1.08 0.00 0.00 175.30 175.10 2k2o s ARG 1022N -2.19 3.74 -0.18 3.89 3.52 -1.26 -1.31 118.95 125.17 2k2o s ARG 1022Ca -0.07 0.07 -0.20 0.00 -0.13 0.00 0.00 55.73 55.40 2k2o s ARG 1022Cb -0.01 -3.78 -0.03 0.00 -1.56 0.00 0.00 34.95 29.57 2k2o s ARG 1022CO -0.00 -0.65 0.58 -0.51 -0.81 0.00 0.00 175.30 173.90 2k2o s LEU 1023N 2.59 4.18 0.16 -0.88 1.43 -0.27 -0.68 118.68 125.21 2k2o s LEU 1023Ca 0.23 0.81 0.08 0.00 -1.03 0.00 0.00 54.13 54.22 2k2o s LEU 1023Cb -0.15 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.21 2k2o s LEU 1023CO 0.13 -0.19 -0.06 0.68 0.23 0.00 0.00 176.35 177.14 2k2o s VAL 1024N 1.54 3.41 -0.29 -1.59 -7.23 0.19 -1.18 120.40 115.25 2k2o s VAL 1024Ca 0.28 -1.49 -0.01 0.00 -1.81 0.00 0.00 61.98 58.94 2k2o s VAL 1024Cb -0.16 -2.68 0.18 0.00 0.56 0.00 0.00 36.38 34.28 2k2o s VAL 1024CO 0.11 -0.06 0.57 -0.60 -0.31 0.00 0.00 175.10 174.81 2k2o s ARG 1025N -2.72 0.54 0.46 4.82 3.52 -0.58 -1.69 118.95 123.29 2k2o s ARG 1025Ca 0.25 0.96 -0.21 0.00 -0.13 0.00 0.00 55.73 56.60 2k2o s ARG 1025Cb -0.09 0.43 -0.09 0.00 -1.56 0.00 0.00 34.95 33.64 2k2o s ARG 1025CO 0.16 -0.61 1.02 0.21 -0.81 0.00 0.00 175.30 175.27 2k2o s LYS 1026N 2.82 3.93 -0.01 5.12 2.36 -1.26 -1.30 119.74 131.40 2k2o s LYS 1026Ca 0.19 1.33 0.01 0.00 -2.55 0.00 0.00 55.97 54.96 2k2o s LYS 1026Cb -0.15 -2.17 -0.00 0.00 -1.05 0.00 0.00 37.83 34.46 2k2o s LYS 1026CO -0.20 -0.32 -0.05 -0.98 1.55 0.00 0.00 175.35 175.35 2k2o s ARG 1027N -3.13 0.41 -0.04 4.03 1.70 -0.39 -2.56 118.95 118.97 2k2o s ARG 1027Ca 0.65 -0.17 0.05 0.00 -0.47 0.00 0.00 55.73 55.79 2k2o s ARG 1027Cb -0.16 -0.41 -0.00 0.00 -0.57 0.00 0.00 34.95 33.81 2k2o s ARG 1027CO 0.19 0.09 -0.18 0.21 -1.08 0.00 0.00 175.30 174.54 2k2o s LYS 1028N -0.05 1.78 0.22 3.89 2.20 0.21 -0.64 119.74 127.35 2k2o s LYS 1028Ca 0.01 -0.63 0.21 0.00 -0.36 0.00 0.00 55.97 55.21 2k2o s LYS 1028Cb -0.03 -1.56 0.03 0.00 -1.51 0.00 0.00 37.83 34.76 2k2o s LYS 1028CO -0.00 0.27 1.10 -0.22 -0.36 0.00 0.00 175.35 176.14 2k2o h LYS 1029N 6.18 0.00 0.00 4.03 3.64 -0.17 -0.69 116.57 129.56 2k2o h LYS 1029Ca -0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2k2o h LYS 1029Cb 1.17 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 2k2o h LYS 1029CO 0.48 0.06 0.00 -3.47 -2.27 0.00 0.00 179.45 174.25 2k2o n ASP 1030N -2.79 0.00 -0.93 4.20 2.03 -1.24 -3.44 116.55 114.39 2k2o n ASP 1030Ca -0.01 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.18 2k2o n ASP 1030Cb 0.60 -1.51 -0.05 0.00 -0.72 0.00 0.00 41.12 39.44 2k2o n ASP 1030CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2k2o n LEU 1031N 0.00 -0.55 0.00 -2.67 7.94 -1.26 -4.63 117.00 115.83 2k2o n LEU 1031Ca 0.00 0.30 0.00 0.00 -1.11 0.00 0.00 56.01 55.20 2k2o n LEU 1031Cb 0.00 -2.55 0.00 0.00 0.53 0.00 0.00 43.42 41.40 2k2o n LEU 1031CO 0.00 -0.97 0.30 1.07 -1.11 0.00 0.00 177.39 176.67 2k2o n THR 1032N -2.31 0.29 -3.94 1.96 5.66 -1.23 -4.77 114.28 109.95 2k2o n THR 1032Ca -0.12 -0.57 -0.35 0.00 -3.05 0.00 0.00 64.05 59.96 2k2o n THR 1032Cb 0.57 0.96 -0.09 0.00 -1.55 0.00 0.00 70.33 70.21 2k2o n THR 1032CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 2k2o s GLN 1033N -0.29 3.97 -0.59 1.09 0.74 -1.22 -3.88 119.66 119.47 2k2o s GLN 1033Ca 0.00 -0.30 0.00 0.00 0.05 0.00 0.00 55.36 55.11 2k2o s GLN 1033Cb 0.00 -3.25 0.00 0.00 1.10 0.00 0.00 33.01 30.86 2k2o s GLN 1033CO 0.00 0.33 0.00 0.25 -0.55 0.00 0.00 175.29 175.32 2k2o n THR 1034N 3.38 0.00 -4.46 -0.34 -2.24 -1.26 -4.75 114.28 104.60 2k2o n THR 1034Ca -0.17 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.39 2k2o n THR 1034Cb 0.52 -1.09 -0.10 0.00 -2.10 0.00 0.00 70.33 67.56 2k2o n THR 1034CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k2o s ALA 1035N -1.67 2.50 -0.21 6.98 0.00 -1.25 -4.99 121.76 123.11 2k2o s ALA 1035Ca 0.00 -1.75 -0.01 0.00 0.00 0.00 0.00 51.96 50.21 2k2o s ALA 1035Cb 0.00 0.72 0.00 0.00 0.00 0.00 0.00 23.12 23.85 2k2o s ALA 1035CO 0.00 -0.33 0.01 0.43 0.00 0.00 0.00 175.76 175.87 2k2o n SER 1036N -0.87 -5.75 -4.00 0.00 7.64 -1.26 -4.87 113.62 104.51 2k2o n SER 1036Ca -0.03 1.00 -0.31 0.00 1.01 0.00 0.00 58.87 60.53 2k2o n SER 1036Cb 0.66 -4.02 -0.15 0.00 -1.01 0.00 0.00 64.21 59.70 2k2o n SER 1036CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k2o s SER 1037N -1.08 4.66 -0.21 6.43 0.01 -1.26 -5.08 113.70 117.17 2k2o s SER 1037Ca -0.02 -2.35 -0.09 0.00 1.31 0.00 0.00 55.95 54.81 2k2o s SER 1037Cb 0.00 -1.63 -0.04 0.00 0.21 0.00 0.00 66.02 64.56 2k2o s SER 1037CO 0.55 -0.35 0.10 -0.89 0.41 0.00 0.00 173.24 173.06 2k2o s THR 1038N 0.64 4.96 -0.53 1.44 2.01 -1.26 -5.04 115.64 117.86 2k2o s THR 1038Ca 0.12 0.04 -0.27 0.00 0.31 0.00 0.00 61.69 61.89 2k2o s THR 1038Cb -0.21 -3.28 -0.02 0.00 0.01 0.00 0.00 72.50 69.00 2k2o s THR 1038CO -0.06 0.40 1.89 0.00 -0.69 0.00 0.00 174.62 176.16 2k2o s ALA 1039N 0.77 2.29 -2.12 7.40 0.00 -1.26 -5.31 121.76 123.53 2k2o s ALA 1039Ca 0.05 -0.37 0.17 0.00 0.00 0.00 0.00 51.96 51.81 2k2o s ALA 1039Cb -0.13 -4.24 0.13 0.00 0.00 0.00 0.00 23.12 18.89 2k2o s ALA 1039CO 0.02 -3.64 1.04 0.54 0.00 0.00 0.00 175.76 173.72