#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 7.25 1.10 7.28 2.15 -1.26 -5.02 116.67 128.18 2k2o s ASP 919 Ca 0.00 1.52 -0.13 0.00 0.43 0.00 0.00 52.55 54.37 2k2o s ASP 919 Cb 0.00 -2.54 0.25 0.00 -0.30 0.00 0.00 42.92 40.33 2k2o s ASP 919 CO 0.00 -0.34 1.05 -2.84 -0.17 0.00 0.00 175.17 172.87 2k2o s PRO 920 N 1.52 -0.44 0.00 4.34 0.02 -1.26 -5.07 135.00 134.11 2k2o s PRO 920 Ca 0.48 0.66 0.00 0.00 0.02 0.00 0.00 61.00 62.16 2k2o s PRO 920 Cb -0.19 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.70 2k2o s PRO 920 CO 0.21 -3.35 0.00 1.19 -0.33 0.00 0.00 177.00 174.72 2k2o n PHE 921 N -4.63 -1.60 -1.68 6.54 3.01 -1.26 -5.02 117.46 112.81 2k2o n PHE 921 Ca 0.04 0.00 -0.48 0.00 1.01 0.00 0.00 57.45 58.02 2k2o n PHE 921 Cb 0.56 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.98 2k2o n PHE 921 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2k2o n THR 922 N -0.53 0.60 -4.55 4.37 -1.04 -1.26 -4.98 114.28 106.88 2k2o n THR 922 Ca 0.00 -0.11 -0.27 0.00 -2.04 0.00 0.00 64.05 61.64 2k2o n THR 922 Cb 0.00 -1.92 -0.10 0.00 -1.82 0.00 0.00 70.33 66.49 2k2o n THR 922 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k2o s ALA 923 N 4.08 3.05 -0.14 2.41 0.00 -1.26 -5.13 121.76 124.77 2k2o s ALA 923 Ca 0.92 -2.15 -0.06 0.00 0.00 0.00 0.00 51.96 50.66 2k2o s ALA 923 Cb -0.67 -0.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 2k2o s ALA 923 CO 0.51 0.01 0.08 0.34 0.00 0.00 0.00 175.76 176.70 2k2o s ASP 924 N -3.65 5.83 -0.07 0.00 2.15 -1.26 -4.92 116.67 114.74 2k2o s ASP 924 Ca 0.34 0.23 0.18 0.00 0.43 0.00 0.00 52.55 53.73 2k2o s ASP 924 Cb 0.05 -1.90 0.37 0.00 -0.30 0.00 0.00 42.92 41.14 2k2o s ASP 924 CO 0.17 0.29 1.17 0.00 -0.17 0.00 0.00 175.17 176.63 2k2o n ALA 925 N 2.74 2.73 0.00 3.66 0.00 -1.26 -4.95 120.51 123.42 2k2o n ALA 925 Ca -0.18 -2.53 0.00 0.00 0.00 0.00 0.00 53.44 50.73 2k2o n ALA 925 Cb 0.53 -0.57 0.00 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.18 0.86 3.16 0.00 0.00 -1.26 -5.14 105.19 102.64 2k2o n GLY 926 Ca 0.10 -0.80 -0.16 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.91 1.09 -0.24 1.61 3.76 -1.26 -4.62 115.29 113.73 2k2o s HIS 927 Ca 0.00 -0.56 -0.09 0.00 -0.15 0.00 0.00 55.06 54.26 2k2o s HIS 927 Cb 0.00 -0.60 -0.04 0.00 1.11 0.00 0.00 32.58 33.04 2k2o s HIS 927 CO 0.00 0.02 0.12 0.99 -0.85 0.00 0.00 174.74 175.03 2k2o s THR 928 N -1.87 4.99 -0.04 1.30 2.01 -1.26 -4.99 115.64 115.79 2k2o s THR 928 Ca 0.01 0.05 -0.02 0.00 0.31 0.00 0.00 61.69 62.05 2k2o s THR 928 Cb -0.06 -3.32 0.03 0.00 0.01 0.00 0.00 72.50 69.15 2k2o s THR 928 CO 0.01 0.35 0.08 -1.83 -0.69 0.00 0.00 174.62 172.54 2k2o s GLU 929 N 1.17 0.04 -0.04 4.92 1.03 -1.26 0.52 118.70 125.08 2k2o s GLU 929 Ca 0.06 0.22 0.04 0.00 0.03 0.00 0.00 54.97 55.32 2k2o s GLU 929 Cb -0.14 -0.14 -0.00 0.00 -0.80 0.00 0.00 34.13 33.05 2k2o s GLU 929 CO 0.05 -0.12 -0.14 0.12 -1.33 0.00 0.00 175.26 173.84 2k2o s PHE 930 N 0.80 1.42 -0.10 4.83 5.36 0.06 -4.95 117.98 125.40 2k2o s PHE 930 Ca -0.06 -0.39 -0.30 0.00 -0.96 0.00 0.00 56.93 55.22 2k2o s PHE 930 Cb -0.09 -0.97 -0.02 0.00 -0.34 0.00 0.00 43.02 41.60 2k2o s PHE 930 CO -0.03 -0.14 1.12 0.99 -1.46 0.00 0.00 175.22 175.70 2k2o s THR 931 N 0.08 4.49 0.24 0.12 2.01 -1.26 -1.08 115.64 120.24 2k2o s THR 931 Ca -0.03 1.79 0.07 0.00 0.31 0.00 0.00 61.69 63.82 2k2o s THR 931 Cb -0.10 -4.15 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 2k2o s THR 931 CO 0.01 -0.03 0.21 -0.62 -0.69 0.00 0.00 174.62 173.51 2k2o s ASP 932 N 1.35 5.63 0.01 3.53 -1.08 -0.37 -4.93 116.67 120.82 2k2o s ASP 932 Ca 0.52 -0.20 -0.16 0.00 -0.52 0.00 0.00 52.55 52.19 2k2o s ASP 932 Cb -0.21 -1.47 0.03 0.00 -1.46 0.00 0.00 42.92 39.81 2k2o s ASP 932 CO 0.19 -0.03 0.35 -1.83 0.52 0.00 0.00 175.17 174.37 2k2o s GLU 933 N -3.77 0.79 0.35 4.34 -1.05 -1.26 -1.22 118.70 116.87 2k2o s GLU 933 Ca 0.33 -0.30 0.06 0.00 -0.15 0.00 0.00 54.97 54.91 2k2o s GLU 933 Cb -0.08 0.35 -0.03 0.00 -0.44 0.00 0.00 34.13 33.93 2k2o s GLU 933 CO 0.25 -0.24 0.23 0.54 0.95 0.00 0.00 175.26 176.99 2k2o s VAL 934 N -1.95 0.17 -0.15 1.83 0.11 -0.58 -4.94 120.40 114.88 2k2o s VAL 934 Ca -0.09 -2.00 -0.04 0.00 -2.93 0.00 0.00 61.98 56.92 2k2o s VAL 934 Cb -0.03 -2.45 0.07 0.00 -1.53 0.00 0.00 36.38 32.45 2k2o s VAL 934 CO 0.01 0.00 0.16 -0.31 -3.33 0.00 0.00 175.10 171.62 2k2o s TYR 935 N -3.40 -0.08 -0.05 1.54 2.02 -0.80 -1.38 117.35 115.19 2k2o s TYR 935 Ca 0.35 0.15 -0.30 0.00 -0.37 0.00 0.00 57.07 56.91 2k2o s TYR 935 Cb 0.02 -0.45 -0.02 0.00 -0.40 0.00 0.00 41.96 41.11 2k2o s TYR 935 CO 0.23 -0.47 1.02 -1.14 -1.57 0.00 0.00 175.55 173.63 2k2o s GLN 936 N 2.25 4.47 0.16 -0.62 0.74 -0.56 -2.16 119.66 123.95 2k2o s GLN 936 Ca 0.04 1.45 0.11 0.00 0.05 0.00 0.00 55.36 57.01 2k2o s GLN 936 Cb -0.15 -3.50 -0.04 0.00 1.10 0.00 0.00 33.01 30.42 2k2o s GLN 936 CO -0.09 -0.22 -0.22 -0.80 -0.55 0.00 0.00 175.29 173.41 2k2o s ASN 937 N 1.09 3.60 0.09 6.67 0.01 -0.53 -1.75 114.94 124.13 2k2o s ASN 937 Ca 0.51 -0.74 -0.02 0.00 -0.71 0.00 0.00 52.86 51.90 2k2o s ASN 937 Cb -0.20 -0.36 -0.04 0.00 0.41 0.00 0.00 41.25 41.06 2k2o s ASN 937 CO 0.23 0.14 0.03 -1.61 -1.51 0.00 0.00 177.10 174.38 2k2o s GLU 938 N -2.44 0.76 0.01 -0.60 2.02 -1.12 -2.77 118.70 114.56 2k2o s GLU 938 Ca 0.19 -1.28 0.01 0.00 0.02 0.00 0.00 54.97 53.92 2k2o s GLU 938 Cb -0.09 0.24 -0.01 0.00 0.10 0.00 0.00 34.13 34.37 2k2o s GLU 938 CO 0.10 -0.19 -0.04 -1.54 0.02 0.00 0.00 175.26 173.61 2k2o s SER 939 N -2.96 0.42 0.11 -0.19 1.04 -0.21 -2.93 113.70 108.98 2k2o s SER 939 Ca 0.13 -0.17 -0.14 0.00 0.48 0.00 0.00 55.95 56.26 2k2o s SER 939 Cb 0.07 -0.02 0.02 0.00 0.10 0.00 0.00 66.02 66.20 2k2o s SER 939 CO -0.05 -0.03 0.34 0.00 0.98 0.00 0.00 173.24 174.47 2k2o s ARG 940 N -0.42 1.00 0.86 4.02 1.70 -0.17 -1.12 118.95 124.82 2k2o s ARG 940 Ca -0.02 -0.79 -0.11 0.00 -0.47 0.00 0.00 55.73 54.35 2k2o s ARG 940 Cb -0.03 0.43 0.11 0.00 -0.57 0.00 0.00 34.95 34.89 2k2o s ARG 940 CO -0.00 -0.37 1.11 0.71 -1.08 0.00 0.00 175.30 175.66 2k2o s TYR 941 N -3.82 2.16 -0.58 5.89 2.02 -1.26 -4.27 117.35 117.50 2k2o s TYR 941 Ca 0.04 1.57 -0.26 0.00 -0.37 0.00 0.00 57.07 58.05 2k2o s TYR 941 Cb 0.03 -3.16 -0.08 0.00 -0.40 0.00 0.00 41.96 38.35 2k2o s TYR 941 CO -0.12 -2.32 2.33 -2.14 -1.57 0.00 0.00 175.55 171.73 2k2o s PRO 942 N -4.80 2.07 0.00 -1.71 0.02 -1.25 -2.68 135.00 126.65 2k2o s PRO 942 Ca 0.64 1.08 0.00 0.00 0.02 0.00 0.00 61.00 62.74 2k2o s PRO 942 Cb -0.19 -4.62 0.00 0.00 0.02 0.00 0.00 34.50 29.71 2k2o s PRO 942 CO 0.57 -3.45 0.00 0.41 -0.33 0.00 0.00 177.00 174.20 2k2o n GLY 943 N 6.15 0.74 0.00 0.52 0.00 -0.98 -4.99 105.19 106.62 2k2o n GLY 943 Ca 0.37 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.74 3.44 3.69 -0.02 0.00 -1.09 -5.13 105.19 105.34 2k2o n GLY 944 Ca 0.00 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.80 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 1.81 5.75 0.37 1.61 2.15 -1.26 -4.86 116.67 122.24 2k2o s ASP 945 Ca 0.00 0.17 -0.22 0.00 0.43 0.00 0.00 52.55 52.92 2k2o s ASP 945 Cb 0.00 -1.92 -0.10 0.00 -0.30 0.00 0.00 42.92 40.60 2k2o s ASP 945 CO 0.00 0.24 0.92 0.26 -0.17 0.00 0.00 175.17 176.42 2k2o s TRP 946 N -0.05 3.49 0.10 -5.34 0.52 -1.26 -4.47 118.94 111.93 2k2o s TRP 946 Ca 0.07 1.64 0.07 0.00 0.02 0.00 0.00 56.10 57.89 2k2o s TRP 946 Cb -0.12 -2.84 -0.03 0.00 -1.15 0.00 0.00 33.47 29.32 2k2o s TRP 946 CO 0.01 0.06 -0.17 0.15 0.02 0.00 0.00 176.95 177.02 2k2o s LYS 947 N -2.64 1.03 0.29 4.98 1.02 -0.28 -4.91 119.74 119.22 2k2o s LYS 947 Ca 0.56 -1.13 -0.28 0.00 0.02 0.00 0.00 55.97 55.13 2k2o s LYS 947 Cb -0.13 -1.12 -0.14 0.00 -0.52 0.00 0.00 37.83 35.91 2k2o s LYS 947 CO 0.18 0.25 0.97 -2.30 -0.92 0.00 0.00 175.35 173.53 2k2o n PRO 948 N 0.97 1.26 -0.51 -1.68 -0.02 -1.26 -1.04 135.00 132.72 2k2o n PRO 948 Ca -0.19 0.44 -0.25 0.00 -2.02 0.00 0.00 63.50 61.48 2k2o n PRO 948 Cb 0.55 -1.79 0.23 0.00 -0.02 0.00 0.00 33.50 32.47 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 0.17 -3.66 0.01 3.55 0.00 -1.11 -4.59 120.51 114.87 2k2o n ALA 949 Ca 0.10 -1.31 -0.22 0.00 0.00 0.00 0.00 53.44 52.01 2k2o n ALA 949 Cb 0.32 -0.10 -0.14 0.00 0.00 0.00 0.00 19.45 19.52 2k2o n ALA 949 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2k2o h GLU 950 N 0.00 0.28 -3.32 0.00 5.08 -1.92 -3.37 114.58 111.32 2k2o h GLU 950 Ca -0.33 -0.48 -0.64 0.00 -1.00 0.00 0.00 59.36 56.91 2k2o h GLU 950 Cb 1.08 0.18 -0.41 0.00 0.50 0.00 0.00 28.75 30.09 2k2o h GLU 950 CO 0.21 1.23 -0.62 -0.51 -1.00 0.00 0.00 179.01 178.32 2k2o s ASP 951 N -7.07 4.39 0.03 1.42 1.01 -1.26 -4.98 116.67 110.21 2k2o s ASP 951 Ca -0.22 -3.17 -0.28 0.00 0.71 0.00 0.00 52.55 49.59 2k2o s ASP 951 Cb 0.06 -1.63 -0.16 0.00 1.01 0.00 0.00 42.92 42.20 2k2o s ASP 951 CO 0.78 -0.20 1.27 0.74 0.21 0.00 0.00 175.17 177.97 2k2o h THR 952 N 5.28 0.26 -3.34 -1.27 2.02 -1.86 -3.43 112.91 110.58 2k2o h THR 952 Ca -0.04 -0.30 -0.58 0.00 0.77 0.00 0.00 66.41 66.26 2k2o h THR 952 Cb 0.86 0.34 -0.09 0.00 -1.74 0.00 0.00 68.15 67.53 2k2o h THR 952 CO 0.69 0.03 -0.17 -0.31 0.37 0.00 0.00 175.52 176.13 2k2o s TYR 953 N -5.03 3.48 0.35 3.16 2.02 -1.25 -1.46 117.35 118.62 2k2o s TYR 953 Ca -0.15 0.81 -0.04 0.00 -0.37 0.00 0.00 57.07 57.32 2k2o s TYR 953 Cb 0.02 -2.52 0.01 0.00 -0.40 0.00 0.00 41.96 39.07 2k2o s TYR 953 CO 0.51 0.15 0.52 0.95 -1.57 0.00 0.00 175.55 176.10 2k2o s THR 954 N 0.72 0.00 0.49 -0.71 -4.23 -0.92 -1.41 115.64 109.58 2k2o s THR 954 Ca 0.24 -1.52 0.08 0.00 -1.18 0.00 0.00 61.69 59.31 2k2o s THR 954 Cb -0.15 -2.67 0.04 0.00 1.34 0.00 0.00 72.50 71.07 2k2o s THR 954 CO 0.09 0.00 0.67 -0.62 -0.54 0.00 0.00 174.62 174.22 2k2o s ASP 955 N -3.21 5.41 0.50 3.99 2.15 -1.14 -1.90 116.67 122.47 2k2o s ASP 955 Ca 0.28 -0.53 0.24 0.00 0.43 0.00 0.00 52.55 52.98 2k2o s ASP 955 Cb -0.01 -0.35 1.31 0.00 -0.30 0.00 0.00 42.92 43.58 2k2o s ASP 955 CO 0.19 -1.01 1.93 0.00 -0.17 0.00 0.00 175.17 176.11 2k2o h ALA 956 N 0.41 2.49 -0.00 3.66 0.00 -1.94 0.31 119.26 124.20 2k2o h ALA 956 Ca -0.37 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2k2o h ALA 956 Cb 1.28 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2k2o h ALA 956 CO 0.44 -0.71 -0.16 0.27 0.00 0.00 0.00 179.25 179.09 2k2o n ASN 957 N -4.38 0.30 -1.85 0.00 0.23 -1.26 -4.93 115.26 103.37 2k2o n ASN 957 Ca 0.15 -0.12 -0.04 0.00 -0.53 0.00 0.00 54.58 54.03 2k2o n ASN 957 Cb 0.72 -0.15 0.02 0.00 -2.08 0.00 0.00 39.78 38.29 2k2o n ASN 957 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2k2o n GLY 958 N 1.40 0.32 3.35 4.83 0.00 0.11 -5.02 105.19 110.20 2k2o n GLY 958 Ca 0.10 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 2k2o n GLY 958 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k2o s ASP 959 N -3.19 5.69 -0.36 1.61 -1.08 -1.26 -4.83 116.67 113.25 2k2o s ASP 959 Ca 0.08 -1.06 -0.40 0.00 -0.52 0.00 0.00 52.55 50.65 2k2o s ASP 959 Cb -0.01 -2.00 -0.16 0.00 -1.46 0.00 0.00 42.92 39.29 2k2o s ASP 959 CO 0.19 -0.39 1.90 1.17 0.52 0.00 0.00 175.17 178.56 2k2o n LYS 960 N 4.97 0.83 -3.98 4.34 3.00 -1.26 -2.87 118.16 123.19 2k2o n LYS 960 Ca -0.12 0.28 -0.23 0.00 -0.00 0.00 0.00 58.31 58.24 2k2o n LYS 960 Cb 0.46 -2.03 -0.05 0.00 0.00 0.00 0.00 35.03 33.40 2k2o n LYS 960 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k2o n ALA 961 N 6.68 0.35 -1.90 3.14 0.00 -0.50 -4.99 120.51 123.30 2k2o n ALA 961 Ca 0.35 -1.69 -0.30 0.00 0.00 0.00 0.00 53.44 51.79 2k2o n ALA 961 Cb 0.11 0.97 0.02 0.00 0.00 0.00 0.00 19.45 20.55 2k2o n ALA 961 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k2o s ALA 962 N -2.70 3.05 0.61 0.00 0.00 -1.26 -4.65 121.76 116.81 2k2o s ALA 962 Ca 0.04 -0.21 -0.11 0.00 0.00 0.00 0.00 51.96 51.68 2k2o s ALA 962 Cb 0.00 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 20.06 2k2o s ALA 962 CO 0.03 -0.82 1.01 -1.12 0.00 0.00 0.00 175.76 174.85 2k2o s SER 963 N -4.24 6.24 0.47 0.00 0.01 -1.26 -4.68 113.70 110.23 2k2o s SER 963 Ca 0.56 1.38 0.29 0.00 1.31 0.00 0.00 55.95 59.49 2k2o s SER 963 Cb -0.11 -2.45 1.37 0.00 0.21 0.00 0.00 66.02 65.04 2k2o s SER 963 CO 0.53 -0.84 1.73 -0.65 0.41 0.00 0.00 173.24 174.42 2k2o h PRO 964 N -0.25 0.16 -0.05 12.44 0.11 -1.97 0.45 132.00 142.88 2k2o h PRO 964 Ca -0.44 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 2k2o h PRO 964 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2k2o h PRO 964 CO 0.62 0.11 -0.17 0.66 -0.21 0.00 0.00 178.00 179.00 2k2o h SER 965 N 0.17 0.24 -0.03 -2.05 4.64 -2.02 -3.15 113.55 111.34 2k2o h SER 965 Ca 0.67 -0.62 -0.06 0.00 -0.47 0.00 0.00 61.79 61.31 2k2o h SER 965 Cb 2.17 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 64.18 2k2o h SER 965 CO -0.21 0.82 -0.13 -0.33 -0.87 0.00 0.00 176.83 176.11 2k2o h GLU 966 N -0.32 0.33 -6.03 4.77 5.08 -1.35 -3.42 114.58 113.64 2k2o h GLU 966 Ca -0.01 -0.08 -0.59 0.00 -1.00 0.00 0.00 59.36 57.68 2k2o h GLU 966 Cb 0.80 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2k2o h GLU 966 CO 0.04 0.46 1.46 -0.51 -1.00 0.00 0.00 179.01 179.46 2k2o s LEU 967 N -8.79 3.48 0.32 1.33 1.43 0.14 -4.90 118.68 111.69 2k2o s LEU 967 Ca -0.06 1.86 0.07 0.00 -1.03 0.00 0.00 54.13 54.97 2k2o s LEU 967 Cb 0.15 -3.51 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 2k2o s LEU 967 CO 0.75 -1.91 0.32 0.42 0.23 0.00 0.00 176.35 176.16 2k2o s THR 968 N 8.06 3.81 -0.12 5.49 -4.23 -1.26 -4.94 115.64 122.45 2k2o s THR 968 Ca 0.98 -1.28 -0.10 0.00 -1.18 0.00 0.00 61.69 60.11 2k2o s THR 968 Cb -0.32 -3.28 -0.05 0.00 1.34 0.00 0.00 72.50 70.19 2k2o s THR 968 CO 0.35 -0.20 0.22 0.00 -0.54 0.00 0.00 174.62 174.45 2k2o s PRO 970 N -0.46 -0.44 0.21 0.00 0.04 -1.25 -4.92 135.00 128.19 2k2o s PRO 970 Ca 0.16 0.02 -0.09 0.00 0.04 0.00 0.00 61.00 61.13 2k2o s PRO 970 Cb -0.13 -1.68 0.32 0.00 0.04 0.00 0.00 34.50 33.05 2k2o s PRO 970 CO 0.05 -3.21 1.70 -1.00 0.04 0.00 0.00 177.00 174.58 2k2o h PRO 971 N -2.22 0.26 0.08 0.56 0.13 -1.99 -2.89 132.00 125.93 2k2o h PRO 971 Ca -0.47 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2k2o h PRO 971 Cb 1.30 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2k2o h PRO 971 CO 0.42 0.17 -0.04 0.78 -0.23 0.00 0.00 178.00 179.10 2k2o h GLY 972 N 0.27 -0.11 -3.08 1.56 0.00 -1.93 -3.39 103.07 96.39 2k2o h GLY 972 Ca 0.33 0.04 -0.50 0.00 0.00 0.00 0.00 47.33 47.20 2k2o h GLY 972 CO -0.41 -0.04 0.48 -0.98 0.00 0.00 0.00 176.54 175.58 2k2o s TRP 973 N -3.69 3.15 0.10 5.60 0.52 -1.09 -4.29 118.94 119.24 2k2o s TRP 973 Ca -0.15 1.59 0.03 0.00 0.02 0.00 0.00 56.10 57.59 2k2o s TRP 973 Cb 0.01 -3.32 -0.04 0.00 -1.15 0.00 0.00 33.47 28.97 2k2o s TRP 973 CO 0.59 -1.08 -0.09 -2.00 0.02 0.00 0.00 176.95 174.39 2k2o s GLU 974 N -2.29 0.86 0.29 4.98 2.56 -0.33 -3.93 118.70 120.84 2k2o s GLU 974 Ca 0.56 -1.21 -0.09 0.00 0.00 0.00 0.00 54.97 54.23 2k2o s GLU 974 Cb -0.28 -0.48 -0.07 0.00 2.00 0.00 0.00 34.13 35.30 2k2o s GLU 974 CO 0.36 0.06 0.62 -1.58 -0.56 0.00 0.00 175.26 174.16 2k2o s TRP 975 N -2.72 3.44 0.00 5.30 0.52 -1.26 -0.68 118.94 123.54 2k2o s TRP 975 Ca 0.07 0.90 0.00 0.00 0.02 0.00 0.00 56.10 57.09 2k2o s TRP 975 Cb -0.01 -2.30 0.00 0.00 -1.15 0.00 0.00 33.47 30.01 2k2o s TRP 975 CO -0.01 0.15 0.00 -1.91 0.02 0.00 0.00 176.95 175.20 2k2o n GLU 976 N -0.60 1.11 -2.20 4.98 2.13 -1.00 -4.65 120.64 120.40 2k2o n GLU 976 Ca 0.01 0.00 -0.34 0.00 0.66 0.00 0.00 57.16 57.49 2k2o n GLU 976 Cb 0.53 -0.72 0.00 0.00 0.27 0.00 0.00 31.44 31.52 2k2o n GLU 976 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2k2o s ASP 977 N -2.48 5.75 0.06 4.31 -1.08 -0.45 -4.97 116.67 117.82 2k2o s ASP 977 Ca 0.00 2.05 -0.21 0.00 -0.52 0.00 0.00 52.55 53.87 2k2o s ASP 977 Cb 0.00 -2.57 -0.12 0.00 -1.46 0.00 0.00 42.92 38.78 2k2o s ASP 977 CO 0.00 -1.19 1.51 0.44 0.52 0.00 0.00 175.17 176.45 2k2o h ASP 978 N 0.97 0.27 -5.24 -0.34 5.19 -1.94 -3.46 116.42 111.88 2k2o h ASP 978 Ca -0.49 -0.29 0.13 0.00 -0.62 0.00 0.00 57.03 55.76 2k2o h ASP 978 Cb 1.24 -0.07 -0.06 0.00 0.18 0.00 0.00 39.33 40.62 2k2o h ASP 978 CO 0.57 0.49 0.42 0.00 -3.12 0.00 0.00 179.24 177.60 2k2o s ALA 979 N -5.05 -1.46 -1.05 3.45 0.00 -1.26 -5.08 121.76 111.30 2k2o s ALA 979 Ca -0.14 -0.12 -0.19 0.00 0.00 0.00 0.00 51.96 51.51 2k2o s ALA 979 Cb 0.06 0.71 0.10 0.00 0.00 0.00 0.00 23.12 23.99 2k2o s ALA 979 CO 0.72 -1.04 1.37 -1.58 0.00 0.00 0.00 175.76 175.23 2k2o s TRP 980 N -3.19 2.92 0.10 0.00 0.52 -1.25 -4.49 118.94 113.55 2k2o s TRP 980 Ca 0.14 -1.34 -0.10 0.00 0.02 0.00 0.00 56.10 54.81 2k2o s TRP 980 Cb -0.03 -4.50 -0.06 0.00 -1.15 0.00 0.00 33.47 27.73 2k2o s TRP 980 CO 0.05 -1.68 0.43 -1.12 0.02 0.00 0.00 176.95 174.65 2k2o s SER 981 N 4.07 6.67 0.20 2.95 0.01 -1.04 -4.55 113.70 122.01 2k2o s SER 981 Ca 0.42 0.84 -0.30 0.00 1.31 0.00 0.00 55.95 58.22 2k2o s SER 981 Cb -0.02 -2.19 -0.08 0.00 0.21 0.00 0.00 66.02 63.94 2k2o s SER 981 CO -0.06 0.15 1.17 -0.72 0.41 0.00 0.00 173.24 174.19 2k2o s TYR 982 N -1.43 3.47 0.21 2.43 1.13 -1.26 -0.69 117.35 121.20 2k2o s TYR 982 Ca 0.35 1.50 -0.26 0.00 -1.41 0.00 0.00 57.07 57.25 2k2o s TYR 982 Cb -0.14 -3.38 -0.08 0.00 -1.10 0.00 0.00 41.96 37.25 2k2o s TYR 982 CO 0.19 -1.00 0.83 0.34 -2.51 0.00 0.00 175.55 173.39 2k2o s ASP 983 N -0.08 7.40 0.00 -0.18 2.15 -0.13 -4.90 116.67 120.94 2k2o s ASP 983 Ca 0.51 1.71 0.00 0.00 0.43 0.00 0.00 52.55 55.20 2k2o s ASP 983 Cb -0.32 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.78 2k2o s ASP 983 CO 0.37 0.15 0.47 2.30 -0.17 0.00 0.00 175.17 178.30 2k2o n ILE 984 N 1.35 0.22 -0.10 4.11 -6.64 -1.26 -4.14 119.36 112.89 2k2o n ILE 984 Ca -0.04 -0.30 0.05 0.00 -1.77 0.00 0.00 62.75 60.69 2k2o n ILE 984 Cb 0.49 1.16 0.25 0.00 -1.44 0.00 0.00 39.64 40.09 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 -0.11 3.78 -2.81 7.28 4.13 -1.26 -4.85 115.26 121.42 2k2o n ASN 985 Ca 0.00 -2.52 -0.15 0.00 1.68 0.00 0.00 54.58 53.60 2k2o n ASN 985 Cb 0.29 -0.58 -0.05 0.00 -1.54 0.00 0.00 39.78 37.90 2k2o n ASN 985 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2k2o n ARG 986 N 0.44 0.46 -2.38 3.52 3.00 -1.26 -5.06 116.66 115.38 2k2o n ARG 986 Ca 0.17 -2.64 -0.37 0.00 -0.01 0.00 0.00 57.85 55.00 2k2o n ARG 986 Cb 0.79 2.32 -0.03 0.00 0.00 0.00 0.00 32.46 35.54 2k2o n ARG 986 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k2o s ALA 987 N -2.91 2.59 0.06 7.54 0.00 -1.26 -4.87 121.76 122.90 2k2o s ALA 987 Ca 0.30 -2.39 -0.05 0.00 0.00 0.00 0.00 51.96 49.82 2k2o s ALA 987 Cb 0.01 -4.62 -0.02 0.00 0.00 0.00 0.00 23.12 18.49 2k2o s ALA 987 CO 0.21 -4.05 0.09 0.14 0.00 0.00 0.00 175.76 172.15 2k2o s VAL 988 N 6.84 0.16 1.19 0.00 -7.23 -1.26 -4.21 120.40 115.89 2k2o s VAL 988 Ca 0.58 -1.31 -0.17 0.00 -1.81 0.00 0.00 61.98 59.27 2k2o s VAL 988 Cb 0.00 -1.18 0.22 0.00 0.56 0.00 0.00 36.38 35.98 2k2o s VAL 988 CO 0.04 -0.72 0.48 -0.67 -0.31 0.00 0.00 175.10 173.91 2k2o n ASP 989 N 0.37 -2.66 0.15 4.85 -0.08 -0.27 -4.74 116.55 114.16 2k2o n ASP 989 Ca -0.17 -0.33 0.03 0.00 -1.51 0.00 0.00 54.79 52.82 2k2o n ASP 989 Cb 0.60 -1.01 0.41 0.00 2.34 0.00 0.00 41.12 43.46 2k2o n ASP 989 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2k2o h GLU 990 N -2.65 0.16 -0.03 -0.67 5.08 -1.88 0.19 114.58 114.78 2k2o h GLU 990 Ca -0.50 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 2k2o h GLU 990 Cb 1.26 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2k2o h GLU 990 CO 0.36 0.34 0.00 1.63 -1.00 0.00 0.00 179.01 180.33 2k2o n LYS 991 N -4.26 1.85 0.00 2.33 5.02 -1.26 -4.89 118.16 116.94 2k2o n LYS 991 Ca -0.01 -1.23 0.00 0.00 -2.02 0.00 0.00 58.31 55.05 2k2o n LYS 991 Cb 0.28 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2k2o n LYS 991 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k2o n GLY 992 N 1.22 3.25 3.66 0.72 0.00 0.67 -4.83 105.19 109.88 2k2o n GLY 992 Ca 0.18 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.68 2k2o n GLY 992 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2k2o n TRP 993 N -1.53 1.97 -3.87 1.61 7.02 -1.26 -4.01 117.44 117.36 2k2o n TRP 993 Ca 0.00 0.42 -0.24 0.00 -1.02 0.00 0.00 57.50 56.67 2k2o n TRP 993 Cb 0.00 -2.47 -0.02 0.00 -2.42 0.00 0.00 31.31 26.40 2k2o n TRP 993 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 2k2o s GLU 994 N 2.22 3.45 -1.10 -0.99 2.02 0.13 -1.12 118.70 123.32 2k2o s GLU 994 Ca 0.90 -0.62 -0.20 0.00 0.02 0.00 0.00 54.97 55.07 2k2o s GLU 994 Cb -0.90 -2.89 0.08 0.00 0.10 0.00 0.00 34.13 30.53 2k2o s GLU 994 CO 0.52 0.43 1.47 -0.47 0.02 0.00 0.00 175.26 177.23 2k2o s TYR 995 N -1.92 2.80 -0.82 1.61 5.04 -0.36 -3.38 117.35 120.32 2k2o s TYR 995 Ca 0.35 -1.27 -0.03 0.00 -2.44 0.00 0.00 57.07 53.67 2k2o s TYR 995 Cb -0.10 -4.60 0.21 0.00 0.35 0.00 0.00 41.96 37.81 2k2o s TYR 995 CO 0.29 -1.77 0.70 0.20 -1.34 0.00 0.00 175.55 173.63 2k2o s GLY 996 N 4.33 2.89 -0.09 8.97 0.00 -1.10 -3.57 107.32 118.75 2k2o s GLY 996 Ca 0.45 -3.64 -0.17 0.00 0.00 0.00 0.00 44.72 41.36 2k2o s GLY 996 CO -0.04 1.18 0.46 -1.50 0.00 0.00 0.00 173.10 173.20 2k2o s ILE 997 N -0.86 5.15 -0.09 0.90 2.07 -1.26 -1.78 121.20 125.33 2k2o s ILE 997 Ca 0.24 0.93 -0.00 0.00 -1.41 0.00 0.00 60.65 60.40 2k2o s ILE 997 Cb -0.11 -3.80 0.02 0.00 0.13 0.00 0.00 42.46 38.70 2k2o s ILE 997 CO -0.09 0.38 -0.05 -0.89 -1.91 0.00 0.00 174.94 172.37 2k2o s THR 998 N 0.29 0.76 -0.42 4.00 2.01 -1.26 -4.07 115.64 116.94 2k2o s THR 998 Ca 0.25 -0.14 -0.01 0.00 0.31 0.00 0.00 61.69 62.10 2k2o s THR 998 Cb -0.15 -0.81 0.11 0.00 0.01 0.00 0.00 72.50 71.66 2k2o s THR 998 CO 0.11 0.31 0.20 -0.63 -0.69 0.00 0.00 174.62 173.92 2k2o s ILE 999 N 1.63 3.04 0.23 1.82 1.01 -1.26 -4.85 121.20 122.81 2k2o s ILE 999 Ca 0.02 -2.32 -0.31 0.00 0.00 0.00 0.00 60.65 58.04 2k2o s ILE 999 Cb -0.13 -3.10 -0.11 0.00 0.01 0.00 0.00 42.46 39.13 2k2o s ILE 999 CO -0.05 -0.70 1.60 -2.16 0.00 0.00 0.00 174.94 173.63 2k2o s PRO 1000N 0.85 4.17 0.32 2.79 0.04 -1.26 -3.26 135.00 138.65 2k2o s PRO 1000Ca 0.11 2.48 -0.26 0.00 0.04 0.00 0.00 61.00 63.36 2k2o s PRO 1000Cb -0.22 -3.09 -0.10 0.00 0.04 0.00 0.00 34.50 31.14 2k2o s PRO 1000CO -0.05 -0.63 0.96 -1.25 0.04 0.00 0.00 177.00 176.07 2k2o s PRO 1001N 0.45 4.58 0.17 0.56 0.05 -1.26 -5.18 135.00 134.38 2k2o s PRO 1001Ca 0.68 1.37 -0.00 0.00 0.05 0.00 0.00 61.00 63.10 2k2o s PRO 1001Cb -0.46 -2.84 0.00 0.00 0.05 0.00 0.00 34.50 31.25 2k2o s PRO 1001CO 0.38 0.27 0.23 -3.47 0.05 0.00 0.00 177.00 174.46 2k2o n ASP 1002N 0.62 -0.63 0.02 6.66 -0.08 -1.20 -5.10 116.55 116.84 2k2o n ASP 1002Ca 0.02 -1.97 -0.01 0.00 -1.51 0.00 0.00 54.79 51.31 2k2o n ASP 1002Cb 0.50 1.20 -0.00 0.00 2.34 0.00 0.00 41.12 45.15 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 -0.29 0.00 -3.45 -0.67 8.25 -1.26 -5.05 115.22 112.75 2k2o n HIS 1003Ca 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.34 2k2o n HIS 1003Cb 0.29 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.30 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 -1.97 1.20 0.04 -0.41 1.02 -1.26 -5.10 119.74 113.26 2k2o s LYS 1004Ca -0.05 -0.31 -0.31 0.00 0.02 0.00 0.00 55.97 55.33 2k2o s LYS 1004Cb 0.01 0.56 -0.10 0.00 -0.52 0.00 0.00 37.83 37.77 2k2o s LYS 1004CO 0.07 -0.50 1.93 -2.30 -0.92 0.00 0.00 175.35 173.63 2k2o n PRO 1005N -0.10 2.75 0.21 -1.68 -0.02 -1.26 -4.84 135.00 130.07 2k2o n PRO 1005Ca -0.17 1.01 0.05 0.00 -2.02 0.00 0.00 63.50 62.37 2k2o n PRO 1005Cb 0.63 -2.94 0.46 0.00 -0.02 0.00 0.00 33.50 31.63 2k2o n PRO 1005CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2k2o h LYS 1006N 9.97 0.00 -3.28 -0.52 1.57 -1.95 -3.45 116.57 118.91 2k2o h LYS 1006Ca -0.49 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.11 2k2o h LYS 1006Cb 1.24 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.29 2k2o h LYS 1006CO 0.94 0.27 -0.49 0.45 -0.57 0.00 0.00 179.45 180.05 2k2o s SER 1007N -6.82 -0.19 -0.02 0.86 0.15 -1.26 -5.14 113.70 101.28 2k2o s SER 1007Ca -0.03 0.35 0.05 0.00 0.70 0.00 0.00 55.95 57.02 2k2o s SER 1007Cb 0.14 0.38 -0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2k2o s SER 1007CO 0.69 -0.09 -0.18 0.26 1.20 0.00 0.00 173.24 175.13 2k2o s TRP 1008N 0.00 1.64 0.15 3.44 0.52 -1.23 -4.24 118.94 119.22 2k2o s TRP 1008Ca -0.01 -0.36 -0.01 0.00 0.02 0.00 0.00 56.10 55.74 2k2o s TRP 1008Cb -0.02 -1.07 -0.04 0.00 -1.15 0.00 0.00 33.47 31.19 2k2o s TRP 1008CO 0.00 -0.07 0.08 0.08 0.02 0.00 0.00 176.95 177.07 2k2o s VAL 1009N -0.29 0.08 -0.41 4.03 1.01 -1.24 -4.86 120.40 118.71 2k2o s VAL 1009Ca 0.04 -1.94 0.06 0.00 0.00 0.00 0.00 61.98 60.14 2k2o s VAL 1009Cb -0.08 -2.19 0.49 0.00 0.00 0.00 0.00 36.38 34.60 2k2o s VAL 1009CO 0.00 -0.32 1.44 0.00 0.00 0.00 0.00 175.10 176.23 2k2o n ALA 1010N -0.15 3.90 -3.00 5.51 0.00 -1.26 -1.22 120.51 124.29 2k2o n ALA 1010Ca -0.03 -1.53 -0.17 0.00 0.00 0.00 0.00 53.44 51.71 2k2o n ALA 1010Cb 0.64 -1.18 -0.15 0.00 0.00 0.00 0.00 19.45 18.77 2k2o n ALA 1010CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k2o s ALA 1011N -2.15 0.47 -0.09 0.00 0.00 -1.26 -2.20 121.76 116.52 2k2o s ALA 1011Ca 0.36 -0.16 -0.17 0.00 0.00 0.00 0.00 51.96 52.00 2k2o s ALA 1011Cb 0.29 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 23.18 2k2o s ALA 1011CO 0.09 0.07 0.44 -2.00 0.00 0.00 0.00 175.76 174.37 2k2o s GLU 1012N 0.16 4.24 0.34 0.00 -6.30 -1.26 -4.27 118.70 111.61 2k2o s GLU 1012Ca -0.02 0.41 -0.09 0.00 -2.50 0.00 0.00 54.97 52.78 2k2o s GLU 1012Cb -0.05 -3.38 0.02 0.00 0.00 0.00 0.00 34.13 30.71 2k2o s GLU 1012CO -0.00 0.29 0.57 0.15 0.02 0.00 0.00 175.26 176.30 2k2o s LYS 1013N 0.19 1.94 0.00 4.30 1.02 -1.26 -5.03 119.74 120.91 2k2o s LYS 1013Ca 0.24 -1.55 0.13 0.00 0.02 0.00 0.00 55.97 54.81 2k2o s LYS 1013Cb -0.15 0.51 0.66 0.00 -0.52 0.00 0.00 37.83 38.33 2k2o s LYS 1013CO 0.10 -0.84 1.44 0.00 -0.92 0.00 0.00 175.35 175.14 2k2o n MET 1014N -0.52 1.20 -0.17 1.68 0.00 -1.26 -2.13 117.12 115.93 2k2o n MET 1014Ca -0.02 -0.31 0.08 0.00 0.00 0.00 0.00 57.70 57.45 2k2o n MET 1014Cb 0.61 -1.23 0.24 0.00 0.00 0.00 0.00 33.22 32.85 2k2o n MET 1014CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2k2o n TYR 1015N -0.39 0.44 -2.36 3.17 4.01 -1.26 -2.32 117.16 118.44 2k2o n TYR 1015Ca 0.10 -0.22 -0.25 0.00 -0.16 0.00 0.00 57.90 57.38 2k2o n TYR 1015Cb 0.11 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.22 2k2o n TYR 1015CO 0.00 0.00 0.00 -1.01 -0.46 0.00 0.00 176.86 175.39 2k2o s HIS 1016N -1.56 2.51 0.00 -0.72 3.76 -0.90 -4.68 115.29 113.69 2k2o s HIS 1016Ca 0.29 0.17 0.00 0.00 -0.15 0.00 0.00 55.06 55.38 2k2o s HIS 1016Cb 0.16 -3.13 0.00 0.00 1.11 0.00 0.00 32.58 30.71 2k2o s HIS 1016CO 0.22 -1.46 0.00 0.25 -0.85 0.00 0.00 174.74 172.90 2k2o n THR 1017N -2.84 0.00 -4.16 1.30 -2.24 -1.26 -3.96 114.28 101.11 2k2o n THR 1017Ca 0.10 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.72 2k2o n THR 1017Cb 0.60 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.00 1.10 -0.03 4.78 3.76 -0.74 -1.00 115.29 122.16 2k2o s HIS 1018Ca 0.00 -0.52 -0.14 0.00 -0.15 0.00 0.00 55.06 54.25 2k2o s HIS 1018Cb 0.00 -0.61 0.02 0.00 1.11 0.00 0.00 32.58 33.10 2k2o s HIS 1018CO 0.00 0.03 0.30 -0.98 -0.85 0.00 0.00 174.74 173.23 2k2o s ARG 1019N -2.04 0.61 0.01 1.40 1.70 -1.15 -2.71 118.95 116.77 2k2o s ARG 1019Ca -0.01 -0.11 -0.17 0.00 -0.47 0.00 0.00 55.73 54.97 2k2o s ARG 1019Cb -0.08 0.27 0.03 0.00 -0.57 0.00 0.00 34.95 34.60 2k2o s ARG 1019CO 0.01 -0.16 0.36 -0.98 -1.08 0.00 0.00 175.30 173.46 2k2o s ARG 1020N -1.10 0.79 0.02 3.89 1.70 -1.22 -2.77 118.95 120.26 2k2o s ARG 1020Ca -0.12 -0.26 0.05 0.00 -0.47 0.00 0.00 55.73 54.93 2k2o s ARG 1020Cb -0.05 0.35 -0.02 0.00 -0.57 0.00 0.00 34.95 34.66 2k2o s ARG 1020CO 0.03 -0.24 -0.16 -0.98 -1.08 0.00 0.00 175.30 172.87 2k2o s ARG 1021N -1.86 1.17 -0.13 3.89 1.70 -0.71 -0.69 118.95 122.32 2k2o s ARG 1021Ca -0.10 -0.69 -0.29 0.00 -0.47 0.00 0.00 55.73 54.18 2k2o s ARG 1021Cb -0.03 -1.18 -0.01 0.00 -0.57 0.00 0.00 34.95 33.16 2k2o s ARG 1021CO 0.02 0.31 1.09 0.50 -1.08 0.00 0.00 175.30 176.13 2k2o s ARG 1022N -0.78 4.34 -0.18 3.89 3.52 -1.25 -1.49 118.95 127.01 2k2o s ARG 1022Ca 0.05 1.48 -0.07 0.00 -0.13 0.00 0.00 55.73 57.05 2k2o s ARG 1022Cb -0.07 -3.60 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 2k2o s ARG 1022CO 0.00 -0.47 0.06 -0.51 -0.81 0.00 0.00 175.30 173.57 2k2o s LEU 1023N 2.54 3.80 -0.14 -0.88 1.43 -0.48 -0.95 118.68 124.00 2k2o s LEU 1023Ca 0.50 0.07 -0.05 0.00 -1.03 0.00 0.00 54.13 53.62 2k2o s LEU 1023Cb -0.19 -1.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 2k2o s LEU 1023CO 0.15 0.17 0.02 0.68 0.23 0.00 0.00 176.35 177.61 2k2o s VAL 1024N 0.38 4.45 -0.26 -1.59 -7.23 0.13 -1.53 120.40 114.75 2k2o s VAL 1024Ca 0.03 -0.17 -0.03 0.00 -1.81 0.00 0.00 61.98 60.00 2k2o s VAL 1024Cb -0.12 -2.95 0.08 0.00 0.56 0.00 0.00 36.38 33.95 2k2o s VAL 1024CO 0.00 0.52 0.09 -0.60 -0.31 0.00 0.00 175.10 174.80 2k2o s ARG 1025N -0.11 0.51 0.27 4.82 6.06 -0.36 -2.49 118.95 127.66 2k2o s ARG 1025Ca 0.05 -0.65 -0.29 0.00 -2.50 0.00 0.00 55.73 52.34 2k2o s ARG 1025Cb -0.12 -1.80 -0.10 0.00 0.06 0.00 0.00 34.95 32.99 2k2o s ARG 1025CO 0.02 -0.86 1.23 0.21 -2.50 0.00 0.00 175.30 173.40 2k2o s LYS 1026N 1.86 4.47 0.02 5.12 2.36 -1.26 -1.23 119.74 131.07 2k2o s LYS 1026Ca 0.05 2.02 0.04 0.00 -2.55 0.00 0.00 55.97 55.53 2k2o s LYS 1026Cb -0.17 -3.15 -0.02 0.00 -1.05 0.00 0.00 37.83 33.45 2k2o s LYS 1026CO -0.22 -0.06 -0.12 -0.98 1.55 0.00 0.00 175.35 175.52 2k2o s ARG 1027N -1.18 0.88 -0.03 4.03 1.70 -0.24 -1.34 118.95 122.77 2k2o s ARG 1027Ca 0.49 -0.59 0.02 0.00 -0.47 0.00 0.00 55.73 55.19 2k2o s ARG 1027Cb -0.36 -0.86 0.01 0.00 -0.57 0.00 0.00 34.95 33.17 2k2o s ARG 1027CO 0.45 0.22 -0.08 0.21 -1.08 0.00 0.00 175.30 175.02 2k2o s LYS 1028N -0.76 0.94 0.28 3.89 2.20 0.14 -0.76 119.74 125.67 2k2o s LYS 1028Ca 0.02 -0.26 0.20 0.00 -0.36 0.00 0.00 55.97 55.57 2k2o s LYS 1028Cb -0.06 -0.88 0.11 0.00 -1.51 0.00 0.00 37.83 35.48 2k2o s LYS 1028CO 0.00 0.06 1.30 -0.22 -0.36 0.00 0.00 175.35 176.14 2k2o h LYS 1029N 6.58 0.00 0.00 4.03 3.64 -0.15 -0.87 116.57 129.79 2k2o h LYS 1029Ca -0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 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 0.17 0.00 -3.47 -2.27 0.00 0.00 179.45 174.37 2k2o n ASP 1030N -2.99 0.00 0.00 4.20 2.03 -1.24 -3.63 116.55 114.92 2k2o n ASP 1030Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2k2o n ASP 1030Cb 0.64 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.04 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 0.00 -0.04 -2.67 7.94 -1.26 -4.42 117.00 116.55 2k2o n LEU 1031Ca 0.00 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 54.94 2k2o n LEU 1031Cb 0.00 -0.31 -0.04 0.00 0.53 0.00 0.00 43.42 43.61 2k2o n LEU 1031CO 0.00 0.00 0.03 0.41 -1.11 0.00 0.00 177.39 176.72 2k2o n THR 1032N -2.62 0.00 0.04 1.96 -1.04 -1.24 -4.48 114.28 106.90 2k2o n THR 1032Ca 0.00 -0.34 -0.18 0.00 -2.04 0.00 0.00 64.05 61.49 2k2o n THR 1032Cb 0.00 1.02 -0.14 0.00 -1.82 0.00 0.00 70.33 69.39 2k2o n THR 1032CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2k2o h GLN 1033N 0.18 0.25 -5.52 -2.82 4.15 -1.82 -3.43 115.11 106.10 2k2o h GLN 1033Ca 0.00 -0.43 -0.60 0.00 0.77 0.00 0.00 58.65 58.39 2k2o h GLN 1033Cb 0.20 0.16 -0.10 0.00 0.21 0.00 0.00 27.48 27.96 2k2o h GLN 1033CO 0.00 1.11 -0.34 -0.08 -1.93 0.00 0.00 178.83 177.59 2k2o s THR 1034N -2.59 5.31 -0.57 2.39 -1.32 -1.26 -4.69 115.64 112.91 2k2o s THR 1034Ca -0.14 0.53 -0.23 0.00 -1.21 0.00 0.00 61.69 60.64 2k2o s THR 1034Cb 0.07 -3.62 0.05 0.00 -1.51 0.00 0.00 72.50 67.49 2k2o s THR 1034CO 0.83 0.42 0.89 0.00 -2.21 0.00 0.00 174.62 174.54 2k2o s ALA 1035N 0.28 3.19 -0.48 11.08 0.00 -1.26 -4.86 121.76 129.71 2k2o s ALA 1035Ca 0.16 -1.49 0.25 0.00 0.00 0.00 0.00 51.96 50.88 2k2o s ALA 1035Cb -0.13 -3.70 0.58 0.00 0.00 0.00 0.00 23.12 19.87 2k2o s ALA 1035CO 0.04 -2.42 1.69 0.66 0.00 0.00 0.00 175.76 175.73 2k2o h SER 1036N 9.32 0.00 -3.16 0.00 4.64 -1.96 -3.39 113.55 119.00 2k2o h SER 1036Ca -0.27 0.00 -0.75 0.00 -0.47 0.00 0.00 61.79 60.30 2k2o h SER 1036Cb 1.08 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.93 2k2o h SER 1036CO 1.09 0.00 -0.05 -0.44 -0.87 0.00 0.00 176.83 176.56 2k2o s SER 1037N -5.61 6.31 -0.21 4.97 0.01 -1.26 -5.04 113.70 112.87 2k2o s SER 1037Ca 0.08 -1.88 -0.10 0.00 1.31 0.00 0.00 55.95 55.35 2k2o s SER 1037Cb 0.08 -2.24 -0.05 0.00 0.21 0.00 0.00 66.02 64.02 2k2o s SER 1037CO 0.63 -0.87 0.13 0.42 0.41 0.00 0.00 173.24 173.95 2k2o s THR 1038N 1.62 5.24 0.00 1.44 -4.23 -1.26 -4.93 115.64 113.51 2k2o s THR 1038Ca 0.09 0.13 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 2k2o s THR 1038Cb -0.24 -3.41 0.00 0.00 1.34 0.00 0.00 72.50 70.19 2k2o s THR 1038CO 0.01 0.41 0.00 0.00 -0.54 0.00 0.00 174.62 174.50 2k2o n ALA 1039N 3.84 1.43 1.04 3.99 0.00 -1.26 -5.26 120.51 124.29 2k2o n ALA 1039Ca -0.16 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.40 2k2o n ALA 1039Cb 0.52 0.11 0.13 0.00 0.00 0.00 0.00 19.45 20.21 2k2o n ALA 1039CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04