#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k2o n ASP 919 N 0.00 -5.93 0.29 4.38 9.92 -1.26 -4.28 116.55 119.67 2k2o n ASP 919 Ca 0.00 0.73 0.17 0.00 -0.53 0.00 0.00 54.79 55.16 2k2o n ASP 919 Cb 0.00 -2.29 0.85 0.00 -0.64 0.00 0.00 41.12 39.04 2k2o n ASP 919 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 2k2o h PRO 920 N 1.52 0.00 -0.18 -0.24 0.11 -2.06 -2.13 132.00 129.02 2k2o h PRO 920 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.05 2k2o h PRO 920 Cb 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 2k2o h PRO 920 CO 0.00 0.05 -0.16 0.74 -0.21 0.00 0.00 178.00 178.43 2k2o h PHE 921 N 0.00 0.31 -2.04 0.65 0.04 -2.04 -3.25 116.94 110.61 2k2o h PHE 921 Ca -0.00 -0.04 -0.74 0.00 2.80 0.00 0.00 57.97 59.99 2k2o h PHE 921 Cb 0.30 -0.08 -0.17 0.00 2.20 0.00 0.00 35.95 38.19 2k2o h PHE 921 CO 0.00 0.44 1.46 2.41 -0.60 0.00 0.00 178.31 182.02 2k2o n THR 922 N -4.23 4.25 0.21 -1.55 -1.04 -0.80 -4.67 114.28 106.45 2k2o n THR 922 Ca -0.00 -4.67 0.12 0.00 -2.04 0.00 0.00 64.05 57.45 2k2o n THR 922 Cb 0.30 -2.45 0.10 0.00 -1.82 0.00 0.00 70.33 66.46 2k2o n THR 922 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k2o h ALA 923 N 6.99 0.74 -3.11 2.41 0.00 -1.79 -3.44 119.26 121.05 2k2o h ALA 923 Ca 0.33 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 54.58 2k2o h ALA 923 Cb 0.84 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.32 2k2o h ALA 923 CO 1.29 0.00 -0.78 0.34 0.00 0.00 0.00 179.25 180.10 2k2o s ASP 924 N -5.59 3.87 -0.04 0.00 2.15 -1.26 -4.91 116.67 110.88 2k2o s ASP 924 Ca 0.04 -0.64 0.10 0.00 0.43 0.00 0.00 52.55 52.48 2k2o s ASP 924 Cb 0.08 -1.62 0.29 0.00 -0.30 0.00 0.00 42.92 41.37 2k2o s ASP 924 CO 0.73 -0.04 1.23 0.00 -0.17 0.00 0.00 175.17 176.91 2k2o n ALA 925 N 4.69 2.31 0.00 3.66 0.00 -1.26 -4.90 120.51 125.01 2k2o n ALA 925 Ca -0.19 -1.45 0.00 0.00 0.00 0.00 0.00 53.44 51.81 2k2o n ALA 925 Cb 0.49 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 -0.03 0.78 0.00 0.00 0.00 -1.26 -5.15 105.19 99.52 2k2o n GLY 926 Ca 0.11 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2k2o n GLY 926 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k2o n HIS 927 N 0.00 0.00 -3.34 1.61 8.25 -1.26 -4.28 115.22 116.20 2k2o n HIS 927 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.48 2k2o n HIS 927 Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 2k2o n HIS 927 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2k2o s THR 928 N 2.48 -0.69 -0.05 1.59 2.01 -1.26 -4.52 115.64 115.19 2k2o s THR 928 Ca 0.00 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 61.97 2k2o s THR 928 Cb 0.00 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.53 2k2o s THR 928 CO 0.00 0.00 0.11 -1.83 -0.69 0.00 0.00 174.62 172.21 2k2o s GLU 929 N 2.75 0.10 -0.01 4.92 1.03 -1.26 0.13 118.70 126.36 2k2o s GLU 929 Ca 0.03 0.22 0.01 0.00 0.03 0.00 0.00 54.97 55.26 2k2o s GLU 929 Cb -0.10 -0.04 0.00 0.00 -0.80 0.00 0.00 34.13 33.19 2k2o s GLU 929 CO -0.17 -0.08 -0.02 0.12 -1.33 0.00 0.00 175.26 173.78 2k2o s PHE 930 N 0.49 0.29 0.12 4.83 5.36 -0.09 -4.95 117.98 124.03 2k2o s PHE 930 Ca -0.04 -0.04 -0.30 0.00 -0.96 0.00 0.00 56.93 55.59 2k2o s PHE 930 Cb -0.05 -0.23 -0.06 0.00 -0.34 0.00 0.00 43.02 42.33 2k2o s PHE 930 CO -0.02 -0.03 1.09 0.99 -1.46 0.00 0.00 175.22 175.79 2k2o s THR 931 N 0.17 4.10 0.32 0.12 2.01 -1.26 -1.88 115.64 119.21 2k2o s THR 931 Ca -0.01 1.69 0.08 0.00 0.31 0.00 0.00 61.69 63.76 2k2o s THR 931 Cb -0.04 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 2k2o s THR 931 CO -0.00 0.23 0.13 -0.62 -0.69 0.00 0.00 174.62 173.67 2k2o s ASP 932 N 0.30 4.76 -0.01 3.53 -1.08 -0.26 -4.94 116.67 118.97 2k2o s ASP 932 Ca 0.52 -0.69 -0.17 0.00 -0.52 0.00 0.00 52.55 51.68 2k2o s ASP 932 Cb -0.28 -0.81 0.03 0.00 -1.46 0.00 0.00 42.92 40.40 2k2o s ASP 932 CO 0.32 -0.23 0.37 -1.83 0.52 0.00 0.00 175.17 174.32 2k2o s GLU 933 N -3.82 0.75 0.29 4.34 -1.05 -1.26 -1.41 118.70 116.53 2k2o s GLU 933 Ca 0.36 -0.17 0.04 0.00 -0.15 0.00 0.00 54.97 55.05 2k2o s GLU 933 Cb -0.04 0.34 -0.03 0.00 -0.44 0.00 0.00 34.13 33.95 2k2o s GLU 933 CO 0.23 -0.22 0.20 0.54 0.95 0.00 0.00 175.26 176.96 2k2o s VAL 934 N -1.50 0.09 0.01 1.83 0.11 -0.37 -4.97 120.40 115.61 2k2o s VAL 934 Ca -0.12 -2.00 0.00 0.00 -2.93 0.00 0.00 61.98 56.93 2k2o s VAL 934 Cb -0.04 -2.50 -0.01 0.00 -1.53 0.00 0.00 36.38 32.30 2k2o s VAL 934 CO 0.04 0.00 -0.03 -0.31 -3.33 0.00 0.00 175.10 171.47 2k2o s TYR 935 N -3.69 0.23 -0.17 1.54 1.51 -0.63 -0.97 117.35 115.17 2k2o s TYR 935 Ca 0.39 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.11 2k2o s TYR 935 Cb 0.04 -0.16 0.02 0.00 -0.11 0.00 0.00 41.96 41.76 2k2o s TYR 935 CO 0.20 -0.11 -0.18 -1.14 -1.11 0.00 0.00 175.55 173.21 2k2o s GLN 936 N -0.96 2.75 -0.07 -0.62 0.74 -0.49 -1.70 119.66 119.30 2k2o s GLN 936 Ca -0.10 -0.74 0.00 0.00 0.05 0.00 0.00 55.36 54.58 2k2o s GLN 936 Cb -0.07 -2.40 -0.03 0.00 1.10 0.00 0.00 33.01 31.62 2k2o s GLN 936 CO -0.01 -0.21 -0.04 -0.80 -0.55 0.00 0.00 175.29 173.69 2k2o s ASN 937 N 1.33 4.87 0.11 6.67 0.01 0.20 -2.27 114.94 125.86 2k2o s ASN 937 Ca 0.04 0.03 0.03 0.00 -0.71 0.00 0.00 52.86 52.25 2k2o s ASN 937 Cb -0.13 -1.27 -0.04 0.00 0.41 0.00 0.00 41.25 40.21 2k2o s ASN 937 CO -0.12 0.36 -0.09 -1.61 -1.51 0.00 0.00 177.10 174.14 2k2o s GLU 938 N -0.90 0.90 0.02 -0.60 2.02 -0.57 -2.84 118.70 116.72 2k2o s GLU 938 Ca 0.13 -1.32 -0.04 0.00 0.02 0.00 0.00 54.97 53.77 2k2o s GLU 938 Cb -0.11 -0.42 -0.01 0.00 0.10 0.00 0.00 34.13 33.69 2k2o s GLU 938 CO 0.02 0.04 0.06 -1.12 0.02 0.00 0.00 175.26 174.28 2k2o s SER 939 N -2.91 0.17 0.09 -0.19 0.01 -0.17 -1.56 113.70 109.14 2k2o s SER 939 Ca 0.11 -0.44 -0.11 0.00 1.31 0.00 0.00 55.95 56.82 2k2o s SER 939 Cb 0.02 0.17 0.01 0.00 0.21 0.00 0.00 66.02 66.43 2k2o s SER 939 CO -0.02 -0.40 0.25 0.00 0.41 0.00 0.00 173.24 173.49 2k2o s ARG 940 N -1.87 0.90 0.71 12.44 1.70 -0.51 -1.24 118.95 131.07 2k2o s ARG 940 Ca -0.11 -0.85 -0.11 0.00 -0.47 0.00 0.00 55.73 54.18 2k2o s ARG 940 Cb -0.06 0.38 0.02 0.00 -0.57 0.00 0.00 34.95 34.71 2k2o s ARG 940 CO -0.02 -0.31 1.10 0.71 -1.08 0.00 0.00 175.30 175.71 2k2o s TYR 941 N -3.72 3.30 -0.79 5.89 2.02 -1.26 -3.75 117.35 119.03 2k2o s TYR 941 Ca 0.03 1.06 -0.26 0.00 -0.37 0.00 0.00 57.07 57.54 2k2o s TYR 941 Cb 0.04 -3.07 -0.09 0.00 -0.40 0.00 0.00 41.96 38.43 2k2o s TYR 941 CO -0.11 -1.21 2.22 -2.14 -1.57 0.00 0.00 175.55 172.74 2k2o s PRO 942 N -5.35 2.03 0.00 -1.71 0.02 -1.14 -0.27 135.00 128.58 2k2o s PRO 942 Ca 0.58 0.30 0.00 0.00 0.02 0.00 0.00 61.00 61.91 2k2o s PRO 942 Cb -0.11 -4.84 0.00 0.00 0.02 0.00 0.00 34.50 29.57 2k2o s PRO 942 CO 0.52 -3.89 0.00 0.41 -0.33 0.00 0.00 177.00 173.71 2k2o n GLY 943 N 6.70 0.63 2.04 0.52 0.00 -1.21 -4.95 105.19 108.92 2k2o n GLY 943 Ca 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.34 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 2.07 3.58 -0.02 0.00 0.63 -5.14 105.19 106.32 2k2o n GLY 944 Ca 0.00 -2.19 -0.26 0.00 0.00 0.00 0.00 46.02 43.57 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 -2.86 3.85 0.27 1.61 2.15 -1.26 -4.73 116.67 115.70 2k2o s ASP 945 Ca 0.30 -1.23 -0.29 0.00 0.43 0.00 0.00 52.55 51.76 2k2o s ASP 945 Cb -0.02 -0.39 -0.09 0.00 -0.30 0.00 0.00 42.92 42.11 2k2o s ASP 945 CO 0.19 -0.30 1.19 0.26 -0.17 0.00 0.00 175.17 176.34 2k2o s TRP 946 N -2.63 3.39 0.37 -5.34 0.52 -1.26 -4.39 118.94 109.59 2k2o s TRP 946 Ca 0.34 1.54 0.03 0.00 0.02 0.00 0.00 56.10 58.03 2k2o s TRP 946 Cb 0.05 -3.44 -0.04 0.00 -1.15 0.00 0.00 33.47 28.89 2k2o s TRP 946 CO 0.17 -1.11 0.09 0.15 0.02 0.00 0.00 176.95 176.28 2k2o s LYS 947 N -1.23 1.80 0.23 4.98 1.02 -0.38 -4.87 119.74 121.29 2k2o s LYS 947 Ca 0.48 -2.06 -0.32 0.00 0.02 0.00 0.00 55.97 54.10 2k2o s LYS 947 Cb -0.34 -0.72 -0.13 0.00 -0.52 0.00 0.00 37.83 36.11 2k2o s LYS 947 CO 0.43 -0.35 1.53 -2.30 -0.92 0.00 0.00 175.35 173.74 2k2o n PRO 948 N -0.81 2.32 -0.07 -1.68 -0.02 -1.26 -1.00 135.00 132.48 2k2o n PRO 948 Ca -0.05 0.83 -0.03 0.00 -2.02 0.00 0.00 63.50 62.24 2k2o n PRO 948 Cb 0.66 -2.56 0.02 0.00 -0.02 0.00 0.00 33.50 31.60 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 2.52 -0.36 -0.02 3.55 0.00 -1.13 -4.47 120.51 120.60 2k2o n ALA 949 Ca 0.12 -0.14 -0.17 0.00 0.00 0.00 0.00 53.44 53.25 2k2o n ALA 949 Cb 0.33 -0.01 -0.14 0.00 0.00 0.00 0.00 19.45 19.63 2k2o n ALA 949 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2k2o n GLU 950 N -1.97 0.71 -4.04 0.00 0.00 -1.26 -4.53 120.64 109.56 2k2o n GLU 950 Ca 0.01 0.25 -0.31 0.00 0.00 0.00 0.00 57.16 57.11 2k2o n GLU 950 Cb 0.05 -1.71 -0.15 0.00 0.00 0.00 0.00 31.44 29.63 2k2o n GLU 950 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2k2o s ASP 951 N -6.67 4.55 0.00 -1.84 1.01 -1.26 -5.04 116.67 107.42 2k2o s ASP 951 Ca -0.18 -1.71 -0.14 0.00 0.71 0.00 0.00 52.55 51.22 2k2o s ASP 951 Cb 0.07 -1.56 -0.08 0.00 1.01 0.00 0.00 42.92 42.36 2k2o s ASP 951 CO 0.77 -0.28 0.89 0.74 0.21 0.00 0.00 175.17 177.50 2k2o h THR 952 N 6.69 0.00 -3.16 -1.27 2.02 -1.83 -3.41 112.91 111.95 2k2o h THR 952 Ca -0.13 -0.19 -0.59 0.00 0.77 0.00 0.00 66.41 66.27 2k2o h THR 952 Cb 1.03 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.38 2k2o h THR 952 CO 0.48 0.00 -0.19 -0.31 0.37 0.00 0.00 175.52 175.87 2k2o s TYR 953 N -3.58 3.63 0.26 3.16 2.02 -1.25 -0.63 117.35 120.96 2k2o s TYR 953 Ca -0.08 0.92 -0.00 0.00 -0.37 0.00 0.00 57.07 57.54 2k2o s TYR 953 Cb 0.01 -2.39 0.00 0.00 -0.40 0.00 0.00 41.96 39.18 2k2o s TYR 953 CO 0.23 0.44 0.34 0.25 -1.57 0.00 0.00 175.55 175.24 2k2o n THR 954 N 2.63 0.00 -3.30 -0.71 -2.24 -0.69 -0.02 114.28 109.95 2k2o n THR 954 Ca -0.11 -1.42 -0.18 0.00 -2.27 0.00 0.00 64.05 60.06 2k2o n THR 954 Cb 0.52 0.84 0.04 0.00 -2.10 0.00 0.00 70.33 69.63 2k2o n THR 954 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2k2o n ASP 955 N -1.79 1.99 0.07 3.42 5.75 -0.44 -1.60 116.55 123.94 2k2o n ASP 955 Ca 0.01 -2.38 0.21 0.00 -0.01 0.00 0.00 54.79 52.63 2k2o n ASP 955 Cb 0.45 -0.25 0.74 0.00 -1.03 0.00 0.00 41.12 41.02 2k2o n ASP 955 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k2o h ALA 956 N 0.35 2.18 0.00 2.12 0.00 -1.94 -2.91 119.26 119.05 2k2o h ALA 956 Ca -0.25 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.49 2k2o h ALA 956 Cb 1.04 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 2k2o h ALA 956 CO 0.37 -0.70 -0.89 -0.91 0.00 0.00 0.00 179.25 177.12 2k2o h ASN 957 N 0.00 0.00 0.00 0.00 2.35 -1.94 -3.49 115.58 112.50 2k2o h ASN 957 Ca 0.21 -0.54 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 2k2o h ASN 957 Cb 1.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.52 2k2o h ASN 957 CO -0.00 1.28 0.00 0.61 -1.65 0.00 0.00 177.43 177.67 2k2o n GLY 958 N 1.50 0.10 3.59 2.83 0.00 -1.10 -4.89 105.19 107.22 2k2o n GLY 958 Ca -0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 5.48 -0.31 1.61 2.15 -1.26 -4.69 116.67 119.65 2k2o s ASP 959 Ca 0.00 1.57 -0.41 0.00 0.43 0.00 0.00 52.55 54.14 2k2o s ASP 959 Cb 0.00 -2.51 -0.16 0.00 -0.30 0.00 0.00 42.92 39.94 2k2o s ASP 959 CO 0.00 -1.99 1.74 1.17 -0.17 0.00 0.00 175.17 175.92 2k2o n LYS 960 N 8.70 1.04 -2.48 4.34 4.81 -1.26 -1.33 118.16 131.97 2k2o n LYS 960 Ca 0.28 0.38 -0.24 0.00 -0.87 0.00 0.00 58.31 57.86 2k2o n LYS 960 Cb 0.47 -2.05 0.10 0.00 0.02 0.00 0.00 35.03 33.57 2k2o n LYS 960 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2k2o s ALA 961 N 3.55 3.53 -0.05 3.14 0.00 0.96 -4.85 121.76 128.05 2k2o s ALA 961 Ca 0.99 -1.51 -0.23 0.00 0.00 0.00 0.00 51.96 51.21 2k2o s ALA 961 Cb -1.11 -2.17 -0.18 0.00 0.00 0.00 0.00 23.12 19.66 2k2o s ALA 961 CO 0.68 -1.40 0.98 0.00 0.00 0.00 0.00 175.76 176.01 2k2o h ALA 962 N -0.54 -0.15 0.00 0.00 0.00 -1.90 -3.42 119.26 113.26 2k2o h ALA 962 Ca -0.39 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2k2o h ALA 962 Cb 1.28 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2k2o h ALA 962 CO 0.45 -0.27 0.00 -1.13 0.00 0.00 0.00 179.25 178.30 2k2o n SER 963 N -4.88 0.00 0.26 0.00 3.41 -1.26 -4.76 113.62 106.38 2k2o n SER 963 Ca -0.08 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.67 2k2o n SER 963 Cb 0.28 0.00 0.84 0.00 -0.26 0.00 0.00 64.21 65.07 2k2o n SER 963 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2k2o h PRO 964 N 0.00 0.00 0.10 4.33 0.13 -1.97 0.10 132.00 134.69 2k2o h PRO 964 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2k2o h PRO 964 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2k2o h PRO 964 CO 0.00 0.00 -0.05 0.77 -0.23 0.00 0.00 178.00 178.49 2k2o h SER 965 N 0.00 -0.11 0.00 1.44 0.02 -2.03 -3.25 113.55 109.62 2k2o h SER 965 Ca 0.03 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2k2o h SER 965 Cb 0.17 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2k2o h SER 965 CO -0.00 0.51 0.00 -0.62 -1.14 0.00 0.00 176.83 175.58 2k2o n GLU 966 N -4.85 0.77 -3.34 3.45 1.02 -1.01 -4.46 120.64 112.22 2k2o n GLU 966 Ca -0.08 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.64 2k2o n GLU 966 Cb 0.29 -1.24 -0.09 0.00 -0.02 0.00 0.00 31.44 30.38 2k2o n GLU 966 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k2o s LEU 967 N -1.47 4.71 0.48 -4.62 2.01 0.33 -4.75 118.68 115.36 2k2o s LEU 967 Ca 0.18 -0.51 0.06 0.00 0.01 0.00 0.00 54.13 53.87 2k2o s LEU 967 Cb 0.08 -2.38 -0.00 0.00 0.01 0.00 0.00 46.19 43.90 2k2o s LEU 967 CO 0.14 -0.50 0.32 0.42 1.01 0.00 0.00 176.35 177.74 2k2o s THR 968 N 2.10 2.03 -0.17 5.49 -4.23 -1.26 -4.91 115.64 114.70 2k2o s THR 968 Ca 0.12 -1.54 -0.04 0.00 -1.18 0.00 0.00 61.69 59.05 2k2o s THR 968 Cb -0.17 -2.57 -0.03 0.00 1.34 0.00 0.00 72.50 71.08 2k2o s THR 968 CO 0.13 0.00 -0.03 0.00 -0.54 0.00 0.00 174.62 174.18 2k2o s PRO 970 N 0.49 1.63 0.52 0.00 0.04 -1.26 -4.89 135.00 131.54 2k2o s PRO 970 Ca -0.03 0.61 0.32 0.00 0.04 0.00 0.00 61.00 61.95 2k2o s PRO 970 Cb -0.14 -1.87 1.47 0.00 0.04 0.00 0.00 34.50 34.00 2k2o s PRO 970 CO 0.03 -1.93 1.84 -1.00 0.04 0.00 0.00 177.00 175.98 2k2o h PRO 971 N -1.31 0.05 -0.45 0.56 0.13 -2.00 0.31 132.00 129.29 2k2o h PRO 971 Ca -0.49 -0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 2k2o h PRO 971 Cb 1.29 -0.01 -0.06 0.00 0.13 0.00 0.00 31.00 32.34 2k2o h PRO 971 CO 0.59 0.03 0.07 0.41 -0.23 0.00 0.00 178.00 178.87 2k2o n GLY 972 N -1.71 4.02 2.89 1.56 0.00 -1.26 -4.30 105.19 106.40 2k2o n GLY 972 Ca 0.22 -1.06 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 2k2o n GLY 972 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2k2o s TRP 973 N -2.96 0.55 -0.03 1.61 0.52 0.10 -4.65 118.94 114.07 2k2o s TRP 973 Ca 0.48 -0.11 0.03 0.00 0.02 0.00 0.00 56.10 56.51 2k2o s TRP 973 Cb 0.39 -0.49 -0.03 0.00 -1.15 0.00 0.00 33.47 32.19 2k2o s TRP 973 CO 0.09 -0.12 -0.09 -2.00 0.02 0.00 0.00 176.95 174.86 2k2o s GLU 974 N 0.62 2.58 0.23 4.98 2.56 0.10 -4.12 118.70 125.66 2k2o s GLU 974 Ca -0.07 -0.67 -0.30 0.00 0.00 0.00 0.00 54.97 53.93 2k2o s GLU 974 Cb -0.11 -2.50 -0.09 0.00 2.00 0.00 0.00 34.13 33.44 2k2o s GLU 974 CO -0.00 0.62 1.05 -1.58 -0.56 0.00 0.00 175.26 174.79 2k2o s TRP 975 N -0.89 3.69 -0.13 5.30 0.52 -1.26 -0.85 118.94 125.33 2k2o s TRP 975 Ca 0.14 1.73 0.06 0.00 0.02 0.00 0.00 56.10 58.05 2k2o s TRP 975 Cb -0.11 -3.20 -0.12 0.00 -1.15 0.00 0.00 33.47 28.90 2k2o s TRP 975 CO 0.04 -0.28 -0.04 -0.85 0.02 0.00 0.00 176.95 175.84 2k2o n GLU 976 N 1.67 1.32 -2.66 4.98 0.28 -1.09 -4.77 120.64 120.38 2k2o n GLU 976 Ca -0.00 0.04 -0.28 0.00 -0.16 0.00 0.00 57.16 56.76 2k2o n GLU 976 Cb 0.46 -1.29 -0.00 0.00 1.43 0.00 0.00 31.44 32.04 2k2o n GLU 976 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2k2o s ASP 977 N -4.85 6.29 -0.05 -1.84 -1.08 -0.96 -5.01 116.67 109.17 2k2o s ASP 977 Ca -0.12 0.95 0.08 0.00 -0.52 0.00 0.00 52.55 52.95 2k2o s ASP 977 Cb 0.04 -2.26 -0.24 0.00 -1.46 0.00 0.00 42.92 39.01 2k2o s ASP 977 CO 0.40 -0.56 0.64 -0.78 0.52 0.00 0.00 175.17 175.40 2k2o h ASP 978 N 0.34 0.09 -5.09 -0.34 3.58 -1.93 -3.46 116.42 109.62 2k2o h ASP 978 Ca -0.47 -0.19 0.02 0.00 0.42 0.00 0.00 57.03 56.81 2k2o h ASP 978 Cb 1.20 -0.03 -0.06 0.00 1.72 0.00 0.00 39.33 42.16 2k2o h ASP 978 CO 0.62 1.17 0.11 0.00 -2.88 0.00 0.00 179.24 178.26 2k2o s ALA 979 N -2.60 -0.86 -0.43 -0.78 0.00 -1.26 -5.11 121.76 110.72 2k2o s ALA 979 Ca -0.08 -0.52 -0.19 0.00 0.00 0.00 0.00 51.96 51.17 2k2o s ALA 979 Cb 0.08 0.92 0.02 0.00 0.00 0.00 0.00 23.12 24.14 2k2o s ALA 979 CO 0.82 -0.97 0.52 -1.58 0.00 0.00 0.00 175.76 174.54 2k2o s TRP 980 N -3.91 3.13 0.21 0.00 0.52 -1.25 -4.53 118.94 113.11 2k2o s TRP 980 Ca 0.15 -0.24 0.09 0.00 0.02 0.00 0.00 56.10 56.12 2k2o s TRP 980 Cb -0.04 -3.08 -0.05 0.00 -1.15 0.00 0.00 33.47 29.16 2k2o s TRP 980 CO 0.08 -0.77 -0.17 -1.12 0.02 0.00 0.00 176.95 174.99 2k2o s SER 981 N 1.89 2.85 0.38 2.95 0.01 -1.09 -4.71 113.70 115.97 2k2o s SER 981 Ca 0.16 -0.99 -0.25 0.00 1.31 0.00 0.00 55.95 56.19 2k2o s SER 981 Cb -0.16 -0.18 -0.09 0.00 0.21 0.00 0.00 66.02 65.80 2k2o s SER 981 CO 0.16 -0.09 1.07 -0.72 0.41 0.00 0.00 173.24 174.07 2k2o s TYR 982 N -2.65 3.30 -0.26 2.43 1.13 -1.26 -0.82 117.35 119.23 2k2o s TYR 982 Ca 0.23 1.65 -0.15 0.00 -1.41 0.00 0.00 57.07 57.39 2k2o s TYR 982 Cb -0.03 -3.18 -0.04 0.00 -1.10 0.00 0.00 41.96 37.62 2k2o s TYR 982 CO 0.09 -0.67 0.37 0.34 -2.51 0.00 0.00 175.55 173.17 2k2o s ASP 983 N -1.41 6.28 0.00 -0.18 2.15 -0.11 -4.87 116.67 118.54 2k2o s ASP 983 Ca 0.55 0.32 0.17 0.00 0.43 0.00 0.00 52.55 54.03 2k2o s ASP 983 Cb -0.24 -2.21 0.45 0.00 -0.30 0.00 0.00 42.92 40.62 2k2o s ASP 983 CO 0.31 -0.16 1.37 2.30 -0.17 0.00 0.00 175.17 178.82 2k2o n ILE 984 N 4.97 0.94 -1.08 4.11 -6.64 -1.26 -4.49 119.36 115.91 2k2o n ILE 984 Ca -0.08 -0.97 -0.25 0.00 -1.77 0.00 0.00 62.75 59.68 2k2o n ILE 984 Cb 0.51 0.55 0.06 0.00 -1.44 0.00 0.00 39.64 39.32 2k2o n ILE 984 CO 0.00 0.00 0.00 -3.20 -1.77 0.00 0.00 176.55 171.58 2k2o n ASN 985 N 1.07 6.95 -3.45 7.28 4.05 -1.26 -4.82 115.26 125.08 2k2o n ASN 985 Ca 0.18 -3.40 -0.15 0.00 0.45 0.00 0.00 54.58 51.65 2k2o n ASN 985 Cb 0.52 -1.01 -0.06 0.00 1.23 0.00 0.00 39.78 40.46 2k2o n ASN 985 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2k2o s ARG 986 N -2.76 1.76 -1.12 1.20 0.52 -1.26 -5.05 118.95 112.23 2k2o s ARG 986 Ca 0.47 -1.76 -0.21 0.00 -0.52 0.00 0.00 55.73 53.70 2k2o s ARG 986 Cb 0.37 0.40 0.03 0.00 0.52 0.00 0.00 34.95 36.27 2k2o s ARG 986 CO -0.00 -0.70 1.66 0.00 0.02 0.00 0.00 175.30 176.27 2k2o s ALA 987 N -3.37 2.72 0.15 2.13 0.00 -1.26 -4.89 121.76 117.25 2k2o s ALA 987 Ca 0.33 -2.40 0.01 0.00 0.00 0.00 0.00 51.96 49.90 2k2o s ALA 987 Cb 0.01 -4.59 -0.00 0.00 0.00 0.00 0.00 23.12 18.54 2k2o s ALA 987 CO 0.20 -3.80 0.03 1.33 0.00 0.00 0.00 175.76 173.53 2k2o n VAL 988 N 6.92 0.00 -2.75 0.00 0.24 -1.26 -2.98 118.33 118.50 2k2o n VAL 988 Ca 0.41 -0.83 -0.09 0.00 -2.04 0.00 0.00 64.34 61.78 2k2o n VAL 988 Cb 0.48 0.26 0.04 0.00 -1.47 0.00 0.00 33.84 33.15 2k2o n VAL 988 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2k2o n ASP 989 N -1.62 0.76 0.03 -1.34 -0.08 -0.43 -4.65 116.55 109.22 2k2o n ASP 989 Ca -0.04 -1.58 -0.02 0.00 -1.51 0.00 0.00 54.79 51.64 2k2o n ASP 989 Cb 0.22 -0.22 0.25 0.00 2.34 0.00 0.00 41.12 43.71 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 0.00 0.44 -0.27 -0.67 4.39 -1.93 -1.67 114.58 114.87 2k2o h GLU 990 Ca -0.13 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.43 2k2o h GLU 990 Cb 0.53 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.14 2k2o h GLU 990 CO 0.16 0.61 0.00 1.63 -1.16 0.00 0.00 179.01 180.25 2k2o n LYS 991 N -4.17 1.89 -2.35 2.33 5.02 -1.26 -4.96 118.16 114.66 2k2o n LYS 991 Ca -0.00 -1.35 -0.05 0.00 -2.02 0.00 0.00 58.31 54.89 2k2o n LYS 991 Cb 0.35 -1.39 0.01 0.00 -0.02 0.00 0.00 35.03 33.98 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 1.18 -1.18 3.31 0.72 0.00 -0.63 -5.00 105.19 103.60 2k2o n GLY 992 Ca 0.16 0.74 -0.14 0.00 0.00 0.00 0.00 46.02 46.78 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 -1.98 -0.38 0.24 1.61 0.52 -1.26 -4.63 118.94 113.06 2k2o s TRP 993 Ca 0.15 0.79 0.11 0.00 0.02 0.00 0.00 56.10 57.18 2k2o s TRP 993 Cb -0.04 0.17 -0.05 0.00 -1.15 0.00 0.00 33.47 32.40 2k2o s TRP 993 CO 0.49 -0.34 -0.20 -1.83 0.02 0.00 0.00 176.95 175.08 2k2o s GLU 994 N -0.57 1.66 -0.62 4.98 -1.05 0.02 -1.32 118.70 121.80 2k2o s GLU 994 Ca -0.07 -1.63 -0.27 0.00 -0.15 0.00 0.00 54.97 52.85 2k2o s GLU 994 Cb -0.04 -1.84 0.00 0.00 -0.44 0.00 0.00 34.13 31.82 2k2o s GLU 994 CO 0.03 0.37 1.58 -0.47 0.95 0.00 0.00 175.26 177.72 2k2o s TYR 995 N -2.11 2.00 -0.25 4.83 6.14 0.02 -3.38 117.35 124.61 2k2o s TYR 995 Ca 0.26 0.47 0.03 0.00 0.64 0.00 0.00 57.07 58.46 2k2o s TYR 995 Cb -0.06 -4.32 0.05 0.00 0.42 0.00 0.00 41.96 38.05 2k2o s TYR 995 CO 0.13 -2.19 -0.12 0.20 0.64 0.00 0.00 175.55 174.21 2k2o s GLY 996 N 5.84 1.62 0.05 8.97 0.00 -0.99 -3.21 107.32 119.60 2k2o s GLY 996 Ca 0.55 -1.68 0.09 0.00 0.00 0.00 0.00 44.72 43.68 2k2o s GLY 996 CO 0.21 0.56 -0.25 -0.26 0.00 0.00 0.00 173.10 173.36 2k2o s ILE 997 N 1.14 2.00 0.00 0.90 -4.36 -1.26 -1.10 121.20 118.51 2k2o s ILE 997 Ca -0.07 -1.37 0.00 0.00 -0.26 0.00 0.00 60.65 58.96 2k2o s ILE 997 Cb -0.19 -1.72 -0.00 0.00 1.25 0.00 0.00 42.46 41.80 2k2o s ILE 997 CO -0.06 0.28 -0.01 0.28 0.24 0.00 0.00 174.94 175.67 2k2o s THR 998 N -0.83 0.10 -0.16 8.37 -1.32 -1.26 -4.33 115.64 116.20 2k2o s THR 998 Ca 0.10 -0.09 -0.05 0.00 -1.21 0.00 0.00 61.69 60.45 2k2o s THR 998 Cb -0.10 -0.10 -0.03 0.00 -1.51 0.00 0.00 72.50 70.76 2k2o s THR 998 CO 0.02 0.01 -0.01 0.27 -2.21 0.00 0.00 174.62 172.71 2k2o s ILE 999 N -0.08 4.18 0.30 5.08 -5.25 -1.26 -4.92 121.20 119.24 2k2o s ILE 999 Ca -0.00 -0.26 -0.29 0.00 -0.99 0.00 0.00 60.65 59.11 2k2o s ILE 999 Cb -0.01 -2.85 -0.10 0.00 2.95 0.00 0.00 42.46 42.46 2k2o s ILE 999 CO -0.00 0.49 1.17 -2.16 -1.79 0.00 0.00 174.94 172.65 2k2o s PRO 1000N 0.32 4.54 0.31 0.37 0.04 -1.26 -3.76 135.00 135.57 2k2o s PRO 1000Ca -0.02 1.95 -0.03 0.00 0.04 0.00 0.00 61.00 62.94 2k2o s PRO 1000Cb -0.14 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 2k2o s PRO 1000CO 0.02 0.07 0.56 -1.25 0.04 0.00 0.00 177.00 176.44 2k2o s PRO 1001N -1.57 3.57 0.00 0.56 0.05 -1.26 -5.15 135.00 131.21 2k2o s PRO 1001Ca 0.46 -0.11 0.00 0.00 0.05 0.00 0.00 61.00 61.40 2k2o s PRO 1001Cb -0.35 -2.65 0.00 0.00 0.05 0.00 0.00 34.50 31.56 2k2o s PRO 1001CO 0.45 0.18 0.00 -3.47 0.05 0.00 0.00 177.00 174.21 2k2o n ASP 1002N -1.27 0.00 0.00 6.66 -0.08 -1.25 -5.10 116.55 115.51 2k2o n ASP 1002Ca -0.03 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.25 2k2o n ASP 1002Cb 0.55 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.01 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 0.00 0.00 -4.60 -0.67 8.25 -1.26 -5.15 115.22 111.79 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 -0.15 0.00 1.12 0.00 0.00 29.99 30.96 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 1.12 0.43 -0.41 -0.14 -1.26 -5.04 119.74 114.45 2k2o s LYS 1004Ca 0.00 -0.56 -0.24 0.00 -1.36 0.00 0.00 55.97 53.81 2k2o s LYS 1004Cb 0.00 -1.09 -0.10 0.00 -1.68 0.00 0.00 37.83 34.96 2k2o s LYS 1004CO 0.00 0.30 1.11 -2.30 -0.76 0.00 0.00 175.35 173.70 2k2o n PRO 1005N 2.57 1.54 -0.09 -1.68 -0.02 -1.26 -4.91 135.00 131.15 2k2o n PRO 1005Ca -0.15 0.55 -0.17 0.00 -2.02 0.00 0.00 63.50 61.71 2k2o n PRO 1005Cb 0.55 -2.18 -0.08 0.00 -0.02 0.00 0.00 33.50 31.77 2k2o n PRO 1005CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2k2o n LYS 1006N 0.02 0.43 -3.75 -0.52 4.76 -1.26 -4.92 118.16 112.91 2k2o n LYS 1006Ca 0.09 0.14 -0.35 0.00 -2.87 0.00 0.00 58.31 55.33 2k2o n LYS 1006Cb 0.40 -1.27 -0.05 0.00 -1.84 0.00 0.00 35.03 32.27 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 -6.26 6.50 -0.02 4.39 0.01 -1.26 -4.96 113.70 112.10 2k2o s SER 1007Ca -0.26 0.57 0.02 0.00 1.31 0.00 0.00 55.95 57.59 2k2o s SER 1007Cb 0.08 -2.09 0.01 0.00 0.21 0.00 0.00 66.02 64.23 2k2o s SER 1007CO 0.38 0.25 -0.05 0.26 0.41 0.00 0.00 173.24 174.48 2k2o s TRP 1008N -1.31 0.59 0.27 2.43 0.52 -1.21 -4.18 118.94 116.05 2k2o s TRP 1008Ca 0.28 -0.12 -0.05 0.00 0.02 0.00 0.00 56.10 56.22 2k2o s TRP 1008Cb -0.13 -0.45 -0.01 0.00 -1.15 0.00 0.00 33.47 31.73 2k2o s TRP 1008CO 0.16 -0.07 0.37 0.08 0.02 0.00 0.00 176.95 177.52 2k2o s VAL 1009N 0.26 0.00 -0.45 4.03 1.01 -1.20 -4.83 120.40 119.22 2k2o s VAL 1009Ca -0.03 -1.66 0.25 0.00 0.00 0.00 0.00 61.98 60.53 2k2o s VAL 1009Cb -0.07 -2.45 0.33 0.00 0.00 0.00 0.00 36.38 34.20 2k2o s VAL 1009CO -0.00 0.00 1.68 0.00 0.00 0.00 0.00 175.10 176.78 2k2o h ALA 1010N 2.29 1.00 -2.13 5.51 0.00 -1.80 0.10 119.26 124.23 2k2o h ALA 1010Ca -0.29 0.00 -0.67 0.00 0.00 0.00 0.00 54.91 53.95 2k2o h ALA 1010Cb 1.25 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.87 2k2o h ALA 1010CO 0.41 0.00 0.09 0.00 0.00 0.00 0.00 179.25 179.76 2k2o s ALA 1011N -3.23 3.36 -0.09 0.00 0.00 -1.26 -4.10 121.76 116.44 2k2o s ALA 1011Ca 0.07 -1.48 -0.30 0.00 0.00 0.00 0.00 51.96 50.26 2k2o s ALA 1011Cb 0.07 -3.33 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 2k2o s ALA 1011CO 0.64 -1.91 1.39 -2.00 0.00 0.00 0.00 175.76 173.87 2k2o s GLU 1012N 2.76 4.24 0.14 0.00 2.56 -1.26 -4.67 118.70 122.47 2k2o s GLU 1012Ca 0.19 1.86 0.09 0.00 0.00 0.00 0.00 54.97 57.11 2k2o s GLU 1012Cb -0.16 -3.76 -0.04 0.00 2.00 0.00 0.00 34.13 32.16 2k2o s GLU 1012CO 0.15 -0.69 -0.21 0.15 -0.56 0.00 0.00 175.26 174.11 2k2o s LYS 1013N 3.28 1.26 0.32 4.30 1.02 -1.26 -5.04 119.74 123.61 2k2o s LYS 1013Ca 0.61 -1.33 0.02 0.00 0.02 0.00 0.00 55.97 55.30 2k2o s LYS 1013Cb -0.27 -1.45 0.59 0.00 -0.52 0.00 0.00 37.83 36.18 2k2o s LYS 1013CO 0.22 0.32 1.92 1.98 -0.92 0.00 0.00 175.35 178.86 2k2o h MET 1014N 3.58 0.92 -0.61 1.68 1.85 -2.00 -1.29 114.93 119.07 2k2o h MET 1014Ca -0.45 -0.06 0.00 0.00 -0.61 0.00 0.00 59.70 58.59 2k2o h MET 1014Cb 1.19 -0.21 0.00 0.00 0.43 0.00 0.00 31.60 33.02 2k2o h MET 1014CO 0.46 0.61 0.00 0.66 -0.40 0.00 0.00 176.91 178.24 2k2o n TYR 1015N -4.49 0.00 -1.11 1.39 4.02 -1.26 -3.32 117.16 112.40 2k2o n TYR 1015Ca 0.13 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.73 2k2o n TYR 1015Cb 0.21 -0.06 0.22 0.00 -0.02 0.00 0.00 39.34 39.69 2k2o n TYR 1015CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 2k2o s HIS 1016N -1.02 1.04 0.00 -0.72 3.76 -0.49 -4.78 115.29 113.07 2k2o s HIS 1016Ca 0.00 0.66 0.00 0.00 -0.15 0.00 0.00 55.06 55.57 2k2o s HIS 1016Cb 0.00 -3.39 0.00 0.00 1.11 0.00 0.00 32.58 30.30 2k2o s HIS 1016CO 0.00 -3.56 0.00 0.25 -0.85 0.00 0.00 174.74 170.58 2k2o n THR 1017N -4.57 0.00 -4.00 1.30 -2.24 -1.22 -2.91 114.28 100.64 2k2o n THR 1017Ca 0.10 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 2k2o n THR 1017Cb 0.59 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.70 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 0.35 -0.05 4.78 3.76 -0.26 -1.43 115.29 121.44 2k2o s HIS 1018Ca 0.00 -0.40 -0.08 0.00 -0.15 0.00 0.00 55.06 54.43 2k2o s HIS 1018Cb 0.00 -0.23 0.02 0.00 1.11 0.00 0.00 32.58 33.48 2k2o s HIS 1018CO 0.00 -0.11 0.20 0.50 -0.85 0.00 0.00 174.74 174.48 2k2o s ARG 1019N -1.13 0.35 0.19 1.40 3.52 -0.60 -2.34 118.95 120.33 2k2o s ARG 1019Ca -0.10 0.06 -0.12 0.00 -0.13 0.00 0.00 55.73 55.43 2k2o s ARG 1019Cb -0.08 0.16 0.00 0.00 -1.56 0.00 0.00 34.95 33.48 2k2o s ARG 1019CO -0.00 -0.07 0.39 -0.98 -0.81 0.00 0.00 175.30 173.83 2k2o s ARG 1020N -0.44 1.30 -0.01 5.12 1.70 -1.22 -1.52 118.95 123.89 2k2o s ARG 1020Ca -0.05 -1.09 -0.07 0.00 -0.47 0.00 0.00 55.73 54.05 2k2o s ARG 1020Cb -0.04 0.44 0.00 0.00 -0.57 0.00 0.00 34.95 34.79 2k2o s ARG 1020CO 0.01 -0.51 0.14 -0.98 -1.08 0.00 0.00 175.30 172.87 2k2o s ARG 1021N -3.95 0.44 -0.25 3.89 1.70 -0.96 -0.80 118.95 119.02 2k2o s ARG 1021Ca 0.16 -0.32 -0.25 0.00 -0.47 0.00 0.00 55.73 54.85 2k2o s ARG 1021Cb 0.01 0.18 -0.00 0.00 -0.57 0.00 0.00 34.95 34.57 2k2o s ARG 1021CO 0.01 -0.10 0.85 0.50 -1.08 0.00 0.00 175.30 175.48 2k2o s ARG 1022N -1.18 4.16 -0.21 3.89 3.52 -1.25 -1.40 118.95 126.47 2k2o s ARG 1022Ca -0.13 0.94 -0.12 0.00 -0.13 0.00 0.00 55.73 56.29 2k2o s ARG 1022Cb -0.07 -3.66 -0.05 0.00 -1.56 0.00 0.00 34.95 29.62 2k2o s ARG 1022CO 0.01 -0.57 0.24 -0.51 -0.81 0.00 0.00 175.30 173.66 2k2o s LEU 1023N 2.93 4.16 -0.03 -0.88 1.43 -0.14 -0.93 118.68 125.21 2k2o s LEU 1023Ca 0.36 0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.74 2k2o s LEU 1023Cb -0.15 -2.25 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 2k2o s LEU 1023CO 0.08 0.05 0.06 0.68 0.23 0.00 0.00 176.35 177.46 2k2o s VAL 1024N 0.92 4.67 -0.19 -1.59 -7.23 0.00 -1.23 120.40 115.75 2k2o s VAL 1024Ca 0.12 -0.32 -0.04 0.00 -1.81 0.00 0.00 61.98 59.93 2k2o s VAL 1024Cb -0.13 -3.08 0.10 0.00 0.56 0.00 0.00 36.38 33.82 2k2o s VAL 1024CO 0.04 0.44 0.30 -0.60 -0.31 0.00 0.00 175.10 174.97 2k2o s ARG 1025N -1.45 0.24 0.54 4.82 3.52 -0.50 -2.69 118.95 123.43 2k2o s ARG 1025Ca 0.20 0.53 -0.17 0.00 -0.13 0.00 0.00 55.73 56.16 2k2o s ARG 1025Cb -0.12 -0.53 -0.06 0.00 -1.56 0.00 0.00 34.95 32.68 2k2o s ARG 1025CO 0.10 -0.51 1.01 0.21 -0.81 0.00 0.00 175.30 175.30 2k2o s LYS 1026N 2.44 3.72 0.03 5.12 2.36 -1.26 -1.10 119.74 131.05 2k2o s LYS 1026Ca 0.06 1.08 -0.04 0.00 -2.55 0.00 0.00 55.97 54.53 2k2o s LYS 1026Cb -0.14 -2.10 -0.01 0.00 -1.05 0.00 0.00 37.83 34.53 2k2o s LYS 1026CO -0.12 -0.47 0.05 -0.98 1.55 0.00 0.00 175.35 175.38 2k2o s ARG 1027N -3.99 0.49 -0.03 4.03 1.70 -0.79 -2.27 118.95 118.09 2k2o s ARG 1027Ca 0.61 -0.71 -0.02 0.00 -0.47 0.00 0.00 55.73 55.14 2k2o s ARG 1027Cb -0.13 0.19 0.02 0.00 -0.57 0.00 0.00 34.95 34.46 2k2o s ARG 1027CO 0.32 -0.11 0.08 0.21 -1.08 0.00 0.00 175.30 174.72 2k2o s LYS 1028N -2.22 0.07 0.09 3.89 2.20 -0.03 -0.91 119.74 122.83 2k2o s LYS 1028Ca -0.08 0.17 0.18 0.00 -0.36 0.00 0.00 55.97 55.87 2k2o s LYS 1028Cb -0.04 -0.04 -0.11 0.00 -1.51 0.00 0.00 37.83 36.13 2k2o s LYS 1028CO -0.03 -0.06 0.86 1.17 -0.36 0.00 0.00 175.35 176.92 2k2o n LYS 1029N 3.43 0.62 -0.90 4.03 4.81 0.36 -0.72 118.16 129.78 2k2o n LYS 1029Ca -0.17 0.20 -0.04 0.00 -0.87 0.00 0.00 58.31 57.43 2k2o n LYS 1029Cb 0.57 -1.81 -0.02 0.00 0.02 0.00 0.00 35.03 33.79 2k2o n LYS 1029CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2k2o n ASP 1030N -2.84 -4.33 0.00 3.14 2.03 -1.23 -2.40 116.55 110.91 2k2o n ASP 1030Ca -0.08 0.09 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2k2o n ASP 1030Cb 0.78 -2.94 0.00 0.00 -0.72 0.00 0.00 41.12 38.24 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 -0.47 0.00 -2.09 -2.67 7.94 -1.26 -4.56 117.00 113.89 2k2o n LEU 1031Ca -0.04 0.00 -0.22 0.00 -1.11 0.00 0.00 56.01 54.65 2k2o n LEU 1031Cb 0.40 0.00 0.15 0.00 0.53 0.00 0.00 43.42 44.50 2k2o n LEU 1031CO 0.05 0.00 1.21 0.35 -1.11 0.00 0.00 177.39 177.89 2k2o n THR 1032N 0.00 2.97 -0.02 1.96 -2.24 -1.23 -4.49 114.28 111.23 2k2o n THR 1032Ca 0.00 -1.74 -0.10 0.00 -2.27 0.00 0.00 64.05 59.95 2k2o n THR 1032Cb 0.00 -0.57 -0.04 0.00 -2.10 0.00 0.00 70.33 67.63 2k2o n THR 1032CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2k2o h GLN 1033N 0.93 0.07 -2.47 -0.78 1.08 -1.71 -3.37 115.11 108.86 2k2o h GLN 1033Ca 0.56 -0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 57.17 2k2o h GLN 1033Cb 2.57 -0.02 -0.39 0.00 -0.05 0.00 0.00 27.48 29.60 2k2o h GLN 1033CO 1.00 0.05 -0.92 -0.08 -0.95 0.00 0.00 178.83 177.93 2k2o s THR 1034N -6.19 0.41 -0.20 -0.54 -1.32 -1.26 -4.91 115.64 101.62 2k2o s THR 1034Ca -0.13 -2.44 -0.06 0.00 -1.21 0.00 0.00 61.69 57.86 2k2o s THR 1034Cb 0.09 -1.30 -0.03 0.00 -1.51 0.00 0.00 72.50 69.75 2k2o s THR 1034CO 0.68 -1.15 0.02 0.00 -2.21 0.00 0.00 174.62 171.96 2k2o s ALA 1035N 0.30 3.10 -0.04 11.08 0.00 -1.26 -4.96 121.76 129.99 2k2o s ALA 1035Ca 0.28 -0.95 0.06 0.00 0.00 0.00 0.00 51.96 51.34 2k2o s ALA 1035Cb -0.05 -1.81 0.08 0.00 0.00 0.00 0.00 23.12 21.34 2k2o s ALA 1035CO -0.13 -0.11 0.95 -1.13 0.00 0.00 0.00 175.76 175.34 2k2o n SER 1036N 4.15 1.44 -4.71 0.00 3.41 -1.26 -5.03 113.62 111.62 2k2o n SER 1036Ca -0.17 -2.13 -0.41 0.00 -0.26 0.00 0.00 58.87 55.90 2k2o n SER 1036Cb 0.52 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 2k2o n SER 1036CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2k2o s SER 1037N -1.36 7.24 -0.17 4.04 0.01 -1.26 -4.99 113.70 117.21 2k2o s SER 1037Ca 0.09 1.51 -0.29 0.00 1.31 0.00 0.00 55.95 58.57 2k2o s SER 1037Cb 0.08 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.77 2k2o s SER 1037CO 0.01 -0.26 1.29 -0.89 0.41 0.00 0.00 173.24 173.80 2k2o s THR 1038N 1.15 4.23 -0.93 1.44 2.01 -1.26 -4.93 115.64 117.35 2k2o s THR 1038Ca 0.47 1.48 -0.24 0.00 0.31 0.00 0.00 61.69 63.72 2k2o s THR 1038Cb -0.20 -3.98 -0.01 0.00 0.01 0.00 0.00 72.50 68.32 2k2o s THR 1038CO 0.24 -0.16 1.75 0.00 -0.69 0.00 0.00 174.62 175.76 2k2o s ALA 1039N 3.61 2.08 0.00 7.40 0.00 -1.26 -5.33 121.76 128.26 2k2o s ALA 1039Ca 0.56 -1.75 0.00 0.00 0.00 0.00 0.00 51.96 50.76 2k2o s ALA 1039Cb -0.22 -4.53 0.00 0.00 0.00 0.00 0.00 23.12 18.37 2k2o s ALA 1039CO 0.16 -4.32 0.37 0.54 0.00 0.00 0.00 175.76 172.51