#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 -2.84 0.41 4.38 8.00 -1.26 -4.98 116.55 120.26 2k2o n ASP 919 Ca 0.00 0.94 -0.17 0.00 0.71 0.00 0.00 54.79 56.28 2k2o n ASP 919 Cb 0.00 -3.93 -0.08 0.00 -0.02 0.00 0.00 41.12 37.09 2k2o n ASP 919 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 2k2o h PRO 920 N 2.52 -1.01 0.00 -0.24 0.11 -2.02 -3.44 132.00 127.92 2k2o h PRO 920 Ca -0.24 0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2k2o h PRO 920 Cb 0.55 0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.89 2k2o h PRO 920 CO 0.03 -0.66 -0.52 1.19 -0.21 0.00 0.00 178.00 177.83 2k2o n PHE 921 N -5.48 -0.17 -3.46 0.65 3.72 -1.26 -5.02 117.46 106.43 2k2o n PHE 921 Ca -0.13 0.03 -0.18 0.00 -0.05 0.00 0.00 57.45 57.12 2k2o n PHE 921 Cb 0.42 0.09 -0.12 0.00 -0.94 0.00 0.00 39.48 38.93 2k2o n PHE 921 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2k2o s THR 922 N -2.00 -0.36 -0.00 4.37 -4.23 -1.26 -4.98 115.64 107.18 2k2o s THR 922 Ca 0.00 -0.20 0.11 0.00 -1.18 0.00 0.00 61.69 60.43 2k2o s THR 922 Cb 0.00 -0.75 -0.19 0.00 1.34 0.00 0.00 72.50 72.90 2k2o s THR 922 CO 0.00 -0.26 0.97 0.00 -0.54 0.00 0.00 174.62 174.79 2k2o h ALA 923 N 8.29 0.60 -3.67 3.99 0.00 -1.94 -3.44 119.26 123.09 2k2o h ALA 923 Ca -0.17 -1.11 -0.68 0.00 0.00 0.00 0.00 54.91 52.95 2k2o h ALA 923 Cb 1.14 0.18 -0.20 0.00 0.00 0.00 0.00 17.79 18.91 2k2o h ALA 923 CO 0.30 1.31 -0.70 0.34 0.00 0.00 0.00 179.25 180.49 2k2o s ASP 924 N -6.31 4.58 -0.02 0.00 2.15 -1.26 -5.00 116.67 110.82 2k2o s ASP 924 Ca -0.02 -0.05 0.02 0.00 0.43 0.00 0.00 52.55 52.94 2k2o s ASP 924 Cb 0.09 -1.18 0.04 0.00 -0.30 0.00 0.00 42.92 41.56 2k2o s ASP 924 CO 0.81 0.35 0.92 0.00 -0.17 0.00 0.00 175.17 177.08 2k2o n ALA 925 N 2.34 1.83 0.00 3.66 0.00 -1.26 -4.93 120.51 122.14 2k2o n ALA 925 Ca -0.18 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.17 2k2o n ALA 925 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -0.49 0.94 0.00 0.00 0.00 -1.26 -5.15 105.19 99.24 2k2o n GLY 926 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.17 1.61 8.25 -1.26 -4.71 115.22 115.95 2k2o n HIS 927 Ca 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.49 2k2o n HIS 927 Cb 0.00 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 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 2.15 -0.96 0.01 1.59 2.01 -1.25 -4.79 115.64 114.40 2k2o s THR 928 Ca 0.00 -0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.00 2k2o s THR 928 Cb 0.00 -0.98 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 2k2o s THR 928 CO 0.00 -0.01 -0.05 -1.83 -0.69 0.00 0.00 174.62 172.04 2k2o s GLU 929 N 2.83 0.36 -0.01 4.92 1.03 -1.26 0.79 118.70 127.35 2k2o s GLU 929 Ca 0.19 -0.39 0.01 0.00 0.03 0.00 0.00 54.97 54.81 2k2o s GLU 929 Cb -0.15 -0.21 0.00 0.00 -0.80 0.00 0.00 34.13 32.97 2k2o s GLU 929 CO -0.21 0.05 -0.03 0.12 -1.33 0.00 0.00 175.26 173.86 2k2o s PHE 930 N -0.69 0.31 0.06 4.83 5.36 -0.01 -4.96 117.98 122.88 2k2o s PHE 930 Ca -0.05 -0.05 -0.31 0.00 -0.96 0.00 0.00 56.93 55.57 2k2o s PHE 930 Cb -0.05 -0.24 -0.06 0.00 -0.34 0.00 0.00 43.02 42.33 2k2o s PHE 930 CO -0.00 -0.03 1.20 0.99 -1.46 0.00 0.00 175.22 175.92 2k2o s THR 931 N 0.13 4.02 0.18 0.12 2.01 -1.26 -1.38 115.64 119.45 2k2o s THR 931 Ca -0.01 1.45 0.04 0.00 0.31 0.00 0.00 61.69 63.48 2k2o s THR 931 Cb -0.04 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 2k2o s THR 931 CO -0.00 0.11 0.24 -0.62 -0.69 0.00 0.00 174.62 173.66 2k2o s ASP 932 N 1.06 6.00 0.03 3.53 -1.08 -0.35 -4.92 116.67 120.95 2k2o s ASP 932 Ca 0.59 0.02 -0.15 0.00 -0.52 0.00 0.00 52.55 52.49 2k2o s ASP 932 Cb -0.30 -1.71 0.02 0.00 -1.46 0.00 0.00 42.92 39.48 2k2o s ASP 932 CO 0.29 0.03 0.33 -1.83 0.52 0.00 0.00 175.17 174.51 2k2o s GLU 933 N -3.38 0.80 0.35 4.34 -1.05 -1.26 -1.29 118.70 117.21 2k2o s GLU 933 Ca 0.33 -0.40 -0.00 0.00 -0.15 0.00 0.00 54.97 54.75 2k2o s GLU 933 Cb -0.10 0.35 -0.00 0.00 -0.44 0.00 0.00 34.13 33.94 2k2o s GLU 933 CO 0.27 -0.25 0.44 0.54 0.95 0.00 0.00 175.26 177.21 2k2o s VAL 934 N -2.23 0.00 -0.16 1.83 0.11 -0.50 -4.97 120.40 114.48 2k2o s VAL 934 Ca -0.07 -1.67 -0.04 0.00 -2.93 0.00 0.00 61.98 57.27 2k2o s VAL 934 Cb -0.02 -2.63 0.07 0.00 -1.53 0.00 0.00 36.38 32.27 2k2o s VAL 934 CO -0.01 0.00 0.19 -0.31 -3.33 0.00 0.00 175.10 171.64 2k2o s TYR 935 N -3.08 -0.20 0.05 1.54 1.51 -0.51 -0.99 117.35 115.68 2k2o s TYR 935 Ca 0.33 0.33 -0.29 0.00 -1.01 0.00 0.00 57.07 56.43 2k2o s TYR 935 Cb 0.00 -0.35 -0.05 0.00 -0.11 0.00 0.00 41.96 41.46 2k2o s TYR 935 CO 0.22 -0.47 0.91 -1.14 -1.11 0.00 0.00 175.55 173.97 2k2o s GLN 936 N 2.30 4.60 0.20 -0.62 0.74 -0.47 -1.38 119.66 125.03 2k2o s GLN 936 Ca 0.05 1.33 0.11 0.00 0.05 0.00 0.00 55.36 56.89 2k2o s GLN 936 Cb -0.14 -3.41 -0.04 0.00 1.10 0.00 0.00 33.01 30.52 2k2o s GLN 936 CO -0.09 0.13 -0.21 -0.80 -0.55 0.00 0.00 175.29 173.76 2k2o s ASN 937 N 0.37 3.24 0.03 6.67 0.01 -0.22 -1.49 114.94 123.54 2k2o s ASN 937 Ca 0.46 -0.90 -0.04 0.00 -0.71 0.00 0.00 52.86 51.67 2k2o s ASN 937 Cb -0.22 -0.23 -0.01 0.00 0.41 0.00 0.00 41.25 41.20 2k2o s ASN 937 CO 0.27 0.05 0.05 -1.61 -1.51 0.00 0.00 177.10 174.35 2k2o s GLU 938 N -2.91 0.48 0.03 -0.60 2.02 -1.18 -3.64 118.70 112.90 2k2o s GLU 938 Ca 0.21 -0.69 0.05 0.00 0.02 0.00 0.00 54.97 54.57 2k2o s GLU 938 Cb -0.06 0.18 -0.02 0.00 0.10 0.00 0.00 34.13 34.33 2k2o s GLU 938 CO 0.10 -0.10 -0.16 -1.12 0.02 0.00 0.00 175.26 174.00 2k2o s SER 939 N -1.84 1.86 0.13 -0.19 0.01 -0.28 -3.04 113.70 110.34 2k2o s SER 939 Ca -0.09 -0.45 -0.12 0.00 1.31 0.00 0.00 55.95 56.60 2k2o s SER 939 Cb -0.04 -0.14 0.01 0.00 0.21 0.00 0.00 66.02 66.06 2k2o s SER 939 CO -0.03 0.08 0.31 0.00 0.41 0.00 0.00 173.24 174.01 2k2o s ARG 940 N -1.05 1.04 0.91 12.44 1.70 -0.16 -0.96 118.95 132.86 2k2o s ARG 940 Ca 0.03 -0.93 -0.11 0.00 -0.47 0.00 0.00 55.73 54.25 2k2o s ARG 940 Cb -0.08 0.41 0.14 0.00 -0.57 0.00 0.00 34.95 34.85 2k2o s ARG 940 CO 0.01 -0.38 1.10 0.71 -1.08 0.00 0.00 175.30 175.66 2k2o s TYR 941 N -3.87 2.06 -0.85 5.89 2.02 -1.26 -4.22 117.35 117.12 2k2o s TYR 941 Ca 0.08 1.46 -0.25 0.00 -0.37 0.00 0.00 57.07 57.98 2k2o s TYR 941 Cb 0.03 -3.17 -0.08 0.00 -0.40 0.00 0.00 41.96 38.34 2k2o s TYR 941 CO -0.08 -2.57 2.10 -2.14 -1.57 0.00 0.00 175.55 171.29 2k2o s PRO 942 N -4.79 2.25 0.00 -1.71 0.02 -1.25 -3.02 135.00 126.49 2k2o s PRO 942 Ca 0.64 -0.00 0.00 0.00 0.02 0.00 0.00 61.00 61.66 2k2o s PRO 942 Cb -0.20 -4.95 0.00 0.00 0.02 0.00 0.00 34.50 29.37 2k2o s PRO 942 CO 0.58 -3.70 0.00 0.41 -0.33 0.00 0.00 177.00 173.96 2k2o n GLY 943 N 6.80 0.63 0.00 0.52 0.00 -1.07 -4.94 105.19 107.13 2k2o n GLY 943 Ca 0.42 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.13 2.85 3.59 -0.02 0.00 -1.17 -5.15 105.19 105.17 2k2o n GLY 944 Ca 0.00 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 2k2o n GLY 944 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k2o s ASP 945 N 2.00 4.96 0.25 1.61 1.01 -1.26 -4.89 116.67 120.35 2k2o s ASP 945 Ca 0.00 0.01 -0.19 0.00 0.71 0.00 0.00 52.55 53.08 2k2o s ASP 945 Cb 0.00 -1.52 -0.09 0.00 1.01 0.00 0.00 42.92 42.33 2k2o s ASP 945 CO 0.00 0.30 0.74 0.26 0.21 0.00 0.00 175.17 176.68 2k2o s TRP 946 N -0.41 3.58 0.32 4.23 0.52 -1.26 -4.39 118.94 121.53 2k2o s TRP 946 Ca 0.07 1.38 0.04 0.00 0.02 0.00 0.00 56.10 57.61 2k2o s TRP 946 Cb -0.12 -2.62 -0.06 0.00 -1.15 0.00 0.00 33.47 29.51 2k2o s TRP 946 CO 0.02 0.27 0.04 0.15 0.02 0.00 0.00 176.95 177.45 2k2o s LYS 947 N -2.22 1.64 0.07 4.98 1.02 -0.14 -4.90 119.74 120.18 2k2o s LYS 947 Ca 0.46 -1.90 -0.32 0.00 0.02 0.00 0.00 55.97 54.23 2k2o s LYS 947 Cb -0.15 -0.93 -0.11 0.00 -0.52 0.00 0.00 37.83 36.11 2k2o s LYS 947 CO 0.20 -0.15 1.82 -2.30 -0.92 0.00 0.00 175.35 174.00 2k2o n PRO 948 N -0.67 2.52 0.00 -1.68 -0.02 -1.26 -1.13 135.00 132.76 2k2o n PRO 948 Ca -0.03 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.37 2k2o n PRO 948 Cb 0.66 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 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 5.69 1.67 0.00 3.55 0.00 -1.24 -4.61 120.51 125.58 2k2o n ALA 949 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2k2o n ALA 949 Cb 0.34 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2k2o n ALA 949 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2k2o n GLU 950 N -0.44 0.00 -3.76 0.00 1.02 -1.26 -4.62 120.64 111.59 2k2o n GLU 950 Ca 0.00 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.78 2k2o n GLU 950 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.32 2k2o n GLU 950 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k2o s ASP 951 N 0.00 5.19 -0.05 1.62 1.01 -1.26 -4.96 116.67 118.22 2k2o s ASP 951 Ca 0.00 -2.51 -0.18 0.00 0.71 0.00 0.00 52.55 50.57 2k2o s ASP 951 Cb 0.00 -1.83 -0.12 0.00 1.01 0.00 0.00 42.92 41.98 2k2o s ASP 951 CO 0.00 -0.44 0.73 0.74 0.21 0.00 0.00 175.17 176.41 2k2o h THR 952 N 5.76 0.46 -3.60 -1.27 2.02 -1.85 -3.43 112.91 111.01 2k2o h THR 952 Ca -0.07 -0.91 -0.62 0.00 0.77 0.00 0.00 66.41 65.59 2k2o h THR 952 Cb 0.99 0.78 -0.13 0.00 -1.74 0.00 0.00 68.15 68.05 2k2o h THR 952 CO 0.70 0.12 -0.21 -0.31 0.37 0.00 0.00 175.52 176.20 2k2o s TYR 953 N -3.28 3.30 0.27 3.16 2.02 -1.25 -1.06 117.35 120.51 2k2o s TYR 953 Ca -0.10 0.51 0.02 0.00 -0.37 0.00 0.00 57.07 57.13 2k2o s TYR 953 Cb 0.01 -2.56 -0.04 0.00 -0.40 0.00 0.00 41.96 38.97 2k2o s TYR 953 CO 0.36 -0.13 0.16 0.95 -1.57 0.00 0.00 175.55 175.31 2k2o s THR 954 N 1.74 0.19 0.55 -0.71 -4.23 -0.48 -0.65 115.64 112.05 2k2o s THR 954 Ca 0.17 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.72 2k2o s THR 954 Cb -0.15 -2.52 0.05 0.00 1.34 0.00 0.00 72.50 71.22 2k2o s THR 954 CO 0.09 0.00 0.76 -0.62 -0.54 0.00 0.00 174.62 174.31 2k2o s ASP 955 N -3.29 5.19 0.48 3.99 2.15 0.17 -1.43 116.67 123.93 2k2o s ASP 955 Ca 0.38 -0.31 0.22 0.00 0.43 0.00 0.00 52.55 53.27 2k2o s ASP 955 Cb 0.06 -0.49 1.25 0.00 -0.30 0.00 0.00 42.92 43.44 2k2o s ASP 955 CO 0.17 -1.20 1.91 0.00 -0.17 0.00 0.00 175.17 175.88 2k2o h ALA 956 N 0.13 2.41 -0.00 3.66 0.00 -1.95 0.26 119.26 123.78 2k2o h ALA 956 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2k2o h ALA 956 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2k2o h ALA 956 CO 0.46 -0.64 -0.00 0.09 0.00 0.00 0.00 179.25 179.16 2k2o n ASN 957 N -4.41 0.05 0.00 0.00 3.02 -1.26 -4.88 115.26 107.78 2k2o n ASN 957 Ca 0.16 -0.67 0.00 0.00 -0.03 0.00 0.00 54.58 54.03 2k2o n ASN 957 Cb 0.70 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 2k2o n ASN 957 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k2o n GLY 958 N 1.12 1.50 3.50 7.41 0.00 0.90 -4.97 105.19 114.66 2k2o n GLY 958 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 1.74 -4.68 1.61 8.00 -1.26 -4.49 116.55 117.47 2k2o n ASP 959 Ca 0.00 -0.02 -0.52 0.00 0.71 0.00 0.00 54.79 54.96 2k2o n ASP 959 Cb 0.00 -1.31 -0.06 0.00 -0.02 0.00 0.00 41.12 39.74 2k2o n ASP 959 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2k2o n LYS 960 N 8.61 1.70 -2.80 -1.24 0.00 -1.26 -0.65 118.16 122.52 2k2o n LYS 960 Ca 0.46 0.62 -0.09 0.00 0.00 0.00 0.00 58.31 59.30 2k2o n LYS 960 Cb 0.31 -2.38 -0.02 0.00 0.00 0.00 0.00 35.03 32.93 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 5.51 0.15 -2.01 3.14 0.00 0.17 -4.92 120.51 122.56 2k2o n ALA 961 Ca 0.23 -0.68 -0.29 0.00 0.00 0.00 0.00 53.44 52.70 2k2o n ALA 961 Cb 0.22 0.40 0.02 0.00 0.00 0.00 0.00 19.45 20.09 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 -2.29 3.16 0.41 0.00 0.00 -1.26 -4.68 121.76 117.10 2k2o s ALA 962 Ca 0.02 -0.38 -0.06 0.00 0.00 0.00 0.00 51.96 51.54 2k2o s ALA 962 Cb 0.00 -2.85 -0.05 0.00 0.00 0.00 0.00 23.12 20.22 2k2o s ALA 962 CO 0.01 -0.75 0.72 -1.12 0.00 0.00 0.00 175.76 174.62 2k2o s SER 963 N -4.24 6.37 0.50 0.00 0.01 -1.26 -4.82 113.70 110.27 2k2o s SER 963 Ca 0.54 0.90 0.39 0.00 1.31 0.00 0.00 55.95 59.08 2k2o s SER 963 Cb -0.11 -2.23 1.56 0.00 0.21 0.00 0.00 66.02 65.45 2k2o s SER 963 CO 0.49 -0.43 1.65 -0.65 0.41 0.00 0.00 173.24 174.71 2k2o h PRO 964 N 0.82 0.05 0.09 12.44 0.10 -1.98 0.12 132.00 143.65 2k2o h PRO 964 Ca -0.47 -0.00 -0.31 0.00 0.10 0.00 0.00 66.00 65.31 2k2o h PRO 964 Cb 1.20 -0.01 -0.02 0.00 0.10 0.00 0.00 31.00 32.27 2k2o h PRO 964 CO 0.63 0.03 -1.65 0.77 0.10 0.00 0.00 178.00 177.88 2k2o h SER 965 N 0.05 0.30 0.79 -2.05 0.02 -2.03 -3.05 113.55 107.58 2k2o h SER 965 Ca 0.80 -0.50 0.00 0.00 -0.84 0.00 0.00 61.79 61.25 2k2o h SER 965 Cb 2.91 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 65.35 2k2o h SER 965 CO -0.17 1.43 0.00 1.21 -1.14 0.00 0.00 176.83 178.16 2k2o n GLU 966 N -3.37 0.10 -3.01 3.45 4.07 -0.03 -4.57 120.64 117.28 2k2o n GLU 966 Ca -0.19 0.26 -0.43 0.00 -0.06 0.00 0.00 57.16 56.74 2k2o n GLU 966 Cb 1.04 -1.66 -0.06 0.00 -0.06 0.00 0.00 31.44 30.70 2k2o n GLU 966 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2k2o s LEU 967 N -3.68 4.31 0.00 4.31 1.43 0.22 -4.86 118.68 120.41 2k2o s LEU 967 Ca 0.08 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.04 2k2o s LEU 967 Cb 0.11 -2.90 0.01 0.00 0.03 0.00 0.00 46.19 43.44 2k2o s LEU 967 CO 0.39 -0.86 0.05 0.35 0.23 0.00 0.00 176.35 176.51 2k2o n THR 968 N 6.03 0.00 -4.80 5.49 -2.24 -1.26 -4.91 114.28 112.59 2k2o n THR 968 Ca 0.01 -0.47 -0.33 0.00 -2.27 0.00 0.00 64.05 60.99 2k2o n THR 968 Cb 0.48 -0.19 -0.15 0.00 -2.10 0.00 0.00 70.33 68.38 2k2o n THR 968 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k2o s PRO 970 N 0.40 0.48 0.46 0.00 0.04 -1.26 -4.84 135.00 130.29 2k2o s PRO 970 Ca -0.11 0.46 0.27 0.00 0.04 0.00 0.00 61.00 61.66 2k2o s PRO 970 Cb -0.16 -1.75 1.33 0.00 0.04 0.00 0.00 34.50 33.96 2k2o s PRO 970 CO 0.06 -2.68 1.77 -1.35 0.04 0.00 0.00 177.00 174.84 2k2o h PRO 971 N -1.86 0.19 -0.63 0.56 0.11 -2.00 -0.76 132.00 127.62 2k2o h PRO 971 Ca -0.54 -0.01 -0.39 0.00 0.11 0.00 0.00 66.00 65.17 2k2o h PRO 971 Cb 1.33 -0.04 -0.23 0.00 0.11 0.00 0.00 31.00 32.17 2k2o h PRO 971 CO 0.58 0.13 0.02 0.41 -0.21 0.00 0.00 178.00 178.93 2k2o n GLY 972 N -1.61 5.37 3.11 -0.55 0.00 -1.26 -4.72 105.19 105.54 2k2o n GLY 972 Ca 0.26 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.43 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 -3.44 -0.22 0.07 1.61 0.52 -0.29 -4.73 118.94 112.45 2k2o s TRP 973 Ca 0.51 0.53 0.07 0.00 0.02 0.00 0.00 56.10 57.24 2k2o s TRP 973 Cb 0.44 0.07 -0.03 0.00 -1.15 0.00 0.00 33.47 32.80 2k2o s TRP 973 CO 0.02 -0.14 -0.20 -2.00 0.02 0.00 0.00 176.95 174.64 2k2o s GLU 974 N -0.05 1.19 0.34 4.98 2.56 -0.17 -3.99 118.70 123.56 2k2o s GLU 974 Ca -0.02 -1.04 -0.26 0.00 0.00 0.00 0.00 54.97 53.65 2k2o s GLU 974 Cb -0.02 -1.37 -0.09 0.00 2.00 0.00 0.00 34.13 34.65 2k2o s GLU 974 CO 0.01 0.33 1.04 -1.58 -0.56 0.00 0.00 175.26 174.50 2k2o s TRP 975 N -1.01 3.47 -0.14 5.30 0.52 -1.26 -0.86 118.94 124.95 2k2o s TRP 975 Ca 0.06 1.70 -0.03 0.00 0.02 0.00 0.00 56.10 57.85 2k2o s TRP 975 Cb -0.09 -3.14 -0.08 0.00 -1.15 0.00 0.00 33.47 29.01 2k2o s TRP 975 CO 0.03 -0.42 -0.15 0.39 0.02 0.00 0.00 176.95 176.82 2k2o n GLU 976 N 0.50 0.33 -3.11 4.98 -0.58 -0.90 -4.65 120.64 117.21 2k2o n GLU 976 Ca 0.02 0.10 -0.26 0.00 -0.42 0.00 0.00 57.16 56.61 2k2o n GLU 976 Cb 0.48 -1.17 -0.01 0.00 -0.57 0.00 0.00 31.44 30.17 2k2o n GLU 976 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2k2o s ASP 977 N -5.77 6.31 0.05 1.62 -1.08 -0.86 -5.00 116.67 111.94 2k2o s ASP 977 Ca -0.19 0.66 -0.26 0.00 -0.52 0.00 0.00 52.55 52.24 2k2o s ASP 977 Cb 0.06 -2.13 -0.17 0.00 -1.46 0.00 0.00 42.92 39.22 2k2o s ASP 977 CO 0.29 -0.38 1.51 -0.78 0.52 0.00 0.00 175.17 176.33 2k2o h ASP 978 N 0.71 -0.27 -4.86 -0.34 3.58 -1.96 -3.48 116.42 109.80 2k2o h ASP 978 Ca -0.48 -0.11 0.03 0.00 0.42 0.00 0.00 57.03 56.89 2k2o h ASP 978 Cb 1.21 0.07 -0.13 0.00 1.72 0.00 0.00 39.33 42.20 2k2o h ASP 978 CO 0.62 -0.06 0.33 0.00 -2.88 0.00 0.00 179.24 177.25 2k2o s ALA 979 N -5.52 -1.68 -0.25 -0.78 0.00 -1.26 -5.11 121.76 107.16 2k2o s ALA 979 Ca -0.15 0.68 -0.29 0.00 0.00 0.00 0.00 51.96 52.20 2k2o s ALA 979 Cb 0.04 0.70 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 2k2o s ALA 979 CO 0.62 -0.74 1.30 -1.58 0.00 0.00 0.00 175.76 175.36 2k2o s TRP 980 N -3.50 2.72 0.22 0.00 0.52 -1.25 -4.74 118.94 112.91 2k2o s TRP 980 Ca 0.03 0.91 0.09 0.00 0.02 0.00 0.00 56.10 57.14 2k2o s TRP 980 Cb -0.01 -3.76 -0.05 0.00 -1.15 0.00 0.00 33.47 28.50 2k2o s TRP 980 CO -0.11 -1.76 -0.16 -1.12 0.02 0.00 0.00 176.95 173.83 2k2o s SER 981 N 2.56 2.79 0.16 2.95 0.01 -1.09 -4.80 113.70 116.28 2k2o s SER 981 Ca 0.56 -1.02 -0.30 0.00 1.31 0.00 0.00 55.95 56.50 2k2o s SER 981 Cb -0.19 -0.17 -0.07 0.00 0.21 0.00 0.00 66.02 65.80 2k2o s SER 981 CO 0.20 -0.12 1.13 -0.72 0.41 0.00 0.00 173.24 174.13 2k2o s TYR 982 N -2.86 3.55 -0.13 2.43 1.13 -1.26 -0.67 117.35 119.53 2k2o s TYR 982 Ca 0.24 1.54 -0.28 0.00 -1.41 0.00 0.00 57.07 57.16 2k2o s TYR 982 Cb -0.02 -3.32 -0.01 0.00 -1.10 0.00 0.00 41.96 37.51 2k2o s TYR 982 CO 0.09 -0.77 0.93 0.34 -2.51 0.00 0.00 175.55 173.62 2k2o s ASP 983 N 0.10 7.12 -0.02 -0.18 2.15 0.62 -4.88 116.67 121.57 2k2o s ASP 983 Ca 0.51 1.37 0.03 0.00 0.43 0.00 0.00 52.55 54.90 2k2o s ASP 983 Cb -0.30 -2.51 0.05 0.00 -0.30 0.00 0.00 42.92 39.87 2k2o s ASP 983 CO 0.34 -0.42 0.99 2.30 -0.17 0.00 0.00 175.17 178.21 2k2o n ILE 984 N 4.61 1.06 0.24 4.11 -6.64 -1.26 -4.61 119.36 116.87 2k2o n ILE 984 Ca 0.07 -1.13 -0.01 0.00 -1.77 0.00 0.00 62.75 59.90 2k2o n ILE 984 Cb 0.49 0.41 0.13 0.00 -1.44 0.00 0.00 39.64 39.22 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 -0.62 2.96 -2.45 7.28 2.85 -1.26 -4.83 115.26 119.18 2k2o n ASN 985 Ca 0.03 -2.44 -0.11 0.00 -0.11 0.00 0.00 54.58 51.95 2k2o n ASN 985 Cb 0.35 -0.59 -0.03 0.00 1.24 0.00 0.00 39.78 40.75 2k2o n ASN 985 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2k2o n ARG 986 N 0.12 0.45 -2.66 1.20 1.74 -1.26 -5.06 116.66 111.18 2k2o n ARG 986 Ca 0.14 -2.08 -0.43 0.00 -0.77 0.00 0.00 57.85 54.72 2k2o n ARG 986 Cb 0.72 1.92 -0.01 0.00 -1.02 0.00 0.00 32.46 34.07 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 -2.56 3.26 0.11 7.54 0.00 -1.26 -4.91 121.76 123.94 2k2o s ALA 987 Ca 0.22 -2.79 0.02 0.00 0.00 0.00 0.00 51.96 49.41 2k2o s ALA 987 Cb -0.00 -4.48 -0.04 0.00 0.00 0.00 0.00 23.12 18.60 2k2o s ALA 987 CO 0.16 -3.28 -0.06 0.14 0.00 0.00 0.00 175.76 172.72 2k2o s VAL 988 N 3.88 0.73 1.14 0.00 -7.23 -1.26 -3.71 120.40 113.95 2k2o s VAL 988 Ca 0.48 -1.95 -0.16 0.00 -1.81 0.00 0.00 61.98 58.54 2k2o s VAL 988 Cb 0.01 -1.75 0.18 0.00 0.56 0.00 0.00 36.38 35.38 2k2o s VAL 988 CO 0.00 -0.82 0.43 -0.67 -0.31 0.00 0.00 175.10 173.73 2k2o n ASP 989 N -0.08 -2.11 0.05 4.85 2.03 -0.48 -4.74 116.55 116.07 2k2o n ASP 989 Ca -0.11 -0.13 0.06 0.00 0.52 0.00 0.00 54.79 55.13 2k2o n ASP 989 Cb 0.61 -1.09 0.48 0.00 -0.72 0.00 0.00 41.12 40.41 2k2o n ASP 989 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2k2o h GLU 990 N -2.32 0.40 -0.25 -0.67 5.08 -1.88 0.95 114.58 115.88 2k2o h GLU 990 Ca -0.57 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.77 2k2o h GLU 990 Cb 1.35 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2k2o h GLU 990 CO 0.43 0.26 0.00 1.63 -1.00 0.00 0.00 179.01 180.33 2k2o n LYS 991 N -4.49 2.15 0.00 2.33 5.02 -1.26 -4.92 118.16 116.98 2k2o n LYS 991 Ca 0.02 -1.72 0.00 0.00 -2.02 0.00 0.00 58.31 54.59 2k2o n LYS 991 Cb 0.10 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.65 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 1.33 3.25 3.69 0.72 0.00 0.33 -4.85 105.19 109.66 2k2o n GLY 992 Ca 0.18 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.47 2.11 -3.86 1.61 7.02 -1.26 -4.15 117.44 117.43 2k2o n TRP 993 Ca 0.00 0.34 -0.31 0.00 -1.02 0.00 0.00 57.50 56.51 2k2o n TRP 993 Cb 0.00 -2.52 -0.04 0.00 -2.42 0.00 0.00 31.31 26.33 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 3.21 3.48 -1.06 -0.99 2.02 -0.14 -1.39 118.70 123.83 2k2o s GLU 994 Ca 0.94 -0.34 -0.22 0.00 0.02 0.00 0.00 54.97 55.36 2k2o s GLU 994 Cb -0.90 -3.01 0.02 0.00 0.10 0.00 0.00 34.13 30.34 2k2o s GLU 994 CO 0.57 0.59 1.67 -0.47 0.02 0.00 0.00 175.26 177.64 2k2o s TYR 995 N -1.52 2.35 -0.60 1.61 5.04 -0.06 -3.21 117.35 120.96 2k2o s TYR 995 Ca 0.35 -0.51 -0.03 0.00 -2.44 0.00 0.00 57.07 54.45 2k2o s TYR 995 Cb -0.13 -4.48 0.15 0.00 0.35 0.00 0.00 41.96 37.85 2k2o s TYR 995 CO 0.26 -1.79 0.41 0.20 -1.34 0.00 0.00 175.55 173.29 2k2o s GLY 996 N 5.72 2.45 0.10 8.97 0.00 -1.14 -2.92 107.32 120.49 2k2o s GLY 996 Ca 0.56 -3.19 0.03 0.00 0.00 0.00 0.00 44.72 42.12 2k2o s GLY 996 CO -0.02 1.09 0.12 -0.26 0.00 0.00 0.00 173.10 174.03 2k2o s ILE 997 N 0.05 4.68 -0.01 0.90 -4.36 -1.25 -2.42 121.20 118.79 2k2o s ILE 997 Ca 0.16 -0.77 0.01 0.00 -0.26 0.00 0.00 60.65 59.79 2k2o s ILE 997 Cb -0.21 -3.29 0.01 0.00 1.25 0.00 0.00 42.46 40.22 2k2o s ILE 997 CO -0.03 0.07 -0.02 0.28 0.24 0.00 0.00 174.94 175.48 2k2o s THR 998 N -1.49 0.24 -0.31 8.37 -1.32 -1.26 -3.90 115.64 115.97 2k2o s THR 998 Ca 0.31 -0.06 0.01 0.00 -1.21 0.00 0.00 61.69 60.74 2k2o s THR 998 Cb -0.12 -0.26 0.07 0.00 -1.51 0.00 0.00 72.50 70.69 2k2o s THR 998 CO 0.23 0.11 0.01 -0.63 -2.21 0.00 0.00 174.62 172.13 2k2o s ILE 999 N 0.36 2.60 0.33 5.08 1.01 -1.26 -4.95 121.20 124.37 2k2o s ILE 999 Ca -0.04 -1.79 -0.29 0.00 0.00 0.00 0.00 60.65 58.54 2k2o s ILE 999 Cb -0.06 -2.65 -0.11 0.00 0.01 0.00 0.00 42.46 39.65 2k2o s ILE 999 CO -0.01 -0.28 1.49 -2.16 0.00 0.00 0.00 174.94 173.99 2k2o s PRO 1000N 1.10 4.16 0.22 2.79 0.04 -1.26 -3.69 135.00 138.37 2k2o s PRO 1000Ca -0.01 2.49 -0.25 0.00 0.04 0.00 0.00 61.00 63.28 2k2o s PRO 1000Cb -0.20 -3.02 -0.09 0.00 0.04 0.00 0.00 34.50 31.24 2k2o s PRO 1000CO -0.04 -0.51 0.83 -1.25 0.04 0.00 0.00 177.00 176.07 2k2o s PRO 1001N -1.31 4.55 0.00 0.56 0.05 -1.26 -5.13 135.00 132.46 2k2o s PRO 1001Ca 0.57 1.19 0.00 0.00 0.05 0.00 0.00 61.00 62.80 2k2o s PRO 1001Cb -0.45 -3.09 0.00 0.00 0.05 0.00 0.00 34.50 31.01 2k2o s PRO 1001CO 0.54 0.47 0.00 -3.47 0.05 0.00 0.00 177.00 174.59 2k2o n ASP 1002N 1.18 0.00 0.00 6.66 2.03 -1.24 -5.11 116.55 120.07 2k2o n ASP 1002Ca -0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.28 2k2o n ASP 1002Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 2k2o n ASP 1002CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k2o n HIS 1003N 0.00 0.00 -3.62 -0.67 1.44 -1.26 -5.12 115.22 105.99 2k2o n HIS 1003Ca 0.00 0.00 -0.12 0.00 -2.01 0.00 0.00 57.72 55.59 2k2o n HIS 1003Cb 0.00 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.04 2k2o n HIS 1003CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2k2o s LYS 1004N 0.00 0.66 -0.15 -1.40 1.02 -1.26 -5.12 119.74 113.50 2k2o s LYS 1004Ca 0.00 0.67 -0.38 0.00 0.02 0.00 0.00 55.97 56.28 2k2o s LYS 1004Cb 0.00 0.32 -0.15 0.00 -0.52 0.00 0.00 37.83 37.48 2k2o s LYS 1004CO 0.00 -0.10 1.70 -2.30 -0.92 0.00 0.00 175.35 173.73 2k2o n PRO 1005N 2.15 1.46 -0.13 -1.68 -0.02 -1.26 -4.83 135.00 130.68 2k2o n PRO 1005Ca -0.13 0.53 0.08 0.00 -2.02 0.00 0.00 63.50 61.96 2k2o n PRO 1005Cb 0.56 -2.25 0.14 0.00 -0.02 0.00 0.00 33.50 31.93 2k2o n PRO 1005CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2k2o n LYS 1006N 5.10 2.06 -3.84 -0.52 2.85 -1.25 -4.92 118.16 117.65 2k2o n LYS 1006Ca 0.24 -1.88 -0.12 0.00 -1.05 0.00 0.00 58.31 55.49 2k2o n LYS 1006Cb 0.19 -1.34 -0.14 0.00 -0.65 0.00 0.00 35.03 33.09 2k2o n LYS 1006CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2k2o s SER 1007N -1.13 -0.05 -0.02 -5.58 0.15 -1.26 -5.11 113.70 100.70 2k2o s SER 1007Ca 0.26 0.12 0.01 0.00 0.70 0.00 0.00 55.95 57.05 2k2o s SER 1007Cb 0.15 0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.58 2k2o s SER 1007CO 0.21 -0.04 -0.05 0.26 1.20 0.00 0.00 173.24 174.82 2k2o s TRP 1008N 0.20 0.57 0.16 3.44 0.52 -1.15 -3.75 118.94 118.93 2k2o s TRP 1008Ca -0.01 -0.12 -0.04 0.00 0.02 0.00 0.00 56.10 55.94 2k2o s TRP 1008Cb -0.02 -0.45 -0.03 0.00 -1.15 0.00 0.00 33.47 31.82 2k2o s TRP 1008CO -0.01 -0.08 0.17 0.08 0.02 0.00 0.00 176.95 177.14 2k2o s VAL 1009N 0.33 0.07 -1.99 4.03 1.01 -1.16 -4.81 120.40 117.87 2k2o s VAL 1009Ca -0.04 -1.72 0.10 0.00 0.00 0.00 0.00 61.98 60.32 2k2o s VAL 1009Cb -0.08 -2.06 0.29 0.00 0.00 0.00 0.00 36.38 34.53 2k2o s VAL 1009CO -0.00 -0.30 1.24 0.00 0.00 0.00 0.00 175.10 176.03 2k2o n ALA 1010N -0.18 2.45 -3.19 5.51 0.00 -1.24 -0.88 120.51 122.97 2k2o n ALA 1010Ca -0.05 -0.57 -0.30 0.00 0.00 0.00 0.00 53.44 52.53 2k2o n ALA 1010Cb 0.64 -0.97 -0.17 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.57 1.94 -0.40 0.00 0.00 -1.26 -2.79 121.76 117.68 2k2o s ALA 1011Ca 0.22 -0.85 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 2k2o s ALA 1011Cb 0.11 -0.72 0.02 0.00 0.00 0.00 0.00 23.12 22.53 2k2o s ALA 1011CO 0.15 0.27 1.16 -2.00 0.00 0.00 0.00 175.76 175.34 2k2o s GLU 1012N 0.33 3.84 0.21 0.00 2.56 -1.26 -4.50 118.70 119.87 2k2o s GLU 1012Ca -0.15 0.84 0.09 0.00 0.00 0.00 0.00 54.97 55.74 2k2o s GLU 1012Cb -0.17 -3.86 -0.05 0.00 2.00 0.00 0.00 34.13 32.06 2k2o s GLU 1012CO 0.07 -1.22 -0.16 0.15 -0.56 0.00 0.00 175.26 173.54 2k2o s LYS 1013N 4.21 1.38 0.23 4.30 1.02 -1.26 -5.05 119.74 124.57 2k2o s LYS 1013Ca 0.49 -1.58 -0.06 0.00 0.02 0.00 0.00 55.97 54.85 2k2o s LYS 1013Cb -0.10 -1.28 0.38 0.00 -0.52 0.00 0.00 37.83 36.31 2k2o s LYS 1013CO 0.26 0.23 1.77 1.98 -0.92 0.00 0.00 175.35 178.67 2k2o h MET 1014N 2.67 0.58 0.00 1.68 1.85 -1.99 -0.89 114.93 118.83 2k2o h MET 1014Ca -0.39 -0.03 0.00 0.00 -0.61 0.00 0.00 59.70 58.66 2k2o h MET 1014Cb 1.22 -0.13 0.00 0.00 0.43 0.00 0.00 31.60 33.12 2k2o h MET 1014CO 0.59 0.38 0.29 0.66 -0.40 0.00 0.00 176.91 178.43 2k2o n TYR 1015N -4.87 0.09 -1.26 1.39 4.01 -1.26 -2.60 117.16 112.66 2k2o n TYR 1015Ca 0.12 0.05 -0.35 0.00 -0.16 0.00 0.00 57.90 57.57 2k2o n TYR 1015Cb 0.31 -0.32 0.11 0.00 -0.31 0.00 0.00 39.34 39.14 2k2o n TYR 1015CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2k2o n HIS 1016N -1.43 1.18 0.00 -0.72 8.25 -0.34 -4.64 115.22 117.52 2k2o n HIS 1016Ca -0.00 0.40 0.00 0.00 -0.26 0.00 0.00 57.72 57.86 2k2o n HIS 1016Cb 0.29 -2.12 0.00 0.00 1.12 0.00 0.00 29.99 29.28 2k2o n HIS 1016CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2k2o n THR 1017N -2.90 0.00 -4.01 1.59 -2.24 -1.26 -3.51 114.28 101.95 2k2o n THR 1017Ca 0.14 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.83 2k2o n THR 1017Cb 0.50 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.62 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 -0.99 0.34 0.00 4.78 3.76 -1.01 -0.99 115.29 121.18 2k2o s HIS 1018Ca 0.00 -0.69 -0.29 0.00 -0.15 0.00 0.00 55.06 53.93 2k2o s HIS 1018Cb 0.00 -0.25 0.07 0.00 1.11 0.00 0.00 32.58 33.51 2k2o s HIS 1018CO 0.00 -0.25 0.66 -0.98 -0.85 0.00 0.00 174.74 173.33 2k2o s ARG 1019N -2.20 1.11 -0.04 1.40 1.70 -1.17 -2.90 118.95 116.85 2k2o s ARG 1019Ca -0.09 0.07 -0.19 0.00 -0.47 0.00 0.00 55.73 55.06 2k2o s ARG 1019Cb -0.05 0.52 0.04 0.00 -0.57 0.00 0.00 34.95 34.89 2k2o s ARG 1019CO -0.04 -0.39 0.41 -0.98 -1.08 0.00 0.00 175.30 173.23 2k2o s ARG 1020N -1.84 0.74 -0.01 3.89 1.70 -1.20 -3.13 118.95 119.09 2k2o s ARG 1020Ca -0.08 0.02 0.06 0.00 -0.47 0.00 0.00 55.73 55.26 2k2o s ARG 1020Cb -0.00 0.34 -0.02 0.00 -0.57 0.00 0.00 34.95 34.70 2k2o s ARG 1020CO 0.04 -0.20 -0.20 -0.98 -1.08 0.00 0.00 175.30 172.88 2k2o s ARG 1021N -1.09 1.59 -0.16 3.89 1.70 -0.56 -0.97 118.95 123.35 2k2o s ARG 1021Ca -0.11 -0.74 -0.28 0.00 -0.47 0.00 0.00 55.73 54.12 2k2o s ARG 1021Cb -0.04 -1.56 -0.01 0.00 -0.57 0.00 0.00 34.95 32.78 2k2o s ARG 1021CO 0.05 0.42 0.98 0.50 -1.08 0.00 0.00 175.30 176.17 2k2o s ARG 1022N -0.56 4.34 -0.19 3.89 3.52 -1.25 -1.37 118.95 127.32 2k2o s ARG 1022Ca 0.08 1.29 -0.14 0.00 -0.13 0.00 0.00 55.73 56.82 2k2o s ARG 1022Cb -0.08 -3.58 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 2k2o s ARG 1022CO -0.00 -0.43 0.33 -0.51 -0.81 0.00 0.00 175.30 173.88 2k2o s LEU 1023N 2.45 4.18 -0.09 -0.88 1.43 -0.16 -0.28 118.68 125.34 2k2o s LEU 1023Ca 0.44 0.46 -0.02 0.00 -1.03 0.00 0.00 54.13 53.98 2k2o s LEU 1023Cb -0.17 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 2k2o s LEU 1023CO 0.13 0.01 0.01 0.68 0.23 0.00 0.00 176.35 177.40 2k2o s VAL 1024N 0.96 4.37 -0.28 -1.59 -7.23 0.15 -1.41 120.40 115.39 2k2o s VAL 1024Ca 0.17 -0.22 -0.03 0.00 -1.81 0.00 0.00 61.98 60.09 2k2o s VAL 1024Cb -0.14 -2.85 0.11 0.00 0.56 0.00 0.00 36.38 34.07 2k2o s VAL 1024CO 0.06 0.60 0.20 -0.60 -0.31 0.00 0.00 175.10 175.05 2k2o s ARG 1025N -0.84 0.23 0.47 4.82 6.06 -0.41 -2.69 118.95 126.59 2k2o s ARG 1025Ca 0.13 -0.29 -0.22 0.00 -2.50 0.00 0.00 55.73 52.84 2k2o s ARG 1025Cb -0.11 -1.01 -0.08 0.00 0.06 0.00 0.00 34.95 33.81 2k2o s ARG 1025CO 0.02 -0.97 1.12 0.21 -2.50 0.00 0.00 175.30 173.18 2k2o s LYS 1026N 2.22 3.76 0.02 5.12 2.36 -1.26 -1.21 119.74 130.75 2k2o s LYS 1026Ca 0.09 1.64 -0.01 0.00 -2.55 0.00 0.00 55.97 55.13 2k2o s LYS 1026Cb -0.15 -2.32 -0.02 0.00 -1.05 0.00 0.00 37.83 34.29 2k2o s LYS 1026CO -0.32 -0.51 0.00 -0.98 1.55 0.00 0.00 175.35 175.09 2k2o s ARG 1027N -2.84 0.39 -0.00 4.03 1.70 -0.48 -2.03 118.95 119.71 2k2o s ARG 1027Ca 0.65 -0.66 0.01 0.00 -0.47 0.00 0.00 55.73 55.25 2k2o s ARG 1027Cb -0.25 0.14 -0.00 0.00 -0.57 0.00 0.00 34.95 34.27 2k2o s ARG 1027CO 0.30 -0.07 -0.02 0.21 -1.08 0.00 0.00 175.30 174.63 2k2o s LYS 1028N -1.81 0.19 0.00 3.89 2.20 -0.04 -0.83 119.74 123.34 2k2o s LYS 1028Ca -0.12 -0.10 0.27 0.00 -0.36 0.00 0.00 55.97 55.66 2k2o s LYS 1028Cb -0.07 -0.18 0.89 0.00 -1.51 0.00 0.00 37.83 36.97 2k2o s LYS 1028CO -0.02 0.05 1.65 1.17 -0.36 0.00 0.00 175.35 177.84 2k2o n LYS 1029N 2.99 0.88 0.00 4.03 4.81 0.24 -1.00 118.16 130.10 2k2o n LYS 1029Ca -0.13 -0.48 0.00 0.00 -0.87 0.00 0.00 58.31 56.84 2k2o n LYS 1029Cb 0.59 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 34.15 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 -0.64 0.00 0.00 3.14 -0.08 -1.26 -3.25 116.55 114.46 2k2o n ASP 1030Ca 0.13 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.41 2k2o n ASP 1030Cb 0.33 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.79 2k2o n ASP 1030CO 0.00 0.00 0.00 -0.11 0.12 0.00 0.00 177.20 177.21 2k2o n LEU 1031N 0.00 0.00 -0.45 -2.67 7.94 -1.26 -3.74 117.00 116.82 2k2o n LEU 1031Ca 0.00 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 54.96 2k2o n LEU 1031Cb 0.00 0.00 0.14 0.00 0.53 0.00 0.00 43.42 44.09 2k2o n LEU 1031CO 0.00 0.00 0.61 0.35 -1.11 0.00 0.00 177.39 177.24 2k2o n THR 1032N 0.00 1.46 0.14 1.96 -2.24 -1.25 -4.47 114.28 109.88 2k2o n THR 1032Ca 0.00 -1.42 -0.01 0.00 -2.27 0.00 0.00 64.05 60.34 2k2o n THR 1032Cb 0.00 0.19 0.21 0.00 -2.10 0.00 0.00 70.33 68.63 2k2o n THR 1032CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 2k2o h GLN 1033N 1.13 0.05 -4.52 -0.78 4.15 -1.91 -3.32 115.11 109.91 2k2o h GLN 1033Ca 0.00 -0.03 -0.71 0.00 0.77 0.00 0.00 58.65 58.68 2k2o h GLN 1033Cb 0.89 0.00 -0.27 0.00 0.21 0.00 0.00 27.48 28.32 2k2o h GLN 1033CO 0.05 0.58 -0.50 0.95 -1.93 0.00 0.00 178.83 177.99 2k2o s THR 1034N -3.80 4.29 0.04 2.39 -4.23 -1.26 -4.74 115.64 108.31 2k2o s THR 1034Ca -0.02 -1.20 -0.30 0.00 -1.18 0.00 0.00 61.69 58.98 2k2o s THR 1034Cb 0.13 -3.53 -0.04 0.00 1.34 0.00 0.00 72.50 70.39 2k2o s THR 1034CO 0.76 -0.39 1.08 0.00 -0.54 0.00 0.00 174.62 175.54 2k2o s ALA 1035N 1.46 3.28 -1.07 3.99 0.00 -1.25 -4.96 121.76 123.21 2k2o s ALA 1035Ca 0.02 0.69 -0.19 0.00 0.00 0.00 0.00 51.96 52.49 2k2o s ALA 1035Cb -0.21 -3.39 0.11 0.00 0.00 0.00 0.00 23.12 19.63 2k2o s ALA 1035CO 0.04 -0.32 1.37 -1.12 0.00 0.00 0.00 175.76 175.73 2k2o s SER 1036N 0.97 6.71 -0.16 0.00 0.01 -1.26 -4.75 113.70 115.23 2k2o s SER 1036Ca 0.55 -2.13 -0.14 0.00 1.31 0.00 0.00 55.95 55.54 2k2o s SER 1036Cb -0.25 -2.47 -0.05 0.00 0.21 0.00 0.00 66.02 63.46 2k2o s SER 1036CO 0.29 -1.14 -0.27 -0.24 0.41 0.00 0.00 173.24 172.29 2k2o n SER 1037N 7.29 1.78 -0.01 2.44 2.88 -1.26 -4.64 113.62 122.10 2k2o n SER 1037Ca 0.33 0.43 0.11 0.00 -1.33 0.00 0.00 58.87 58.40 2k2o n SER 1037Cb 0.48 -0.77 -0.15 0.00 -0.75 0.00 0.00 64.21 63.01 2k2o n SER 1037CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2k2o n THR 1038N -4.40 0.01 -3.99 2.46 -2.24 -1.26 -4.95 114.28 99.91 2k2o n THR 1038Ca -0.11 -0.37 -0.15 0.00 -2.27 0.00 0.00 64.05 61.15 2k2o n THR 1038Cb 0.40 0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.86 2k2o n THR 1038CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k2o n ALA 1039N -2.07 0.33 -1.07 6.98 0.00 -1.26 -5.31 120.51 118.12 2k2o n ALA 1039Ca -0.02 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.29 2k2o n ALA 1039Cb 0.51 0.53 0.00 0.00 0.00 0.00 0.00 19.45 20.49 2k2o n ALA 1039CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37