#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b0x s SER 911 N 0.00 3.37 0.00 -2.13 0.15 -1.26 -5.02 113.70 108.81 1b0x s SER 911 Ca 0.00 -0.40 0.29 0.00 0.70 0.00 0.00 55.95 56.54 1b0x s SER 911 Cb 0.00 -0.64 1.27 0.00 -1.71 0.00 0.00 66.02 64.94 1b0x s SER 911 CO 0.00 0.31 1.88 0.00 1.20 0.00 0.00 173.24 176.62 1b0x n ALA 912 N 2.55 2.74 -2.86 5.45 0.00 -1.26 -4.87 120.51 122.27 1b0x n ALA 912 Ca -0.17 -0.28 -0.29 0.00 0.00 0.00 0.00 53.44 52.71 1b0x n ALA 912 Cb 0.52 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.58 1b0x n ALA 912 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1b0x s VAL 913 N -2.39 4.94 0.93 0.00 -7.23 -1.26 -5.12 120.40 110.27 1b0x s VAL 913 Ca 0.31 -0.70 -0.14 0.00 -1.81 0.00 0.00 61.98 59.64 1b0x s VAL 913 Cb 0.20 -3.46 0.16 0.00 0.56 0.00 0.00 36.38 33.84 1b0x s VAL 913 CO 0.45 0.04 1.22 0.68 -0.31 0.00 0.00 175.10 177.18 1b0x s VAL 914 N -1.57 1.96 0.63 1.32 -7.23 -1.26 -5.03 120.40 109.22 1b0x s VAL 914 Ca 0.32 0.00 -0.14 0.00 -1.81 0.00 0.00 61.98 60.35 1b0x s VAL 914 Cb -0.12 -2.90 -0.02 0.00 0.56 0.00 0.00 36.38 33.90 1b0x s VAL 914 CO 0.25 0.00 1.06 -0.94 -0.31 0.00 0.00 175.10 175.16 1b0x s SER 915 N -4.51 5.67 0.29 4.85 1.04 -1.26 -4.52 113.70 115.25 1b0x s SER 915 Ca 0.68 1.74 -0.02 0.00 0.48 0.00 0.00 55.95 58.82 1b0x s SER 915 Cb -0.09 -2.52 0.41 0.00 0.10 0.00 0.00 66.02 63.92 1b0x s SER 915 CO 0.52 -1.25 1.91 0.58 0.98 0.00 0.00 173.24 175.99 1b0x h VAL 916 N 0.05 1.22 -0.72 5.02 2.07 -1.92 -2.17 116.25 119.81 1b0x h VAL 916 Ca -0.46 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 66.55 1b0x h VAL 916 Cb 1.22 0.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1b0x h VAL 916 CO 0.57 0.24 0.46 1.23 0.02 0.00 0.00 177.57 180.10 1b0x h GLY 917 N 1.08 1.03 0.98 2.17 0.00 -1.93 0.35 103.07 106.75 1b0x h GLY 917 Ca 0.27 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 1b0x h GLY 917 CO -0.04 0.33 0.09 -0.55 0.00 0.00 0.00 176.54 176.36 1b0x h ASP 918 N 0.93 0.77 -0.26 0.19 3.32 -1.79 -1.70 116.42 117.88 1b0x h ASP 918 Ca 0.28 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1b0x h ASP 918 Cb -0.04 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 1b0x h ASP 918 CO -0.08 0.83 0.11 -0.25 -1.72 0.00 0.00 179.24 178.12 1b0x h TRP 919 N 0.69 0.39 -0.75 4.55 7.01 -1.03 -1.99 115.95 124.82 1b0x h TRP 919 Ca 0.15 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.12 1b0x h TRP 919 Cb 0.38 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.28 1b0x h TRP 919 CO 0.03 0.40 0.45 -0.07 -2.79 0.00 0.00 178.44 176.46 1b0x h LEU 920 N 0.27 0.90 -0.79 0.65 3.38 -0.80 -2.12 115.31 116.81 1b0x h LEU 920 Ca 0.09 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1b0x h LEU 920 Cb 0.17 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1b0x h LEU 920 CO -0.01 0.70 -0.04 -0.61 0.09 0.00 0.00 178.44 178.58 1b0x h GLN 921 N 1.03 0.88 -0.13 1.13 4.15 -1.23 0.14 115.11 121.08 1b0x h GLN 921 Ca 0.27 -0.27 -0.05 0.00 0.77 0.00 0.00 58.65 59.37 1b0x h GLN 921 Cb -0.03 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 1b0x h GLN 921 CO -0.05 0.90 -0.14 0.00 -1.93 0.00 0.00 178.83 177.61 1b0x h ALA 922 N 1.15 1.54 -0.50 3.38 0.00 -0.91 -2.22 119.26 121.70 1b0x h ALA 922 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1b0x h ALA 922 Cb 0.53 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1b0x h ALA 922 CO 0.03 0.33 0.00 0.44 0.00 0.00 0.00 179.25 180.05 1b0x n ILE 923 N -4.28 2.09 -2.94 0.00 -5.35 -0.84 -4.96 119.36 103.08 1b0x n ILE 923 Ca -0.01 -1.41 -0.19 0.00 -0.27 0.00 0.00 62.75 60.87 1b0x n ILE 923 Cb 0.26 -0.03 0.00 0.00 -1.74 0.00 0.00 39.64 38.14 1b0x n ILE 923 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1b0x n LYS 924 N 0.50 -3.28 -0.39 6.28 5.02 -0.75 -4.85 118.16 120.69 1b0x n LYS 924 Ca 0.24 0.65 0.06 0.00 -2.02 0.00 0.00 58.31 57.24 1b0x n LYS 924 Cb 0.92 -5.36 0.20 0.00 -0.02 0.00 0.00 35.03 30.77 1b0x n LYS 924 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1b0x n MET 925 N -3.47 1.97 0.00 1.97 2.81 0.40 -4.72 117.12 116.08 1b0x n MET 925 Ca -0.09 -2.87 0.05 0.00 -1.81 0.00 0.00 57.70 52.98 1b0x n MET 925 Cb 0.59 -1.69 0.26 0.00 -0.71 0.00 0.00 33.22 31.68 1b0x n MET 925 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1b0x n ASP 926 N -1.03 0.00 0.10 7.83 5.75 -1.08 -1.63 116.55 126.49 1b0x n ASP 926 Ca 0.21 0.11 0.12 0.00 -0.01 0.00 0.00 54.79 55.22 1b0x n ASP 926 Cb 0.80 -0.27 0.46 0.00 -1.03 0.00 0.00 41.12 41.08 1b0x n ASP 926 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1b0x n ARG 927 N -1.27 0.17 -0.27 0.11 1.85 -1.26 -2.42 116.66 113.58 1b0x n ARG 927 Ca 0.05 0.33 0.11 0.00 -1.00 0.00 0.00 57.85 57.34 1b0x n ARG 927 Cb 0.08 -1.79 0.25 0.00 -1.05 0.00 0.00 32.46 29.95 1b0x n ARG 927 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1b0x n TYR 928 N -2.10 0.70 -0.21 2.89 4.01 -0.65 -4.68 117.16 117.12 1b0x n TYR 928 Ca 0.03 -0.39 -0.07 0.00 -0.16 0.00 0.00 57.90 57.31 1b0x n TYR 928 Cb 0.27 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.28 1b0x n TYR 928 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1b0x h LYS 929 N 3.97 -0.18 -0.04 -0.72 1.57 -1.65 0.14 116.57 119.66 1b0x h LYS 929 Ca 0.00 0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1b0x h LYS 929 Cb 0.93 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.28 1b0x h LYS 929 CO 0.00 -0.12 -0.09 -0.44 -0.57 0.00 0.00 179.45 178.22 1b0x h ASP 930 N -0.19 0.05 -0.56 0.86 3.32 -1.85 -2.53 116.42 115.51 1b0x h ASP 930 Ca 0.21 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1b0x h ASP 930 Cb 0.56 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 1b0x h ASP 930 CO -0.69 0.15 0.31 0.78 -1.72 0.00 0.00 179.24 178.06 1b0x h ASN 931 N 0.05 0.71 -0.05 6.45 2.35 -1.28 -0.33 115.58 123.48 1b0x h ASN 931 Ca 0.01 -0.09 -0.02 0.00 -0.55 0.00 0.00 56.30 55.65 1b0x h ASN 931 Cb 0.20 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 1b0x h ASN 931 CO 0.01 0.60 -0.03 -0.26 -1.65 0.00 0.00 177.43 176.10 1b0x h PHE 932 N 0.76 0.13 -0.11 1.19 -1.00 -1.17 -3.18 116.94 113.55 1b0x h PHE 932 Ca 0.20 -0.04 0.02 0.00 2.81 0.00 0.00 57.97 60.97 1b0x h PHE 932 Cb 0.05 -0.03 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 1b0x h PHE 932 CO -0.01 0.53 -0.03 1.15 -1.61 0.00 0.00 178.31 178.34 1b0x h THR 933 N -0.31 0.89 -0.14 -1.55 2.02 -1.37 0.14 112.91 112.59 1b0x h THR 933 Ca 0.01 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.23 1b0x h THR 933 Cb 0.50 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1b0x h THR 933 CO 0.01 0.00 0.12 0.00 0.37 0.00 0.00 175.52 176.02 1b0x h ALA 934 N 1.11 1.90 -0.64 6.16 0.00 -1.14 -0.84 119.26 125.80 1b0x h ALA 934 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1b0x h ALA 934 Cb 0.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1b0x h ALA 934 CO -0.12 -0.19 0.00 0.00 0.00 0.00 0.00 179.25 178.94 1b0x n ALA 935 N -2.44 2.40 -0.71 0.00 0.00 -0.92 -4.94 120.51 113.91 1b0x n ALA 935 Ca 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 53.44 52.32 1b0x n ALA 935 Cb 0.24 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.74 1b0x n ALA 935 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b0x n GLY 936 N 1.52 0.81 3.53 0.00 0.00 -0.32 -4.97 105.19 105.77 1b0x n GLY 936 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1b0x n GLY 936 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b0x s TYR 937 N -3.15 3.01 -0.89 1.61 2.02 -0.01 -4.67 117.35 115.27 1b0x s TYR 937 Ca 0.00 -1.71 0.20 0.00 -0.37 0.00 0.00 57.07 55.18 1b0x s TYR 937 Cb 0.00 -4.58 -0.22 0.00 -0.40 0.00 0.00 41.96 36.76 1b0x s TYR 937 CO 0.00 -1.67 0.82 0.25 -1.57 0.00 0.00 175.55 173.38 1b0x n THR 938 N 5.81 0.00 -4.23 -0.71 -2.24 -1.26 -3.88 114.28 107.76 1b0x n THR 938 Ca 0.42 -0.05 -0.21 0.00 -2.27 0.00 0.00 64.05 61.94 1b0x n THR 938 Cb 0.46 0.95 -0.12 0.00 -2.10 0.00 0.00 70.33 69.52 1b0x n THR 938 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1b0x s THR 939 N -2.89 1.42 0.40 4.28 -4.23 -1.26 -4.51 115.64 108.85 1b0x s THR 939 Ca 0.07 -1.48 0.37 0.00 -1.18 0.00 0.00 61.69 59.48 1b0x s THR 939 Cb 0.15 -1.36 0.40 0.00 1.34 0.00 0.00 72.50 73.03 1b0x s THR 939 CO 0.81 -0.18 2.17 -0.07 -0.54 0.00 0.00 174.62 176.82 1b0x h LEU 940 N 4.08 0.00 -0.75 4.79 3.38 -1.92 -2.12 115.31 122.77 1b0x h LEU 940 Ca -0.43 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.46 1b0x h LEU 940 Cb 1.19 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 1b0x h LEU 940 CO 0.41 0.02 0.10 -0.33 0.09 0.00 0.00 178.44 178.73 1b0x h GLU 941 N 0.00 1.06 -0.08 1.13 5.08 -1.95 -0.78 114.58 119.04 1b0x h GLU 941 Ca -0.00 -0.28 -0.24 0.00 -1.00 0.00 0.00 59.36 57.84 1b0x h GLU 941 Cb 0.26 -0.13 0.01 0.00 0.50 0.00 0.00 28.75 29.40 1b0x h GLU 941 CO 0.00 0.97 -0.90 0.00 -1.00 0.00 0.00 179.01 178.09 1b0x h ALA 942 N 1.11 0.25 -0.52 3.43 0.00 -1.82 -3.28 119.26 118.43 1b0x h ALA 942 Ca 0.20 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 1b0x h ALA 942 Cb 0.43 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1b0x h ALA 942 CO 0.01 0.69 0.27 0.28 0.00 0.00 0.00 179.25 180.51 1b0x h VAL 943 N 0.46 1.19 0.00 0.00 2.07 -1.26 -2.65 116.25 116.05 1b0x h VAL 943 Ca -0.09 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 66.94 1b0x h VAL 943 Cb 1.54 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1b0x h VAL 943 CO 0.18 0.20 0.00 0.55 0.02 0.00 0.00 177.57 178.52 1b0x n VAL 944 N -4.62 1.67 -0.74 2.57 3.14 -0.32 -1.25 118.33 118.79 1b0x n VAL 944 Ca 0.02 0.51 0.08 0.00 -2.96 0.00 0.00 64.34 61.99 1b0x n VAL 944 Cb 0.10 -1.48 0.24 0.00 -1.06 0.00 0.00 33.84 31.64 1b0x n VAL 944 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 1b0x n HIS 945 N -1.67 0.87 -2.05 1.45 8.25 -1.00 -5.01 115.22 116.06 1b0x n HIS 945 Ca 0.00 -0.75 -0.31 0.00 -0.26 0.00 0.00 57.72 56.40 1b0x n HIS 945 Cb 0.03 -0.24 -0.00 0.00 1.12 0.00 0.00 29.99 30.90 1b0x n HIS 945 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1b0x s MET 946 N -2.26 3.68 0.49 -0.41 -1.94 -0.38 -5.09 119.30 113.40 1b0x s MET 946 Ca 0.37 0.77 0.02 0.00 -1.71 0.00 0.00 55.69 55.15 1b0x s MET 946 Cb 0.28 -2.11 -0.02 0.00 2.01 0.00 0.00 34.83 34.98 1b0x s MET 946 CO 0.12 -0.47 0.01 -1.54 -0.01 0.00 0.00 175.02 173.12 1b0x s SER 947 N -3.89 4.03 0.20 3.03 1.04 -1.26 -5.00 113.70 111.85 1b0x s SER 947 Ca 0.56 -1.61 -0.10 0.00 0.48 0.00 0.00 55.95 55.27 1b0x s SER 947 Cb -0.11 0.38 0.14 0.00 0.10 0.00 0.00 66.02 66.53 1b0x s SER 947 CO 0.48 -0.79 1.84 -0.61 0.98 0.00 0.00 173.24 175.14 1b0x h GLN 948 N 1.44 1.00 -0.32 4.02 4.15 -1.98 -2.09 115.11 121.33 1b0x h GLN 948 Ca -0.44 -0.09 -0.02 0.00 0.77 0.00 0.00 58.65 58.87 1b0x h GLN 948 Cb 1.30 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 28.77 1b0x h GLN 948 CO 0.75 0.71 0.12 0.22 -1.93 0.00 0.00 178.83 178.70 1b0x h ASP 949 N 1.01 0.41 -0.54 -0.69 3.58 -1.99 -1.56 116.42 116.63 1b0x h ASP 949 Ca 0.26 -0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.59 1b0x h ASP 949 Cb -0.03 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 40.90 1b0x h ASP 949 CO -0.05 0.38 0.02 0.44 -2.88 0.00 0.00 179.24 177.15 1b0x h ASP 950 N 0.45 0.93 -0.62 2.28 3.32 -1.78 -1.22 116.42 119.78 1b0x h ASP 950 Ca 0.11 -0.30 -0.09 0.00 0.02 0.00 0.00 57.03 56.77 1b0x h ASP 950 Cb 0.11 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 1b0x h ASP 950 CO -0.01 1.00 0.04 -0.07 -1.72 0.00 0.00 179.24 178.48 1b0x h LEU 951 N 0.83 1.04 -0.29 1.55 3.38 -1.00 -1.77 115.31 119.06 1b0x h LEU 951 Ca 0.16 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 1b0x h LEU 951 Cb 0.51 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1b0x h LEU 951 CO 0.02 1.08 0.05 0.00 0.09 0.00 0.00 178.44 179.68 1b0x h ALA 952 N 1.01 0.38 0.00 1.53 0.00 -1.18 -0.13 119.26 120.87 1b0x h ALA 952 Ca 0.18 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1b0x h ALA 952 Cb 0.52 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1b0x h ALA 952 CO 0.02 0.07 -0.01 -0.09 0.00 0.00 0.00 179.25 179.25 1b0x h ARG 953 N 0.30 0.00 0.00 0.00 2.43 -1.05 -1.01 114.38 115.06 1b0x h ARG 953 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1b0x h ARG 953 Cb 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1b0x h ARG 953 CO 0.01 0.01 -0.17 -0.89 -1.51 0.00 0.00 179.97 177.41 1b0x n ILE 954 N -4.16 0.47 0.00 1.20 -0.00 -0.68 -4.92 119.36 111.26 1b0x n ILE 954 Ca -0.03 -0.25 0.00 0.00 -0.00 0.00 0.00 62.75 62.47 1b0x n ILE 954 Cb 0.09 -0.44 0.00 0.00 -0.00 0.00 0.00 39.64 39.30 1b0x n ILE 954 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1b0x n GLY 955 N 1.34 0.84 3.38 7.39 0.00 -0.38 -4.78 105.19 112.97 1b0x n GLY 955 Ca 0.05 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.62 1b0x n GLY 955 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b0x s ILE 956 N -2.00 5.35 -0.15 -0.61 1.01 -0.10 -4.80 121.20 119.90 1b0x s ILE 956 Ca 0.00 -2.34 0.20 0.00 0.00 0.00 0.00 60.65 58.51 1b0x s ILE 956 Cb 0.00 -4.62 -0.14 0.00 0.01 0.00 0.00 42.46 37.71 1b0x s ILE 956 CO 0.00 -1.24 0.77 0.35 0.00 0.00 0.00 174.94 174.82 1b0x n THR 957 N 4.32 0.69 -1.95 2.92 -2.24 -1.26 -3.49 114.28 113.27 1b0x n THR 957 Ca 0.20 -0.60 -0.43 0.00 -2.27 0.00 0.00 64.05 60.95 1b0x n THR 957 Cb 0.46 -0.38 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 1b0x n THR 957 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b0x s ALA 958 N -3.21 3.10 0.36 6.98 0.00 -1.26 -4.87 121.76 122.87 1b0x s ALA 958 Ca -0.04 0.56 0.10 0.00 0.00 0.00 0.00 51.96 52.58 1b0x s ALA 958 Cb 0.10 -3.93 0.85 0.00 0.00 0.00 0.00 23.12 20.14 1b0x s ALA 958 CO 0.83 -2.23 1.87 0.82 0.00 0.00 0.00 175.76 177.04 1b0x h ILE 959 N 6.44 0.82 -0.63 0.00 2.04 -1.99 -0.76 117.51 123.43 1b0x h ILE 959 Ca -0.37 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1b0x h ILE 959 Cb 1.18 0.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1b0x h ILE 959 CO 1.00 0.12 0.40 0.74 0.00 0.00 0.00 178.15 180.40 1b0x h THR 960 N 0.65 1.18 -0.18 -0.27 2.02 -1.99 -0.21 112.91 114.11 1b0x h THR 960 Ca 0.44 -0.36 -0.14 0.00 0.77 0.00 0.00 66.41 67.12 1b0x h THR 960 Cb 0.75 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1b0x h THR 960 CO -0.20 0.18 -0.48 0.45 0.37 0.00 0.00 175.52 175.84 1b0x h HIS 961 N 0.86 0.56 -0.46 3.16 3.86 -1.59 -1.51 115.15 120.03 1b0x h HIS 961 Ca 0.23 -0.18 -0.01 0.00 -1.16 0.00 0.00 60.37 59.25 1b0x h HIS 961 Cb -0.06 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 1b0x h HIS 961 CO -0.02 0.85 0.26 1.96 0.86 0.00 0.00 177.93 181.84 1b0x h GLN 962 N 0.37 0.64 -0.32 2.45 4.20 -0.67 -1.92 115.11 119.86 1b0x h GLN 962 Ca 0.02 -0.07 -0.12 0.00 0.06 0.00 0.00 58.65 58.54 1b0x h GLN 962 Cb 0.98 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 1b0x h GLN 962 CO 0.09 0.50 -0.29 -0.91 -0.67 0.00 0.00 178.83 177.55 1b0x h ASN 963 N 0.61 0.69 -0.50 1.46 2.35 -0.86 0.64 115.58 119.98 1b0x h ASN 963 Ca 0.16 -0.27 -0.03 0.00 -0.55 0.00 0.00 56.30 55.61 1b0x h ASN 963 Cb 0.04 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1b0x h ASN 963 CO -0.03 0.94 0.18 0.50 -1.65 0.00 0.00 177.43 177.38 1b0x h LYS 964 N 0.58 0.76 -0.13 0.81 3.64 -1.05 0.66 116.57 121.83 1b0x h LYS 964 Ca 0.07 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1b0x h LYS 964 Cb 0.78 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.48 1b0x h LYS 964 CO 0.06 0.69 -0.04 0.82 -2.27 0.00 0.00 179.45 178.72 1b0x h ILE 965 N 0.67 1.29 -0.79 2.00 2.04 -1.16 -2.01 117.51 119.56 1b0x h ILE 965 Ca 0.16 -0.99 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1b0x h ILE 965 Cb 0.23 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.95 1b0x h ILE 965 CO -0.01 0.29 0.36 -0.07 0.00 0.00 0.00 178.15 178.72 1b0x h LEU 966 N -0.05 1.04 -0.75 1.44 3.38 -0.75 -0.47 115.31 119.15 1b0x h LEU 966 Ca 0.03 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1b0x h LEU 966 Cb 0.46 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1b0x h LEU 966 CO 0.01 0.89 0.17 0.28 0.09 0.00 0.00 178.44 179.89 1b0x h SER 967 N 1.13 1.05 -0.46 -0.43 0.02 -0.83 -1.36 113.55 112.68 1b0x h SER 967 Ca 0.27 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.95 1b0x h SER 967 Cb 0.14 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.39 1b0x h SER 967 CO -0.03 1.01 0.11 -1.28 -1.14 0.00 0.00 176.83 175.49 1b0x h SER 968 N 1.06 0.70 -0.51 3.07 0.87 -0.84 -1.91 113.55 115.99 1b0x h SER 968 Ca 0.22 -0.24 0.04 0.00 -1.23 0.00 0.00 61.79 60.59 1b0x h SER 968 Cb 0.37 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 62.10 1b0x h SER 968 CO 0.00 0.75 0.26 0.58 -0.53 0.00 0.00 176.83 177.89 1b0x h VAL 969 N 0.61 0.96 -0.72 2.23 2.07 -0.76 0.36 116.25 121.00 1b0x h VAL 969 Ca 0.14 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 67.52 1b0x h VAL 969 Cb 0.33 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1b0x h VAL 969 CO 0.00 0.09 0.45 1.56 0.02 0.00 0.00 177.57 179.70 1b0x h GLN 970 N 0.51 0.84 -0.45 1.57 4.20 -0.90 -0.69 115.11 120.20 1b0x h GLN 970 Ca 0.22 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.76 1b0x h GLN 970 Cb 0.13 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1b0x h GLN 970 CO -0.15 0.56 -0.19 0.00 -0.67 0.00 0.00 178.83 178.37 1b0x h ALA 971 N 1.32 0.82 -0.22 3.87 0.00 -0.65 -2.15 119.26 122.24 1b0x h ALA 971 Ca 0.30 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 1b0x h ALA 971 Cb 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1b0x h ALA 971 CO -0.12 0.65 -0.38 0.52 0.00 0.00 0.00 179.25 179.91 1b0x h MET 972 N 0.77 0.51 -0.18 0.00 2.86 -0.44 -1.07 114.93 117.38 1b0x h MET 972 Ca 0.11 -0.25 -0.03 0.00 -2.06 0.00 0.00 59.70 57.47 1b0x h MET 972 Cb 0.73 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 1b0x h MET 972 CO 0.06 0.81 0.00 0.00 1.06 0.00 0.00 176.91 178.84 1b0x h ARG 973 N 0.42 0.31 -0.58 1.72 3.08 -1.00 -1.10 114.38 117.24 1b0x h ARG 973 Ca 0.04 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 1b0x h ARG 973 Cb 0.86 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.85 1b0x h ARG 973 CO 0.07 0.52 0.31 1.15 -1.07 0.00 0.00 179.97 180.96 1b0x h THR 974 N 0.07 1.18 -0.35 2.04 2.02 -1.29 -1.60 112.91 114.97 1b0x h THR 974 Ca 0.05 -0.46 -0.10 0.00 0.77 0.00 0.00 66.41 66.67 1b0x h THR 974 Cb 0.38 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1b0x h THR 974 CO 0.01 0.20 -0.21 -0.61 0.37 0.00 0.00 175.52 175.28 1b0x h GLN 975 N 0.80 0.67 0.00 6.66 4.15 -0.97 -2.80 115.11 123.62 1b0x h GLN 975 Ca 0.21 -0.25 -0.05 0.00 0.77 0.00 0.00 58.65 59.32 1b0x h GLN 975 Cb 0.03 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.68 1b0x h GLN 975 CO -0.03 0.83 -0.23 0.52 -1.93 0.00 0.00 178.83 177.99 1b0x h MET 976 N 0.59 0.00 -0.19 1.69 2.86 -0.34 -2.91 114.93 116.64 1b0x h MET 976 Ca 0.09 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.61 1b0x h MET 976 Cb 0.68 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 1b0x h MET 976 CO 0.05 0.23 -0.40 1.96 1.06 0.00 0.00 176.91 179.80 1b0x h GLN 977 N 0.00 0.43 0.00 1.72 4.20 -1.05 -2.47 115.11 117.93 1b0x h GLN 977 Ca -0.00 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.50 1b0x h GLN 977 Cb 0.89 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1b0x h GLN 977 CO 0.03 0.76 0.00 1.04 -0.67 0.00 0.00 178.83 179.99 1b0x n GLN 978 N -4.03 0.30 -0.09 1.46 6.02 -1.10 -2.92 117.38 117.01 1b0x n GLN 978 Ca -0.02 0.06 0.03 0.00 -0.01 0.00 0.00 57.00 57.07 1b0x n GLN 978 Cb 0.50 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.35 1b0x n GLN 978 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 177.06 175.93 1b0x n MET 979 N -1.32 1.43 -2.71 -1.09 1.56 -0.93 -4.25 117.12 109.81 1b0x n MET 979 Ca 0.11 -0.67 -0.07 0.00 -0.27 0.00 0.00 57.70 56.79 1b0x n MET 979 Cb 0.21 -1.15 0.09 0.00 2.15 0.00 0.00 33.22 34.51 1b0x n MET 979 CO 0.00 0.00 0.00 -2.39 -0.73 0.00 0.00 175.97 172.85 1b0x n HIS 980 N 0.04 -2.19 1.53 1.12 1.44 -1.15 -5.11 115.22 110.91 1b0x n HIS 980 Ca 0.06 -1.60 0.14 0.00 -2.01 0.00 0.00 57.72 54.32 1b0x n HIS 980 Cb 0.16 1.47 0.55 0.00 0.12 0.00 0.00 29.99 32.29 1b0x n HIS 980 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94