#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8b s GLN 2 N 0.00 3.10 0.32 3.17 0.74 -1.26 -1.11 119.66 124.61 2k8b s GLN 2 Ca 0.00 -0.84 0.09 0.00 0.05 0.00 0.00 55.36 54.67 2k8b s GLN 2 Cb 0.00 -2.40 -0.05 0.00 1.10 0.00 0.00 33.01 31.66 2k8b s GLN 2 CO 0.00 0.13 0.01 0.96 -0.55 0.00 0.00 175.29 175.84 2k8b s ILE 3 N 0.49 2.89 -0.42 -2.34 -0.00 0.10 -3.93 121.20 117.99 2k8b s ILE 3 Ca -0.14 -1.95 -0.11 0.00 -0.00 0.00 0.00 60.65 58.45 2k8b s ILE 3 Cb -0.17 -2.80 0.06 0.00 -0.00 0.00 0.00 42.46 39.56 2k8b s ILE 3 CO 0.05 -0.26 0.27 -0.36 -0.00 0.00 0.00 174.94 174.65 2k8b s PHE 4 N -2.45 3.30 -0.36 1.37 0.08 -1.09 -2.32 117.98 116.50 2k8b s PHE 4 Ca 0.34 -1.27 -0.18 0.00 0.12 0.00 0.00 56.93 55.94 2k8b s PHE 4 Cb -0.02 -2.86 -0.00 0.00 -0.57 0.00 0.00 43.02 39.56 2k8b s PHE 4 CO 0.20 -0.79 0.51 0.54 -0.10 0.00 0.00 175.22 175.57 2k8b s VAL 5 N 1.50 5.02 -0.33 -0.44 0.11 -0.82 -1.34 120.40 124.10 2k8b s VAL 5 Ca 0.03 0.26 -0.17 0.00 -2.93 0.00 0.00 61.98 59.17 2k8b s VAL 5 Cb -0.22 -3.98 -0.01 0.00 -1.53 0.00 0.00 36.38 30.64 2k8b s VAL 5 CO 0.04 -0.25 0.46 -0.75 -3.33 0.00 0.00 175.10 171.28 2k8b s LYS 6 N 2.38 3.68 0.68 1.54 2.20 0.87 -1.11 119.74 129.98 2k8b s LYS 6 Ca 0.18 -0.17 -0.12 0.00 -0.36 0.00 0.00 55.97 55.51 2k8b s LYS 6 Cb -0.16 -3.78 0.00 0.00 -1.51 0.00 0.00 37.83 32.39 2k8b s LYS 6 CO 0.14 -0.56 1.06 0.99 -0.36 0.00 0.00 175.35 176.62 2k8b s THR 7 N 2.26 3.93 0.28 3.43 2.01 0.18 -0.13 115.64 127.61 2k8b s THR 7 Ca 0.17 0.68 0.01 0.00 0.31 0.00 0.00 61.69 62.85 2k8b s THR 7 Cb -0.16 -3.36 0.28 0.00 0.01 0.00 0.00 72.50 69.28 2k8b s THR 7 CO 0.12 -0.77 1.67 0.25 -0.69 0.00 0.00 174.62 175.21 2k8b h LEU 8 N -0.53 0.11 0.00 4.42 5.85 -1.56 0.27 115.31 123.87 2k8b h LEU 8 Ca -0.44 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.45 2k8b h LEU 8 Cb 1.21 0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.45 2k8b h LEU 8 CO 0.56 -0.07 0.00 1.07 -0.34 0.00 0.00 178.44 179.66 2k8b n THR 9 N -5.15 0.55 0.00 1.05 5.66 -1.26 -4.84 114.28 110.29 2k8b n THR 9 Ca 0.20 0.14 0.00 0.00 -3.05 0.00 0.00 64.05 61.33 2k8b n THR 9 Cb 0.61 -0.83 0.00 0.00 -1.55 0.00 0.00 70.33 68.56 2k8b n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k8b n GLY 10 N 0.33 0.50 3.73 1.09 0.00 0.96 -5.06 105.19 106.74 2k8b n GLY 10 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2k8b n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k8b s LYS 11 N -0.68 4.13 -0.23 1.61 2.20 -1.25 -4.65 119.74 120.88 2k8b s LYS 11 Ca 0.00 2.57 -0.05 0.00 -0.36 0.00 0.00 55.97 58.13 2k8b s LYS 11 Cb 0.00 -3.07 -0.02 0.00 -1.51 0.00 0.00 37.83 33.23 2k8b s LYS 11 CO 0.00 -0.70 0.01 0.99 -0.36 0.00 0.00 175.35 175.29 2k8b s THR 12 N 0.84 3.83 0.03 3.43 2.01 -1.26 0.52 115.64 125.05 2k8b s THR 12 Ca 0.71 -0.34 0.05 0.00 0.31 0.00 0.00 61.69 62.42 2k8b s THR 12 Cb -0.49 -2.76 -0.04 0.00 0.01 0.00 0.00 72.50 69.23 2k8b s THR 12 CO 0.36 0.39 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.97 2k8b s ILE 13 N 1.48 3.52 -0.39 1.82 1.01 -0.27 -4.98 121.20 123.40 2k8b s ILE 13 Ca 0.06 -0.93 -0.16 0.00 0.00 0.00 0.00 60.65 59.61 2k8b s ILE 13 Cb -0.15 -2.56 0.01 0.00 0.01 0.00 0.00 42.46 39.77 2k8b s ILE 13 CO 0.00 0.31 0.38 0.42 0.00 0.00 0.00 174.94 176.06 2k8b s THR 14 N -1.05 5.15 -0.20 2.92 -4.23 -1.26 -1.94 115.64 115.02 2k8b s THR 14 Ca 0.18 -0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 60.44 2k8b s THR 14 Cb -0.11 -3.93 -0.01 0.00 1.34 0.00 0.00 72.50 69.79 2k8b s THR 14 CO 0.09 -0.26 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.07 2k8b s LEU 15 N 2.02 2.77 -0.14 4.79 2.01 -0.98 -5.00 118.68 124.15 2k8b s LEU 15 Ca 0.11 -0.41 0.01 0.00 0.01 0.00 0.00 54.13 53.84 2k8b s LEU 15 Cb -0.17 -1.69 -0.01 0.00 0.01 0.00 0.00 46.19 44.34 2k8b s LEU 15 CO 0.12 0.01 -0.16 -1.83 1.01 0.00 0.00 176.35 175.50 2k8b s GLU 16 N 1.29 3.25 0.21 1.70 1.03 -1.26 -0.72 118.70 124.19 2k8b s GLU 16 Ca 0.03 -0.75 -0.09 0.00 0.03 0.00 0.00 54.97 54.20 2k8b s GLU 16 Cb -0.14 -2.57 -0.02 0.00 -0.80 0.00 0.00 34.13 30.60 2k8b s GLU 16 CO -0.03 0.12 0.33 0.14 -1.33 0.00 0.00 175.26 174.49 2k8b s VAL 17 N 0.56 0.02 0.54 1.83 -7.23 -0.27 -4.99 120.40 110.86 2k8b s VAL 17 Ca -0.10 -1.57 -0.17 0.00 -1.81 0.00 0.00 61.98 58.33 2k8b s VAL 17 Cb -0.16 -2.20 -0.06 0.00 0.56 0.00 0.00 36.38 34.52 2k8b s VAL 17 CO 0.04 -0.07 1.04 -1.61 -0.31 0.00 0.00 175.10 174.18 2k8b s GLU 18 N -4.05 3.59 0.55 4.82 0.41 -1.26 0.63 118.70 123.39 2k8b s GLU 18 Ca 0.26 1.21 0.27 0.00 -0.41 0.00 0.00 54.97 56.30 2k8b s GLU 18 Cb 0.02 -2.07 1.60 0.00 -1.78 0.00 0.00 34.13 31.90 2k8b s GLU 18 CO 0.08 -0.59 2.16 -1.00 -0.49 0.00 0.00 175.26 175.42 2k8b h PRO 19 N 0.90 0.00 -0.69 0.39 0.13 -2.02 -0.80 132.00 129.91 2k8b h PRO 19 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2k8b h PRO 19 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k8b h PRO 19 CO 0.59 0.06 0.00 0.43 -0.23 0.00 0.00 178.00 178.85 2k8b n SER 20 N -3.82 3.86 -4.73 1.44 7.64 -1.26 -3.64 113.62 113.10 2k8b n SER 20 Ca -0.02 -2.00 -0.41 0.00 1.01 0.00 0.00 58.87 57.44 2k8b n SER 20 Cb 0.16 -0.46 -0.04 0.00 -1.01 0.00 0.00 64.21 62.86 2k8b n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2k8b s ASP 21 N -1.07 7.17 0.45 6.43 1.01 -0.31 -4.97 116.67 125.38 2k8b s ASP 21 Ca 0.48 2.14 -0.22 0.00 0.71 0.00 0.00 52.55 55.65 2k8b s ASP 21 Cb 0.25 -2.60 -0.08 0.00 1.01 0.00 0.00 42.92 41.50 2k8b s ASP 21 CO 0.33 -0.31 1.07 0.42 0.21 0.00 0.00 175.17 176.89 2k8b s THR 22 N -0.01 3.61 0.38 -1.27 -4.23 -1.26 -3.84 115.64 109.02 2k8b s THR 22 Ca 0.52 1.13 0.10 0.00 -1.18 0.00 0.00 61.69 62.26 2k8b s THR 22 Cb -0.31 -3.53 0.33 0.00 1.34 0.00 0.00 72.50 70.33 2k8b s THR 22 CO 0.35 -0.09 1.91 0.40 -0.54 0.00 0.00 174.62 176.65 2k8b h ILE 23 N 1.85 0.87 -0.17 2.99 1.08 -1.39 0.10 117.51 122.84 2k8b h ILE 23 Ca -0.49 -0.21 -0.05 0.00 -0.39 0.00 0.00 64.86 63.72 2k8b h ILE 23 Cb 1.23 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 2k8b h ILE 23 CO 0.60 0.11 -0.12 1.05 -0.69 0.00 0.00 178.15 179.11 2k8b h GLU 24 N 0.61 0.27 -0.02 2.37 -0.00 -1.82 -1.12 114.58 114.87 2k8b h GLU 24 Ca 0.38 -0.06 -0.23 0.00 -0.00 0.00 0.00 59.36 59.46 2k8b h GLU 24 Cb 0.64 -0.04 0.00 0.00 -0.00 0.00 0.00 28.75 29.36 2k8b h GLU 24 CO -0.15 0.40 -0.92 -0.97 -0.00 0.00 0.00 179.01 177.37 2k8b h ASN 25 N 0.26 0.60 -0.54 3.06 -1.24 -1.34 -1.89 115.58 114.48 2k8b h ASN 25 Ca 0.05 -0.46 -0.01 0.00 0.71 0.00 0.00 56.30 56.59 2k8b h ASN 25 Cb 0.37 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 39.22 2k8b h ASN 25 CO 0.02 1.26 0.31 0.58 -1.29 0.00 0.00 177.43 178.30 2k8b h VAL 26 N 0.27 1.18 -0.07 2.57 2.07 -0.90 -1.05 116.25 120.32 2k8b h VAL 26 Ca -0.08 -0.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 2k8b h VAL 26 Cb 1.55 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 2k8b h VAL 26 CO 0.16 0.19 -0.31 0.11 0.02 0.00 0.00 177.57 177.74 2k8b h LYS 27 N 0.73 0.13 -0.04 1.57 1.57 -1.19 -2.55 116.57 116.79 2k8b h LYS 27 Ca 0.19 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 2k8b h LYS 27 Cb 0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 2k8b h LYS 27 CO -0.03 0.43 -0.54 0.00 -0.57 0.00 0.00 179.45 178.73 2k8b h ALA 28 N 1.57 1.01 -0.06 3.86 0.00 -0.52 -2.84 119.26 122.29 2k8b h ALA 28 Ca 0.02 -0.50 -0.12 0.00 0.00 0.00 0.00 54.91 54.31 2k8b h ALA 28 Cb 0.61 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2k8b h ALA 28 CO 0.04 0.69 -0.50 -0.22 0.00 0.00 0.00 179.25 179.26 2k8b h LYS 29 N 0.10 0.15 0.00 0.00 3.64 -0.80 -2.45 116.57 117.21 2k8b h LYS 29 Ca -0.00 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 2k8b h LYS 29 Cb 0.99 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.81 2k8b h LYS 29 CO 0.08 0.61 -0.31 0.82 -2.27 0.00 0.00 179.45 178.38 2k8b h ILE 30 N 0.12 0.93 0.00 2.00 2.04 -1.35 -1.11 117.51 120.15 2k8b h ILE 30 Ca 0.00 -1.21 -0.06 0.00 1.00 0.00 0.00 64.86 64.59 2k8b h ILE 30 Cb 0.92 1.71 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 2k8b h ILE 30 CO 0.07 0.31 -0.30 -0.61 0.00 0.00 0.00 178.15 177.62 2k8b h GLN 31 N 0.00 0.00 0.10 2.37 4.15 -1.28 0.40 115.11 120.84 2k8b h GLN 31 Ca -0.00 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 59.07 2k8b h GLN 31 Cb 0.69 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.35 2k8b h GLN 31 CO 0.04 0.30 -1.90 0.22 -1.93 0.00 0.00 178.83 175.56 2k8b h ASP 32 N 0.00 0.33 0.39 -0.69 3.58 -1.38 -2.64 116.42 116.01 2k8b h ASP 32 Ca -0.00 -0.72 -0.02 0.00 0.42 0.00 0.00 57.03 56.71 2k8b h ASP 32 Cb 0.55 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.50 2k8b h ASP 32 CO 0.04 1.64 -0.19 0.11 -2.88 0.00 0.00 179.24 177.96 2k8b h LYS 33 N 0.06 -0.51 0.01 0.28 1.57 -1.09 -3.40 116.57 113.49 2k8b h LYS 33 Ca -0.38 0.03 -0.39 0.00 -1.87 0.00 0.00 60.65 58.05 2k8b h LYS 33 Cb 2.03 0.12 -0.07 0.00 0.08 0.00 0.00 32.23 34.39 2k8b h LYS 33 CO 0.09 -0.23 -2.45 0.39 -0.57 0.00 0.00 179.45 176.69 2k8b n GLU 34 N -5.14 0.66 0.00 3.15 -0.58 0.05 -5.03 120.64 113.74 2k8b n GLU 34 Ca -0.08 0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 2k8b n GLU 34 Cb 0.27 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 2k8b n GLU 34 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2k8b n GLY 35 N 2.23 1.24 3.32 0.62 0.00 -0.73 -5.02 105.19 106.86 2k8b n GLY 35 Ca -0.45 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.23 2k8b n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k8b s ILE 36 N -2.00 3.30 0.37 -0.61 1.01 -1.24 -4.95 121.20 117.08 2k8b s ILE 36 Ca 0.00 -0.53 -0.28 0.00 0.00 0.00 0.00 60.65 59.84 2k8b s ILE 36 Cb 0.00 -2.48 -0.11 0.00 0.01 0.00 0.00 42.46 39.88 2k8b s ILE 36 CO 0.00 0.45 1.42 -0.81 0.00 0.00 0.00 174.94 176.00 2k8b n PRO 37 N 4.53 2.49 0.28 2.79 -0.04 -1.26 -3.41 135.00 140.38 2k8b n PRO 37 Ca -0.18 0.87 0.15 0.00 -0.04 0.00 0.00 63.50 64.30 2k8b n PRO 37 Cb 0.51 -2.56 0.83 0.00 -0.04 0.00 0.00 33.50 32.24 2k8b n PRO 37 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2k8b h PRO 38 N 2.80 0.00 0.00 0.54 0.13 -1.95 -1.42 132.00 132.10 2k8b h PRO 38 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2k8b h PRO 38 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2k8b h PRO 38 CO 0.63 0.06 0.00 -0.44 -0.23 0.00 0.00 178.00 178.03 2k8b h ASP 39 N 0.00 0.00 -0.15 1.44 5.19 -1.95 -2.50 116.42 118.46 2k8b h ASP 39 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2k8b h ASP 39 Cb 0.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.71 2k8b h ASP 39 CO 0.01 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.13 2k8b n GLN 40 N -3.07 2.35 -2.65 3.56 6.02 -0.56 -4.91 117.38 118.12 2k8b n GLN 40 Ca -0.00 -1.61 -0.42 0.00 -0.01 0.00 0.00 57.00 54.96 2k8b n GLN 40 Cb 0.24 -1.13 -0.02 0.00 1.02 0.00 0.00 30.24 30.35 2k8b n GLN 40 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2k8b s GLN 41 N -0.90 3.74 -0.93 -1.09 2.00 -0.94 -3.26 119.66 118.28 2k8b s GLN 41 Ca 0.11 -1.57 -0.18 0.00 -2.00 0.00 0.00 55.36 51.72 2k8b s GLN 41 Cb 0.06 -5.32 0.14 0.00 0.80 0.00 0.00 33.01 28.69 2k8b s GLN 41 CO 0.08 -2.12 1.11 0.50 -0.50 0.00 0.00 175.29 174.36 2k8b s ARG 42 N 4.15 3.62 -0.28 1.67 3.52 -0.92 -5.00 118.95 125.72 2k8b s ARG 42 Ca 0.46 -1.85 -0.20 0.00 -0.13 0.00 0.00 55.73 54.00 2k8b s ARG 42 Cb 0.00 -4.88 -0.01 0.00 -1.56 0.00 0.00 34.95 28.50 2k8b s ARG 42 CO -0.04 -1.73 0.63 -0.51 -0.81 0.00 0.00 175.30 172.84 2k8b s LEU 43 N 2.43 4.10 -0.24 -0.88 1.43 -1.26 -1.39 118.68 122.87 2k8b s LEU 43 Ca 0.32 0.56 -0.08 0.00 -1.03 0.00 0.00 54.13 53.90 2k8b s LEU 43 Cb -0.05 -2.83 -0.03 0.00 0.03 0.00 0.00 46.19 43.30 2k8b s LEU 43 CO -0.09 -0.43 0.08 -0.63 0.23 0.00 0.00 176.35 175.51 2k8b s ILE 44 N 2.56 4.52 -0.34 -0.59 1.01 0.70 -1.41 121.20 127.65 2k8b s ILE 44 Ca 0.26 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.81 2k8b s ILE 44 Cb -0.15 -3.10 0.09 0.00 0.01 0.00 0.00 42.46 39.31 2k8b s ILE 44 CO 0.10 0.36 0.06 0.12 0.00 0.00 0.00 174.94 175.58 2k8b s PHE 45 N 1.36 3.59 -1.52 3.97 5.36 0.16 -1.80 117.98 129.10 2k8b s PHE 45 Ca 0.05 -2.61 -0.02 0.00 -0.96 0.00 0.00 56.93 53.39 2k8b s PHE 45 Cb -0.15 -2.77 0.01 0.00 -0.34 0.00 0.00 43.02 39.77 2k8b s PHE 45 CO 0.04 -0.93 0.18 0.00 -1.46 0.00 0.00 175.22 173.05 2k8b n ALA 46 N 4.41 -0.77 -0.03 11.12 0.00 -1.26 -0.70 120.51 133.28 2k8b n ALA 46 Ca -0.02 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2k8b n ALA 46 Cb 0.42 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.40 2k8b n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8b n GLY 47 N -1.10 0.76 3.72 0.00 0.00 -1.26 -5.05 105.19 102.26 2k8b n GLY 47 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 2k8b n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8b s LYS 48 N -0.74 3.66 0.21 1.61 3.01 0.12 -5.08 119.74 122.54 2k8b s LYS 48 Ca 0.00 -0.29 -0.30 0.00 -1.01 0.00 0.00 55.97 54.37 2k8b s LYS 48 Cb 0.00 -3.15 -0.08 0.00 -1.01 0.00 0.00 37.83 33.59 2k8b s LYS 48 CO 0.00 0.50 0.95 1.14 0.51 0.00 0.00 175.35 178.45 2k8b s GLN 49 N -0.25 4.82 -0.61 1.68 0.00 -1.26 0.39 119.66 124.42 2k8b s GLN 49 Ca 0.09 1.49 -0.25 0.00 -0.00 0.00 0.00 55.36 56.69 2k8b s GLN 49 Cb -0.12 -3.30 0.05 0.00 0.00 0.00 0.00 33.01 29.64 2k8b s GLN 49 CO 0.01 0.44 1.03 -0.51 0.00 0.00 0.00 175.29 176.26 2k8b s LEU 50 N -0.93 3.96 0.48 2.60 1.43 -0.50 -4.92 118.68 120.80 2k8b s LEU 50 Ca 0.42 -0.48 -0.21 0.00 -1.03 0.00 0.00 54.13 52.84 2k8b s LEU 50 Cb -0.26 -2.72 -0.08 0.00 0.03 0.00 0.00 46.19 43.16 2k8b s LEU 50 CO 0.32 -1.40 1.07 -1.61 0.23 0.00 0.00 176.35 174.95 2k8b s GLU 51 N 4.36 3.77 0.36 1.70 2.02 -1.26 -4.77 118.70 124.88 2k8b s GLU 51 Ca 0.30 1.47 0.07 0.00 0.02 0.00 0.00 54.97 56.83 2k8b s GLU 51 Cb -0.12 -2.18 0.68 0.00 0.10 0.00 0.00 34.13 32.60 2k8b s GLU 51 CO 0.17 -0.47 1.89 0.38 0.02 0.00 0.00 175.26 177.25 2k8b h ASP 52 N 1.70 0.36 -0.31 -0.19 2.03 -1.95 -2.91 116.42 115.16 2k8b h ASP 52 Ca -0.49 -0.07 -0.20 0.00 -0.73 0.00 0.00 57.03 55.53 2k8b h ASP 52 Cb 1.23 -0.10 -0.09 0.00 -0.83 0.00 0.00 39.33 39.54 2k8b h ASP 52 CO 0.59 0.48 0.26 0.61 -1.03 0.00 0.00 179.24 180.15 2k8b n GLY 53 N -0.86 3.39 3.36 7.15 0.00 -1.26 -3.54 105.19 113.44 2k8b n GLY 53 Ca 0.00 -0.64 -0.20 0.00 0.00 0.00 0.00 46.02 45.18 2k8b n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8b s ARG 54 N -1.14 1.70 0.14 1.61 1.81 -1.10 -5.05 118.95 116.92 2k8b s ARG 54 Ca 0.19 -1.99 0.01 0.00 -1.72 0.00 0.00 55.73 52.22 2k8b s ARG 54 Cb 0.15 -0.12 -0.04 0.00 -0.45 0.00 0.00 34.95 34.49 2k8b s ARG 54 CO 0.00 -0.50 -0.00 0.95 -0.68 0.00 0.00 175.30 175.08 2k8b s THR 55 N -3.49 0.51 0.11 0.02 -4.23 -1.26 -1.52 115.64 105.78 2k8b s THR 55 Ca 0.34 -1.94 -0.21 0.00 -1.18 0.00 0.00 61.69 58.70 2k8b s THR 55 Cb 0.04 -1.97 -0.10 0.00 1.34 0.00 0.00 72.50 71.80 2k8b s THR 55 CO 0.19 -0.59 1.76 -0.07 -0.54 0.00 0.00 174.62 175.37 2k8b h LEU 56 N 2.82 0.13 -1.53 4.79 3.38 -1.74 -1.84 115.31 121.32 2k8b h LEU 56 Ca -0.36 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.56 2k8b h LEU 56 Cb 1.19 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2k8b h LEU 56 CO 0.62 0.10 -0.24 0.28 0.09 0.00 0.00 178.44 179.29 2k8b h SER 57 N 0.16 0.00 -0.37 -0.43 0.02 -1.89 -2.13 113.55 108.91 2k8b h SER 57 Ca 0.04 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 2k8b h SER 57 Cb -0.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 2k8b h SER 57 CO -0.01 0.24 -0.15 -0.78 -1.14 0.00 0.00 176.83 174.99 2k8b h ASP 58 N 0.00 0.76 0.58 3.07 3.58 -1.74 -2.36 116.42 120.31 2k8b h ASP 58 Ca -0.00 -0.39 0.00 0.00 0.42 0.00 0.00 57.03 57.05 2k8b h ASP 58 Cb 0.51 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.35 2k8b h ASP 58 CO 0.03 0.99 0.00 -1.22 -2.88 0.00 0.00 179.24 176.16 2k8b n TYR 59 N -4.32 0.00 -3.43 0.28 4.01 -0.75 -4.89 117.16 108.06 2k8b n TYR 59 Ca -0.02 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.52 2k8b n TYR 59 Cb 0.39 -0.32 0.07 0.00 -0.31 0.00 0.00 39.34 39.17 2k8b n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2k8b n ASN 60 N -1.32 -5.44 -4.68 7.72 2.85 -0.89 -4.94 115.26 108.56 2k8b n ASN 60 Ca 0.12 -0.47 -0.42 0.00 -0.11 0.00 0.00 54.58 53.69 2k8b n ASN 60 Cb 0.23 -4.43 -0.03 0.00 1.24 0.00 0.00 39.78 36.80 2k8b n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2k8b s ILE 61 N -3.28 3.97 0.66 -1.44 1.01 -0.85 -5.02 121.20 116.25 2k8b s ILE 61 Ca 0.46 1.29 -0.10 0.00 0.00 0.00 0.00 60.65 62.30 2k8b s ILE 61 Cb -0.20 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.44 2k8b s ILE 61 CO 0.63 -0.03 1.03 -1.58 0.00 0.00 0.00 174.94 174.99 2k8b s GLN 62 N 2.72 3.03 0.47 2.79 -0.44 -1.26 -4.86 119.66 122.11 2k8b s GLN 62 Ca 0.61 0.41 -0.23 0.00 -2.50 0.00 0.00 55.36 53.65 2k8b s GLN 62 Cb -0.28 -2.09 -0.07 0.00 -1.64 0.00 0.00 33.01 28.93 2k8b s GLN 62 CO 0.23 -0.85 1.18 -1.59 0.50 0.00 0.00 175.29 174.76 2k8b s LYS 63 N -5.23 3.67 -1.32 1.67 -2.85 -1.26 -3.47 119.74 110.95 2k8b s LYS 63 Ca 0.56 1.81 -0.05 0.00 -1.00 0.00 0.00 55.97 57.30 2k8b s LYS 63 Cb -0.11 -2.37 0.02 0.00 -2.06 0.00 0.00 37.83 33.31 2k8b s LYS 63 CO 0.51 -0.63 0.99 0.39 0.10 0.00 0.00 175.35 176.70 2k8b n GLU 64 N -0.59 -6.50 -3.14 1.78 4.71 -1.25 -4.98 120.64 110.68 2k8b n GLU 64 Ca 0.08 0.76 -0.34 0.00 -0.01 0.00 0.00 57.16 57.65 2k8b n GLU 64 Cb 0.48 -5.67 -0.06 0.00 -1.01 0.00 0.00 31.44 25.18 2k8b n GLU 64 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 2k8b s SER 65 N -3.91 6.85 -0.60 1.62 1.04 -1.23 -4.88 113.70 112.60 2k8b s SER 65 Ca 0.27 1.31 -0.21 0.00 0.48 0.00 0.00 55.95 57.80 2k8b s SER 65 Cb -0.12 -2.38 0.08 0.00 0.10 0.00 0.00 66.02 63.69 2k8b s SER 65 CO 0.76 -0.13 0.82 -0.89 0.98 0.00 0.00 173.24 174.79 2k8b s THR 66 N -1.83 4.58 0.21 2.02 2.01 -1.26 -2.68 115.64 118.69 2k8b s THR 66 Ca 0.50 -0.52 -0.01 0.00 0.31 0.00 0.00 61.69 61.96 2k8b s THR 66 Cb -0.12 -4.54 -0.04 0.00 0.01 0.00 0.00 72.50 67.80 2k8b s THR 66 CO 0.19 -1.21 0.42 -0.76 -0.69 0.00 0.00 174.62 172.56 2k8b s LEU 67 N 3.37 4.20 -0.15 4.42 1.02 -0.45 -4.77 118.68 126.32 2k8b s LEU 67 Ca 0.18 0.45 0.01 0.00 0.02 0.00 0.00 54.13 54.80 2k8b s LEU 67 Cb -0.19 -3.23 0.00 0.00 0.02 0.00 0.00 46.19 42.79 2k8b s LEU 67 CO 0.10 -0.06 -0.18 -1.00 0.02 0.00 0.00 176.35 175.23 2k8b s HIS 68 N -1.90 2.75 -0.28 0.29 3.76 -0.74 -0.09 115.29 119.07 2k8b s HIS 68 Ca 0.39 -1.22 -0.07 0.00 -0.15 0.00 0.00 55.06 54.01 2k8b s HIS 68 Cb -0.11 -1.87 -0.01 0.00 1.11 0.00 0.00 32.58 31.70 2k8b s HIS 68 CO 0.29 -0.57 0.09 -1.17 -0.85 0.00 0.00 174.74 172.53 2k8b s LEU 69 N 0.90 3.77 0.17 0.89 2.96 0.82 -0.21 118.68 127.97 2k8b s LEU 69 Ca -0.04 -0.52 0.08 0.00 -0.22 0.00 0.00 54.13 53.42 2k8b s LEU 69 Cb -0.15 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 2k8b s LEU 69 CO -0.02 -0.15 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.01 2k8b s VAL 70 N 1.56 1.74 0.74 1.68 1.01 -0.49 -1.43 120.40 125.21 2k8b s VAL 70 Ca 0.04 -1.99 -0.12 0.00 0.00 0.00 0.00 61.98 59.91 2k8b s VAL 70 Cb -0.16 -1.87 0.04 0.00 0.00 0.00 0.00 36.38 34.38 2k8b s VAL 70 CO 0.03 -0.42 1.13 -0.76 0.00 0.00 0.00 175.10 175.08 2k8b s LEU 71 N -2.86 2.76 0.52 3.92 1.02 -1.26 -2.16 118.68 120.62 2k8b s LEU 71 Ca 0.17 1.01 -0.22 0.00 0.02 0.00 0.00 54.13 55.11 2k8b s LEU 71 Cb -0.04 -3.70 -0.06 0.00 0.02 0.00 0.00 46.19 42.42 2k8b s LEU 71 CO 0.06 -1.54 1.25 0.00 0.02 0.00 0.00 176.35 176.14 2k8b s ARG 72 N -5.44 3.37 -0.15 1.70 3.03 -1.20 -4.74 118.95 115.52 2k8b s ARG 72 Ca 0.60 1.97 -0.12 0.00 2.03 0.00 0.00 55.73 60.20 2k8b s ARG 72 Cb -0.11 -2.26 -0.04 0.00 -1.03 0.00 0.00 34.95 31.51 2k8b s ARG 72 CO 0.51 -0.92 -0.24 -0.11 -1.13 0.00 0.00 175.30 173.41 2k8b n LEU 73 N -0.90 1.75 -4.83 -1.89 7.94 -1.26 -5.01 117.00 112.81 2k8b n LEU 73 Ca 0.10 0.49 -0.22 0.00 -1.11 0.00 0.00 56.01 55.27 2k8b n LEU 73 Cb 0.47 -0.80 -0.04 0.00 0.53 0.00 0.00 43.42 43.58 2k8b n LEU 73 CO 0.49 -0.40 -0.14 -0.13 -1.11 0.00 0.00 177.39 176.10 2k8b s ARG 74 N -2.44 2.84 0.00 1.96 0.52 -1.26 -5.11 118.95 115.46 2k8b s ARG 74 Ca -0.20 -1.14 0.00 0.00 -0.52 0.00 0.00 55.73 53.87 2k8b s ARG 74 Cb 0.03 -2.52 0.00 0.00 0.52 0.00 0.00 34.95 32.97 2k8b s ARG 74 CO 0.29 0.30 0.00 0.41 0.02 0.00 0.00 175.30 176.32 2k8b n GLY 75 N -1.23 1.09 0.00 -3.53 0.00 -1.26 -5.15 105.19 95.11 2k8b n GLY 75 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2k8b n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93