#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8c s GLN 2 N 0.00 3.37 0.10 3.17 -0.21 -1.26 -2.70 119.66 122.14 2k8c s GLN 2 Ca 0.00 -0.18 0.10 0.00 0.02 0.00 0.00 55.36 55.31 2k8c s GLN 2 Cb 0.00 -3.13 -0.04 0.00 1.00 0.00 0.00 33.01 30.84 2k8c s GLN 2 CO 0.00 0.76 -0.27 0.96 -2.12 0.00 0.00 175.29 174.63 2k8c s ILE 3 N -1.03 2.22 -0.45 1.08 -0.00 -0.84 -2.74 121.20 119.45 2k8c s ILE 3 Ca 0.15 -1.65 -0.16 0.00 -0.00 0.00 0.00 60.65 58.99 2k8c s ILE 3 Cb -0.12 -1.95 0.04 0.00 -0.00 0.00 0.00 42.46 40.44 2k8c s ILE 3 CO 0.05 0.18 0.42 -0.36 -0.00 0.00 0.00 174.94 175.22 2k8c s PHE 4 N -0.98 3.19 -0.11 1.37 0.08 -0.97 -1.76 117.98 118.80 2k8c s PHE 4 Ca 0.13 -0.62 -0.13 0.00 0.12 0.00 0.00 56.93 56.43 2k8c s PHE 4 Cb -0.10 -3.01 -0.05 0.00 -0.57 0.00 0.00 43.02 39.29 2k8c s PHE 4 CO 0.05 -0.76 0.32 0.54 -0.10 0.00 0.00 175.22 175.27 2k8c s VAL 5 N 1.96 5.25 -0.23 -0.44 0.11 0.25 -1.15 120.40 126.15 2k8c s VAL 5 Ca 0.08 0.61 -0.03 0.00 -2.93 0.00 0.00 61.98 59.71 2k8c s VAL 5 Cb -0.20 -3.64 0.00 0.00 -1.53 0.00 0.00 36.38 31.02 2k8c s VAL 5 CO 0.10 0.47 -0.05 -0.75 -3.33 0.00 0.00 175.10 171.55 2k8c s LYS 6 N -0.16 3.21 0.86 1.54 2.20 0.14 -0.88 119.74 126.66 2k8c s LYS 6 Ca 0.19 -0.73 -0.12 0.00 -0.36 0.00 0.00 55.97 54.95 2k8c s LYS 6 Cb -0.14 -3.00 0.11 0.00 -1.51 0.00 0.00 37.83 33.28 2k8c s LYS 6 CO 0.07 -0.26 1.16 0.99 -0.36 0.00 0.00 175.35 176.95 2k8c s THR 7 N 1.44 2.00 0.26 3.43 2.01 0.80 -0.10 115.64 125.46 2k8c s THR 7 Ca 0.04 0.00 -0.02 0.00 0.31 0.00 0.00 61.69 62.02 2k8c s THR 7 Cb -0.15 -2.88 0.23 0.00 0.01 0.00 0.00 72.50 69.71 2k8c s THR 7 CO -0.04 -0.00 1.75 0.25 -0.69 0.00 0.00 174.62 175.89 2k8c h LEU 8 N -1.26 0.43 0.00 4.42 5.85 -1.80 0.15 115.31 123.10 2k8c h LEU 8 Ca -0.48 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2k8c h LEU 8 Cb 1.33 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2k8c h LEU 8 CO 0.64 0.17 0.00 1.07 -0.34 0.00 0.00 178.44 179.99 2k8c n THR 9 N -4.92 0.01 -0.36 1.05 5.66 -1.26 -4.84 114.28 109.62 2k8c n THR 9 Ca 0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.16 2k8c n THR 9 Cb 0.43 -0.57 0.00 0.00 -1.55 0.00 0.00 70.33 68.64 2k8c n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k8c n GLY 10 N 0.73 0.81 3.70 1.09 0.00 0.52 -5.04 105.19 107.00 2k8c n GLY 10 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 2k8c n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k8c s LYS 11 N -0.64 4.26 -0.25 1.61 2.20 -1.25 -4.69 119.74 120.97 2k8c s LYS 11 Ca 0.00 2.13 -0.08 0.00 -0.36 0.00 0.00 55.97 57.66 2k8c s LYS 11 Cb 0.00 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 2k8c s LYS 11 CO 0.00 -0.59 0.09 0.99 -0.36 0.00 0.00 175.35 175.48 2k8c s THR 12 N 2.03 4.50 -0.02 3.43 2.01 -1.26 -0.14 115.64 126.18 2k8c s THR 12 Ca 0.67 -0.11 0.05 0.00 0.31 0.00 0.00 61.69 62.61 2k8c s THR 12 Cb -0.36 -3.11 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 2k8c s THR 12 CO 0.29 0.33 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.76 2k8c s ILE 13 N 1.61 1.30 -0.18 1.82 1.01 -0.06 -4.97 121.20 121.75 2k8c s ILE 13 Ca 0.06 -0.68 -0.10 0.00 0.00 0.00 0.00 60.65 59.93 2k8c s ILE 13 Cb -0.15 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.17 2k8c s ILE 13 CO 0.05 0.37 0.17 -0.89 0.00 0.00 0.00 174.94 174.64 2k8c s THR 14 N -0.20 5.39 -0.12 2.92 2.01 -1.26 -0.59 115.64 123.79 2k8c s THR 14 Ca 0.02 0.28 0.02 0.00 0.31 0.00 0.00 61.69 62.32 2k8c s THR 14 Cb -0.08 -3.50 -0.00 0.00 0.01 0.00 0.00 72.50 68.93 2k8c s THR 14 CO 0.00 0.46 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.99 2k8c s LEU 15 N 0.14 2.38 -0.36 4.42 1.98 -0.72 -4.96 118.68 121.56 2k8c s LEU 15 Ca 0.11 -0.47 -0.16 0.00 -2.89 0.00 0.00 54.13 50.72 2k8c s LEU 15 Cb -0.12 -1.51 -0.00 0.00 0.66 0.00 0.00 46.19 45.22 2k8c s LEU 15 CO 0.00 0.14 0.39 -1.83 -1.89 0.00 0.00 176.35 173.16 2k8c s GLU 16 N 0.49 3.47 0.24 1.98 1.03 -1.26 -1.98 118.70 122.68 2k8c s GLU 16 Ca -0.12 -0.46 0.01 0.00 0.03 0.00 0.00 54.97 54.43 2k8c s GLU 16 Cb -0.17 -3.84 -0.04 0.00 -0.80 0.00 0.00 34.13 29.29 2k8c s GLU 16 CO 0.05 -0.60 0.14 0.14 -1.33 0.00 0.00 175.26 173.66 2k8c s VAL 17 N 2.08 0.17 0.25 1.83 -7.23 -1.10 -5.03 120.40 111.37 2k8c s VAL 17 Ca 0.12 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.29 2k8c s VAL 17 Cb -0.17 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 2k8c s VAL 17 CO 0.12 0.00 0.43 -1.61 -0.31 0.00 0.00 175.10 173.74 2k8c s GLU 18 N -4.00 3.51 0.53 4.82 0.41 -1.26 -0.51 118.70 122.21 2k8c s GLU 18 Ca 0.38 -0.37 0.22 0.00 -0.41 0.00 0.00 54.97 54.80 2k8c s GLU 18 Cb 0.06 -2.79 1.44 0.00 -1.78 0.00 0.00 34.13 31.06 2k8c s GLU 18 CO 0.15 0.33 2.15 -1.00 -0.49 0.00 0.00 175.26 176.40 2k8c h PRO 19 N 1.59 0.00 -0.63 0.39 0.13 -2.01 -0.98 132.00 130.49 2k8c h PRO 19 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2k8c h PRO 19 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k8c h PRO 19 CO 0.65 0.05 0.00 0.43 -0.23 0.00 0.00 178.00 178.91 2k8c n SER 20 N -4.13 3.98 -4.76 1.44 7.64 -1.26 -3.43 113.62 113.09 2k8c n SER 20 Ca -0.03 -2.38 -0.39 0.00 1.01 0.00 0.00 58.87 57.08 2k8c n SER 20 Cb 0.14 -0.52 -0.05 0.00 -1.01 0.00 0.00 64.21 62.76 2k8c n SER 20 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2k8c s ASP 21 N -0.80 7.04 0.42 6.43 1.01 -0.37 -4.97 116.67 125.43 2k8c s ASP 21 Ca 0.41 1.24 -0.16 0.00 0.71 0.00 0.00 52.55 54.75 2k8c s ASP 21 Cb 0.27 -2.39 -0.09 0.00 1.01 0.00 0.00 42.92 41.72 2k8c s ASP 21 CO 0.19 0.09 0.88 0.42 0.21 0.00 0.00 175.17 176.96 2k8c s THR 22 N -0.22 4.57 0.52 -1.27 -4.23 -1.26 -3.49 115.64 110.27 2k8c s THR 22 Ca 0.33 1.13 0.23 0.00 -1.18 0.00 0.00 61.69 62.20 2k8c s THR 22 Cb -0.19 -3.66 0.37 0.00 1.34 0.00 0.00 72.50 70.37 2k8c s THR 22 CO 0.19 -0.42 2.02 0.40 -0.54 0.00 0.00 174.62 176.26 2k8c h ILE 23 N 1.51 0.79 -0.76 2.99 1.08 -0.99 -0.45 117.51 121.68 2k8c h ILE 23 Ca -0.48 -0.01 -0.05 0.00 -0.39 0.00 0.00 64.86 63.94 2k8c h ILE 23 Cb 1.18 0.76 -0.03 0.00 -3.07 0.00 0.00 36.82 35.66 2k8c h ILE 23 CO 0.63 0.00 0.29 1.05 -0.69 0.00 0.00 178.15 179.43 2k8c h GLU 24 N 0.02 1.13 -0.15 2.37 4.11 -1.81 -0.47 114.58 119.79 2k8c h GLU 24 Ca 0.21 -0.21 -0.16 0.00 0.07 0.00 0.00 59.36 59.28 2k8c h GLU 24 Cb 0.82 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2k8c h GLU 24 CO -0.01 0.92 -0.58 -0.97 0.07 0.00 0.00 179.01 178.45 2k8c h ASN 25 N 1.10 0.54 -0.55 3.06 -1.24 -1.43 -1.70 115.58 115.37 2k8c h ASN 25 Ca 0.25 -0.30 -0.00 0.00 0.71 0.00 0.00 56.30 56.96 2k8c h ASN 25 Cb 0.22 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.09 2k8c h ASN 25 CO -0.02 1.00 0.33 0.58 -1.29 0.00 0.00 177.43 178.03 2k8c h VAL 26 N 0.37 1.17 -0.79 2.57 2.07 -0.95 -0.82 116.25 119.87 2k8c h VAL 26 Ca 0.00 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2k8c h VAL 26 Cb 1.11 0.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2k8c h VAL 26 CO 0.10 0.17 0.37 0.11 0.02 0.00 0.00 177.57 178.34 2k8c h LYS 27 N 0.74 1.13 -0.52 1.57 1.57 -0.90 -1.96 116.57 118.19 2k8c h LYS 27 Ca 0.20 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2k8c h LYS 27 Cb -0.01 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.07 2k8c h LYS 27 CO -0.04 0.88 0.13 0.00 -0.57 0.00 0.00 179.45 179.85 2k8c h ALA 28 N 1.28 1.25 -0.16 3.86 0.00 -0.59 0.15 119.26 125.05 2k8c h ALA 28 Ca 0.27 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 2k8c h ALA 28 Cb 0.12 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2k8c h ALA 28 CO -0.03 0.52 -0.45 0.87 0.00 0.00 0.00 179.25 180.16 2k8c h LYS 29 N 0.76 0.39 -0.04 0.00 1.57 -0.61 -1.06 116.57 117.57 2k8c h LYS 29 Ca 0.17 -0.20 -0.15 0.00 -1.87 0.00 0.00 60.65 58.60 2k8c h LYS 29 Cb 0.28 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2k8c h LYS 29 CO -0.00 0.76 -0.63 0.82 -0.57 0.00 0.00 179.45 179.83 2k8c h ILE 30 N 0.31 1.42 0.00 1.86 2.04 -0.81 -0.34 117.51 121.99 2k8c h ILE 30 Ca 0.02 -2.09 0.00 0.00 1.00 0.00 0.00 64.86 63.79 2k8c h ILE 30 Cb 0.92 2.09 0.00 0.00 -0.74 0.00 0.00 36.82 39.09 2k8c h ILE 30 CO 0.08 0.61 0.00 -0.61 0.00 0.00 0.00 178.15 178.23 2k8c h GLN 31 N 0.11 0.00 0.16 2.37 4.15 -0.59 -0.03 115.11 121.28 2k8c h GLN 31 Ca -0.01 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.08 2k8c h GLN 31 Cb 1.14 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.84 2k8c h GLN 31 CO 0.09 0.00 -1.64 0.22 -1.93 0.00 0.00 178.83 175.57 2k8c h ASP 32 N 0.00 0.53 0.00 -0.69 3.58 -0.57 -3.02 116.42 116.26 2k8c h ASP 32 Ca 0.00 -0.91 0.00 0.00 0.42 0.00 0.00 57.03 56.54 2k8c h ASP 32 Cb 0.64 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.52 2k8c h ASP 32 CO 0.00 1.73 0.00 0.29 -2.88 0.00 0.00 179.24 178.38 2k8c n LYS 33 N -3.71 0.00 0.10 0.28 5.02 -0.20 -4.52 118.16 115.14 2k8c n LYS 33 Ca -0.25 0.44 -0.16 0.00 -2.02 0.00 0.00 58.31 56.31 2k8c n LYS 33 Cb 1.01 -0.96 -0.13 0.00 -0.02 0.00 0.00 35.03 34.93 2k8c n LYS 33 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2k8c h GLU 34 N 0.00 0.30 0.00 1.97 4.39 -1.32 -3.48 114.58 116.45 2k8c h GLU 34 Ca 0.00 -0.49 0.00 0.00 0.34 0.00 0.00 59.36 59.21 2k8c h GLU 34 Cb 0.00 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2k8c h GLU 34 CO 0.00 1.22 0.00 0.41 -1.16 0.00 0.00 179.01 179.48 2k8c n GLY 35 N 1.48 0.98 3.66 -3.84 0.00 -0.43 -4.99 105.19 102.06 2k8c n GLY 35 Ca -0.09 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 2k8c n GLY 35 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k8c s ILE 36 N -2.00 4.68 0.23 -0.61 1.01 -1.23 -4.86 121.20 118.43 2k8c s ILE 36 Ca 0.00 2.02 -0.32 0.00 0.00 0.00 0.00 60.65 62.35 2k8c s ILE 36 Cb 0.00 -4.30 -0.13 0.00 0.01 0.00 0.00 42.46 38.04 2k8c s ILE 36 CO 0.00 -0.16 1.59 -0.81 0.00 0.00 0.00 174.94 175.55 2k8c n PRO 37 N 6.21 2.47 0.27 2.79 -0.04 -1.26 -3.63 135.00 141.80 2k8c n PRO 37 Ca 0.12 0.89 0.18 0.00 -0.04 0.00 0.00 63.50 64.64 2k8c n PRO 37 Cb 0.46 -2.66 0.90 0.00 -0.04 0.00 0.00 33.50 32.16 2k8c n PRO 37 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2k8c h PRO 38 N 5.39 0.00 0.01 0.54 0.13 -1.90 -0.16 132.00 136.01 2k8c h PRO 38 Ca -0.45 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2k8c h PRO 38 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2k8c h PRO 38 CO 0.85 0.00 -0.01 0.38 -0.23 0.00 0.00 178.00 178.99 2k8c h ASP 39 N 0.00 -0.02 1.58 1.44 2.03 -1.98 -3.34 116.42 116.13 2k8c h ASP 39 Ca 0.00 -0.77 -0.06 0.00 -0.73 0.00 0.00 57.03 55.47 2k8c h ASP 39 Cb 0.14 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.64 2k8c h ASP 39 CO 0.00 0.79 -0.43 1.56 -1.03 0.00 0.00 179.24 180.13 2k8c h GLN 40 N -0.87 0.00 -6.28 4.15 4.20 -1.91 -3.44 115.11 110.96 2k8c h GLN 40 Ca -0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2k8c h GLN 40 Cb 0.78 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.54 2k8c h GLN 40 CO 0.00 0.24 1.14 -1.14 -0.67 0.00 0.00 178.83 178.40 2k8c s GLN 41 N -3.09 3.77 -0.26 1.46 0.74 -0.09 -3.74 119.66 118.45 2k8c s GLN 41 Ca 0.04 1.67 -0.05 0.00 0.05 0.00 0.00 55.36 57.07 2k8c s GLN 41 Cb 0.07 -4.05 0.00 0.00 1.10 0.00 0.00 33.01 30.13 2k8c s GLN 41 CO 0.73 -1.32 0.02 0.50 -0.55 0.00 0.00 175.29 174.66 2k8c s ARG 42 N 4.74 3.21 -0.28 1.67 3.52 0.16 -4.89 118.95 127.08 2k8c s ARG 42 Ca 0.72 -0.75 -0.09 0.00 -0.13 0.00 0.00 55.73 55.48 2k8c s ARG 42 Cb -0.25 -3.19 -0.03 0.00 -1.56 0.00 0.00 34.95 29.92 2k8c s ARG 42 CO 0.30 -0.33 0.14 -0.51 -0.81 0.00 0.00 175.30 174.09 2k8c s LEU 43 N 1.48 3.87 -0.13 -0.88 1.43 -1.26 -0.73 118.68 122.46 2k8c s LEU 43 Ca 0.04 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 2k8c s LEU 43 Cb -0.16 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 2k8c s LEU 43 CO -0.00 -0.09 -0.13 -0.63 0.23 0.00 0.00 176.35 175.72 2k8c s ILE 44 N 1.67 3.04 -0.03 -0.59 1.01 0.46 -0.50 121.20 126.25 2k8c s ILE 44 Ca 0.06 -0.67 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 2k8c s ILE 44 Cb -0.16 -2.27 0.03 0.00 0.01 0.00 0.00 42.46 40.07 2k8c s ILE 44 CO 0.07 0.53 0.03 0.12 0.00 0.00 0.00 174.94 175.69 2k8c s PHE 45 N 0.31 0.19 -1.93 3.97 5.36 0.83 -0.86 117.98 125.85 2k8c s PHE 45 Ca -0.10 0.10 0.00 0.00 -0.96 0.00 0.00 56.93 55.97 2k8c s PHE 45 Cb -0.16 -0.43 0.00 0.00 -0.34 0.00 0.00 43.02 42.10 2k8c s PHE 45 CO 0.06 -0.16 0.00 0.00 -1.46 0.00 0.00 175.22 173.66 2k8c n ALA 46 N 4.63 -0.28 -0.27 11.12 0.00 -1.26 -1.13 120.51 133.32 2k8c n ALA 46 Ca -0.17 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2k8c n ALA 46 Cb 0.50 -1.88 0.00 0.00 0.00 0.00 0.00 19.45 18.07 2k8c n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8c n GLY 47 N -0.65 0.68 3.35 0.00 0.00 -1.26 -5.05 105.19 102.27 2k8c n GLY 47 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 2k8c n GLY 47 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k8c s LYS 48 N -0.69 2.35 0.26 1.61 2.47 -0.29 -5.11 119.74 120.34 2k8c s LYS 48 Ca 0.00 -0.85 -0.29 0.00 -1.56 0.00 0.00 55.97 53.27 2k8c s LYS 48 Cb 0.00 -2.18 -0.09 0.00 -1.46 0.00 0.00 37.83 34.10 2k8c s LYS 48 CO 0.00 0.53 0.97 1.14 0.16 0.00 0.00 175.35 178.15 2k8c s GLN 49 N -0.52 4.79 -0.25 4.03 -2.07 -1.26 -0.12 119.66 124.25 2k8c s GLN 49 Ca 0.07 1.52 -0.28 0.00 -1.82 0.00 0.00 55.36 54.85 2k8c s GLN 49 Cb -0.11 -3.21 0.01 0.00 -1.09 0.00 0.00 33.01 28.61 2k8c s GLN 49 CO 0.01 0.44 1.02 -0.51 -1.32 0.00 0.00 175.29 174.93 2k8c s LEU 50 N -1.32 4.07 0.62 2.60 1.43 0.34 -4.92 118.68 121.49 2k8c s LEU 50 Ca 0.43 1.27 -0.09 0.00 -1.03 0.00 0.00 54.13 54.70 2k8c s LEU 50 Cb -0.26 -3.50 -0.01 0.00 0.03 0.00 0.00 46.19 42.45 2k8c s LEU 50 CO 0.33 -0.69 0.99 -1.61 0.23 0.00 0.00 176.35 175.59 2k8c s GLU 51 N 3.24 3.24 0.08 1.70 2.02 -1.26 -4.77 118.70 122.95 2k8c s GLU 51 Ca 0.43 0.43 -0.18 0.00 0.02 0.00 0.00 54.97 55.68 2k8c s GLU 51 Cb -0.14 -2.14 -0.08 0.00 0.10 0.00 0.00 34.13 31.86 2k8c s GLU 51 CO 0.08 -0.68 1.49 0.38 0.02 0.00 0.00 175.26 176.55 2k8c h ASP 52 N -0.31 0.50 -0.19 -0.19 2.03 -1.96 -3.24 116.42 113.06 2k8c h ASP 52 Ca -0.45 -0.35 -0.34 0.00 -0.73 0.00 0.00 57.03 55.15 2k8c h ASP 52 Cb 1.22 -0.14 -0.07 0.00 -0.83 0.00 0.00 39.33 39.52 2k8c h ASP 52 CO 0.62 0.74 0.63 0.61 -1.03 0.00 0.00 179.24 180.81 2k8c n GLY 53 N -0.19 3.51 2.97 7.15 0.00 -1.26 -3.52 105.19 113.85 2k8c n GLY 53 Ca -0.03 -1.39 -0.11 0.00 0.00 0.00 0.00 46.02 44.49 2k8c n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k8c s ARG 54 N 0.75 0.21 0.58 1.61 1.81 -1.22 -5.04 118.95 117.66 2k8c s ARG 54 Ca 0.66 -0.27 0.08 0.00 -1.72 0.00 0.00 55.73 54.47 2k8c s ARG 54 Cb 0.30 0.08 0.08 0.00 -0.45 0.00 0.00 34.95 34.96 2k8c s ARG 54 CO -0.05 -0.04 0.64 0.95 -0.68 0.00 0.00 175.30 176.13 2k8c s THR 55 N -0.77 1.79 0.22 0.02 -4.23 -1.26 -0.76 115.64 110.65 2k8c s THR 55 Ca -0.08 -1.23 -0.04 0.00 -1.18 0.00 0.00 61.69 59.16 2k8c s THR 55 Cb -0.05 -2.01 0.05 0.00 1.34 0.00 0.00 72.50 71.83 2k8c s THR 55 CO -0.00 0.00 1.65 -0.07 -0.54 0.00 0.00 174.62 175.66 2k8c h LEU 56 N 0.37 0.81 -0.18 4.79 3.38 -1.59 -2.32 115.31 120.57 2k8c h LEU 56 Ca -0.32 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.39 2k8c h LEU 56 Cb 1.30 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2k8c h LEU 56 CO 0.47 0.97 0.00 -1.20 0.09 0.00 0.00 178.44 178.77 2k8c n SER 57 N -4.14 0.42 0.01 -0.43 7.64 -1.26 -1.86 113.62 114.01 2k8c n SER 57 Ca 0.01 0.57 -0.12 0.00 1.01 0.00 0.00 58.87 60.33 2k8c n SER 57 Cb 0.40 -0.67 -0.07 0.00 -1.01 0.00 0.00 64.21 62.86 2k8c n SER 57 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2k8c h ASP 58 N 0.00 0.04 -0.22 6.43 3.32 -1.77 -2.77 116.42 121.44 2k8c h ASP 58 Ca 0.00 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2k8c h ASP 58 Cb 0.49 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.03 2k8c h ASP 58 CO 0.00 0.18 0.00 -1.22 -1.72 0.00 0.00 179.24 176.48 2k8c n TYR 59 N -4.99 0.28 -3.54 4.55 4.01 -1.23 -4.93 117.16 111.30 2k8c n TYR 59 Ca -0.07 -0.14 -0.21 0.00 -0.16 0.00 0.00 57.90 57.33 2k8c n TYR 59 Cb 0.10 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.21 2k8c n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2k8c n ASN 60 N 0.81 -3.69 -4.69 7.72 3.02 -1.05 -4.88 115.26 112.51 2k8c n ASN 60 Ca 0.17 -0.62 -0.44 0.00 -0.03 0.00 0.00 54.58 53.67 2k8c n ASN 60 Cb 0.45 -4.95 -0.03 0.00 -0.61 0.00 0.00 39.78 34.64 2k8c n ASN 60 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2k8c n ILE 61 N -4.49 0.25 -2.55 2.41 5.41 -0.78 -4.95 119.36 114.65 2k8c n ILE 61 Ca -0.17 -0.04 -0.37 0.00 1.00 0.00 0.00 62.75 63.17 2k8c n ILE 61 Cb 0.62 -1.96 -0.04 0.00 -0.71 0.00 0.00 39.64 37.55 2k8c n ILE 61 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2k8c s GLN 62 N 2.21 4.19 -0.07 0.38 -1.52 -1.26 -4.93 119.66 118.67 2k8c s GLN 62 Ca 0.81 1.51 -0.32 0.00 -1.95 0.00 0.00 55.36 55.41 2k8c s GLN 62 Cb -0.55 -2.56 -0.10 0.00 -0.22 0.00 0.00 33.01 29.58 2k8c s GLN 62 CO 0.38 -0.12 1.98 0.36 -0.25 0.00 0.00 175.29 177.64 2k8c n LYS 63 N -0.02 2.39 -3.19 2.91 2.85 -1.26 -2.04 118.16 119.80 2k8c n LYS 63 Ca 0.05 0.85 -0.14 0.00 -1.05 0.00 0.00 58.31 58.02 2k8c n LYS 63 Cb 0.50 -2.86 0.07 0.00 -0.65 0.00 0.00 35.03 32.08 2k8c n LYS 63 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k8c n GLU 64 N 7.37 -5.51 -2.32 -1.58 1.02 -1.11 -5.02 120.64 113.49 2k8c n GLU 64 Ca 0.23 0.70 -0.25 0.00 -0.02 0.00 0.00 57.16 57.82 2k8c n GLU 64 Cb 0.36 -5.29 0.10 0.00 -0.02 0.00 0.00 31.44 26.60 2k8c n GLU 64 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2k8c s SER 65 N -4.10 4.34 -0.45 1.62 1.04 -0.87 -4.67 113.70 110.61 2k8c s SER 65 Ca 0.01 0.09 -0.18 0.00 0.48 0.00 0.00 55.95 56.36 2k8c s SER 65 Cb -0.01 -0.54 0.04 0.00 0.10 0.00 0.00 66.02 65.61 2k8c s SER 65 CO 0.60 -1.88 0.48 -0.89 0.98 0.00 0.00 173.24 172.53 2k8c s THR 66 N -3.30 5.05 -0.18 2.02 2.01 -1.26 -2.29 115.64 117.68 2k8c s THR 66 Ca 0.65 -0.44 -0.10 0.00 0.31 0.00 0.00 61.69 62.11 2k8c s THR 66 Cb -0.07 -4.11 -0.05 0.00 0.01 0.00 0.00 72.50 68.28 2k8c s THR 66 CO 0.46 -0.53 0.14 -0.76 -0.69 0.00 0.00 174.62 173.24 2k8c s LEU 67 N 2.22 4.25 -0.33 4.42 1.02 -0.30 -4.81 118.68 125.14 2k8c s LEU 67 Ca 0.12 0.29 -0.20 0.00 0.02 0.00 0.00 54.13 54.37 2k8c s LEU 67 Cb -0.18 -2.11 -0.00 0.00 0.02 0.00 0.00 46.19 43.92 2k8c s LEU 67 CO 0.13 0.22 0.61 -1.00 0.02 0.00 0.00 176.35 176.33 2k8c s HIS 68 N 0.11 3.18 -0.43 0.29 3.76 -0.04 0.27 115.29 122.42 2k8c s HIS 68 Ca 0.10 0.42 -0.12 0.00 -0.15 0.00 0.00 55.06 55.30 2k8c s HIS 68 Cb -0.11 -3.04 0.06 0.00 1.11 0.00 0.00 32.58 30.60 2k8c s HIS 68 CO -0.00 -0.55 0.30 -1.17 -0.85 0.00 0.00 174.74 172.47 2k8c s LEU 69 N 2.61 5.23 0.00 0.89 2.96 0.85 -0.40 118.68 130.83 2k8c s LEU 69 Ca 0.24 -1.27 0.02 0.00 -0.22 0.00 0.00 54.13 52.89 2k8c s LEU 69 Cb -0.15 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.45 2k8c s LEU 69 CO 0.13 -0.54 0.06 1.33 -1.32 0.00 0.00 176.35 176.02 2k8c n VAL 70 N 5.06 0.00 -2.42 1.68 0.24 0.09 -2.36 118.33 120.62 2k8c n VAL 70 Ca -0.11 -1.33 0.00 0.00 -2.04 0.00 0.00 64.34 60.85 2k8c n VAL 70 Cb 0.44 0.43 0.00 0.00 -1.47 0.00 0.00 33.84 33.24 2k8c n VAL 70 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58 2k8c n LEU 71 N 0.00 0.00 -4.18 1.34 7.94 -1.26 -0.67 117.00 120.17 2k8c n LEU 71 Ca -0.05 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.68 2k8c n LEU 71 Cb 0.35 0.00 -0.11 0.00 0.53 0.00 0.00 43.42 44.18 2k8c n LEU 71 CO 0.18 0.00 -0.44 0.00 -1.11 0.00 0.00 177.39 176.02 2k8c s ARG 72 N 2.13 0.84 -0.08 1.96 1.04 -1.25 -4.58 118.95 119.01 2k8c s ARG 72 Ca 0.00 -1.04 -0.05 0.00 -1.04 0.00 0.00 55.73 53.60 2k8c s ARG 72 Cb 0.00 -0.72 -0.02 0.00 -2.04 0.00 0.00 34.95 32.18 2k8c s ARG 72 CO 0.00 0.14 -0.10 1.25 -0.04 0.00 0.00 175.30 176.56 2k8c h LEU 73 N 3.97 0.00 -9.24 -1.89 5.85 -2.01 -3.46 115.31 108.53 2k8c h LEU 73 Ca -0.39 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 57.77 2k8c h LEU 73 Cb 1.19 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 2k8c h LEU 73 CO 0.45 0.43 0.72 -0.13 -0.34 0.00 0.00 178.44 179.58 2k8c s ARG 74 N -1.70 4.33 0.07 1.25 0.52 -1.26 -4.90 118.95 117.26 2k8c s ARG 74 Ca -0.08 1.56 0.23 0.00 -0.52 0.00 0.00 55.73 56.92 2k8c s ARG 74 Cb 0.01 -3.61 0.02 0.00 0.52 0.00 0.00 34.95 31.90 2k8c s ARG 74 CO 0.12 -0.49 1.00 0.41 0.02 0.00 0.00 175.30 176.35 2k8c n GLY 75 N 3.35 -1.24 0.00 -3.53 0.00 -1.26 -5.18 105.19 97.32 2k8c n GLY 75 Ca 0.11 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2k8c n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93