#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 1.23 0.16 2.12 0.74 -1.26 -0.21 119.66 122.44 2k8c s GLN 2 Ca 0.00 -0.30 0.05 0.00 0.05 0.00 0.00 55.36 55.16 2k8c s GLN 2 Cb 0.00 -1.67 -0.04 0.00 1.10 0.00 0.00 33.01 32.40 2k8c s GLN 2 CO 0.00 -0.37 0.16 0.96 -0.55 0.00 0.00 175.29 175.48 2k8c s ILE 3 N 1.75 4.60 -0.44 -2.34 -0.00 -0.73 -3.92 121.20 120.12 2k8c s ILE 3 Ca 0.03 -1.03 -0.09 0.00 -0.00 0.00 0.00 60.65 59.56 2k8c s ILE 3 Cb -0.14 -3.35 0.10 0.00 -0.00 0.00 0.00 42.46 39.07 2k8c s ILE 3 CO -0.07 -0.11 0.29 -0.36 -0.00 0.00 0.00 174.94 174.69 2k8c s PHE 4 N -1.75 3.38 -0.24 1.37 0.08 -0.04 -2.15 117.98 118.63 2k8c s PHE 4 Ca 0.31 -1.70 -0.15 0.00 0.12 0.00 0.00 56.93 55.51 2k8c s PHE 4 Cb -0.10 -3.18 -0.04 0.00 -0.57 0.00 0.00 43.02 39.13 2k8c s PHE 4 CO 0.24 -0.91 0.37 0.54 -0.10 0.00 0.00 175.22 175.36 2k8c s VAL 5 N 1.39 5.19 -0.18 -0.44 0.11 -0.97 -0.32 120.40 125.18 2k8c s VAL 5 Ca 0.04 0.61 -0.12 0.00 -2.93 0.00 0.00 61.98 59.58 2k8c s VAL 5 Cb -0.24 -3.70 -0.05 0.00 -1.53 0.00 0.00 36.38 30.86 2k8c s VAL 5 CO 0.01 0.21 0.23 -0.75 -3.33 0.00 0.00 175.10 171.47 2k8c s LYS 6 N 1.70 4.23 0.87 1.54 2.20 0.94 -0.65 119.74 130.58 2k8c s LYS 6 Ca 0.16 -0.02 -0.09 0.00 -0.36 0.00 0.00 55.97 55.66 2k8c s LYS 6 Cb -0.15 -3.43 0.18 0.00 -1.51 0.00 0.00 37.83 32.93 2k8c s LYS 6 CO 0.09 0.25 1.20 0.95 -0.36 0.00 0.00 175.35 177.48 2k8c s THR 7 N 0.46 2.02 0.45 3.43 -4.23 -0.11 -0.80 115.64 116.85 2k8c s THR 7 Ca 0.13 -0.28 0.12 0.00 -1.18 0.00 0.00 61.69 60.49 2k8c s THR 7 Cb -0.12 -2.74 0.22 0.00 1.34 0.00 0.00 72.50 71.20 2k8c s THR 7 CO 0.02 0.00 2.03 0.25 -0.54 0.00 0.00 174.62 176.38 2k8c h LEU 8 N -1.21 0.14 -0.37 4.79 5.85 -1.89 -1.50 115.31 121.12 2k8c h LEU 8 Ca -0.40 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.31 2k8c h LEU 8 Cb 1.24 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2k8c h LEU 8 CO 0.35 0.21 -0.12 1.07 -0.34 0.00 0.00 178.44 179.61 2k8c n THR 9 N -4.40 0.00 -0.24 1.05 5.66 -1.26 -4.90 114.28 110.19 2k8c n THR 9 Ca -0.01 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 2k8c n THR 9 Cb 0.17 0.06 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 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 1.26 0.64 3.68 1.09 0.00 -0.56 -5.04 105.19 106.26 2k8c n GLY 10 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 2k8c n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8c s LYS 11 N -0.74 4.31 -0.14 1.61 1.02 -1.26 -4.68 119.74 119.86 2k8c s LYS 11 Ca 0.00 1.64 -0.14 0.00 0.02 0.00 0.00 55.97 57.49 2k8c s LYS 11 Cb 0.00 -3.64 -0.05 0.00 -0.52 0.00 0.00 37.83 33.63 2k8c s LYS 11 CO 0.00 -0.55 0.31 0.99 -0.92 0.00 0.00 175.35 175.18 2k8c s THR 12 N 2.73 5.28 -0.08 2.17 2.01 -1.26 -0.94 115.64 125.55 2k8c s THR 12 Ca 0.55 0.59 0.01 0.00 0.31 0.00 0.00 61.69 63.15 2k8c s THR 12 Cb -0.23 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.61 2k8c s THR 12 CO 0.18 0.42 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.79 2k8c s ILE 13 N 0.24 3.32 -0.56 1.82 1.01 0.18 -4.94 121.20 122.27 2k8c s ILE 13 Ca 0.18 -0.61 -0.22 0.00 0.00 0.00 0.00 60.65 60.00 2k8c s ILE 13 Cb -0.13 -2.35 0.05 0.00 0.01 0.00 0.00 42.46 40.04 2k8c s ILE 13 CO 0.05 0.57 0.85 0.42 0.00 0.00 0.00 174.94 176.84 2k8c s THR 14 N -0.41 4.52 -0.32 2.92 -4.23 -1.26 -2.29 115.64 114.56 2k8c s THR 14 Ca 0.05 -0.05 -0.13 0.00 -1.18 0.00 0.00 61.69 60.38 2k8c s THR 14 Cb -0.12 -4.50 -0.03 0.00 1.34 0.00 0.00 72.50 69.20 2k8c s THR 14 CO 0.02 -1.08 0.27 -0.76 -0.54 0.00 0.00 174.62 172.52 2k8c s LEU 15 N 3.58 4.34 -0.34 4.79 2.01 -0.91 -4.97 118.68 127.18 2k8c s LEU 15 Ca 0.25 -0.22 -0.13 0.00 0.01 0.00 0.00 54.13 54.03 2k8c s LEU 15 Cb -0.15 -2.20 -0.02 0.00 0.01 0.00 0.00 46.19 43.83 2k8c s LEU 15 CO 0.16 -0.21 0.26 -1.83 1.01 0.00 0.00 176.35 175.74 2k8c s GLU 16 N 1.83 3.50 0.24 1.70 1.03 -1.26 -1.77 118.70 123.96 2k8c s GLU 16 Ca 0.08 -0.61 -0.10 0.00 0.03 0.00 0.00 54.97 54.37 2k8c s GLU 16 Cb -0.17 -3.81 -0.01 0.00 -0.80 0.00 0.00 34.13 29.34 2k8c s GLU 16 CO 0.11 -0.46 0.40 0.14 -1.33 0.00 0.00 175.26 174.12 2k8c s VAL 17 N 1.77 0.00 0.22 1.83 -7.23 0.70 -4.97 120.40 112.72 2k8c s VAL 17 Ca 0.07 -1.53 0.07 0.00 -1.81 0.00 0.00 61.98 58.78 2k8c s VAL 17 Cb -0.17 -2.26 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 2k8c s VAL 17 CO 0.11 -0.01 0.09 -1.61 -0.31 0.00 0.00 175.10 173.37 2k8c s GLU 18 N -4.05 2.64 0.57 4.82 0.41 -1.26 -0.16 118.70 121.67 2k8c s GLU 18 Ca 0.26 -1.12 0.27 0.00 -0.41 0.00 0.00 54.97 53.97 2k8c s GLU 18 Cb 0.01 -2.43 1.54 0.00 -1.78 0.00 0.00 34.13 31.46 2k8c s GLU 18 CO 0.09 0.42 2.06 -1.35 -0.49 0.00 0.00 175.26 176.00 2k8c h PRO 19 N 2.06 0.00 0.00 0.39 0.11 -1.97 0.20 132.00 132.79 2k8c h PRO 19 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2k8c h PRO 19 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2k8c h PRO 19 CO 0.60 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.82 2k8c n SER 20 N -4.01 0.00 -4.65 -2.05 7.64 -1.26 -3.63 113.62 105.67 2k8c n SER 20 Ca 0.04 0.35 -0.43 0.00 1.01 0.00 0.00 58.87 59.84 2k8c n SER 20 Cb 0.40 -0.45 -0.03 0.00 -1.01 0.00 0.00 64.21 63.13 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 -2.90 6.98 0.66 6.43 1.01 0.69 -5.01 116.67 124.52 2k8c s ASP 21 Ca 0.17 1.18 -0.17 0.00 0.71 0.00 0.00 52.55 54.44 2k8c s ASP 21 Cb 0.19 -2.52 -0.00 0.00 1.01 0.00 0.00 42.92 41.60 2k8c s ASP 21 CO 0.51 -0.71 1.21 0.42 0.21 0.00 0.00 175.17 176.82 2k8c s THR 22 N 3.26 2.46 0.35 -1.27 -4.23 -1.26 -4.05 115.64 110.90 2k8c s THR 22 Ca 0.42 0.26 0.09 0.00 -1.18 0.00 0.00 61.69 61.28 2k8c s THR 22 Cb -0.14 -2.97 0.32 0.00 1.34 0.00 0.00 72.50 71.05 2k8c s THR 22 CO 0.09 -0.09 1.86 0.40 -0.54 0.00 0.00 174.62 176.35 2k8c h ILE 23 N 0.34 0.82 -0.81 2.99 1.08 -1.47 -0.30 117.51 120.17 2k8c h ILE 23 Ca -0.49 -0.24 -0.02 0.00 -0.39 0.00 0.00 64.86 63.72 2k8c h ILE 23 Cb 1.30 0.06 -0.04 0.00 -3.07 0.00 0.00 36.82 35.08 2k8c h ILE 23 CO 0.53 0.13 0.45 1.05 -0.69 0.00 0.00 178.15 179.61 2k8c h GLU 24 N 0.70 1.13 -0.49 2.37 -0.00 -1.84 -0.13 114.58 116.32 2k8c h GLU 24 Ca 0.46 -0.13 -0.08 0.00 -0.00 0.00 0.00 59.36 59.61 2k8c h GLU 24 Cb 0.75 -0.22 -0.02 0.00 -0.00 0.00 0.00 28.75 29.25 2k8c h GLU 24 CO -0.22 0.83 -0.02 -0.97 -0.00 0.00 0.00 179.01 178.63 2k8c h ASN 25 N 1.13 0.80 -0.26 3.06 -1.24 -1.43 -0.48 115.58 117.16 2k8c h ASN 25 Ca 0.29 -0.21 -0.02 0.00 0.71 0.00 0.00 56.30 57.07 2k8c h ASN 25 Cb 0.03 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 38.85 2k8c h ASN 25 CO -0.05 0.88 0.10 0.58 -1.29 0.00 0.00 177.43 177.66 2k8c h VAL 26 N 0.76 1.17 -0.49 2.57 2.07 -0.70 -0.93 116.25 120.71 2k8c h VAL 26 Ca 0.14 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 2k8c h VAL 26 Cb 0.50 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 2k8c h VAL 26 CO 0.02 0.18 0.21 0.11 0.02 0.00 0.00 177.57 178.12 2k8c h LYS 27 N 0.27 0.70 -0.34 1.57 1.57 -0.73 -1.86 116.57 117.75 2k8c h LYS 27 Ca 0.09 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2k8c h LYS 27 Cb 0.19 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2k8c h LYS 27 CO -0.01 0.56 -0.20 0.00 -0.57 0.00 0.00 179.45 179.24 2k8c h ALA 28 N 1.54 1.02 -0.13 3.86 0.00 -0.65 -2.50 119.26 122.40 2k8c h ALA 28 Ca 0.17 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2k8c h ALA 28 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2k8c h ALA 28 CO -0.02 0.59 -0.24 -0.22 0.00 0.00 0.00 179.25 179.36 2k8c h LYS 29 N 0.57 0.23 0.00 0.00 3.64 -0.36 -1.78 116.57 118.86 2k8c h LYS 29 Ca 0.09 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 2k8c h LYS 29 Cb 0.65 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 2k8c h LYS 29 CO 0.05 0.46 -0.40 0.82 -2.27 0.00 0.00 179.45 178.11 2k8c h ILE 30 N 0.21 0.97 0.00 2.00 2.04 -1.03 -2.30 117.51 119.41 2k8c h ILE 30 Ca 0.03 -1.54 -0.07 0.00 1.00 0.00 0.00 64.86 64.29 2k8c h ILE 30 Cb 0.54 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 2k8c h ILE 30 CO 0.04 0.39 -0.33 -0.61 0.00 0.00 0.00 178.15 177.64 2k8c h GLN 31 N 0.00 0.00 0.25 2.37 4.15 -0.99 0.26 115.11 121.16 2k8c h GLN 31 Ca -0.00 0.00 -0.33 0.00 0.77 0.00 0.00 58.65 59.08 2k8c h GLN 31 Cb 0.88 0.00 0.04 0.00 0.21 0.00 0.00 27.48 28.61 2k8c h GLN 31 CO 0.05 0.33 -1.48 0.22 -1.93 0.00 0.00 178.83 176.02 2k8c h ASP 32 N 0.00 0.83 0.05 -0.69 3.58 -1.25 -2.51 116.42 116.43 2k8c h ASP 32 Ca -0.00 -0.92 -0.00 0.00 0.42 0.00 0.00 57.03 56.52 2k8c h ASP 32 Cb 0.76 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.54 2k8c h ASP 32 CO 0.04 1.71 -0.02 0.11 -2.88 0.00 0.00 179.24 178.20 2k8c h LYS 33 N 0.12 -0.06 0.11 0.28 1.57 -1.23 -3.41 116.57 113.95 2k8c h LYS 33 Ca -0.26 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.36 2k8c h LYS 33 Cb 2.15 0.01 0.02 0.00 0.08 0.00 0.00 32.23 34.49 2k8c h LYS 33 CO 0.27 -0.04 -0.72 0.93 -0.57 0.00 0.00 179.45 179.31 2k8c h GLU 34 N -0.29 0.24 0.00 3.15 4.39 -0.73 -3.49 114.58 117.85 2k8c h GLU 34 Ca -0.01 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2k8c h GLU 34 Cb 0.05 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 2k8c h GLU 34 CO 0.01 1.19 0.00 0.41 -1.16 0.00 0.00 179.01 179.47 2k8c n GLY 35 N 1.66 1.22 3.65 -3.84 0.00 -0.75 -5.00 105.19 102.14 2k8c n GLY 35 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 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 4.92 0.50 -0.61 1.01 -1.25 -4.87 121.20 118.90 2k8c s ILE 36 Ca 0.00 1.41 -0.23 0.00 0.00 0.00 0.00 60.65 61.83 2k8c s ILE 36 Cb 0.00 -4.05 -0.06 0.00 0.01 0.00 0.00 42.46 38.36 2k8c s ILE 36 CO 0.00 0.03 1.34 -2.16 0.00 0.00 0.00 174.94 174.15 2k8c s PRO 37 N 2.30 3.42 0.00 2.79 0.04 -1.26 -3.43 135.00 138.85 2k8c s PRO 37 Ca 0.33 2.21 0.15 0.00 0.04 0.00 0.00 61.00 63.73 2k8c s PRO 37 Cb -0.16 -2.41 0.88 0.00 0.04 0.00 0.00 34.50 32.85 2k8c s PRO 37 CO 0.10 -0.96 1.30 -0.35 0.04 0.00 0.00 177.00 177.12 2k8c n PRO 38 N -0.67 0.49 -0.00 0.56 -0.04 -1.26 -2.53 135.00 131.55 2k8c n PRO 38 Ca 0.08 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.54 2k8c n PRO 38 Cb 0.44 -1.47 -0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2k8c n PRO 38 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2k8c h ASP 39 N 0.00 0.00 1.34 3.54 5.19 -1.96 -3.38 116.42 121.15 2k8c h ASP 39 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2k8c h ASP 39 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 2k8c h ASP 39 CO 0.00 0.00 0.00 1.56 -3.12 0.00 0.00 179.24 177.68 2k8c h GLN 40 N -0.01 0.00 -6.26 3.56 7.50 -1.93 -3.44 115.11 114.53 2k8c h GLN 40 Ca 0.00 0.00 -0.55 0.00 0.50 0.00 0.00 58.65 58.60 2k8c h GLN 40 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.52 2k8c h GLN 40 CO 0.00 0.00 1.12 -1.14 -1.50 0.00 0.00 178.83 177.31 2k8c s GLN 41 N -3.42 4.08 -0.06 1.46 0.74 -1.05 -4.52 119.66 116.90 2k8c s GLN 41 Ca 0.04 2.13 0.05 0.00 0.05 0.00 0.00 55.36 57.64 2k8c s GLN 41 Cb 0.08 -4.02 -0.02 0.00 1.10 0.00 0.00 33.01 30.15 2k8c s GLN 41 CO 0.57 -0.97 -0.22 0.50 -0.55 0.00 0.00 175.29 174.62 2k8c s ARG 42 N 4.26 2.54 -0.14 1.67 3.52 -0.66 -4.90 118.95 125.24 2k8c s ARG 42 Ca 0.75 -0.85 0.02 0.00 -0.13 0.00 0.00 55.73 55.53 2k8c s ARG 42 Cb -0.33 -2.23 0.01 0.00 -1.56 0.00 0.00 34.95 30.84 2k8c s ARG 42 CO 0.31 0.45 -0.22 -0.51 -0.81 0.00 0.00 175.30 174.52 2k8c s LEU 43 N -0.31 2.09 -0.07 -0.88 1.43 -1.26 -0.36 118.68 119.32 2k8c s LEU 43 Ca 0.01 -0.60 0.05 0.00 -1.03 0.00 0.00 54.13 52.57 2k8c s LEU 43 Cb -0.13 -1.43 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 2k8c s LEU 43 CO 0.02 0.07 -0.25 -0.63 0.23 0.00 0.00 176.35 175.80 2k8c s ILE 44 N 0.84 2.08 -0.26 -0.59 1.01 -0.73 -1.41 121.20 122.14 2k8c s ILE 44 Ca -0.07 -1.05 0.03 0.00 0.00 0.00 0.00 60.65 59.56 2k8c s ILE 44 Cb -0.15 -1.76 0.06 0.00 0.01 0.00 0.00 42.46 40.61 2k8c s ILE 44 CO -0.02 0.57 -0.10 0.12 0.00 0.00 0.00 174.94 175.50 2k8c s PHE 45 N -0.02 3.14 0.00 3.97 5.36 0.62 -2.11 117.98 128.95 2k8c s PHE 45 Ca -0.08 -2.24 0.00 0.00 -0.96 0.00 0.00 56.93 53.65 2k8c s PHE 45 Cb -0.15 -1.88 0.00 0.00 -0.34 0.00 0.00 43.02 40.65 2k8c s PHE 45 CO 0.05 -0.86 0.00 0.00 -1.46 0.00 0.00 175.22 172.95 2k8c n ALA 46 N 4.47 0.00 -1.82 11.12 0.00 -1.26 -1.32 120.51 131.70 2k8c n ALA 46 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2k8c n ALA 46 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 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 0.00 0.19 3.15 0.00 0.00 -1.26 -5.11 105.19 102.16 2k8c n GLY 47 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2k8c n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8c s LYS 48 N 0.00 1.10 0.09 1.61 3.01 -0.43 -5.14 119.74 119.99 2k8c s LYS 48 Ca 0.00 -0.69 -0.16 0.00 -1.01 0.00 0.00 55.97 54.11 2k8c s LYS 48 Cb 0.00 -1.11 -0.07 0.00 -1.01 0.00 0.00 37.83 35.65 2k8c s LYS 48 CO 0.00 0.29 0.53 1.14 0.51 0.00 0.00 175.35 177.82 2k8c s GLN 49 N -0.82 4.04 -0.40 1.68 -2.07 -1.26 -0.27 119.66 120.56 2k8c s GLN 49 Ca 0.04 0.55 -0.28 0.00 -1.82 0.00 0.00 55.36 53.86 2k8c s GLN 49 Cb -0.07 -3.09 0.02 0.00 -1.09 0.00 0.00 33.01 28.78 2k8c s GLN 49 CO 0.01 0.58 1.03 -0.51 -1.32 0.00 0.00 175.29 175.07 2k8c s LEU 50 N -1.50 3.87 0.31 2.60 1.43 -0.50 -4.95 118.68 119.93 2k8c s LEU 50 Ca 0.32 0.62 -0.27 0.00 -1.03 0.00 0.00 54.13 53.77 2k8c s LEU 50 Cb -0.17 -3.42 -0.09 0.00 0.03 0.00 0.00 46.19 42.54 2k8c s LEU 50 CO 0.18 -1.01 0.98 -1.61 0.23 0.00 0.00 176.35 175.12 2k8c s GLU 51 N 3.86 4.61 0.53 1.70 2.02 -1.26 -4.79 118.70 125.36 2k8c s GLU 51 Ca 0.43 1.46 0.32 0.00 0.02 0.00 0.00 54.97 57.20 2k8c s GLU 51 Cb -0.10 -2.94 1.30 0.00 0.10 0.00 0.00 34.13 32.49 2k8c s GLU 51 CO 0.23 0.28 1.96 0.38 0.02 0.00 0.00 175.26 178.13 2k8c h ASP 52 N 3.42 0.00 -0.13 -0.19 2.03 -1.95 -2.63 116.42 116.98 2k8c h ASP 52 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 2k8c h ASP 52 Cb 1.20 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 2k8c h ASP 52 CO 0.66 0.04 0.00 0.61 -1.03 0.00 0.00 179.24 179.52 2k8c n GLY 53 N 0.03 -0.36 3.59 7.15 0.00 -1.26 -3.92 105.19 110.42 2k8c n GLY 53 Ca 0.00 -0.14 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.82 1.92 0.45 1.61 0.52 -0.99 -5.04 118.95 115.61 2k8c s ARG 54 Ca 0.09 -2.13 0.05 0.00 -0.52 0.00 0.00 55.73 53.22 2k8c s ARG 54 Cb 0.05 -1.29 -0.05 0.00 0.52 0.00 0.00 34.95 34.18 2k8c s ARG 54 CO 0.06 -0.20 0.02 0.95 0.02 0.00 0.00 175.30 176.15 2k8c s THR 55 N -2.96 1.65 0.31 0.02 -4.23 -1.26 -1.69 115.64 107.48 2k8c s THR 55 Ca 0.28 -1.98 0.04 0.00 -1.18 0.00 0.00 61.69 58.85 2k8c s THR 55 Cb 0.07 -2.63 0.11 0.00 1.34 0.00 0.00 72.50 71.39 2k8c s THR 55 CO 0.14 0.00 1.80 -0.07 -0.54 0.00 0.00 174.62 175.95 2k8c h LEU 56 N 1.56 0.47 -0.60 4.79 3.38 -1.70 -2.29 115.31 120.93 2k8c h LEU 56 Ca -0.44 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.33 2k8c h LEU 56 Cb 1.27 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2k8c h LEU 56 CO 0.77 0.64 -0.37 0.77 0.09 0.00 0.00 178.44 180.34 2k8c h SER 57 N 0.45 0.00 -0.64 -0.43 4.64 -1.92 -2.85 113.55 112.80 2k8c h SER 57 Ca 0.08 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.36 2k8c h SER 57 Cb 0.50 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.56 2k8c h SER 57 CO 0.03 0.37 0.22 -0.78 -0.87 0.00 0.00 176.83 175.80 2k8c h ASP 58 N 0.00 0.91 0.42 4.97 3.58 -1.73 -1.63 116.42 122.94 2k8c h ASP 58 Ca -0.00 -0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.25 2k8c h ASP 58 Cb 1.05 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.86 2k8c h ASP 58 CO 0.05 0.87 -0.07 -1.22 -2.88 0.00 0.00 179.24 175.98 2k8c n TYR 59 N -4.38 0.00 -3.63 0.28 4.01 -1.18 -4.92 117.16 107.34 2k8c n TYR 59 Ca 0.04 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.56 2k8c n TYR 59 Cb 0.20 -0.21 0.06 0.00 -0.31 0.00 0.00 39.34 39.08 2k8c n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2k8c n ASN 60 N -1.07 -3.03 -4.74 7.72 2.85 -0.61 -4.93 115.26 111.45 2k8c n ASN 60 Ca 0.15 -0.69 -0.41 0.00 -0.11 0.00 0.00 54.58 53.51 2k8c n ASN 60 Cb 0.26 -4.57 -0.04 0.00 1.24 0.00 0.00 39.78 36.67 2k8c n ASN 60 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2k8c s ILE 61 N -3.44 3.68 0.67 -1.44 1.01 -1.09 -5.04 121.20 115.55 2k8c s ILE 61 Ca 0.22 1.44 -0.04 0.00 0.00 0.00 0.00 60.65 62.27 2k8c s ILE 61 Cb -0.10 -3.92 0.06 0.00 0.01 0.00 0.00 42.46 38.51 2k8c s ILE 61 CO 0.77 0.24 0.95 -1.10 0.00 0.00 0.00 174.94 175.81 2k8c s GLN 62 N -0.37 2.20 0.71 2.79 -1.52 -1.26 -4.93 119.66 117.28 2k8c s GLN 62 Ca 0.51 -0.50 -0.12 0.00 -1.95 0.00 0.00 55.36 53.30 2k8c s GLN 62 Cb -0.31 -2.27 0.03 0.00 -0.22 0.00 0.00 33.01 30.24 2k8c s GLN 62 CO 0.36 -1.14 1.09 -1.59 -0.25 0.00 0.00 175.29 173.76 2k8c s LYS 63 N -5.12 2.59 -1.41 2.91 -2.85 -1.26 -3.71 119.74 110.89 2k8c s LYS 63 Ca 0.60 1.22 -0.07 0.00 -1.00 0.00 0.00 55.97 56.73 2k8c s LYS 63 Cb -0.10 -1.93 0.04 0.00 -2.06 0.00 0.00 37.83 33.78 2k8c s LYS 63 CO 0.43 -1.39 0.84 0.39 0.10 0.00 0.00 175.35 175.72 2k8c n GLU 64 N -3.01 -5.29 -2.91 1.78 4.71 -1.25 -4.95 120.64 109.73 2k8c n GLU 64 Ca 0.09 0.62 -0.35 0.00 -0.01 0.00 0.00 57.16 57.51 2k8c n GLU 64 Cb 0.53 -5.34 -0.06 0.00 -1.01 0.00 0.00 31.44 25.56 2k8c n GLU 64 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 2k8c s SER 65 N -3.86 7.11 -0.33 1.62 1.04 -1.24 -4.87 113.70 113.17 2k8c s SER 65 Ca 0.32 1.64 -0.11 0.00 0.48 0.00 0.00 55.95 58.27 2k8c s SER 65 Cb -0.16 -2.51 -0.01 0.00 0.10 0.00 0.00 66.02 63.44 2k8c s SER 65 CO 0.82 -0.13 0.20 -0.89 0.98 0.00 0.00 173.24 174.22 2k8c s THR 66 N -1.77 5.00 0.17 2.02 2.01 -1.26 -0.86 115.64 120.94 2k8c s THR 66 Ca 0.52 -0.30 0.07 0.00 0.31 0.00 0.00 61.69 62.28 2k8c s THR 66 Cb -0.15 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.76 2k8c s THR 66 CO 0.20 0.02 0.01 -0.76 -0.69 0.00 0.00 174.62 173.40 2k8c s LEU 67 N 1.68 3.37 -0.18 4.42 1.02 0.56 -4.75 118.68 124.80 2k8c s LEU 67 Ca 0.05 -0.35 0.00 0.00 0.02 0.00 0.00 54.13 53.85 2k8c s LEU 67 Cb -0.17 -2.03 0.01 0.00 0.02 0.00 0.00 46.19 44.02 2k8c s LEU 67 CO 0.09 0.09 -0.16 -1.00 0.02 0.00 0.00 176.35 175.39 2k8c s HIS 68 N -1.71 2.80 -0.35 0.29 3.76 -0.90 -0.04 115.29 119.15 2k8c s HIS 68 Ca 0.28 -1.31 -0.22 0.00 -0.15 0.00 0.00 55.06 53.65 2k8c s HIS 68 Cb -0.09 -1.93 0.00 0.00 1.11 0.00 0.00 32.58 31.67 2k8c s HIS 68 CO 0.19 -0.64 0.73 -1.17 -0.85 0.00 0.00 174.74 173.00 2k8c s LEU 69 N 1.14 4.16 0.28 0.89 2.96 0.02 -1.77 118.68 126.35 2k8c s LEU 69 Ca 0.01 0.36 0.09 0.00 -0.22 0.00 0.00 54.13 54.36 2k8c s LEU 69 Cb -0.14 -2.95 -0.04 0.00 0.50 0.00 0.00 46.19 43.56 2k8c s LEU 69 CO -0.06 -0.65 0.07 -0.69 -1.32 0.00 0.00 176.35 173.70 2k8c s VAL 70 N 2.92 3.58 0.00 1.68 1.01 0.52 -4.16 120.40 125.95 2k8c s VAL 70 Ca 0.29 -1.76 0.00 0.00 0.00 0.00 0.00 61.98 60.51 2k8c s VAL 70 Cb -0.14 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.25 2k8c s VAL 70 CO 0.15 -0.33 0.00 0.18 0.00 0.00 0.00 175.10 175.10 2k8c n LEU 71 N -1.01 0.00 -3.64 3.92 4.32 -1.26 -1.65 117.00 117.68 2k8c n LEU 71 Ca -0.06 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.87 2k8c n LEU 71 Cb 0.59 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.33 2k8c n LEU 71 CO 0.41 0.00 0.36 0.00 -1.22 0.00 0.00 177.39 176.95 2k8c s ARG 72 N 1.19 0.66 0.08 3.23 1.70 -1.26 -4.32 118.95 120.23 2k8c s ARG 72 Ca 0.00 1.22 -0.27 0.00 -0.47 0.00 0.00 55.73 56.21 2k8c s ARG 72 Cb 0.00 0.25 -0.17 0.00 -0.57 0.00 0.00 34.95 34.46 2k8c s ARG 72 CO 0.00 -0.15 1.66 1.25 -1.08 0.00 0.00 175.30 176.98 2k8c h LEU 73 N 7.09 -0.31 0.00 -1.89 5.85 -2.00 -3.44 115.31 120.61 2k8c h LEU 73 Ca -0.28 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.43 2k8c h LEU 73 Cb 1.21 0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.32 2k8c h LEU 73 CO 0.15 -0.19 0.00 0.54 -0.34 0.00 0.00 178.44 178.60 2k8c n ARG 74 N -5.23 0.00 0.00 1.25 1.74 -1.26 -5.15 116.66 108.01 2k8c n ARG 74 Ca -0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.98 2k8c n ARG 74 Cb 0.17 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.61 2k8c n ARG 74 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k8c n GLY 75 N 3.51 -1.43 0.00 -0.13 0.00 -1.26 -5.24 105.19 100.63 2k8c n GLY 75 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 46.02 46.56 2k8c n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93