#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 3.71 -0.11 3.17 0.74 -1.26 -1.80 119.66 124.11 2k8c s GLN 2 Ca 0.00 -0.48 -0.10 0.00 0.05 0.00 0.00 55.36 54.83 2k8c s GLN 2 Cb 0.00 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.98 2k8c s GLN 2 CO 0.00 0.11 0.21 0.96 -0.55 0.00 0.00 175.29 176.02 2k8c s ILE 3 N 0.76 5.38 -0.96 -2.34 -4.36 0.75 -2.71 121.20 117.73 2k8c s ILE 3 Ca 0.01 0.37 -0.13 0.00 -0.26 0.00 0.00 60.65 60.64 2k8c s ILE 3 Cb -0.14 -3.50 0.23 0.00 1.25 0.00 0.00 42.46 40.30 2k8c s ILE 3 CO 0.02 0.56 0.96 -0.36 0.24 0.00 0.00 174.94 176.37 2k8c s PHE 4 N -0.70 3.85 -0.08 1.37 0.40 0.50 -1.43 117.98 121.88 2k8c s PHE 4 Ca 0.16 -2.17 -0.22 0.00 -0.60 0.00 0.00 56.93 54.11 2k8c s PHE 4 Cb -0.13 -3.91 -0.04 0.00 0.51 0.00 0.00 43.02 39.46 2k8c s PHE 4 CO 0.05 -1.06 0.63 0.54 0.70 0.00 0.00 175.22 176.08 2k8c s VAL 5 N 0.05 5.09 -0.19 -0.44 0.11 -0.68 -1.23 120.40 123.12 2k8c s VAL 5 Ca 0.25 1.29 -0.06 0.00 -2.93 0.00 0.00 61.98 60.53 2k8c s VAL 5 Cb -0.09 -3.97 -0.04 0.00 -1.53 0.00 0.00 36.38 30.76 2k8c s VAL 5 CO -0.08 0.28 0.04 -0.54 -3.33 0.00 0.00 175.10 171.47 2k8c s LYS 6 N 0.71 3.85 0.99 1.54 1.02 0.10 0.04 119.74 127.98 2k8c s LYS 6 Ca 0.34 -0.41 -0.17 0.00 0.02 0.00 0.00 55.97 55.75 2k8c s LYS 6 Cb -0.17 -3.16 0.22 0.00 -0.52 0.00 0.00 37.83 34.20 2k8c s LYS 6 CO 0.16 0.19 1.34 0.99 -0.92 0.00 0.00 175.35 177.11 2k8c s THR 7 N 0.57 1.99 0.36 2.17 2.01 0.31 -0.73 115.64 122.33 2k8c s THR 7 Ca 0.02 0.00 0.06 0.00 0.31 0.00 0.00 61.69 62.08 2k8c s THR 7 Cb -0.13 -2.99 0.29 0.00 0.01 0.00 0.00 72.50 69.68 2k8c s THR 7 CO 0.02 0.00 1.95 0.25 -0.69 0.00 0.00 174.62 176.15 2k8c h LEU 8 N -1.73 0.66 0.00 4.42 5.85 -1.81 0.26 115.31 122.96 2k8c h LEU 8 Ca -0.44 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2k8c h LEU 8 Cb 1.22 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.12 2k8c h LEU 8 CO 0.34 0.42 0.00 1.07 -0.34 0.00 0.00 178.44 179.94 2k8c n THR 9 N -4.48 0.00 -0.71 1.05 5.66 -1.26 -4.84 114.28 109.69 2k8c n THR 9 Ca 0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.11 2k8c n THR 9 Cb 0.24 -0.36 0.00 0.00 -1.55 0.00 0.00 70.33 68.66 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 0.82 0.80 3.67 1.09 0.00 0.08 -5.00 105.19 106.64 2k8c n GLY 10 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.29 4.19 -0.35 1.61 2.20 -1.26 -4.66 119.74 121.18 2k8c s LYS 11 Ca 0.00 2.20 -0.20 0.00 -0.36 0.00 0.00 55.97 57.61 2k8c s LYS 11 Cb 0.00 -3.91 0.00 0.00 -1.51 0.00 0.00 37.83 32.41 2k8c s LYS 11 CO 0.00 -0.82 0.63 0.99 -0.36 0.00 0.00 175.35 175.79 2k8c s THR 12 N 3.76 4.90 -0.11 3.43 2.01 -1.26 -0.53 115.64 127.84 2k8c s THR 12 Ca 0.73 0.57 -0.02 0.00 0.31 0.00 0.00 61.69 63.28 2k8c s THR 12 Cb -0.34 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.07 2k8c s THR 12 CO 0.30 -0.30 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.27 2k8c s ILE 13 N 2.68 4.03 -0.38 1.82 1.01 0.11 -4.96 121.20 125.51 2k8c s ILE 13 Ca 0.24 -0.33 -0.17 0.00 0.00 0.00 0.00 60.65 60.38 2k8c s ILE 13 Cb -0.15 -2.72 0.01 0.00 0.01 0.00 0.00 42.46 39.61 2k8c s ILE 13 CO 0.15 0.55 0.45 0.42 0.00 0.00 0.00 174.94 176.51 2k8c s THR 14 N -0.34 5.07 -0.26 2.92 -4.23 -1.26 -1.68 115.64 115.87 2k8c s THR 14 Ca 0.06 -0.04 -0.04 0.00 -1.18 0.00 0.00 61.69 60.49 2k8c s THR 14 Cb -0.12 -3.97 0.01 0.00 1.34 0.00 0.00 72.50 69.75 2k8c s THR 14 CO 0.02 -0.30 -0.01 -0.76 -0.54 0.00 0.00 174.62 173.04 2k8c s LEU 15 N 2.22 3.33 -0.30 4.79 2.01 -0.52 -4.96 118.68 125.25 2k8c s LEU 15 Ca 0.14 -0.67 -0.12 0.00 0.01 0.00 0.00 54.13 53.50 2k8c s LEU 15 Cb -0.16 -1.76 -0.04 0.00 0.01 0.00 0.00 46.19 44.24 2k8c s LEU 15 CO 0.13 -0.12 0.21 -1.83 1.01 0.00 0.00 176.35 175.76 2k8c s GLU 16 N 1.43 3.80 0.10 1.70 1.03 -1.26 -0.17 118.70 125.32 2k8c s GLU 16 Ca 0.03 -0.43 -0.08 0.00 0.03 0.00 0.00 54.97 54.52 2k8c s GLU 16 Cb -0.16 -3.71 -0.01 0.00 -0.80 0.00 0.00 34.13 29.45 2k8c s GLU 16 CO -0.02 -0.27 0.19 0.14 -1.33 0.00 0.00 175.26 173.97 2k8c s VAL 17 N 1.75 0.14 0.24 1.83 -7.23 -0.75 -5.00 120.40 111.39 2k8c s VAL 17 Ca 0.07 -1.25 0.03 0.00 -1.81 0.00 0.00 61.98 59.02 2k8c s VAL 17 Cb -0.16 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.33 2k8c s VAL 17 CO 0.11 -0.63 0.39 -1.61 -0.31 0.00 0.00 175.10 173.05 2k8c s GLU 18 N -3.88 3.46 0.34 4.82 0.41 -1.26 -0.06 118.70 122.54 2k8c s GLU 18 Ca 0.07 -0.59 0.24 0.00 -0.41 0.00 0.00 54.97 54.28 2k8c s GLU 18 Cb 0.05 -2.85 1.24 0.00 -1.78 0.00 0.00 34.13 30.79 2k8c s GLU 18 CO -0.10 0.38 1.75 -1.35 -0.49 0.00 0.00 175.26 175.45 2k8c h PRO 19 N 1.34 0.00 0.00 0.39 0.11 -1.99 -0.10 132.00 131.74 2k8c h PRO 19 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 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 0.63 0.00 -0.16 0.77 -0.21 0.00 0.00 178.00 179.03 2k8c h SER 20 N 0.00 0.00 -3.34 -2.05 0.02 -2.01 -3.37 113.55 102.79 2k8c h SER 20 Ca 0.00 -0.04 -0.58 0.00 -0.84 0.00 0.00 61.79 60.33 2k8c h SER 20 Cb 0.11 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.58 2k8c h SER 20 CO 0.00 0.02 0.27 -1.81 -1.14 0.00 0.00 176.83 174.17 2k8c s ASP 21 N -4.78 6.92 0.70 3.07 1.01 -0.05 -5.05 116.67 118.49 2k8c s ASP 21 Ca 0.09 1.13 -0.13 0.00 0.71 0.00 0.00 52.55 54.35 2k8c s ASP 21 Cb 0.11 -2.43 0.02 0.00 1.01 0.00 0.00 42.92 41.63 2k8c s ASP 21 CO 0.64 -0.31 1.09 0.42 0.21 0.00 0.00 175.17 177.22 2k8c s THR 22 N 1.76 3.48 0.33 -1.27 -4.23 -1.26 -4.30 115.64 110.16 2k8c s THR 22 Ca 0.37 0.58 0.07 0.00 -1.18 0.00 0.00 61.69 61.52 2k8c s THR 22 Cb -0.17 -3.12 0.31 0.00 1.34 0.00 0.00 72.50 70.87 2k8c s THR 22 CO 0.14 -0.54 1.84 0.40 -0.54 0.00 0.00 174.62 175.92 2k8c h ILE 23 N -0.47 0.82 -0.87 2.99 1.08 -0.82 0.13 117.51 120.38 2k8c h ILE 23 Ca -0.45 -0.26 0.03 0.00 -0.39 0.00 0.00 64.86 63.79 2k8c h ILE 23 Cb 1.23 -0.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.91 2k8c h ILE 23 CO 0.54 0.14 0.57 1.05 -0.69 0.00 0.00 178.15 179.76 2k8c h GLU 24 N 0.77 1.07 -0.26 2.37 4.11 -1.81 0.85 114.58 121.68 2k8c h GLU 24 Ca 0.49 -0.06 -0.15 0.00 0.07 0.00 0.00 59.36 59.71 2k8c h GLU 24 Cb 0.73 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2k8c h GLU 24 CO -0.26 0.71 -0.43 -0.97 0.07 0.00 0.00 179.01 178.13 2k8c h ASN 25 N 1.10 0.71 -0.52 3.06 -1.24 -1.32 -2.44 115.58 114.91 2k8c h ASN 25 Ca 0.34 -0.33 -0.06 0.00 0.71 0.00 0.00 56.30 56.96 2k8c h ASN 25 Cb -0.00 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 38.83 2k8c h ASN 25 CO -0.10 1.04 0.10 0.58 -1.29 0.00 0.00 177.43 177.77 2k8c h VAL 26 N 0.53 1.25 -0.32 2.57 2.07 -0.71 -1.55 116.25 120.10 2k8c h VAL 26 Ca 0.04 -0.92 -0.00 0.00 0.82 0.00 0.00 66.70 66.64 2k8c h VAL 26 Cb 0.97 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 2k8c h VAL 26 CO 0.09 0.33 0.19 0.11 0.02 0.00 0.00 177.57 178.31 2k8c h LYS 27 N 0.74 0.42 -0.04 1.57 1.57 -0.70 -1.51 116.57 118.63 2k8c h LYS 27 Ca 0.16 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.71 2k8c h LYS 27 Cb 0.38 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.60 2k8c h LYS 27 CO 0.01 0.30 -0.82 0.00 -0.57 0.00 0.00 179.45 178.37 2k8c h ALA 28 N 1.77 0.50 -0.25 3.86 0.00 -0.96 -3.08 119.26 121.11 2k8c h ALA 28 Ca 0.11 -0.65 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 2k8c h ALA 28 Cb -0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2k8c h ALA 28 CO -0.02 0.80 -0.14 -0.22 0.00 0.00 0.00 179.25 179.66 2k8c h LYS 29 N 0.25 0.42 -0.17 0.00 3.64 -0.32 -1.63 116.57 118.76 2k8c h LYS 29 Ca -0.05 -0.12 -0.09 0.00 -1.27 0.00 0.00 60.65 59.13 2k8c h LYS 29 Cb 1.42 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 33.18 2k8c h LYS 29 CO 0.14 0.56 -0.27 0.82 -2.27 0.00 0.00 179.45 178.43 2k8c h ILE 30 N 0.39 1.26 -0.15 2.00 2.04 -1.32 -0.38 117.51 121.35 2k8c h ILE 30 Ca 0.07 -1.22 -0.17 0.00 1.00 0.00 0.00 64.86 64.54 2k8c h ILE 30 Cb 0.49 1.43 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2k8c h ILE 30 CO 0.03 0.37 -0.62 -0.61 0.00 0.00 0.00 178.15 177.32 2k8c h GLN 31 N 0.29 0.53 -0.37 2.37 4.15 -1.28 0.22 115.11 121.02 2k8c h GLN 31 Ca 0.04 -0.37 -0.13 0.00 0.77 0.00 0.00 58.65 58.96 2k8c h GLN 31 Cb 0.63 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.37 2k8c h GLN 31 CO 0.05 0.99 -0.28 0.22 -1.93 0.00 0.00 178.83 177.88 2k8c h ASP 32 N 0.39 0.88 0.06 -0.69 1.82 -0.91 -2.09 116.42 115.89 2k8c h ASP 32 Ca -0.01 -0.44 -0.00 0.00 -0.39 0.00 0.00 57.03 56.19 2k8c h ASP 32 Cb 1.18 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 40.95 2k8c h ASP 32 CO 0.11 1.14 -0.03 0.11 -1.61 0.00 0.00 179.24 178.96 2k8c h LYS 33 N 0.64 -0.08 0.00 0.28 1.57 -1.03 -3.43 116.57 114.52 2k8c h LYS 33 Ca 0.07 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2k8c h LYS 33 Cb 0.85 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.18 2k8c h LYS 33 CO 0.07 -0.05 -0.06 0.93 -0.57 0.00 0.00 179.45 179.77 2k8c h GLU 34 N -0.76 0.00 0.00 3.15 4.39 -0.72 -3.50 114.58 117.14 2k8c h GLU 34 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2k8c h GLU 34 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2k8c h GLU 34 CO 0.01 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.27 2k8c n GLY 35 N 1.81 1.02 3.67 -3.84 0.00 -0.79 -4.99 105.19 102.08 2k8c n GLY 35 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 3.37 0.55 -0.61 1.01 -1.26 -4.81 121.20 119.45 2k8c s ILE 36 Ca 0.00 0.64 -0.21 0.00 0.00 0.00 0.00 60.65 61.09 2k8c s ILE 36 Cb 0.00 -3.41 -0.05 0.00 0.01 0.00 0.00 42.46 39.01 2k8c s ILE 36 CO 0.00 -0.03 1.26 -2.16 0.00 0.00 0.00 174.94 174.01 2k8c s PRO 37 N 3.35 3.16 0.59 2.79 0.04 -1.26 -3.40 135.00 140.26 2k8c s PRO 37 Ca 0.73 1.99 0.29 0.00 0.04 0.00 0.00 61.00 64.04 2k8c s PRO 37 Cb -0.36 -2.14 1.67 0.00 0.04 0.00 0.00 34.50 33.71 2k8c s PRO 37 CO 0.31 -1.10 2.12 -1.00 0.04 0.00 0.00 177.00 177.37 2k8c h PRO 38 N 1.31 0.00 0.00 0.56 0.13 -1.94 -0.63 132.00 131.44 2k8c h PRO 38 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 2k8c h PRO 38 Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 2k8c h PRO 38 CO 0.57 0.00 -0.07 -0.44 -0.23 0.00 0.00 178.00 177.82 2k8c h ASP 39 N 0.00 0.00 -0.23 1.44 5.19 -1.93 -2.02 116.42 118.87 2k8c h ASP 39 Ca 0.07 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.48 2k8c h ASP 39 Cb 0.42 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.93 2k8c h ASP 39 CO -0.00 0.07 0.00 0.00 -3.12 0.00 0.00 179.24 176.19 2k8c n GLN 40 N -3.41 2.78 -2.64 3.56 6.02 -0.26 -4.88 117.38 118.55 2k8c n GLN 40 Ca -0.01 -2.17 -0.43 0.00 -0.01 0.00 0.00 57.00 54.37 2k8c n GLN 40 Cb 0.22 -1.37 -0.00 0.00 1.02 0.00 0.00 30.24 30.11 2k8c n GLN 40 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2k8c s GLN 41 N -1.58 3.95 -1.27 -1.09 2.00 -0.76 -4.25 119.66 116.66 2k8c s GLN 41 Ca 0.24 -1.98 -0.16 0.00 -2.00 0.00 0.00 55.36 51.46 2k8c s GLN 41 Cb 0.16 -5.43 0.11 0.00 0.80 0.00 0.00 33.01 28.65 2k8c s GLN 41 CO 0.10 -2.17 1.64 -2.13 -0.50 0.00 0.00 175.29 172.23 2k8c n ARG 42 N 8.00 3.27 -2.97 1.67 0.63 -1.15 -4.96 116.66 121.14 2k8c n ARG 42 Ca 0.45 -3.49 -0.41 0.00 -0.92 0.00 0.00 57.85 53.47 2k8c n ARG 42 Cb 0.46 -3.29 -0.05 0.00 0.45 0.00 0.00 32.46 30.03 2k8c n ARG 42 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2k8c s LEU 43 N 2.98 4.07 -0.16 6.15 1.43 -1.26 -1.89 118.68 130.01 2k8c s LEU 43 Ca 0.49 0.89 -0.01 0.00 -1.03 0.00 0.00 54.13 54.47 2k8c s LEU 43 Cb 0.02 -3.06 -0.01 0.00 0.03 0.00 0.00 46.19 43.17 2k8c s LEU 43 CO 0.04 -0.47 -0.13 -0.63 0.23 0.00 0.00 176.35 175.39 2k8c s ILE 44 N 2.73 2.89 -0.04 -0.59 1.01 0.02 -2.40 121.20 124.82 2k8c s ILE 44 Ca 0.32 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 60.26 2k8c s ILE 44 Cb -0.15 -2.23 0.03 0.00 0.01 0.00 0.00 42.46 40.11 2k8c s ILE 44 CO 0.08 0.50 0.01 0.12 0.00 0.00 0.00 174.94 175.66 2k8c s PHE 45 N 0.77 0.37 -1.58 3.97 5.36 0.77 -2.36 117.98 125.28 2k8c s PHE 45 Ca -0.05 0.01 0.00 0.00 -0.96 0.00 0.00 56.93 55.92 2k8c s PHE 45 Cb -0.15 -0.54 0.00 0.00 -0.34 0.00 0.00 43.02 41.98 2k8c s PHE 45 CO 0.01 -0.20 0.00 0.00 -1.46 0.00 0.00 175.22 173.57 2k8c n ALA 46 N 4.68 -0.23 -0.15 11.12 0.00 -1.26 -0.97 120.51 133.71 2k8c n ALA 46 Ca -0.16 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2k8c n ALA 46 Cb 0.50 -1.81 0.00 0.00 0.00 0.00 0.00 19.45 18.14 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 -0.31 0.58 3.45 0.00 0.00 -1.26 -5.06 105.19 102.58 2k8c n GLY 47 Ca -0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.82 1.60 0.01 1.61 3.01 -0.14 -5.12 119.74 119.88 2k8c s LYS 48 Ca 0.00 -1.49 -0.18 0.00 -1.01 0.00 0.00 55.97 53.29 2k8c s LYS 48 Cb 0.00 -1.89 -0.06 0.00 -1.01 0.00 0.00 37.83 34.87 2k8c s LYS 48 CO 0.00 0.41 0.51 1.14 0.51 0.00 0.00 175.35 177.92 2k8c s GLN 49 N -2.69 4.16 -0.47 1.68 0.00 -1.26 -0.16 119.66 120.92 2k8c s GLN 49 Ca 0.21 0.59 -0.28 0.00 -0.00 0.00 0.00 55.36 55.88 2k8c s GLN 49 Cb -0.08 -3.28 0.00 0.00 0.00 0.00 0.00 33.01 29.65 2k8c s GLN 49 CO 0.11 0.53 1.53 -0.51 0.00 0.00 0.00 175.29 176.95 2k8c s LEU 50 N -0.65 3.48 0.51 2.60 1.43 -1.01 -4.95 118.68 120.09 2k8c s LEU 50 Ca 0.27 0.68 -0.21 0.00 -1.03 0.00 0.00 54.13 53.84 2k8c s LEU 50 Cb -0.18 -3.26 -0.07 0.00 0.03 0.00 0.00 46.19 42.71 2k8c s LEU 50 CO 0.16 -1.68 1.12 -1.61 0.23 0.00 0.00 176.35 174.56 2k8c s GLU 51 N 5.49 3.55 0.24 1.70 2.02 -1.26 -4.92 118.70 125.53 2k8c s GLU 51 Ca 0.62 1.60 -0.05 0.00 0.02 0.00 0.00 54.97 57.17 2k8c s GLU 51 Cb -0.14 -2.13 0.26 0.00 0.10 0.00 0.00 34.13 32.21 2k8c s GLU 51 CO 0.29 -0.68 1.79 0.38 0.02 0.00 0.00 175.26 177.05 2k8c h ASP 52 N 1.50 0.96 -0.22 -0.19 2.03 -1.94 -2.83 116.42 115.74 2k8c h ASP 52 Ca -0.50 -0.17 -0.14 0.00 -0.73 0.00 0.00 57.03 55.49 2k8c h ASP 52 Cb 1.25 -0.25 -0.06 0.00 -0.83 0.00 0.00 39.33 39.44 2k8c h ASP 52 CO 0.58 0.90 0.18 0.61 -1.03 0.00 0.00 179.24 180.48 2k8c n GLY 53 N -0.82 3.08 3.19 7.15 0.00 -1.26 -3.49 105.19 113.03 2k8c n GLY 53 Ca 0.05 -0.44 -0.14 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.81 0.90 0.53 1.61 1.81 -1.07 -5.04 118.95 116.88 2k8c s ARG 54 Ca 0.14 -1.26 0.03 0.00 -1.72 0.00 0.00 55.73 52.92 2k8c s ARG 54 Cb 0.11 -0.50 0.01 0.00 -0.45 0.00 0.00 34.95 34.12 2k8c s ARG 54 CO 0.00 0.06 0.17 0.95 -0.68 0.00 0.00 175.30 175.81 2k8c s THR 55 N -2.84 1.32 0.35 0.02 -4.23 -1.26 -0.36 115.64 108.64 2k8c s THR 55 Ca 0.09 -1.79 0.11 0.00 -1.18 0.00 0.00 61.69 58.92 2k8c s THR 55 Cb -0.00 -2.11 0.08 0.00 1.34 0.00 0.00 72.50 71.80 2k8c s THR 55 CO -0.01 0.00 1.79 -0.07 -0.54 0.00 0.00 174.62 175.80 2k8c h LEU 56 N 1.08 0.08 -0.59 4.79 3.38 -1.75 -2.44 115.31 119.87 2k8c h LEU 56 Ca -0.41 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.45 2k8c h LEU 56 Cb 1.31 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 2k8c h LEU 56 CO 0.67 0.45 -0.40 0.77 0.09 0.00 0.00 178.44 180.02 2k8c h SER 57 N 0.07 0.00 -0.78 -0.43 4.64 -1.91 -1.54 113.55 113.59 2k8c h SER 57 Ca 0.01 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.35 2k8c h SER 57 Cb 0.70 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.74 2k8c h SER 57 CO 0.05 0.40 0.51 0.44 -0.87 0.00 0.00 176.83 177.36 2k8c h ASP 58 N 0.00 0.86 -0.16 4.97 3.32 -1.82 -2.08 116.42 121.50 2k8c h ASP 58 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2k8c h ASP 58 Cb 1.07 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.42 2k8c h ASP 58 CO 0.05 0.60 0.00 -1.22 -1.72 0.00 0.00 179.24 176.96 2k8c n TYR 59 N -4.58 0.19 -3.54 4.55 4.01 -1.22 -4.95 117.16 111.62 2k8c n TYR 59 Ca 0.08 -0.10 -0.19 0.00 -0.16 0.00 0.00 57.90 57.54 2k8c n TYR 59 Cb 0.06 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.15 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 1.10 -2.04 -4.72 7.72 2.85 -0.78 -4.91 115.26 114.48 2k8c n ASN 60 Ca 0.17 -0.69 -0.42 0.00 -0.11 0.00 0.00 54.58 53.53 2k8c n ASN 60 Cb 0.53 -4.73 -0.03 0.00 1.24 0.00 0.00 39.78 36.79 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 -3.46 3.23 0.35 -1.44 1.01 -0.60 -4.99 121.20 115.30 2k8c s ILE 61 Ca 0.05 0.91 -0.25 0.00 0.00 0.00 0.00 60.65 61.36 2k8c s ILE 61 Cb -0.02 -3.58 -0.10 0.00 0.01 0.00 0.00 42.46 38.77 2k8c s ILE 61 CO 0.76 0.09 1.00 -1.10 0.00 0.00 0.00 174.94 175.68 2k8c s GLN 62 N 0.80 4.41 0.24 2.79 -1.52 -1.26 -4.92 119.66 120.20 2k8c s GLN 62 Ca 0.63 1.43 -0.31 0.00 -1.95 0.00 0.00 55.36 55.15 2k8c s GLN 62 Cb -0.37 -2.70 -0.12 0.00 -0.22 0.00 0.00 33.01 29.59 2k8c s GLN 62 CO 0.32 0.10 1.63 0.36 -0.25 0.00 0.00 175.29 177.45 2k8c n LYS 63 N 0.31 2.63 -3.54 2.91 2.85 -1.26 -3.03 118.16 119.02 2k8c n LYS 63 Ca 0.03 0.94 -0.24 0.00 -1.05 0.00 0.00 58.31 57.99 2k8c n LYS 63 Cb 0.50 -2.74 0.05 0.00 -0.65 0.00 0.00 35.03 32.19 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 3.03 -2.23 -3.26 -1.58 4.71 -1.10 -5.00 120.64 115.21 2k8c n GLU 64 Ca 0.13 0.62 -0.19 0.00 -0.01 0.00 0.00 57.16 57.71 2k8c n GLU 64 Cb 0.35 -4.87 -0.01 0.00 -1.01 0.00 0.00 31.44 25.90 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 -3.61 5.46 -0.17 1.62 1.04 -1.17 -4.80 113.70 112.07 2k8c s SER 65 Ca 0.38 -0.52 -0.14 0.00 0.48 0.00 0.00 55.95 56.16 2k8c s SER 65 Cb -0.10 -0.68 -0.05 0.00 0.10 0.00 0.00 66.02 65.29 2k8c s SER 65 CO 0.81 -0.69 0.29 -0.89 0.98 0.00 0.00 173.24 173.75 2k8c s THR 66 N -2.38 5.30 0.36 2.02 2.01 -1.26 -0.37 115.64 121.32 2k8c s THR 66 Ca 0.51 0.54 0.05 0.00 0.31 0.00 0.00 61.69 63.11 2k8c s THR 66 Cb -0.07 -3.63 -0.07 0.00 0.01 0.00 0.00 72.50 68.73 2k8c s THR 66 CO 0.31 0.37 0.03 -0.76 -0.69 0.00 0.00 174.62 173.88 2k8c s LEU 67 N 0.57 2.52 -0.04 4.42 1.02 -0.37 -4.93 118.68 121.87 2k8c s LEU 67 Ca 0.16 -1.36 0.05 0.00 0.02 0.00 0.00 54.13 53.00 2k8c s LEU 67 Cb -0.13 -0.64 -0.01 0.00 0.02 0.00 0.00 46.19 45.43 2k8c s LEU 67 CO 0.04 -0.52 -0.20 -1.00 0.02 0.00 0.00 176.35 174.70 2k8c s HIS 68 N -3.00 1.92 -0.16 0.29 3.76 -0.99 0.00 115.29 117.11 2k8c s HIS 68 Ca 0.35 -0.54 0.00 0.00 -0.15 0.00 0.00 55.06 54.73 2k8c s HIS 68 Cb 0.09 -1.28 0.03 0.00 1.11 0.00 0.00 32.58 32.54 2k8c s HIS 68 CO 0.17 -0.16 -0.10 -1.17 -0.85 0.00 0.00 174.74 172.62 2k8c s LEU 69 N -0.08 1.73 0.00 0.89 2.96 0.09 -0.80 118.68 123.48 2k8c s LEU 69 Ca -0.02 -0.60 0.03 0.00 -0.22 0.00 0.00 54.13 53.32 2k8c s LEU 69 Cb -0.12 -1.07 -0.01 0.00 0.50 0.00 0.00 46.19 45.49 2k8c s LEU 69 CO 0.02 -0.12 0.11 1.33 -1.32 0.00 0.00 176.35 176.38 2k8c n VAL 70 N 4.81 0.00 -3.21 1.68 0.24 -0.79 -2.35 118.33 118.71 2k8c n VAL 70 Ca -0.14 -1.79 -0.34 0.00 -2.04 0.00 0.00 64.34 60.02 2k8c n VAL 70 Cb 0.49 0.65 -0.06 0.00 -1.47 0.00 0.00 33.84 33.45 2k8c n VAL 70 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2k8c s LEU 71 N 0.00 4.23 0.22 1.34 1.02 -1.26 -2.95 118.68 121.27 2k8c s LEU 71 Ca 0.16 1.23 -0.30 0.00 0.02 0.00 0.00 54.13 55.24 2k8c s LEU 71 Cb 0.01 -3.69 -0.09 0.00 0.02 0.00 0.00 46.19 42.44 2k8c s LEU 71 CO 0.11 -0.04 1.32 0.00 0.02 0.00 0.00 176.35 177.76 2k8c s ARG 72 N -2.41 4.38 -0.04 1.70 1.04 -1.26 -4.89 118.95 117.47 2k8c s ARG 72 Ca 0.46 2.09 -0.05 0.00 -1.04 0.00 0.00 55.73 57.20 2k8c s ARG 72 Cb -0.13 -3.17 -0.03 0.00 -2.04 0.00 0.00 34.95 29.57 2k8c s ARG 72 CO 0.19 -0.26 0.28 1.25 -0.04 0.00 0.00 175.30 176.73 2k8c h LEU 73 N 5.16 -0.14-10.15 -1.89 5.85 -1.99 -3.46 115.31 108.68 2k8c h LEU 73 Ca -0.45 0.00 -0.49 0.00 0.84 0.00 0.00 57.88 57.78 2k8c h LEU 73 Cb 1.22 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 2k8c h LEU 73 CO 0.76 0.12 -0.37 -0.13 -0.34 0.00 0.00 178.44 178.49 2k8c s ARG 74 N -2.04 3.46 0.00 1.25 0.52 -1.26 -5.07 118.95 115.81 2k8c s ARG 74 Ca -0.02 -0.57 0.00 0.00 -0.52 0.00 0.00 55.73 54.62 2k8c s ARG 74 Cb 0.00 -2.84 0.00 0.00 0.52 0.00 0.00 34.95 32.63 2k8c s ARG 74 CO 0.07 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.18 2k8c n GLY 75 N -1.22 -0.31 0.53 -3.53 0.00 -1.26 -5.18 105.19 94.23 2k8c n GLY 75 Ca -0.07 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.09 2k8c n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93