#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8i s LYS 2 N 0.00 2.34 -0.01 3.17 -2.85 -1.26 -4.68 119.74 116.45 2k8i s LYS 2 Ca 0.00 -1.76 -0.25 0.00 -1.00 0.00 0.00 55.97 52.96 2k8i s LYS 2 Cb 0.00 -2.13 -0.04 0.00 -2.06 0.00 0.00 37.83 33.60 2k8i s LYS 2 CO 0.00 -0.19 0.76 0.54 0.10 0.00 0.00 175.35 176.56 2k8i s VAL 3 N -2.57 4.89 0.15 1.79 0.11 -1.26 -4.93 120.40 118.58 2k8i s VAL 3 Ca 0.43 1.60 -0.01 0.00 -2.93 0.00 0.00 61.98 61.07 2k8i s VAL 3 Cb 0.01 -4.11 0.00 0.00 -1.53 0.00 0.00 36.38 30.75 2k8i s VAL 3 CO 0.24 0.29 0.20 0.00 -3.33 0.00 0.00 175.10 172.50 2k8i n ALA 4 N 3.38 -0.12 -1.33 1.54 0.00 -1.26 -2.05 120.51 120.66 2k8i n ALA 4 Ca -0.01 -0.70 -0.33 0.00 0.00 0.00 0.00 53.44 52.40 2k8i n ALA 4 Cb 0.51 0.57 0.08 0.00 0.00 0.00 0.00 19.45 20.61 2k8i n ALA 4 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2k8i s LYS 5 N -2.35 2.28 0.00 0.00 2.20 -1.26 -2.59 119.74 118.02 2k8i s LYS 5 Ca 0.13 1.52 0.00 0.00 -0.36 0.00 0.00 55.97 57.26 2k8i s LYS 5 Cb -0.00 -1.87 0.00 0.00 -1.51 0.00 0.00 37.83 34.44 2k8i s LYS 5 CO 0.09 -1.68 0.00 -0.25 -0.36 0.00 0.00 175.35 173.15 2k8i n ASP 6 N -2.87 0.00 -4.52 1.43 8.00 0.10 -4.92 116.55 113.76 2k8i n ASP 6 Ca 0.11 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.18 2k8i n ASP 6 Cb 0.51 -1.96 -0.06 0.00 -0.02 0.00 0.00 41.12 39.59 2k8i n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2k8i s LEU 7 N 0.00 4.43 0.49 0.64 1.43 -1.07 -3.54 118.68 121.06 2k8i s LEU 7 Ca 0.00 -0.30 -0.24 0.00 -1.03 0.00 0.00 54.13 52.56 2k8i s LEU 7 Cb 0.00 -2.79 -0.07 0.00 0.03 0.00 0.00 46.19 43.36 2k8i s LEU 7 CO 0.00 -0.84 1.36 0.55 0.23 0.00 0.00 176.35 177.64 2k8i n VAL 8 N 5.94 3.17 -3.73 -1.59 3.14 -0.80 -2.82 118.33 121.65 2k8i n VAL 8 Ca -0.01 -0.50 -0.13 0.00 -2.96 0.00 0.00 64.34 60.75 2k8i n VAL 8 Cb 0.48 -1.70 -0.10 0.00 -1.06 0.00 0.00 33.84 31.46 2k8i n VAL 8 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2k8i s VAL 9 N -1.24 -0.01 -0.26 1.55 1.01 -1.09 -0.72 120.40 119.64 2k8i s VAL 9 Ca 0.66 0.02 -0.09 0.00 0.00 0.00 0.00 61.98 62.56 2k8i s VAL 9 Cb -0.45 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 2k8i s VAL 9 CO 0.54 0.01 0.14 -0.44 0.00 0.00 0.00 175.10 175.34 2k8i s SER 10 N 0.48 5.69 0.06 3.32 0.01 -0.51 -3.65 113.70 119.09 2k8i s SER 10 Ca -0.02 -0.06 0.01 0.00 1.31 0.00 0.00 55.95 57.19 2k8i s SER 10 Cb -0.04 -2.04 -0.03 0.00 0.21 0.00 0.00 66.02 64.12 2k8i s SER 10 CO -0.02 -0.02 -0.06 -0.22 0.41 0.00 0.00 173.24 173.33 2k8i s LEU 11 N 1.54 2.36 0.12 2.44 0.20 -0.87 -1.26 118.68 123.20 2k8i s LEU 11 Ca 0.06 -0.74 0.09 0.00 0.69 0.00 0.00 54.13 54.23 2k8i s LEU 11 Cb -0.15 -0.06 -0.04 0.00 -0.43 0.00 0.00 46.19 45.51 2k8i s LEU 11 CO 0.07 -0.34 -0.21 0.00 -0.29 0.00 0.00 176.35 175.57 2k8i s ALA 12 N -2.39 1.93 0.08 5.97 0.00 0.95 0.12 121.76 128.42 2k8i s ALA 12 Ca -0.02 -1.33 -0.26 0.00 0.00 0.00 0.00 51.96 50.34 2k8i s ALA 12 Cb -0.03 -0.25 0.08 0.00 0.00 0.00 0.00 23.12 22.92 2k8i s ALA 12 CO -0.03 0.36 0.79 1.52 0.00 0.00 0.00 175.76 178.40 2k8i s TYR 13 N -1.35 -0.38 -0.11 0.00 1.13 0.15 0.45 117.35 117.24 2k8i s TYR 13 Ca 0.10 0.19 -0.01 0.00 -1.41 0.00 0.00 57.07 55.94 2k8i s TYR 13 Cb -0.09 0.56 0.03 0.00 -1.10 0.00 0.00 41.96 41.36 2k8i s TYR 13 CO 0.05 -0.70 -0.04 -1.14 -2.51 0.00 0.00 175.55 171.21 2k8i s GLN 14 N -3.38 1.10 -0.19 -3.49 0.74 -0.64 0.31 119.66 114.11 2k8i s GLN 14 Ca 0.05 -0.15 -0.04 0.00 0.05 0.00 0.00 55.36 55.27 2k8i s GLN 14 Cb -0.01 -1.42 -0.02 0.00 1.10 0.00 0.00 33.01 32.66 2k8i s GLN 14 CO -0.09 -0.32 -0.03 0.54 -0.55 0.00 0.00 175.29 174.84 2k8i s VAL 15 N 1.81 3.65 0.35 1.34 0.11 0.13 -0.74 120.40 127.06 2k8i s VAL 15 Ca 0.04 -0.42 0.02 0.00 -2.93 0.00 0.00 61.98 58.69 2k8i s VAL 15 Cb -0.13 -2.64 -0.01 0.00 -1.53 0.00 0.00 36.38 32.08 2k8i s VAL 15 CO -0.07 0.44 0.42 -2.11 -3.33 0.00 0.00 175.10 170.46 2k8i n ARG 16 N 4.26 0.61 -3.02 1.54 1.85 0.23 -1.40 116.66 120.72 2k8i n ARG 16 Ca -0.18 -3.05 -0.18 0.00 -1.00 0.00 0.00 57.85 53.44 2k8i n ARG 16 Cb 0.52 2.76 0.04 0.00 -1.05 0.00 0.00 32.46 34.73 2k8i n ARG 16 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2k8i s THR 17 N -3.03 2.54 0.26 8.89 -4.23 -0.77 0.81 115.64 120.12 2k8i s THR 17 Ca 0.34 -1.00 0.37 0.00 -1.18 0.00 0.00 61.69 60.22 2k8i s THR 17 Cb 0.00 -2.54 0.39 0.00 1.34 0.00 0.00 72.50 71.69 2k8i s THR 17 CO 0.24 0.00 2.10 -0.33 -0.54 0.00 0.00 174.62 176.09 2k8i h GLU 18 N 0.38 0.00 0.00 3.99 5.08 -1.92 -1.39 114.58 120.73 2k8i h GLU 18 Ca -0.35 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2k8i h GLU 18 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2k8i h GLU 18 CO 0.43 0.00 0.00 0.22 -1.00 0.00 0.00 179.01 178.66 2k8i h ASP 19 N 0.00 0.00 0.00 1.42 3.58 -1.93 -3.47 116.42 116.02 2k8i h ASP 19 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k8i h ASP 19 Cb 0.26 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2k8i h ASP 19 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2k8i n GLY 20 N 0.93 1.00 3.69 -0.78 0.00 -0.52 -5.06 105.19 104.45 2k8i n GLY 20 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2k8i n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8i s VAL 21 N -2.14 4.01 -0.01 1.61 0.11 -1.26 -4.74 120.40 117.98 2k8i s VAL 21 Ca 0.00 1.39 -0.30 0.00 -2.93 0.00 0.00 61.98 60.14 2k8i s VAL 21 Cb 0.00 -3.89 -0.04 0.00 -1.53 0.00 0.00 36.38 30.92 2k8i s VAL 21 CO 0.00 0.02 1.11 -0.22 -3.33 0.00 0.00 175.10 172.69 2k8i s LEU 22 N 2.01 4.33 -0.21 2.54 2.96 -1.26 -1.85 118.68 127.19 2k8i s LEU 22 Ca 0.59 1.79 0.09 0.00 -0.22 0.00 0.00 54.13 56.38 2k8i s LEU 22 Cb -0.28 -3.57 -0.21 0.00 0.50 0.00 0.00 46.19 42.63 2k8i s LEU 22 CO 0.25 -0.44 -0.02 1.33 -1.32 0.00 0.00 176.35 176.15 2k8i n VAL 23 N 4.21 1.47 -3.67 1.68 0.24 -0.49 -4.98 118.33 116.79 2k8i n VAL 23 Ca 0.09 -0.71 -0.04 0.00 -2.04 0.00 0.00 64.34 61.63 2k8i n VAL 23 Cb 0.48 -1.02 -0.01 0.00 -1.47 0.00 0.00 33.84 31.81 2k8i n VAL 23 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2k8i s ASP 24 N -6.10 -0.22 0.02 -1.34 -1.08 -0.93 -5.05 116.67 101.96 2k8i s ASP 24 Ca -0.22 -0.27 -0.28 0.00 -0.52 0.00 0.00 52.55 51.26 2k8i s ASP 24 Cb 0.08 0.43 0.10 0.00 -1.46 0.00 0.00 42.92 42.07 2k8i s ASP 24 CO 0.72 -0.78 0.83 -1.83 0.52 0.00 0.00 175.17 174.63 2k8i s GLU 25 N -3.17 0.91 -0.19 4.34 1.03 -1.26 -0.69 118.70 119.67 2k8i s GLU 25 Ca 0.10 -0.30 0.00 0.00 0.03 0.00 0.00 54.97 54.80 2k8i s GLU 25 Cb -0.01 0.42 0.04 0.00 -0.80 0.00 0.00 34.13 33.78 2k8i s GLU 25 CO -0.01 -0.39 -0.08 -1.12 -1.33 0.00 0.00 175.26 172.32 2k8i s SER 26 N -2.45 3.22 0.94 0.83 0.01 0.15 -4.98 113.70 111.42 2k8i s SER 26 Ca 0.04 -0.82 -0.12 0.00 1.31 0.00 0.00 55.95 56.35 2k8i s SER 26 Cb -0.01 -1.12 0.16 0.00 0.21 0.00 0.00 66.02 65.26 2k8i s SER 26 CO -0.09 -0.16 1.09 -2.16 0.41 0.00 0.00 173.24 172.33 2k8i s PRO 27 N 1.48 0.86 0.53 12.44 0.04 -1.23 -0.67 135.00 148.45 2k8i s PRO 27 Ca -0.01 0.80 0.30 0.00 0.04 0.00 0.00 61.00 62.14 2k8i s PRO 27 Cb -0.16 -1.76 1.44 0.00 0.04 0.00 0.00 34.50 34.05 2k8i s PRO 27 CO -0.08 -2.51 2.04 -0.24 0.04 0.00 0.00 177.00 176.25 2k8i h VAL 28 N -1.74 0.36 -0.26 -0.36 3.04 -1.94 -2.89 116.25 112.47 2k8i h VAL 28 Ca -0.51 -0.59 -0.18 0.00 -1.01 0.00 0.00 66.70 64.40 2k8i h VAL 28 Cb 1.30 1.43 -0.00 0.00 -2.01 0.00 0.00 31.29 32.01 2k8i h VAL 28 CO 0.54 0.10 -0.56 0.77 -1.01 0.00 0.00 177.57 177.41 2k8i h SER 29 N 0.00 0.88 -3.24 3.17 4.64 -2.01 -3.41 113.55 113.58 2k8i h SER 29 Ca -0.00 -0.48 -0.49 0.00 -0.47 0.00 0.00 61.79 60.35 2k8i h SER 29 Cb 0.42 -0.25 -0.39 0.00 -0.31 0.00 0.00 62.40 61.87 2k8i h SER 29 CO 0.01 1.26 -0.76 0.00 -0.87 0.00 0.00 176.83 176.47 2k8i s ALA 30 N -4.07 0.86 0.82 5.18 0.00 -1.09 -5.15 121.76 118.31 2k8i s ALA 30 Ca -0.10 -0.49 -0.12 0.00 0.00 0.00 0.00 51.96 51.26 2k8i s ALA 30 Cb 0.10 -1.04 0.08 0.00 0.00 0.00 0.00 23.12 22.27 2k8i s ALA 30 CO 0.88 -0.96 1.11 -2.14 0.00 0.00 0.00 175.76 174.66 2k8i s PRO 31 N 1.92 1.88 0.03 0.00 0.02 -1.24 -3.51 135.00 134.10 2k8i s PRO 31 Ca 0.01 0.49 -0.24 0.00 0.02 0.00 0.00 61.00 61.28 2k8i s PRO 31 Cb -0.15 -1.91 -0.05 0.00 0.02 0.00 0.00 34.50 32.40 2k8i s PRO 31 CO -0.07 -1.73 0.73 -1.17 -0.33 0.00 0.00 177.00 174.43 2k8i s LEU 32 N -5.80 4.43 -0.20 -5.54 2.96 0.31 -4.87 118.68 109.98 2k8i s LEU 32 Ca 0.61 1.37 0.01 0.00 -0.22 0.00 0.00 54.13 55.90 2k8i s LEU 32 Cb -0.14 -3.16 0.02 0.00 0.50 0.00 0.00 46.19 43.41 2k8i s LEU 32 CO 0.53 0.02 -0.17 -1.81 -1.32 0.00 0.00 176.35 173.60 2k8i s ASP 33 N 0.01 3.49 0.38 3.68 1.11 -1.26 -2.06 116.67 122.02 2k8i s ASP 33 Ca 0.37 -0.76 -0.16 0.00 0.18 0.00 0.00 52.55 52.19 2k8i s ASP 33 Cb -0.20 -1.52 0.06 0.00 1.07 0.00 0.00 42.92 42.33 2k8i s ASP 33 CO 0.21 -0.04 0.82 -0.31 1.18 0.00 0.00 175.17 177.03 2k8i s TYR 34 N 1.28 0.15 -0.28 4.23 2.02 -1.24 -4.98 117.35 118.53 2k8i s TYR 34 Ca 0.03 -0.83 -0.09 0.00 -0.37 0.00 0.00 57.07 55.82 2k8i s TYR 34 Cb -0.14 0.84 -0.02 0.00 -0.40 0.00 0.00 41.96 42.24 2k8i s TYR 34 CO -0.11 -1.55 0.12 -1.17 -1.57 0.00 0.00 175.55 171.27 2k8i s LEU 35 N -3.12 3.79 0.08 -1.29 2.96 -1.26 -2.69 118.68 117.15 2k8i s LEU 35 Ca 0.16 -0.34 -0.31 0.00 -0.22 0.00 0.00 54.13 53.42 2k8i s LEU 35 Cb -0.05 -1.97 -0.07 0.00 0.50 0.00 0.00 46.19 44.60 2k8i s LEU 35 CO 0.11 -0.11 1.34 -2.28 -1.32 0.00 0.00 176.35 174.09 2k8i s HIS 36 N 1.62 3.22 0.00 5.38 5.65 -1.13 -3.31 115.29 126.72 2k8i s HIS 36 Ca 0.05 1.02 0.00 0.00 0.25 0.00 0.00 55.06 56.38 2k8i s HIS 36 Cb -0.16 -3.61 0.00 0.00 -1.18 0.00 0.00 32.58 27.63 2k8i s HIS 36 CO 0.05 -2.10 0.00 0.41 -0.65 0.00 0.00 174.74 172.45 2k8i n GLY 37 N 3.45 0.85 0.17 1.59 0.00 -1.26 -0.73 105.19 109.27 2k8i n GLY 37 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.14 2k8i n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k8i n HIS 38 N -2.14 0.00 -0.12 1.61 8.25 -1.21 -4.67 115.22 116.93 2k8i n HIS 38 Ca 0.00 -0.21 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 2k8i n HIS 38 Cb 0.00 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.07 2k8i n HIS 38 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k8i n GLY 39 N -0.26 0.10 0.86 -1.41 0.00 -1.26 -4.95 105.19 98.27 2k8i n GLY 39 Ca 0.02 -0.85 -0.04 0.00 0.00 0.00 0.00 46.02 45.15 2k8i n GLY 39 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2k8i n SER 40 N 0.00 0.55 0.00 1.61 2.88 -1.23 -4.35 113.62 113.07 2k8i n SER 40 Ca 0.00 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.62 2k8i n SER 40 Cb 0.00 -0.20 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 2k8i n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k8i n LEU 41 N -3.32 0.00 0.00 2.46 -0.00 -1.26 -4.81 117.00 110.08 2k8i n LEU 41 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.93 2k8i n LEU 41 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.88 2k8i n LEU 41 CO 0.01 0.00 0.00 2.30 -0.00 0.00 0.00 177.39 179.70 2k8i n ILE 42 N -0.72 0.00 -0.13 1.47 -5.35 -1.26 -5.10 119.36 108.27 2k8i n ILE 42 Ca 0.00 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.20 2k8i n ILE 42 Cb 0.00 0.00 -0.10 0.00 -1.74 0.00 0.00 39.64 37.80 2k8i n ILE 42 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2k8i n SER 43 N -0.43 1.94 0.10 7.28 2.88 0.20 -4.34 113.62 121.24 2k8i n SER 43 Ca 0.00 0.36 -0.16 0.00 -1.33 0.00 0.00 58.87 57.74 2k8i n SER 43 Cb 0.00 -0.85 -0.14 0.00 -0.75 0.00 0.00 64.21 62.47 2k8i n SER 43 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2k8i h GLY 44 N -1.00 0.30 0.60 0.46 0.00 -0.75 -3.30 103.07 99.38 2k8i h GLY 44 Ca -0.63 -0.77 -0.08 0.00 0.00 0.00 0.00 47.33 45.84 2k8i h GLY 44 CO -0.38 0.68 -0.30 -2.00 0.00 0.00 0.00 176.54 174.53 2k8i h LEU 45 N 0.07 0.33 -0.91 3.11 5.85 -1.82 -2.79 115.31 119.15 2k8i h LEU 45 Ca -0.13 -0.70 0.18 0.00 0.84 0.00 0.00 57.88 58.07 2k8i h LEU 45 Cb 1.97 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 42.79 2k8i h LEU 45 CO 0.20 0.97 0.48 -0.33 -0.34 0.00 0.00 178.44 179.43 2k8i h GLU 46 N -0.29 0.59 -0.22 1.25 5.08 -1.76 0.30 114.58 119.53 2k8i h GLU 46 Ca -0.03 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2k8i h GLU 46 Cb 0.99 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 2k8i h GLU 46 CO 0.06 0.39 -0.14 1.15 -1.00 0.00 0.00 179.01 179.47 2k8i h THR 47 N 0.61 1.21 -0.08 1.13 2.02 -1.61 -0.46 112.91 115.73 2k8i h THR 47 Ca 0.53 -0.94 -0.19 0.00 0.77 0.00 0.00 66.41 66.58 2k8i h THR 47 Cb 0.84 1.20 -0.00 0.00 -1.74 0.00 0.00 68.15 68.45 2k8i h THR 47 CO -0.41 0.30 -0.76 0.00 0.37 0.00 0.00 175.52 175.02 2k8i h ALA 48 N 1.52 0.54 -0.38 6.16 0.00 -0.37 -3.01 119.26 123.73 2k8i h ALA 48 Ca 0.07 -0.62 -0.07 0.00 0.00 0.00 0.00 54.91 54.28 2k8i h ALA 48 Cb 0.45 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2k8i h ALA 48 CO 0.03 0.76 -0.08 -0.07 0.00 0.00 0.00 179.25 179.89 2k8i h LEU 49 N 0.30 0.61 -9.79 0.00 3.38 -0.19 -3.46 115.31 106.17 2k8i h LEU 49 Ca -0.04 -0.16 -0.56 0.00 0.09 0.00 0.00 57.88 57.21 2k8i h LEU 49 Cb 1.34 -0.16 0.18 0.00 0.09 0.00 0.00 40.66 42.11 2k8i h LEU 49 CO 0.13 0.73 -0.11 -0.62 0.09 0.00 0.00 178.44 178.66 2k8i n GLU 50 N -4.20 0.49 0.00 1.13 1.02 -0.21 -2.96 120.64 115.91 2k8i n GLU 50 Ca 0.01 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.37 2k8i n GLU 50 Cb 0.32 -2.03 0.00 0.00 -0.02 0.00 0.00 31.44 29.71 2k8i n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k8i n GLY 51 N 1.38 2.68 3.28 0.62 0.00 -0.87 -4.97 105.19 107.31 2k8i n GLY 51 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 2k8i n GLY 51 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k8i s HIS 52 N -1.20 1.50 0.35 1.61 -3.43 -1.15 -4.75 115.29 108.22 2k8i s HIS 52 Ca 0.00 -0.59 0.07 0.00 -0.80 0.00 0.00 55.06 53.74 2k8i s HIS 52 Cb 0.00 -0.75 -0.01 0.00 -1.43 0.00 0.00 32.58 30.39 2k8i s HIS 52 CO 0.00 0.21 0.44 -1.21 -2.00 0.00 0.00 174.74 172.18 2k8i s GLU 53 N -3.18 2.94 0.39 -0.38 2.02 -1.26 -4.02 118.70 115.21 2k8i s GLU 53 Ca 0.15 -1.15 -0.24 0.00 0.02 0.00 0.00 54.97 53.75 2k8i s GLU 53 Cb -0.02 -2.70 -0.12 0.00 0.10 0.00 0.00 34.13 31.39 2k8i s GLU 53 CO 0.04 -0.00 0.72 1.33 0.02 0.00 0.00 175.26 177.37 2k8i n VAL 54 N -1.60 2.01 0.00 2.63 0.24 -1.26 -2.81 118.33 117.54 2k8i n VAL 54 Ca 0.01 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 2k8i n VAL 54 Cb 0.59 -0.73 0.00 0.00 -1.47 0.00 0.00 33.84 32.23 2k8i n VAL 54 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k8i n GLY 55 N 1.57 0.61 3.74 7.63 0.00 -0.91 -4.94 105.19 112.90 2k8i n GLY 55 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2k8i n GLY 55 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k8i s ASP 56 N -2.30 7.28 -0.02 1.61 -1.08 -1.12 -4.89 116.67 116.15 2k8i s ASP 56 Ca 0.00 2.13 0.01 0.00 -0.52 0.00 0.00 52.55 54.16 2k8i s ASP 56 Cb 0.00 -2.61 0.02 0.00 -1.46 0.00 0.00 42.92 38.87 2k8i s ASP 56 CO 0.00 -0.18 -0.01 -0.75 0.52 0.00 0.00 175.17 174.75 2k8i s LYS 57 N -0.68 0.29 -0.09 4.34 2.36 -1.26 -2.70 119.74 122.01 2k8i s LYS 57 Ca 0.48 0.03 -0.32 0.00 -2.55 0.00 0.00 55.97 53.61 2k8i s LYS 57 Cb -0.30 -0.42 0.12 0.00 -1.05 0.00 0.00 37.83 36.18 2k8i s LYS 57 CO 0.36 -0.08 1.14 -0.59 1.55 0.00 0.00 175.35 177.73 2k8i s PHE 58 N 0.74 -0.15 -0.09 4.03 -0.71 -1.06 -4.99 117.98 115.75 2k8i s PHE 58 Ca -0.07 0.05 -0.09 0.00 -1.04 0.00 0.00 56.93 55.78 2k8i s PHE 58 Cb -0.11 0.54 -0.04 0.00 -1.21 0.00 0.00 43.02 42.20 2k8i s PHE 58 CO -0.01 -0.34 0.20 0.16 -1.34 0.00 0.00 175.22 173.89 2k8i s ASP 59 N -2.47 6.49 0.10 1.98 -4.77 -1.26 -0.42 116.67 116.32 2k8i s ASP 59 Ca 0.10 0.59 0.08 0.00 -3.30 0.00 0.00 52.55 50.01 2k8i s ASP 59 Cb 0.00 -2.11 -0.03 0.00 -1.09 0.00 0.00 42.92 39.68 2k8i s ASP 59 CO -0.05 0.39 -0.20 -0.69 0.70 0.00 0.00 175.17 175.32 2k8i s VAL 60 N -1.02 1.66 -0.14 2.11 1.01 0.26 -4.95 120.40 119.33 2k8i s VAL 60 Ca 0.17 -1.55 -0.02 0.00 0.00 0.00 0.00 61.98 60.58 2k8i s VAL 60 Cb -0.13 -1.53 0.05 0.00 0.00 0.00 0.00 36.38 34.76 2k8i s VAL 60 CO 0.06 -0.10 0.03 0.00 0.00 0.00 0.00 175.10 175.09 2k8i s ALA 61 N -1.25 0.83 0.03 5.51 0.00 -1.26 -0.05 121.76 125.57 2k8i s ALA 61 Ca 0.06 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 51.63 2k8i s ALA 61 Cb -0.10 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.01 2k8i s ALA 61 CO 0.04 -0.89 -0.13 0.08 0.00 0.00 0.00 175.76 174.86 2k8i s VAL 62 N 1.93 1.01 0.58 0.00 1.01 -0.51 -4.95 120.40 119.47 2k8i s VAL 62 Ca 0.02 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 60.95 2k8i s VAL 62 Cb -0.15 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 2k8i s VAL 62 CO -0.07 0.03 1.10 -0.83 0.00 0.00 0.00 175.10 175.33 2k8i s GLY 63 N -0.96 2.35 0.55 4.51 0.00 -1.26 -0.84 107.32 111.68 2k8i s GLY 63 Ca 0.01 0.61 0.26 0.00 0.00 0.00 0.00 44.72 45.61 2k8i s GLY 63 CO 0.01 0.96 2.02 0.00 0.00 0.00 0.00 173.10 176.08 2k8i h ALA 64 N 0.70 2.25 0.00 3.20 0.00 -0.17 0.17 119.26 125.43 2k8i h ALA 64 Ca -0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2k8i h ALA 64 Cb 1.24 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2k8i h ALA 64 CO 0.56 -0.53 -0.04 -2.95 0.00 0.00 0.00 179.25 176.29 2k8i h ASN 65 N 0.00 0.00 -0.05 0.00 -1.07 -1.87 -1.79 115.58 110.81 2k8i h ASN 65 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.56 2k8i h ASN 65 Cb 0.84 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.09 2k8i h ASN 65 CO -0.00 0.04 0.00 0.47 0.07 0.00 0.00 177.43 178.01 2k8i n ASP 66 N -3.15 1.96 0.00 6.14 8.00 0.37 -4.92 116.55 124.95 2k8i n ASP 66 Ca 0.01 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.02 2k8i n ASP 66 Cb 0.35 -0.03 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 2k8i n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8i n ALA 67 N 0.54 0.10 -3.38 2.24 0.00 0.18 0.05 120.51 120.23 2k8i n ALA 67 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.58 2k8i n ALA 67 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.72 2k8i n ALA 67 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2k8i n TYR 68 N 0.00 -0.04 -0.58 0.00 4.11 -0.73 -4.66 117.16 115.26 2k8i n TYR 68 Ca 0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 57.90 57.70 2k8i n TYR 68 Cb 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 39.34 39.43 2k8i n TYR 68 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2k8i n GLY 69 N -0.36 0.65 3.61 -7.48 0.00 -1.26 -4.38 105.19 95.96 2k8i n GLY 69 Ca 0.02 -0.61 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 2k8i n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k8i s GLN 70 N -1.12 3.37 -0.34 1.61 1.11 -1.26 -4.86 119.66 118.17 2k8i s GLN 70 Ca 0.00 1.73 -0.08 0.00 0.01 0.00 0.00 55.36 57.03 2k8i s GLN 70 Cb 0.00 -4.23 0.03 0.00 -1.01 0.00 0.00 33.01 27.80 2k8i s GLN 70 CO 0.00 -1.82 0.13 -0.47 0.01 0.00 0.00 175.29 173.14 2k8i s TYR 71 N 7.01 3.24 -1.08 0.91 6.14 -1.26 -4.46 117.35 127.84 2k8i s TYR 71 Ca 0.86 -1.23 -0.09 0.00 0.64 0.00 0.00 57.07 57.26 2k8i s TYR 71 Cb -0.28 -2.32 0.27 0.00 0.42 0.00 0.00 41.96 40.06 2k8i s TYR 71 CO 0.34 -0.68 1.07 0.34 0.64 0.00 0.00 175.55 177.25 2k8i s ASP 72 N 1.46 7.17 0.07 4.32 -1.08 -1.26 -3.98 116.67 123.37 2k8i s ASP 72 Ca -0.00 -3.58 0.22 0.00 -0.52 0.00 0.00 52.55 48.67 2k8i s ASP 72 Cb -0.19 -2.18 0.91 0.00 -1.46 0.00 0.00 42.92 40.00 2k8i s ASP 72 CO 0.04 -0.29 1.70 -1.84 0.52 0.00 0.00 175.17 175.31 2k8i n GLU 73 N 2.71 0.07 0.13 4.34 0.28 -1.26 -1.86 120.64 125.05 2k8i n GLU 73 Ca 0.23 0.19 0.12 0.00 -0.16 0.00 0.00 57.16 57.54 2k8i n GLU 73 Cb 0.39 -1.60 0.06 0.00 1.43 0.00 0.00 31.44 31.72 2k8i n GLU 73 CO 0.00 0.00 0.00 -2.95 -0.16 0.00 0.00 177.13 174.02 2k8i h ASN 74 N 0.00 0.00 0.47 -1.84 7.08 -1.89 -3.31 115.58 116.09 2k8i h ASN 74 Ca 0.00 -0.01 0.00 0.00 -3.08 0.00 0.00 56.30 53.21 2k8i h ASN 74 Cb 0.42 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.66 2k8i h ASN 74 CO 0.00 0.01 -0.65 -0.11 -2.08 0.00 0.00 177.43 174.60 2k8i n LEU 75 N -2.76 0.59 -4.77 6.14 7.94 -0.77 -4.84 117.00 118.53 2k8i n LEU 75 Ca 0.01 -0.03 -0.38 0.00 -1.11 0.00 0.00 56.01 54.49 2k8i n LEU 75 Cb 0.54 -0.19 -0.06 0.00 0.53 0.00 0.00 43.42 44.24 2k8i n LEU 75 CO 0.38 0.11 0.67 0.54 -1.11 0.00 0.00 177.39 177.98 2k8i s VAL 76 N -3.05 4.05 0.36 1.96 0.11 -1.02 -4.62 120.40 118.19 2k8i s VAL 76 Ca 0.09 1.87 -0.16 0.00 -2.93 0.00 0.00 61.98 60.85 2k8i s VAL 76 Cb 0.16 -4.11 0.04 0.00 -1.53 0.00 0.00 36.38 30.94 2k8i s VAL 76 CO 0.74 0.30 0.74 0.00 -3.33 0.00 0.00 175.10 173.55 2k8i s GLN 77 N -1.67 2.10 0.10 1.54 -2.07 -0.86 -4.99 119.66 113.80 2k8i s GLN 77 Ca 0.46 -1.37 0.08 0.00 -1.82 0.00 0.00 55.36 52.72 2k8i s GLN 77 Cb -0.23 0.60 -0.04 0.00 -1.09 0.00 0.00 33.01 32.25 2k8i s GLN 77 CO 0.29 -0.97 -0.15 1.03 -1.32 0.00 0.00 175.29 174.17 2k8i s ARG 78 N -2.76 1.95 -0.04 9.60 3.00 -1.26 -1.20 118.95 128.25 2k8i s ARG 78 Ca 0.16 -1.09 -0.01 0.00 0.00 0.00 0.00 55.73 54.79 2k8i s ARG 78 Cb -0.05 -2.19 0.03 0.00 0.00 0.00 0.00 34.95 32.74 2k8i s ARG 78 CO 0.11 0.50 0.07 0.08 0.00 0.00 0.00 175.30 176.06 2k8i s VAL 79 N -1.12 -0.06 0.30 3.52 1.01 0.85 -4.93 120.40 119.96 2k8i s VAL 79 Ca 0.18 0.22 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 2k8i s VAL 79 Cb -0.11 -0.14 -0.12 0.00 0.00 0.00 0.00 36.38 36.01 2k8i s VAL 79 CO 0.10 0.09 1.46 -2.65 0.00 0.00 0.00 175.10 174.10 2k8i n PRO 80 N 4.26 2.36 -0.07 2.72 -0.02 -1.26 0.06 135.00 143.04 2k8i n PRO 80 Ca -0.26 0.84 0.19 0.00 -2.02 0.00 0.00 63.50 62.24 2k8i n PRO 80 Cb 0.50 -2.53 0.62 0.00 -0.02 0.00 0.00 33.50 32.08 2k8i n PRO 80 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2k8i h LYS 81 N 3.92 0.15 -0.42 -0.52 1.79 -0.96 -0.30 116.57 120.23 2k8i h LYS 81 Ca -0.47 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 57.96 2k8i h LYS 81 Cb 1.26 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.85 2k8i h LYS 81 CO 0.73 0.10 0.11 0.22 -1.08 0.00 0.00 179.45 179.53 2k8i h ASP 82 N 0.16 0.57 -0.75 0.86 3.58 -1.90 -2.30 116.42 116.65 2k8i h ASP 82 Ca 0.30 -0.08 0.08 0.00 0.42 0.00 0.00 57.03 57.75 2k8i h ASP 82 Cb 0.97 -0.15 -0.05 0.00 1.72 0.00 0.00 39.33 41.83 2k8i h ASP 82 CO -0.05 0.57 0.49 0.58 -2.88 0.00 0.00 179.24 177.95 2k8i h VAL 83 N 0.61 0.99 -0.94 2.25 2.07 -1.41 -1.65 116.25 118.18 2k8i h VAL 83 Ca 0.14 -0.25 -0.65 0.00 0.82 0.00 0.00 66.70 66.76 2k8i h VAL 83 Cb 0.22 0.19 -0.32 0.00 -1.52 0.00 0.00 31.29 29.86 2k8i h VAL 83 CO -0.00 0.13 0.47 0.49 0.02 0.00 0.00 177.57 178.68 2k8i n PHE 84 N -4.49 3.11 0.06 1.57 3.72 -0.87 -4.71 117.46 115.85 2k8i n PHE 84 Ca 0.12 -2.83 0.21 0.00 -0.05 0.00 0.00 57.45 54.89 2k8i n PHE 84 Cb 0.27 -1.19 0.74 0.00 -0.94 0.00 0.00 39.48 38.36 2k8i n PHE 84 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k8i h MET 85 N 2.03 0.00 -0.04 -1.08 -0.00 -1.24 0.68 114.93 115.28 2k8i h MET 85 Ca 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.25 2k8i h MET 85 Cb 1.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.60 2k8i h MET 85 CO 1.39 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 178.71 2k8i n GLY 86 N -1.54 -0.62 3.85 -3.00 0.00 -1.26 -4.84 105.19 97.78 2k8i n GLY 86 Ca 0.08 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 2k8i n GLY 86 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k8i s VAL 87 N -1.95 5.01 0.00 1.61 1.01 0.23 -5.04 120.40 121.26 2k8i s VAL 87 Ca 0.33 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.96 2k8i s VAL 87 Cb 0.16 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.85 2k8i s VAL 87 CO 0.26 0.33 0.60 -0.67 0.00 0.00 0.00 175.10 175.63 2k8i n ASP 88 N 1.04 0.00 -3.72 3.32 2.03 -1.26 -4.72 116.55 113.24 2k8i n ASP 88 Ca -0.08 0.60 -0.28 0.00 0.52 0.00 0.00 54.79 55.55 2k8i n ASP 88 Cb 0.52 -0.10 -0.16 0.00 -0.72 0.00 0.00 41.12 40.66 2k8i n ASP 88 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2k8i s GLU 89 N -1.41 0.65 -0.35 -0.67 2.02 -1.26 -5.08 118.70 112.61 2k8i s GLU 89 Ca 0.00 -0.61 -0.27 0.00 0.02 0.00 0.00 54.97 54.11 2k8i s GLU 89 Cb 0.00 -2.01 -0.06 0.00 0.10 0.00 0.00 34.13 32.16 2k8i s GLU 89 CO 0.00 -0.76 2.32 1.28 0.02 0.00 0.00 175.26 178.12 2k8i n LEU 90 N 5.01 2.80 -4.40 1.80 4.77 -1.26 -4.91 117.00 120.81 2k8i n LEU 90 Ca -0.07 -0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 55.59 2k8i n LEU 90 Cb 0.45 -1.56 -0.10 0.00 -2.33 0.00 0.00 43.42 39.88 2k8i n LEU 90 CO 0.12 -1.09 -0.30 -1.58 -1.33 0.00 0.00 177.39 173.20 2k8i s GLN 91 N 7.25 1.53 0.13 3.23 0.74 -1.26 -4.87 119.66 126.40 2k8i s GLN 91 Ca 1.00 -1.81 -0.30 0.00 0.05 0.00 0.00 55.36 54.30 2k8i s GLN 91 Cb -0.28 -0.81 -0.06 0.00 1.10 0.00 0.00 33.01 32.96 2k8i s GLN 91 CO 0.31 -0.13 0.96 0.08 -0.55 0.00 0.00 175.29 175.97 2k8i s VAL 92 N -3.31 4.43 0.00 1.34 1.01 -1.26 -3.09 120.40 119.52 2k8i s VAL 92 Ca 0.33 2.06 0.00 0.00 0.00 0.00 0.00 61.98 64.37 2k8i s VAL 92 Cb 0.07 -4.31 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2k8i s VAL 92 CO 0.13 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.17 2k8i n GLY 93 N 2.16 0.70 3.74 4.51 0.00 0.20 -4.99 105.19 111.52 2k8i n GLY 93 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 2k8i n GLY 93 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k8i s MET 94 N -0.62 4.53 -0.05 1.61 -1.94 -1.18 -4.81 119.30 116.83 2k8i s MET 94 Ca 0.00 1.13 0.06 0.00 -1.71 0.00 0.00 55.69 55.17 2k8i s MET 94 Cb 0.00 -3.37 -0.01 0.00 2.01 0.00 0.00 34.83 33.46 2k8i s MET 94 CO 0.00 0.27 -0.24 1.03 -0.01 0.00 0.00 175.02 176.07 2k8i s ARG 95 N -0.05 2.52 0.15 2.03 0.52 -1.26 -0.85 118.95 122.01 2k8i s ARG 95 Ca 0.40 -0.89 -0.24 0.00 -0.52 0.00 0.00 55.73 54.48 2k8i s ARG 95 Cb -0.21 -2.18 0.06 0.00 0.52 0.00 0.00 34.95 33.14 2k8i s ARG 95 CO 0.24 0.42 0.80 -0.59 0.02 0.00 0.00 175.30 176.19 2k8i s PHE 96 N -0.25 -0.29 -0.04 -0.53 -0.12 -1.13 -5.05 117.98 110.58 2k8i s PHE 96 Ca -0.01 0.01 -0.21 0.00 -0.05 0.00 0.00 56.93 56.67 2k8i s PHE 96 Cb -0.13 0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 42.83 2k8i s PHE 96 CO 0.03 -0.86 0.62 -0.51 -0.05 0.00 0.00 175.22 174.44 2k8i s LEU 97 N -2.78 4.37 -0.28 -1.99 1.43 -1.26 -2.42 118.68 115.75 2k8i s LEU 97 Ca 0.08 1.13 -0.04 0.00 -1.03 0.00 0.00 54.13 54.27 2k8i s LEU 97 Cb -0.02 -2.95 0.02 0.00 0.03 0.00 0.00 46.19 43.27 2k8i s LEU 97 CO -0.03 0.02 0.00 0.00 0.23 0.00 0.00 176.35 176.57 2k8i s ALA 98 N 0.22 2.85 -0.76 4.21 0.00 -0.49 -4.86 121.76 122.94 2k8i s ALA 98 Ca 0.32 -1.52 -0.22 0.00 0.00 0.00 0.00 51.96 50.55 2k8i s ALA 98 Cb -0.18 -1.90 0.08 0.00 0.00 0.00 0.00 23.12 21.12 2k8i s ALA 98 CO 0.17 -0.94 1.06 -1.21 0.00 0.00 0.00 175.76 174.84 2k8i s GLU 99 N 1.38 3.28 0.32 0.00 2.02 -1.26 0.60 118.70 125.03 2k8i s GLU 99 Ca 0.00 -1.06 0.01 0.00 0.02 0.00 0.00 54.97 53.94 2k8i s GLU 99 Cb -0.17 -4.49 0.06 0.00 0.10 0.00 0.00 34.13 29.63 2k8i s GLU 99 CO -0.01 -1.86 0.44 0.25 0.02 0.00 0.00 175.26 174.10 2k8i n THR 100 N 5.92 0.00 -0.28 3.63 -2.24 0.26 -4.83 114.28 116.74 2k8i n THR 100 Ca 0.07 -0.78 0.07 0.00 -2.27 0.00 0.00 64.05 61.13 2k8i n THR 100 Cb 0.47 -1.04 0.21 0.00 -2.10 0.00 0.00 70.33 67.87 2k8i n THR 100 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2k8i h ASP 101 N -0.18 0.37 -0.92 3.42 3.32 -2.00 -1.30 116.42 119.13 2k8i h ASP 101 Ca -0.15 0.11 -0.51 0.00 0.02 0.00 0.00 57.03 56.50 2k8i h ASP 101 Cb 0.57 0.06 -0.28 0.00 0.22 0.00 0.00 39.33 39.91 2k8i h ASP 101 CO 0.17 0.13 0.65 0.00 -1.72 0.00 0.00 179.24 178.47 2k8i n GLN 102 N -4.96 2.24 0.00 3.56 10.64 -1.26 -5.02 117.38 122.58 2k8i n GLN 102 Ca 0.16 -2.83 0.00 0.00 -1.83 0.00 0.00 57.00 52.50 2k8i n GLN 102 Cb 0.45 -2.11 0.00 0.00 -0.86 0.00 0.00 30.24 27.72 2k8i n GLN 102 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2k8i n GLY 103 N -0.97 -0.15 3.76 2.61 0.00 -0.49 -4.95 105.19 105.01 2k8i n GLY 103 Ca 0.56 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.29 2k8i n GLY 103 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2k8i s PRO 104 N -1.02 3.38 -0.11 1.61 0.02 -1.26 -0.57 135.00 137.05 2k8i s PRO 104 Ca 0.00 1.86 -0.02 0.00 0.02 0.00 0.00 61.00 62.86 2k8i s PRO 104 Cb 0.00 -2.20 0.04 0.00 0.02 0.00 0.00 34.50 32.35 2k8i s PRO 104 CO 0.00 -0.88 -0.00 0.08 -0.33 0.00 0.00 177.00 175.87 2k8i s VAL 105 N -1.54 0.53 -0.60 3.83 1.01 0.20 -4.84 120.40 118.99 2k8i s VAL 105 Ca 0.70 -0.15 -0.27 0.00 0.00 0.00 0.00 61.98 62.26 2k8i s VAL 105 Cb -0.31 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.31 2k8i s VAL 105 CO 0.36 0.14 1.58 -2.84 0.00 0.00 0.00 175.10 174.34 2k8i s PRO 106 N 1.89 3.02 0.15 2.72 0.02 -1.26 -1.39 135.00 140.15 2k8i s PRO 106 Ca 0.03 0.43 0.11 0.00 0.02 0.00 0.00 61.00 61.59 2k8i s PRO 106 Cb -0.14 -4.24 -0.04 0.00 0.02 0.00 0.00 34.50 30.10 2k8i s PRO 106 CO -0.06 -2.29 -0.23 0.14 -0.33 0.00 0.00 177.00 174.23 2k8i s VAL 107 N 7.22 2.49 -0.05 3.83 -7.23 -1.01 -4.83 120.40 120.81 2k8i s VAL 107 Ca 0.56 -1.79 0.05 0.00 -1.81 0.00 0.00 61.98 58.99 2k8i s VAL 107 Cb -0.12 -2.16 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 2k8i s VAL 107 CO 0.22 0.00 -0.19 -0.70 -0.31 0.00 0.00 175.10 174.12 2k8i s GLU 108 N -2.36 2.53 -0.03 4.82 2.12 -1.12 -2.84 118.70 121.82 2k8i s GLU 108 Ca 0.18 -0.79 -0.28 0.00 0.36 0.00 0.00 54.97 54.44 2k8i s GLU 108 Cb -0.09 -2.29 -0.03 0.00 0.26 0.00 0.00 34.13 31.98 2k8i s GLU 108 CO 0.09 0.51 0.92 0.42 -0.54 0.00 0.00 175.26 176.66 2k8i s ILE 109 N -0.46 4.90 -0.55 -3.70 1.01 -0.03 -1.48 121.20 120.88 2k8i s ILE 109 Ca 0.05 1.91 0.05 0.00 0.00 0.00 0.00 60.65 62.67 2k8i s ILE 109 Cb -0.12 -4.25 0.10 0.00 0.01 0.00 0.00 42.46 38.20 2k8i s ILE 109 CO 0.01 0.16 0.91 0.35 0.00 0.00 0.00 174.94 176.37 2k8i n THR 110 N 3.98 0.53 0.00 2.92 -2.24 0.24 0.61 114.28 120.31 2k8i n THR 110 Ca 0.05 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 2k8i n THR 110 Cb 0.51 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 2k8i n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k8i n ALA 111 N 0.14 0.00 -3.59 6.98 0.00 -1.21 -4.91 120.51 117.92 2k8i n ALA 111 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.24 2k8i n ALA 111 Cb 0.24 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.53 2k8i n ALA 111 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2k8i s VAL 112 N -2.00 -0.13 0.00 0.00 1.01 -1.26 -0.05 120.40 117.97 2k8i s VAL 112 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.80 2k8i s VAL 112 Cb 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 36.38 35.78 2k8i s VAL 112 CO 0.00 -0.28 0.00 -0.62 0.00 0.00 0.00 175.10 174.20 2k8i n GLU 113 N 5.29 2.97 0.00 2.72 1.02 0.64 -4.98 120.64 128.30 2k8i n GLU 113 Ca -0.07 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 56.98 2k8i n GLU 113 Cb 0.49 0.00 0.06 0.00 -0.02 0.00 0.00 31.44 31.97 2k8i n GLU 113 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2k8i h ASP 114 N 0.00 0.62 0.00 1.62 3.32 -2.03 -3.39 116.42 116.56 2k8i h ASP 114 Ca 0.00 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.73 2k8i h ASP 114 Cb 0.00 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.37 2k8i h ASP 114 CO 0.00 1.03 -0.16 -0.90 -1.72 0.00 0.00 179.24 177.49 2k8i n ASP 115 N -3.97 0.81 -4.08 6.45 5.68 -1.26 -5.02 116.55 115.17 2k8i n ASP 115 Ca -0.03 -0.09 -0.08 0.00 -0.50 0.00 0.00 54.79 54.09 2k8i n ASP 115 Cb 0.60 0.34 -0.10 0.00 -1.14 0.00 0.00 41.12 40.81 2k8i n ASP 115 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 2k8i s HIS 116 N -0.50 0.51 0.37 2.11 -3.43 -1.26 -0.27 115.29 112.83 2k8i s HIS 116 Ca 0.00 -0.92 0.08 0.00 -0.80 0.00 0.00 55.06 53.42 2k8i s HIS 116 Cb 0.00 -0.36 -0.05 0.00 -1.43 0.00 0.00 32.58 30.74 2k8i s HIS 116 CO 0.00 -0.30 0.16 0.14 -2.00 0.00 0.00 174.74 172.73 2k8i s VAL 117 N -3.29 2.66 -0.21 -5.38 -7.23 0.11 -0.26 120.40 106.79 2k8i s VAL 117 Ca 0.02 -1.71 -0.00 0.00 -1.81 0.00 0.00 61.98 58.48 2k8i s VAL 117 Cb 0.03 -2.96 0.02 0.00 0.56 0.00 0.00 36.38 34.03 2k8i s VAL 117 CO -0.07 -0.10 -0.13 -0.69 -0.31 0.00 0.00 175.10 173.80 2k8i s VAL 118 N -2.51 2.54 -0.02 1.32 1.01 0.93 -0.11 120.40 123.56 2k8i s VAL 118 Ca 0.39 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.52 2k8i s VAL 118 Cb 0.00 -2.18 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 2k8i s VAL 118 CO 0.23 0.38 -0.25 0.68 0.00 0.00 0.00 175.10 176.13 2k8i s VAL 119 N 1.32 2.01 0.07 2.92 -7.23 -0.34 0.80 120.40 119.95 2k8i s VAL 119 Ca 0.03 -1.09 0.09 0.00 -1.81 0.00 0.00 61.98 59.20 2k8i s VAL 119 Cb -0.15 -1.67 -0.03 0.00 0.56 0.00 0.00 36.38 35.09 2k8i s VAL 119 CO -0.08 0.57 -0.25 -0.62 -0.31 0.00 0.00 175.10 174.40 2k8i s ASP 120 N -0.60 3.07 -0.36 4.85 -1.08 -0.55 -2.04 116.67 119.96 2k8i s ASP 120 Ca 0.10 -0.62 0.13 0.00 -0.52 0.00 0.00 52.55 51.64 2k8i s ASP 120 Cb -0.10 -0.26 0.42 0.00 -1.46 0.00 0.00 42.92 41.53 2k8i s ASP 120 CO -0.01 0.22 1.31 0.61 0.52 0.00 0.00 175.17 177.82 2k8i n GLY 121 N 1.57 1.59 3.26 2.66 0.00 -1.26 -2.80 105.19 110.21 2k8i n GLY 121 Ca -0.17 -0.44 -0.55 0.00 0.00 0.00 0.00 46.02 44.85 2k8i n GLY 121 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2k8i n ASN 122 N -0.74 -0.04 0.00 1.61 5.03 -1.26 -4.84 115.26 115.03 2k8i n ASN 122 Ca -0.04 1.08 0.00 0.00 0.87 0.00 0.00 54.58 56.50 2k8i n ASN 122 Cb 0.85 -0.86 0.00 0.00 -1.02 0.00 0.00 39.78 38.75 2k8i n ASN 122 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 2k8i n HIS 123 N 1.37 0.00 -0.08 3.10 -0.00 -1.26 -4.80 115.22 113.55 2k8i n HIS 123 Ca 0.19 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.19 2k8i n HIS 123 Cb 0.08 0.00 -0.12 0.00 -0.12 0.00 0.00 29.99 29.82 2k8i n HIS 123 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2k8i h MET 124 N 0.00 0.02 -0.65 1.57 -0.00 -1.95 -3.40 114.93 110.52 2k8i h MET 124 Ca 0.00 -0.03 -0.39 0.00 -0.00 0.00 0.00 59.70 59.29 2k8i h MET 124 Cb 0.00 0.01 -0.23 0.00 -0.00 0.00 0.00 31.60 31.38 2k8i h MET 124 CO 0.00 1.01 0.14 1.28 -0.00 0.00 0.00 176.91 179.34 2k8i n LEU 125 N -4.50 5.40 -0.02 -0.10 4.77 -1.26 -4.65 117.00 116.64 2k8i n LEU 125 Ca -0.20 -3.97 -0.06 0.00 -0.03 0.00 0.00 56.01 51.76 2k8i n LEU 125 Cb 0.59 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 40.94 2k8i n LEU 125 CO 0.28 1.37 0.50 0.00 -1.33 0.00 0.00 177.39 178.22 2k8i h ALA 126 N 1.32 -0.57 0.00 -1.18 0.00 -1.77 -3.44 119.26 113.62 2k8i h ALA 126 Ca 0.40 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2k8i h ALA 126 Cb 1.77 0.77 0.00 0.00 0.00 0.00 0.00 17.79 20.34 2k8i h ALA 126 CO 0.80 -0.65 0.00 0.41 0.00 0.00 0.00 179.25 179.81 2k8i n GLY 127 N -1.16 1.02 3.68 0.00 0.00 -1.26 -4.80 105.19 102.67 2k8i n GLY 127 Ca -0.02 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.52 2k8i n GLY 127 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k8i n GLN 128 N -2.00 2.18 -3.53 1.61 1.13 -1.26 -4.76 117.38 110.76 2k8i n GLN 128 Ca 0.00 0.80 -0.37 0.00 -1.94 0.00 0.00 57.00 55.49 2k8i n GLN 128 Cb 0.00 -2.64 -0.08 0.00 0.11 0.00 0.00 30.24 27.63 2k8i n GLN 128 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2k8i s ASN 129 N 3.75 6.29 0.12 1.08 0.02 -1.26 0.49 114.94 125.43 2k8i s ASN 129 Ca 0.91 0.33 0.03 0.00 -1.02 0.00 0.00 52.86 53.12 2k8i s ASN 129 Cb -0.69 -2.17 -0.04 0.00 0.02 0.00 0.00 41.25 38.37 2k8i s ASN 129 CO 0.50 0.00 0.14 -0.76 0.02 0.00 0.00 177.10 177.01 2k8i s LEU 130 N 1.12 3.94 -0.12 0.60 1.43 -0.02 -3.73 118.68 121.90 2k8i s LEU 130 Ca 0.14 -0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.25 2k8i s LEU 130 Cb -0.14 -2.56 0.01 0.00 0.03 0.00 0.00 46.19 43.53 2k8i s LEU 130 CO 0.06 0.11 -0.20 -0.54 0.23 0.00 0.00 176.35 176.02 2k8i s LYS 131 N -2.82 2.71 -0.08 1.70 1.02 0.24 -1.43 119.74 121.08 2k8i s LYS 131 Ca 0.31 -0.74 0.03 0.00 0.02 0.00 0.00 55.97 55.59 2k8i s LYS 131 Cb -0.11 -2.21 -0.02 0.00 -0.52 0.00 0.00 37.83 34.97 2k8i s LYS 131 CO 0.24 -0.02 -0.17 -0.06 -0.92 0.00 0.00 175.35 174.42 2k8i s PHE 132 N 0.84 2.66 -0.41 3.18 0.08 0.93 -0.60 117.98 124.65 2k8i s PHE 132 Ca -0.08 -0.54 -0.10 0.00 0.12 0.00 0.00 56.93 56.33 2k8i s PHE 132 Cb -0.15 -1.70 0.06 0.00 -0.57 0.00 0.00 43.02 40.65 2k8i s PHE 132 CO -0.01 -0.10 0.25 -0.80 -0.10 0.00 0.00 175.22 174.46 2k8i s ASN 133 N -0.13 5.71 -0.11 1.36 -0.87 0.08 0.91 114.94 121.89 2k8i s ASN 133 Ca -0.02 -1.33 -0.08 0.00 -1.57 0.00 0.00 52.86 49.86 2k8i s ASN 133 Cb -0.14 -2.01 -0.04 0.00 -0.02 0.00 0.00 41.25 39.04 2k8i s ASN 133 CO 0.04 -0.50 0.18 -0.69 -2.57 0.00 0.00 177.10 173.56 2k8i s VAL 134 N 1.48 5.44 -0.41 1.60 1.01 0.44 -1.62 120.40 128.36 2k8i s VAL 134 Ca 0.03 0.29 0.01 0.00 0.00 0.00 0.00 61.98 62.31 2k8i s VAL 134 Cb -0.22 -3.44 0.13 0.00 0.00 0.00 0.00 36.38 32.85 2k8i s VAL 134 CO 0.04 0.61 0.21 -1.61 0.00 0.00 0.00 175.10 174.35 2k8i s GLU 135 N -0.99 1.09 0.72 2.72 2.02 0.17 -2.56 118.70 121.88 2k8i s GLU 135 Ca 0.16 -1.76 -0.15 0.00 0.02 0.00 0.00 54.97 53.24 2k8i s GLU 135 Cb -0.13 -2.14 0.03 0.00 0.10 0.00 0.00 34.13 32.00 2k8i s GLU 135 CO 0.05 -1.14 1.19 0.54 0.02 0.00 0.00 175.26 175.92 2k8i s VAL 136 N 0.66 2.45 0.10 2.63 0.11 -1.10 -0.03 120.40 125.22 2k8i s VAL 136 Ca 0.16 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.43 2k8i s VAL 136 Cb -0.23 -2.78 0.00 0.00 -1.53 0.00 0.00 36.38 31.84 2k8i s VAL 136 CO -0.03 -0.12 0.00 0.52 -3.33 0.00 0.00 175.10 172.14 2k8i n VAL 137 N -2.68 0.35 -3.60 2.04 0.31 -0.39 -2.14 118.33 112.22 2k8i n VAL 137 Ca 0.13 0.11 -0.12 0.00 -0.01 0.00 0.00 64.34 64.46 2k8i n VAL 137 Cb 0.50 -1.05 -0.05 0.00 -0.91 0.00 0.00 33.84 32.33 2k8i n VAL 137 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k8i s ALA 138 N -2.00 -1.11 -0.02 3.52 0.00 -0.66 -4.62 121.76 116.87 2k8i s ALA 138 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.18 2k8i s ALA 138 Cb 0.00 0.59 0.02 0.00 0.00 0.00 0.00 23.12 23.73 2k8i s ALA 138 CO 0.00 -0.59 0.00 0.42 0.00 0.00 0.00 175.76 175.59 2k8i s ILE 139 N -3.26 0.08 0.04 0.00 1.01 -1.26 -1.43 121.20 116.37 2k8i s ILE 139 Ca -0.01 0.08 -0.00 0.00 0.00 0.00 0.00 60.65 60.72 2k8i s ILE 139 Cb 0.00 -0.15 -0.03 0.00 0.01 0.00 0.00 42.46 42.30 2k8i s ILE 139 CO -0.08 0.09 -0.04 -0.60 0.00 0.00 0.00 174.94 174.31 2k8i s ARG 140 N 0.66 0.46 -0.08 2.79 3.52 0.11 -5.00 118.95 121.41 2k8i s ARG 140 Ca -0.06 -0.88 -0.18 0.00 -0.13 0.00 0.00 55.73 54.48 2k8i s ARG 140 Cb -0.09 0.10 -0.05 0.00 -1.56 0.00 0.00 34.95 33.36 2k8i s ARG 140 CO -0.02 -0.06 0.49 -1.83 -0.81 0.00 0.00 175.30 173.07 2k8i s GLU 141 N -2.49 4.27 0.81 5.12 -1.05 -1.26 -1.91 118.70 122.18 2k8i s GLU 141 Ca -0.06 0.49 -0.11 0.00 -0.15 0.00 0.00 54.97 55.14 2k8i s GLU 141 Cb -0.03 -3.39 0.08 0.00 -0.44 0.00 0.00 34.13 30.35 2k8i s GLU 141 CO -0.04 0.28 1.09 0.00 0.95 0.00 0.00 175.26 177.53 2k8i s ALA 142 N 0.22 2.13 -0.39 -0.84 0.00 -1.23 -4.84 121.76 116.81 2k8i s ALA 142 Ca 0.26 -0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.20 2k8i s ALA 142 Cb -0.16 -3.15 0.55 0.00 0.00 0.00 0.00 23.12 20.36 2k8i s ALA 142 CO 0.12 -1.83 1.54 0.25 0.00 0.00 0.00 175.76 175.84 2k8i n THR 143 N -3.52 2.30 0.00 0.00 -2.24 -1.26 -4.89 114.28 104.68 2k8i n THR 143 Ca 0.07 -1.20 0.00 0.00 -2.27 0.00 0.00 64.05 60.65 2k8i n THR 143 Cb 0.55 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 2k8i n THR 143 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k8i n GLU 144 N -0.07 0.00 -0.16 -0.78 1.02 -1.26 -4.52 120.64 114.87 2k8i n GLU 144 Ca 0.31 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.34 2k8i n GLU 144 Cb 1.14 -0.33 -0.00 0.00 -0.02 0.00 0.00 31.44 32.23 2k8i n GLU 144 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2k8i h GLU 145 N 0.00 0.99 -0.75 3.49 4.11 -1.96 0.47 114.58 120.94 2k8i h GLU 145 Ca 0.00 -0.42 0.03 0.00 0.07 0.00 0.00 59.36 59.04 2k8i h GLU 145 Cb 0.00 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 2k8i h GLU 145 CO 0.00 1.09 0.49 0.93 0.07 0.00 0.00 179.01 181.60 2k8i h GLU 146 N 0.85 0.90 -0.12 1.06 5.08 -1.76 0.59 114.58 121.17 2k8i h GLU 146 Ca 0.11 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 2k8i h GLU 146 Cb 0.78 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 2k8i h GLU 146 CO 0.06 0.59 -0.21 -0.07 -1.00 0.00 0.00 179.01 178.39 2k8i h LEU 147 N 0.93 0.40 -1.41 1.33 3.38 -1.62 -0.31 115.31 118.00 2k8i h LEU 147 Ca 0.30 -0.54 0.12 0.00 0.09 0.00 0.00 57.88 57.84 2k8i h LEU 147 Cb 0.03 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 2k8i h LEU 147 CO -0.08 0.86 0.52 0.00 0.09 0.00 0.00 178.44 179.83 2k8i h ALA 148 N 0.55 1.88 0.00 1.53 0.00 0.61 -1.11 119.26 122.72 2k8i h ALA 148 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2k8i h ALA 148 Cb 0.79 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2k8i h ALA 148 CO 0.05 -0.06 -0.72 0.72 0.00 0.00 0.00 179.25 179.23 2k8i n HIS 149 N -4.51 0.49 -0.84 0.00 8.25 0.13 -4.93 115.22 113.81 2k8i n HIS 149 Ca 0.14 0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 2k8i n HIS 149 Cb 0.41 -0.61 0.00 0.00 1.12 0.00 0.00 29.99 30.91 2k8i n HIS 149 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k8i n GLY 150 N 1.34 0.90 3.71 -1.41 0.00 -0.42 -4.95 105.19 104.36 2k8i n GLY 150 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 2k8i n GLY 150 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k8i s HIS 151 N -3.58 -0.12 0.00 1.61 -3.43 -0.21 -4.66 115.29 104.91 2k8i s HIS 151 Ca 0.00 -0.13 0.00 0.00 -0.80 0.00 0.00 55.06 54.13 2k8i s HIS 151 Cb 0.00 0.61 0.00 0.00 -1.43 0.00 0.00 32.58 31.76 2k8i s HIS 151 CO 0.00 -0.66 0.90 0.28 -2.00 0.00 0.00 174.74 173.26 2k8i n VAL 152 N -0.46 0.00 -3.12 -5.38 0.31 -1.26 -4.36 118.33 104.06 2k8i n VAL 152 Ca -0.07 1.40 -0.06 0.00 -0.01 0.00 0.00 64.34 65.60 2k8i n VAL 152 Cb 0.61 -2.24 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 2k8i n VAL 152 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 2k8i n HIS 153 N -2.01 -2.98 0.00 3.52 -0.00 -1.26 -4.37 115.22 108.11 2k8i n HIS 153 Ca 0.00 1.16 0.00 0.00 -0.00 0.00 0.00 57.72 58.88 2k8i n HIS 153 Cb 0.00 -3.86 0.00 0.00 -0.00 0.00 0.00 29.99 26.13 2k8i n HIS 153 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2k8i n GLY 154 N -1.37 0.93 7.00 1.57 0.00 -1.26 -5.00 105.19 107.06 2k8i n GLY 154 Ca -0.01 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.23 2k8i n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k8i n ALA 155 N 0.94 0.00 -3.57 4.61 0.00 -1.26 -4.81 120.51 116.42 2k8i n ALA 155 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 2k8i n ALA 155 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 2k8i n ALA 155 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2k8i s HIS 156 N 0.00 -0.01 0.00 0.00 3.76 -1.26 -5.00 115.29 112.78 2k8i s HIS 156 Ca 0.00 -0.07 0.00 0.00 -0.15 0.00 0.00 55.06 54.84 2k8i s HIS 156 Cb 0.00 -0.55 0.00 0.00 1.11 0.00 0.00 32.58 33.14 2k8i s HIS 156 CO 0.00 -0.54 0.00 -3.47 -0.85 0.00 0.00 174.74 169.88 2k8i n ASP 157 N 5.30 0.00 -4.45 1.40 2.03 -1.26 -5.11 116.55 114.45 2k8i n ASP 157 Ca -0.06 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.88 2k8i n ASP 157 Cb 0.49 0.15 -0.12 0.00 -0.72 0.00 0.00 41.12 40.92 2k8i n ASP 157 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 2k8i s HIS 158 N -0.98 3.11 0.01 -0.67 2.46 -1.26 -5.07 115.29 112.89 2k8i s HIS 158 Ca 0.00 -0.41 -0.03 0.00 0.47 0.00 0.00 55.06 55.09 2k8i s HIS 158 Cb 0.00 -2.26 -0.01 0.00 -0.13 0.00 0.00 32.58 30.18 2k8i s HIS 158 CO 0.00 -0.36 0.05 -3.38 -2.47 0.00 0.00 174.74 168.58 2k8i s HIS 159 N 1.62 0.13 -0.12 3.88 -3.43 -1.26 -5.15 115.29 110.96 2k8i s HIS 159 Ca 0.06 -0.28 -0.03 0.00 -0.80 0.00 0.00 55.06 54.01 2k8i s HIS 159 Cb -0.15 -0.11 -0.03 0.00 -1.43 0.00 0.00 32.58 30.86 2k8i s HIS 159 CO 0.04 -0.21 0.00 -1.01 -2.00 0.00 0.00 174.74 171.56 2k8i s HIS 160 N -1.26 3.14 -0.08 0.38 3.76 -1.26 -5.10 115.29 114.87 2k8i s HIS 160 Ca -0.14 0.04 0.00 0.00 -0.15 0.00 0.00 55.06 54.81 2k8i s HIS 160 Cb -0.08 -1.88 0.02 0.00 1.11 0.00 0.00 32.58 31.75 2k8i s HIS 160 CO 0.00 0.28 -0.06 -0.51 -0.85 0.00 0.00 174.74 173.60 2k8i s ASP 161 N -0.33 1.71 -1.43 1.40 1.11 -1.26 -4.74 116.67 113.12 2k8i s ASP 161 Ca 0.07 -0.22 -0.10 0.00 0.18 0.00 0.00 52.55 52.48 2k8i s ASP 161 Cb -0.12 -0.66 0.05 0.00 1.07 0.00 0.00 42.92 43.25 2k8i s ASP 161 CO 0.02 -0.09 1.05 1.41 1.18 0.00 0.00 175.17 178.74 2k8i n HIS 162 N 4.59 -2.51 0.08 4.23 8.25 -1.26 -4.90 115.22 123.69 2k8i n HIS 162 Ca -0.16 0.95 -0.22 0.00 -0.26 0.00 0.00 57.72 58.03 2k8i n HIS 162 Cb 0.50 -4.49 -0.13 0.00 1.12 0.00 0.00 29.99 27.00 2k8i n HIS 162 CO 0.00 0.00 0.00 0.22 0.64 0.00 0.00 176.34 177.20 2k8i h ASP 163 N -2.32 0.82 -3.08 0.41 3.58 -2.01 -3.41 116.42 110.42 2k8i h ASP 163 Ca -0.58 -0.82 -0.67 0.00 0.42 0.00 0.00 57.03 55.37 2k8i h ASP 163 Cb 1.37 -0.26 -0.12 0.00 1.72 0.00 0.00 39.33 42.04 2k8i h ASP 163 CO 0.61 1.56 -0.57 -1.38 -2.88 0.00 0.00 179.24 176.59 2k8i s HIS 164 N -2.97 3.32 -0.84 0.28 -3.43 -1.26 -4.64 115.29 105.74 2k8i s HIS 164 Ca -0.10 0.30 -0.02 0.00 -0.80 0.00 0.00 55.06 54.44 2k8i s HIS 164 Cb 0.05 -1.86 -0.03 0.00 -1.43 0.00 0.00 32.58 29.31 2k8i s HIS 164 CO 0.92 0.54 0.77 -3.47 -2.00 0.00 0.00 174.74 171.49 2k8i n ASP 165 N 2.18 -7.19 -0.01 7.38 2.03 -1.26 -4.96 116.55 114.73 2k8i n ASP 165 Ca -0.19 -0.32 0.07 0.00 0.52 0.00 0.00 54.79 54.88 2k8i n ASP 165 Cb 0.54 -5.15 -0.11 0.00 -0.72 0.00 0.00 41.12 35.68 2k8i n ASP 165 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2k8i n HIS 166 N -2.32 0.00 -0.55 -0.67 -0.00 -1.26 -4.44 115.22 105.97 2k8i n HIS 166 Ca -0.03 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.22 2k8i n HIS 166 Cb 0.55 -0.31 0.34 0.00 -0.12 0.00 0.00 29.99 30.45 2k8i n HIS 166 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k8i n HIS 167 N -1.96 1.63 -4.16 1.57 8.25 -1.26 -4.75 115.22 114.55 2k8i n HIS 167 Ca -0.02 -0.60 -0.10 0.00 -0.26 0.00 0.00 57.72 56.74 2k8i n HIS 167 Cb 0.37 -0.36 -0.10 0.00 1.12 0.00 0.00 29.99 31.01 2k8i n HIS 167 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2k8i s HIS 168 N -2.24 0.83 0.00 4.41 4.02 -1.26 -4.92 115.29 116.13 2k8i s HIS 168 Ca 0.47 -0.94 0.00 0.00 1.02 0.00 0.00 55.06 55.61 2k8i s HIS 168 Cb 0.34 -0.50 0.00 0.00 -1.02 0.00 0.00 32.58 31.40 2k8i s HIS 168 CO 0.18 -0.19 0.00 0.72 1.02 0.00 0.00 174.74 176.47 2k8i n HIS 169 N -0.02 0.00 -4.01 1.40 8.25 -1.26 -4.69 115.22 114.88 2k8i n HIS 169 Ca -0.12 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.13 2k8i n HIS 169 Cb 0.61 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.55 2k8i n HIS 169 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2k8i s HIS 170 N 0.00 0.67 0.00 4.41 3.76 -1.26 -5.24 115.29 117.63 2k8i s HIS 170 Ca 0.00 -0.17 0.00 0.00 -0.15 0.00 0.00 55.06 54.74 2k8i s HIS 170 Cb 0.00 -0.67 0.00 0.00 1.11 0.00 0.00 32.58 33.02 2k8i s HIS 170 CO 0.00 -0.22 0.41 -2.39 -0.85 0.00 0.00 174.74 171.69