#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 2.01 -0.33 3.17 -2.85 -1.26 -4.80 119.74 115.68 2k8i s LYS 2 Ca 0.00 -2.24 -0.24 0.00 -1.00 0.00 0.00 55.97 52.48 2k8i s LYS 2 Cb 0.00 -0.63 0.01 0.00 -2.06 0.00 0.00 37.83 35.14 2k8i s LYS 2 CO 0.00 -0.52 0.84 0.54 0.10 0.00 0.00 175.35 176.31 2k8i s VAL 3 N -3.15 4.71 0.00 1.79 0.11 -0.88 -4.92 120.40 118.06 2k8i s VAL 3 Ca 0.21 1.19 0.00 0.00 -2.93 0.00 0.00 61.98 60.45 2k8i s VAL 3 Cb 0.01 -4.22 0.00 0.00 -1.53 0.00 0.00 36.38 30.64 2k8i s VAL 3 CO 0.14 -0.36 0.00 0.00 -3.33 0.00 0.00 175.10 171.55 2k8i n ALA 4 N 6.42 0.00 -1.42 1.54 0.00 -1.26 -2.22 120.51 123.57 2k8i n ALA 4 Ca 0.05 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.14 2k8i n ALA 4 Cb 0.48 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.02 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 -1.21 2.17 0.00 0.00 2.20 -1.26 -2.38 119.74 119.26 2k8i s LYS 5 Ca 0.00 1.84 0.00 0.00 -0.36 0.00 0.00 55.97 57.45 2k8i s LYS 5 Cb 0.00 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.49 2k8i s LYS 5 CO 0.00 -1.83 0.00 -0.40 -0.36 0.00 0.00 175.35 172.76 2k8i n ASP 6 N -2.59 -1.23 -4.39 1.43 5.75 0.12 -4.88 116.55 110.77 2k8i n ASP 6 Ca 0.14 0.00 -0.45 0.00 -0.01 0.00 0.00 54.79 54.47 2k8i n ASP 6 Cb 0.50 -1.59 -0.04 0.00 -1.03 0.00 0.00 41.12 38.96 2k8i n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2k8i s LEU 7 N 0.00 5.35 0.48 -2.12 1.43 -1.00 -2.92 118.68 119.89 2k8i s LEU 7 Ca 0.00 -1.53 -0.24 0.00 -1.03 0.00 0.00 54.13 51.33 2k8i s LEU 7 Cb 0.00 -2.32 -0.07 0.00 0.03 0.00 0.00 46.19 43.83 2k8i s LEU 7 CO 0.00 -1.11 1.32 0.54 0.23 0.00 0.00 176.35 177.33 2k8i s VAL 8 N 2.67 2.40 0.01 -1.59 0.11 0.09 -3.69 120.40 120.40 2k8i s VAL 8 Ca 0.15 0.33 -0.13 0.00 -2.93 0.00 0.00 61.98 59.39 2k8i s VAL 8 Cb -0.21 -3.18 0.02 0.00 -1.53 0.00 0.00 36.38 31.48 2k8i s VAL 8 CO 0.04 0.02 0.28 0.68 -3.33 0.00 0.00 175.10 172.79 2k8i s VAL 9 N -1.32 0.08 -0.29 2.04 -7.23 -1.03 -0.06 120.40 112.58 2k8i s VAL 9 Ca 0.64 -0.62 -0.10 0.00 -1.81 0.00 0.00 61.98 60.09 2k8i s VAL 9 Cb -0.38 -0.75 -0.02 0.00 0.56 0.00 0.00 36.38 35.79 2k8i s VAL 9 CO 0.47 -0.34 0.16 -0.44 -0.31 0.00 0.00 175.10 174.63 2k8i s SER 10 N -1.68 5.65 0.04 4.85 0.01 -0.07 -2.75 113.70 119.74 2k8i s SER 10 Ca -0.10 -0.31 0.04 0.00 1.31 0.00 0.00 55.95 56.89 2k8i s SER 10 Cb -0.03 -2.03 -0.02 0.00 0.21 0.00 0.00 66.02 64.14 2k8i s SER 10 CO 0.00 -0.13 -0.11 -0.22 0.41 0.00 0.00 173.24 173.20 2k8i s LEU 11 N 1.67 2.21 0.17 2.44 0.20 0.33 -0.57 118.68 125.11 2k8i s LEU 11 Ca 0.06 -0.49 0.11 0.00 0.69 0.00 0.00 54.13 54.50 2k8i s LEU 11 Cb -0.16 -0.39 -0.04 0.00 -0.43 0.00 0.00 46.19 45.17 2k8i s LEU 11 CO 0.07 -0.07 -0.25 0.00 -0.29 0.00 0.00 176.35 175.81 2k8i s ALA 12 N -1.05 2.48 0.07 5.97 0.00 0.16 0.10 121.76 129.50 2k8i s ALA 12 Ca -0.03 -1.56 -0.26 0.00 0.00 0.00 0.00 51.96 50.10 2k8i s ALA 12 Cb -0.08 -0.37 0.08 0.00 0.00 0.00 0.00 23.12 22.75 2k8i s ALA 12 CO 0.01 0.48 0.69 1.52 0.00 0.00 0.00 175.76 178.46 2k8i s TYR 13 N -1.41 -0.52 -0.09 0.00 1.13 0.43 0.57 117.35 117.47 2k8i s TYR 13 Ca 0.18 0.48 0.00 0.00 -1.41 0.00 0.00 57.07 56.32 2k8i s TYR 13 Cb -0.09 0.52 0.02 0.00 -1.10 0.00 0.00 41.96 41.32 2k8i s TYR 13 CO 0.08 -0.72 -0.07 -1.14 -2.51 0.00 0.00 175.55 171.20 2k8i s GLN 14 N -2.99 1.30 -0.27 -3.49 0.74 0.06 -0.16 119.66 114.86 2k8i s GLN 14 Ca -0.01 -0.20 -0.09 0.00 0.05 0.00 0.00 55.36 55.12 2k8i s GLN 14 Cb -0.01 -1.35 -0.03 0.00 1.10 0.00 0.00 33.01 32.72 2k8i s GLN 14 CO -0.07 -0.20 0.12 0.08 -0.55 0.00 0.00 175.29 174.67 2k8i s VAL 15 N 1.48 4.69 0.04 1.34 1.01 0.26 -0.36 120.40 128.87 2k8i s VAL 15 Ca -0.00 -0.07 -0.00 0.00 0.00 0.00 0.00 61.98 61.91 2k8i s VAL 15 Cb -0.13 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 2k8i s VAL 15 CO -0.05 0.29 -0.04 0.00 0.00 0.00 0.00 175.10 175.30 2k8i s ARG 16 N 1.67 0.51 1.04 2.72 1.70 0.24 -0.79 118.95 126.04 2k8i s ARG 16 Ca 0.06 -0.97 -0.18 0.00 -0.47 0.00 0.00 55.73 54.18 2k8i s ARG 16 Cb -0.16 0.09 0.24 0.00 -0.57 0.00 0.00 34.95 34.56 2k8i s ARG 16 CO 0.06 -0.07 1.31 0.95 -1.08 0.00 0.00 175.30 176.48 2k8i s THR 17 N -2.77 1.91 0.50 4.99 -4.23 -1.08 -0.69 115.64 114.26 2k8i s THR 17 Ca -0.03 0.00 0.26 0.00 -1.18 0.00 0.00 61.69 60.75 2k8i s THR 17 Cb -0.00 -2.90 0.44 0.00 1.34 0.00 0.00 72.50 71.37 2k8i s THR 17 CO -0.05 0.00 1.89 -0.33 -0.54 0.00 0.00 174.62 175.58 2k8i h GLU 18 N -1.96 0.13 0.00 3.99 4.39 -1.93 0.27 114.58 119.48 2k8i h GLU 18 Ca -0.44 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2k8i h GLU 18 Cb 1.23 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 2k8i h GLU 18 CO 0.31 0.09 0.00 -0.44 -1.16 0.00 0.00 179.01 177.81 2k8i h ASP 19 N 0.13 0.00 0.00 1.42 3.32 -1.99 -3.46 116.42 115.85 2k8i h ASP 19 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 2k8i h ASP 19 Cb 1.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.02 2k8i h ASP 19 CO -0.07 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.06 2k8i n GLY 20 N -0.03 0.92 3.73 2.75 0.00 0.08 -5.04 105.19 107.61 2k8i n GLY 20 Ca 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.84 4.34 0.11 1.61 0.11 -1.26 -4.79 120.40 117.67 2k8i s VAL 21 Ca 0.00 2.04 -0.31 0.00 -2.93 0.00 0.00 61.98 60.78 2k8i s VAL 21 Cb 0.00 -4.30 -0.07 0.00 -1.53 0.00 0.00 36.38 30.48 2k8i s VAL 21 CO 0.00 0.36 1.24 -0.22 -3.33 0.00 0.00 175.10 173.14 2k8i s LEU 22 N -0.33 4.39 -0.07 2.54 2.96 -1.26 -2.63 118.68 124.28 2k8i s LEU 22 Ca 0.46 2.13 0.00 0.00 -0.22 0.00 0.00 54.13 56.50 2k8i s LEU 22 Cb -0.24 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.81 2k8i s LEU 22 CO 0.31 -0.48 -0.06 1.33 -1.32 0.00 0.00 176.35 176.13 2k8i n VAL 23 N 3.54 0.39 -3.86 1.68 0.24 0.03 -4.99 118.33 115.36 2k8i n VAL 23 Ca 0.08 -0.14 -0.11 0.00 -2.04 0.00 0.00 64.34 62.12 2k8i n VAL 23 Cb 0.45 -0.79 -0.10 0.00 -1.47 0.00 0.00 33.84 31.94 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 -4.71 0.01 -0.28 -1.34 2.15 -1.07 -5.02 116.67 106.41 2k8i s ASP 24 Ca -0.09 -0.17 -0.25 0.00 0.43 0.00 0.00 52.55 52.47 2k8i s ASP 24 Cb 0.02 0.22 0.10 0.00 -0.30 0.00 0.00 42.92 42.96 2k8i s ASP 24 CO 0.15 -0.36 0.88 -0.70 -0.17 0.00 0.00 175.17 174.97 2k8i s GLU 25 N -1.31 0.66 -0.23 4.34 2.12 -1.26 0.93 118.70 123.95 2k8i s GLU 25 Ca -0.14 0.80 0.01 0.00 0.36 0.00 0.00 54.97 56.01 2k8i s GLU 25 Cb -0.07 0.31 0.04 0.00 0.26 0.00 0.00 34.13 34.67 2k8i s GLU 25 CO 0.02 -0.08 -0.14 -1.12 -0.54 0.00 0.00 175.26 173.40 2k8i s SER 26 N 0.36 3.90 0.92 -1.70 0.01 0.78 -4.97 113.70 113.01 2k8i s SER 26 Ca 0.01 -1.01 -0.12 0.00 1.31 0.00 0.00 55.95 56.14 2k8i s SER 26 Cb -0.05 -1.54 0.14 0.00 0.21 0.00 0.00 66.02 64.78 2k8i s SER 26 CO -0.03 -0.10 1.10 -2.16 0.41 0.00 0.00 173.24 172.45 2k8i s PRO 27 N 1.21 1.05 0.45 12.44 0.04 -1.22 -0.42 135.00 148.55 2k8i s PRO 27 Ca -0.02 0.60 0.28 0.00 0.04 0.00 0.00 61.00 61.90 2k8i s PRO 27 Cb -0.17 -1.80 0.95 0.00 0.04 0.00 0.00 34.50 33.52 2k8i s PRO 27 CO -0.08 -2.33 1.82 -0.39 0.04 0.00 0.00 177.00 176.06 2k8i h VAL 28 N -1.60 0.00 -0.08 -0.36 -1.51 -1.94 -3.05 116.25 107.70 2k8i h VAL 28 Ca -0.51 -0.63 -0.18 0.00 -1.23 0.00 0.00 66.70 64.15 2k8i h VAL 28 Cb 1.31 1.60 -0.01 0.00 -2.13 0.00 0.00 31.29 32.07 2k8i h VAL 28 CO 0.58 0.00 -0.70 0.77 -1.23 0.00 0.00 177.57 176.98 2k8i h SER 29 N 0.00 0.46 -2.84 4.19 4.64 -2.02 -3.41 113.55 114.58 2k8i h SER 29 Ca 0.00 -0.30 -0.36 0.00 -0.47 0.00 0.00 61.79 60.67 2k8i h SER 29 Cb 0.67 -0.14 -0.38 0.00 -0.31 0.00 0.00 62.40 62.25 2k8i h SER 29 CO 0.00 1.02 -0.67 0.00 -0.87 0.00 0.00 176.83 176.31 2k8i s ALA 30 N -3.66 -0.02 0.68 5.18 0.00 -1.15 -5.15 121.76 117.64 2k8i s ALA 30 Ca -0.06 0.15 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 2k8i s ALA 30 Cb 0.11 -1.09 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2k8i s ALA 30 CO 0.83 -1.02 1.06 -2.14 0.00 0.00 0.00 175.76 174.49 2k8i s PRO 31 N 2.26 3.02 -0.08 0.00 0.02 -1.21 -3.40 135.00 135.61 2k8i s PRO 31 Ca 0.04 0.95 -0.30 0.00 0.02 0.00 0.00 61.00 61.72 2k8i s PRO 31 Cb -0.15 -2.00 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 2k8i s PRO 31 CO -0.09 -1.03 1.02 -1.17 -0.33 0.00 0.00 177.00 175.40 2k8i s LEU 32 N -5.45 4.27 -0.21 -5.54 2.96 0.29 -4.82 118.68 110.17 2k8i s LEU 32 Ca 0.58 1.58 -0.04 0.00 -0.22 0.00 0.00 54.13 56.04 2k8i s LEU 32 Cb -0.14 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 42.98 2k8i s LEU 32 CO 0.54 -0.43 -0.05 -1.81 -1.32 0.00 0.00 176.35 173.28 2k8i s ASP 33 N 1.11 4.26 0.10 3.68 1.01 -1.26 -0.52 116.67 125.06 2k8i s ASP 33 Ca 0.50 -0.39 -0.06 0.00 0.71 0.00 0.00 52.55 53.31 2k8i s ASP 33 Cb -0.19 -1.73 -0.02 0.00 1.01 0.00 0.00 42.92 41.99 2k8i s ASP 33 CO 0.20 -0.00 0.14 -0.72 0.21 0.00 0.00 175.17 175.00 2k8i s TYR 34 N 1.39 0.39 -0.40 4.23 1.13 -1.11 -4.95 117.35 118.03 2k8i s TYR 34 Ca 0.05 -0.82 -0.08 0.00 -1.41 0.00 0.00 57.07 54.81 2k8i s TYR 34 Cb -0.14 -0.19 0.07 0.00 -1.10 0.00 0.00 41.96 40.60 2k8i s TYR 34 CO -0.03 -0.54 0.21 -1.17 -2.51 0.00 0.00 175.55 171.51 2k8i s LEU 35 N -2.92 4.94 0.21 -3.49 2.96 -1.22 -2.46 118.68 116.69 2k8i s LEU 35 Ca 0.11 -1.47 -0.32 0.00 -0.22 0.00 0.00 54.13 52.23 2k8i s LEU 35 Cb 0.06 -1.93 -0.11 0.00 0.50 0.00 0.00 46.19 44.70 2k8i s LEU 35 CO -0.07 -0.48 1.68 -2.28 -1.32 0.00 0.00 176.35 173.88 2k8i s HIS 36 N 1.38 2.93 0.00 5.38 5.65 -1.24 -1.33 115.29 128.05 2k8i s HIS 36 Ca 0.02 0.45 0.00 0.00 0.25 0.00 0.00 55.06 55.78 2k8i s HIS 36 Cb -0.22 -4.09 0.00 0.00 -1.18 0.00 0.00 32.58 27.09 2k8i s HIS 36 CO 0.01 -4.05 0.00 0.41 -0.65 0.00 0.00 174.74 170.47 2k8i n GLY 37 N 3.75 0.20 0.00 1.59 0.00 -1.26 0.12 105.19 109.59 2k8i n GLY 37 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -1.85 0.00 0.00 1.61 8.25 -0.45 -4.93 115.22 117.85 2k8i n HIS 38 Ca 0.00 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.42 2k8i n HIS 38 Cb 0.00 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 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 -0.04 0.88 0.35 -1.41 0.00 -1.03 -4.93 105.19 99.02 2k8i n GLY 39 Ca 0.00 0.21 0.06 0.00 0.00 0.00 0.00 46.02 46.29 2k8i n GLY 39 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k8i n SER 40 N 0.00 2.72 -2.06 1.61 7.64 -1.26 -3.39 113.62 118.88 2k8i n SER 40 Ca 0.00 -2.55 -0.00 0.00 1.01 0.00 0.00 58.87 57.33 2k8i n SER 40 Cb 0.00 -0.30 -0.00 0.00 -1.01 0.00 0.00 64.21 62.90 2k8i n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k8i n LEU 41 N -0.58 -0.72 -1.79 -3.43 -0.00 -1.26 -4.09 117.00 105.13 2k8i n LEU 41 Ca 0.12 1.17 0.00 0.00 -0.00 0.00 0.00 56.01 57.30 2k8i n LEU 41 Cb 0.55 -1.66 0.00 0.00 -0.00 0.00 0.00 43.42 42.30 2k8i n LEU 41 CO 0.05 -1.67 -0.29 2.30 -0.00 0.00 0.00 177.39 177.79 2k8i n ILE 42 N 2.00 -4.69 -0.20 1.47 -5.35 -1.26 -3.40 119.36 107.94 2k8i n ILE 42 Ca -0.00 1.73 0.01 0.00 -0.27 0.00 0.00 62.75 64.21 2k8i n ILE 42 Cb 0.00 -2.44 0.10 0.00 -1.74 0.00 0.00 39.64 35.56 2k8i n ILE 42 CO 0.00 0.00 0.00 -1.28 -1.76 0.00 0.00 176.55 173.51 2k8i h SER 43 N 2.99 -0.15 -0.19 7.28 0.87 -1.70 0.26 113.55 122.90 2k8i h SER 43 Ca 0.00 0.13 -0.11 0.00 -1.23 0.00 0.00 61.79 60.58 2k8i h SER 43 Cb 0.00 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2k8i h SER 43 CO 0.00 -0.06 -0.26 1.23 -0.53 0.00 0.00 176.83 177.21 2k8i h GLY 44 N 0.17 0.72 0.54 5.77 0.00 -1.39 -2.77 103.07 106.12 2k8i h GLY 44 Ca 0.31 -0.63 -0.08 0.00 0.00 0.00 0.00 47.33 46.94 2k8i h GLY 44 CO -0.46 0.57 -0.29 -2.00 0.00 0.00 0.00 176.54 174.36 2k8i h LEU 45 N 0.58 0.28 -0.58 3.11 5.85 -1.29 -2.87 115.31 120.39 2k8i h LEU 45 Ca 0.08 -0.74 0.12 0.00 0.84 0.00 0.00 57.88 58.18 2k8i h LEU 45 Cb 0.75 -0.09 -0.11 0.00 0.37 0.00 0.00 40.66 41.59 2k8i h LEU 45 CO 0.06 0.98 -0.10 -0.33 -0.34 0.00 0.00 178.44 178.71 2k8i h GLU 46 N -0.38 0.03 -0.72 1.25 5.08 -0.56 0.73 114.58 120.00 2k8i h GLU 46 Ca -0.03 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2k8i h GLU 46 Cb 1.01 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.22 2k8i h GLU 46 CO 0.06 0.02 0.44 1.15 -1.00 0.00 0.00 179.01 179.68 2k8i h THR 47 N 0.03 1.20 -0.07 1.13 2.02 -1.55 -0.67 112.91 115.01 2k8i h THR 47 Ca 0.28 -0.42 -0.22 0.00 0.77 0.00 0.00 66.41 66.83 2k8i h THR 47 Cb 0.44 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 2k8i h THR 47 CO -0.57 0.20 -0.84 0.00 0.37 0.00 0.00 175.52 174.69 2k8i h ALA 48 N 1.50 0.40 -0.56 6.16 0.00 -0.49 -3.12 119.26 123.15 2k8i h ALA 48 Ca 0.26 -0.65 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 2k8i h ALA 48 Cb -0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 2k8i h ALA 48 CO -0.05 0.75 0.22 -0.07 0.00 0.00 0.00 179.25 180.10 2k8i h LEU 49 N 0.35 0.74 -9.85 0.00 3.38 0.79 -3.45 115.31 107.26 2k8i h LEU 49 Ca -0.06 -0.09 -0.55 0.00 0.09 0.00 0.00 57.88 57.26 2k8i h LEU 49 Cb 1.46 -0.19 0.18 0.00 0.09 0.00 0.00 40.66 42.20 2k8i h LEU 49 CO 0.16 0.67 -0.10 -0.62 0.09 0.00 0.00 178.44 178.63 2k8i n GLU 50 N -4.33 0.35 0.00 1.13 1.02 -0.30 -3.48 120.64 115.04 2k8i n GLU 50 Ca 0.05 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2k8i n GLU 50 Cb 0.16 -2.07 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 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 1.27 2.73 3.99 0.62 0.00 -0.94 -4.97 105.19 107.88 2k8i n GLY 51 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 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 -1.82 2.12 0.43 1.61 -3.43 -1.23 -4.78 115.29 108.19 2k8i s HIS 52 Ca 0.00 -0.59 0.06 0.00 -0.80 0.00 0.00 55.06 53.73 2k8i s HIS 52 Cb 0.00 -2.23 -0.07 0.00 -1.43 0.00 0.00 32.58 28.85 2k8i s HIS 52 CO 0.00 -0.66 0.01 -1.21 -2.00 0.00 0.00 174.74 170.88 2k8i s GLU 53 N -4.43 2.01 0.38 -0.38 8.01 -1.26 -2.07 118.70 120.96 2k8i s GLU 53 Ca 0.54 -2.15 -0.26 0.00 0.01 0.00 0.00 54.97 53.11 2k8i s GLU 53 Cb -0.06 -1.63 -0.12 0.00 -4.31 0.00 0.00 34.13 28.01 2k8i s GLU 53 CO 0.33 -0.11 1.02 1.33 0.01 0.00 0.00 175.26 177.85 2k8i n VAL 54 N -1.03 2.26 0.00 2.63 0.24 -1.26 -2.59 118.33 118.58 2k8i n VAL 54 Ca -0.07 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.73 2k8i n VAL 54 Cb 0.67 -1.14 0.00 0.00 -1.47 0.00 0.00 33.84 31.90 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 1.17 1.98 3.72 7.63 0.00 0.71 -5.00 105.19 115.40 2k8i n GLY 55 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2k8i n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k8i s ASP 56 N -1.59 7.10 -0.07 1.61 1.01 -1.07 -4.85 116.67 118.81 2k8i s ASP 56 Ca 0.00 2.02 0.00 0.00 0.71 0.00 0.00 52.55 55.28 2k8i s ASP 56 Cb 0.00 -2.58 0.02 0.00 1.01 0.00 0.00 42.92 41.37 2k8i s ASP 56 CO 0.00 -0.44 -0.04 -0.75 0.21 0.00 0.00 175.17 174.14 2k8i s LYS 57 N 0.90 0.98 0.30 8.23 2.36 -1.26 -2.49 119.74 128.76 2k8i s LYS 57 Ca 0.58 -0.09 -0.02 0.00 -2.55 0.00 0.00 55.97 53.88 2k8i s LYS 57 Cb -0.29 -1.09 0.01 0.00 -1.05 0.00 0.00 37.83 35.41 2k8i s LYS 57 CO 0.30 -0.18 0.43 1.97 1.55 0.00 0.00 175.35 179.42 2k8i n PHE 58 N 4.56 -1.33 -4.45 4.03 -1.74 -1.10 -5.01 117.46 112.42 2k8i n PHE 58 Ca -0.16 -2.01 -0.31 0.00 -0.56 0.00 0.00 57.45 54.40 2k8i n PHE 58 Cb 0.50 0.48 -0.11 0.00 1.52 0.00 0.00 39.48 41.88 2k8i n PHE 58 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2k8i s ASP 59 N -2.86 4.39 0.01 5.98 1.01 -1.26 -2.21 116.67 121.72 2k8i s ASP 59 Ca 0.25 -0.27 0.02 0.00 0.71 0.00 0.00 52.55 53.26 2k8i s ASP 59 Cb -0.01 -0.92 -0.01 0.00 1.01 0.00 0.00 42.92 42.99 2k8i s ASP 59 CO 0.18 0.25 -0.07 -0.69 0.21 0.00 0.00 175.17 175.05 2k8i s VAL 60 N -1.04 0.52 -0.17 -1.27 1.01 0.85 -4.97 120.40 115.34 2k8i s VAL 60 Ca 0.18 -0.45 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 2k8i s VAL 60 Cb -0.11 -0.47 0.05 0.00 0.00 0.00 0.00 36.38 35.85 2k8i s VAL 60 CO 0.09 0.03 0.01 0.00 0.00 0.00 0.00 175.10 175.22 2k8i s ALA 61 N -0.41 1.08 0.03 5.51 0.00 -1.26 0.11 121.76 126.81 2k8i s ALA 61 Ca -0.00 -0.64 0.06 0.00 0.00 0.00 0.00 51.96 51.38 2k8i s ALA 61 Cb -0.04 -1.09 -0.02 0.00 0.00 0.00 0.00 23.12 21.97 2k8i s ALA 61 CO -0.00 -0.95 -0.18 0.08 0.00 0.00 0.00 175.76 174.71 2k8i s VAL 62 N 1.82 1.45 0.59 0.00 1.01 -0.87 -5.02 120.40 119.38 2k8i s VAL 62 Ca 0.00 -1.05 -0.17 0.00 0.00 0.00 0.00 61.98 60.76 2k8i s VAL 62 Cb -0.16 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.93 2k8i s VAL 62 CO -0.07 0.18 1.09 -0.83 0.00 0.00 0.00 175.10 175.47 2k8i s GLY 63 N -1.02 2.29 0.66 4.51 0.00 -1.26 -2.04 107.32 110.47 2k8i s GLY 63 Ca 0.06 0.57 0.37 0.00 0.00 0.00 0.00 44.72 45.72 2k8i s GLY 63 CO 0.01 0.91 2.16 0.00 0.00 0.00 0.00 173.10 176.19 2k8i h ALA 64 N 0.58 1.22 0.00 3.20 0.00 -1.72 0.31 119.26 122.85 2k8i h ALA 64 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2k8i h ALA 64 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2k8i h ALA 64 CO 0.56 -0.17 0.00 -0.97 0.00 0.00 0.00 179.25 178.68 2k8i h ASN 65 N 0.00 0.00 0.00 0.00 -0.73 -1.89 -3.30 115.58 109.66 2k8i h ASN 65 Ca 0.01 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.18 2k8i h ASN 65 Cb 0.32 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.91 2k8i h ASN 65 CO -0.00 0.00 -1.06 0.47 -0.37 0.00 0.00 177.43 176.47 2k8i n ASP 66 N -3.04 3.35 0.00 1.15 8.00 -0.09 -4.98 116.55 120.94 2k8i n ASP 66 Ca 0.03 -0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.44 2k8i n ASP 66 Cb 0.48 1.18 0.00 0.00 -0.02 0.00 0.00 41.12 42.76 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 -1.58 0.00 -1.07 2.24 0.00 -0.13 -0.98 120.51 119.00 2k8i n ALA 67 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 2k8i n ALA 67 Cb 0.11 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.58 2k8i n ALA 67 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2k8i n TYR 68 N 0.00 -3.83 -0.44 0.00 4.01 -1.26 -4.61 117.16 111.04 2k8i n TYR 68 Ca 0.00 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 2k8i n TYR 68 Cb 0.00 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 38.94 2k8i n TYR 68 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2k8i n GLY 69 N 3.77 0.73 3.66 2.72 0.00 -1.26 -4.06 105.19 110.76 2k8i n GLY 69 Ca 0.01 -0.43 -0.29 0.00 0.00 0.00 0.00 46.02 45.31 2k8i n GLY 69 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k8i n GLN 70 N -2.44 -1.86 -1.47 1.61 1.13 -1.26 -1.58 117.38 111.51 2k8i n GLN 70 Ca 0.00 -1.91 -0.36 0.00 -1.94 0.00 0.00 57.00 52.79 2k8i n GLN 70 Cb 0.00 -1.42 0.09 0.00 0.11 0.00 0.00 30.24 29.01 2k8i n GLN 70 CO 0.00 0.00 0.00 2.48 -1.44 0.00 0.00 177.06 178.10 2k8i n TYR 71 N -4.12 1.31 -2.33 1.08 0.18 -1.26 -4.41 117.16 107.60 2k8i n TYR 71 Ca 0.16 0.41 -0.41 0.00 1.88 0.00 0.00 57.90 59.93 2k8i n TYR 71 Cb 0.57 -2.17 -0.03 0.00 -0.38 0.00 0.00 39.34 37.34 2k8i n TYR 71 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2k8i s ASP 72 N -1.60 6.04 0.00 9.48 2.15 -1.26 -4.86 116.67 126.62 2k8i s ASP 72 Ca 0.77 0.40 0.19 0.00 0.43 0.00 0.00 52.55 54.35 2k8i s ASP 72 Cb -0.35 -2.54 1.14 0.00 -0.30 0.00 0.00 42.92 40.86 2k8i s ASP 72 CO 0.46 -1.75 1.55 -1.84 -0.17 0.00 0.00 175.17 173.42 2k8i n GLU 73 N 8.66 0.58 0.00 4.34 0.28 -1.26 -2.60 120.64 130.63 2k8i n GLU 73 Ca 0.14 0.01 0.02 0.00 -0.16 0.00 0.00 57.16 57.17 2k8i n GLU 73 Cb 0.49 -1.50 0.08 0.00 1.43 0.00 0.00 31.44 31.94 2k8i n GLU 73 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2k8i n ASN 74 N -1.03 0.00 -0.00 -1.84 3.02 -1.26 -1.55 115.26 112.60 2k8i n ASN 74 Ca 0.14 0.48 0.05 0.00 -0.03 0.00 0.00 54.58 55.22 2k8i n ASN 74 Cb 0.07 -0.48 -0.06 0.00 -0.61 0.00 0.00 39.78 38.70 2k8i n ASN 74 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2k8i n LEU 75 N -1.48 0.40 -4.05 3.41 4.77 -1.07 -4.96 117.00 114.02 2k8i n LEU 75 Ca 0.01 -0.45 -0.25 0.00 -0.03 0.00 0.00 56.01 55.29 2k8i n LEU 75 Cb 0.04 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 40.97 2k8i n LEU 75 CO 0.03 0.10 -0.48 0.54 -1.33 0.00 0.00 177.39 176.26 2k8i s VAL 76 N -1.98 1.24 0.21 4.08 0.11 -0.60 -3.12 120.40 120.35 2k8i s VAL 76 Ca 0.03 -0.54 -0.07 0.00 -2.93 0.00 0.00 61.98 58.46 2k8i s VAL 76 Cb 0.07 -1.11 -0.02 0.00 -1.53 0.00 0.00 36.38 33.79 2k8i s VAL 76 CO 0.39 0.38 0.30 0.00 -3.33 0.00 0.00 175.10 172.84 2k8i s GLN 77 N 0.58 1.33 -0.30 1.54 0.00 -1.17 -4.69 119.66 116.94 2k8i s GLN 77 Ca -0.14 -1.38 -0.07 0.00 -0.00 0.00 0.00 55.36 53.76 2k8i s GLN 77 Cb -0.16 0.37 0.01 0.00 0.00 0.00 0.00 33.01 33.24 2k8i s GLN 77 CO 0.04 -0.50 0.10 1.03 0.00 0.00 0.00 175.29 175.96 2k8i s ARG 78 N -4.06 3.11 -0.15 9.60 3.00 -1.26 -3.02 118.95 126.17 2k8i s ARG 78 Ca 0.28 -0.85 -0.02 0.00 0.00 0.00 0.00 55.73 55.14 2k8i s ARG 78 Cb 0.03 -3.41 -0.02 0.00 0.00 0.00 0.00 34.95 31.55 2k8i s ARG 78 CO 0.08 -0.45 -0.09 0.08 0.00 0.00 0.00 175.30 174.92 2k8i s VAL 79 N 1.52 3.40 0.27 3.52 1.01 -0.28 -4.91 120.40 124.93 2k8i s VAL 79 Ca 0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 2k8i s VAL 79 Cb -0.17 -2.47 -0.11 0.00 0.00 0.00 0.00 36.38 33.63 2k8i s VAL 79 CO 0.03 0.50 1.56 -2.84 0.00 0.00 0.00 175.10 174.36 2k8i s PRO 80 N 0.44 4.16 0.31 2.72 0.02 -1.26 -0.64 135.00 140.74 2k8i s PRO 80 Ca -0.07 2.50 0.20 0.00 0.02 0.00 0.00 61.00 63.65 2k8i s PRO 80 Cb -0.15 -3.06 1.11 0.00 0.02 0.00 0.00 34.50 32.42 2k8i s PRO 80 CO 0.04 -0.59 1.62 1.63 -0.33 0.00 0.00 177.00 179.37 2k8i n LYS 81 N 2.46 0.13 0.18 5.54 5.02 0.12 -0.48 118.16 131.13 2k8i n LYS 81 Ca 0.09 0.63 0.04 0.00 -2.02 0.00 0.00 58.31 57.04 2k8i n LYS 81 Cb 0.38 -1.96 0.34 0.00 -0.02 0.00 0.00 35.03 33.77 2k8i n LYS 81 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 2k8i h ASP 82 N 0.00 0.00 -0.25 4.39 1.82 -1.90 -3.19 116.42 117.29 2k8i h ASP 82 Ca 0.00 0.00 -0.14 0.00 -0.39 0.00 0.00 57.03 56.50 2k8i h ASP 82 Cb 0.04 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.04 2k8i h ASP 82 CO 0.00 0.41 -0.35 0.58 -1.61 0.00 0.00 179.24 178.27 2k8i h VAL 83 N 0.00 1.28 -0.62 2.25 2.07 -1.15 -3.16 116.25 116.93 2k8i h VAL 83 Ca -0.00 -1.51 -0.39 0.00 0.82 0.00 0.00 66.70 65.61 2k8i h VAL 83 Cb 0.82 1.39 -0.16 0.00 -1.52 0.00 0.00 31.29 31.82 2k8i h VAL 83 CO 0.05 0.50 0.47 0.49 0.02 0.00 0.00 177.57 179.10 2k8i n PHE 84 N -4.06 1.74 0.05 1.57 3.72 -1.20 -4.54 117.46 114.73 2k8i n PHE 84 Ca -0.01 -2.08 0.22 0.00 -0.05 0.00 0.00 57.45 55.52 2k8i n PHE 84 Cb 0.51 -1.07 0.71 0.00 -0.94 0.00 0.00 39.48 38.69 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 1.74 0.00 -0.49 -1.08 -0.00 -1.72 -0.60 114.93 112.79 2k8i h MET 85 Ca 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.04 2k8i h MET 85 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.47 2k8i h MET 85 CO 0.87 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 178.19 2k8i n GLY 86 N -1.52 1.28 3.96 -3.00 0.00 -1.26 -4.89 105.19 99.76 2k8i n GLY 86 Ca 0.10 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.40 2k8i n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8i s VAL 87 N -1.46 5.08 0.00 1.61 0.11 -0.23 -5.06 120.40 120.44 2k8i s VAL 87 Ca 0.31 -1.03 0.00 0.00 -2.93 0.00 0.00 61.98 58.34 2k8i s VAL 87 Cb 0.17 -3.78 0.00 0.00 -1.53 0.00 0.00 36.38 31.24 2k8i s VAL 87 CO 0.20 -0.31 0.47 -0.67 -3.33 0.00 0.00 175.10 171.45 2k8i n ASP 88 N -1.41 0.00 -3.68 3.54 2.03 -1.26 -4.89 116.55 110.88 2k8i n ASP 88 Ca -0.08 0.56 -0.15 0.00 0.52 0.00 0.00 54.79 55.64 2k8i n ASP 88 Cb 0.57 -0.24 -0.14 0.00 -0.72 0.00 0.00 41.12 40.59 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 -1.42 0.11 -0.41 -0.67 2.02 -1.26 -5.10 118.70 111.97 2k8i s GLU 89 Ca 0.00 0.64 -0.27 0.00 0.02 0.00 0.00 54.97 55.36 2k8i s GLU 89 Cb 0.00 -0.14 -0.05 0.00 0.10 0.00 0.00 34.13 34.04 2k8i s GLU 89 CO 0.00 -0.27 2.23 -0.51 0.02 0.00 0.00 175.26 176.72 2k8i s LEU 90 N 2.19 3.41 0.16 1.80 1.43 -1.26 -4.94 118.68 121.48 2k8i s LEU 90 Ca 0.00 1.24 0.08 0.00 -1.03 0.00 0.00 54.13 54.43 2k8i s LEU 90 Cb -0.12 -2.90 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 2k8i s LEU 90 CO -0.07 -2.45 -0.17 -1.58 0.23 0.00 0.00 176.35 172.31 2k8i s GLN 91 N 7.32 1.25 0.21 1.70 0.74 -1.26 -4.97 119.66 124.65 2k8i s GLN 91 Ca 0.93 -1.41 -0.30 0.00 0.05 0.00 0.00 55.36 54.63 2k8i s GLN 91 Cb -0.22 -1.27 -0.09 0.00 1.10 0.00 0.00 33.01 32.53 2k8i s GLN 91 CO 0.29 0.25 1.40 0.08 -0.55 0.00 0.00 175.29 176.76 2k8i s VAL 92 N -2.15 2.90 0.00 1.34 1.01 -1.26 -2.42 120.40 119.82 2k8i s VAL 92 Ca 0.16 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2k8i s VAL 92 Cb -0.05 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2k8i s VAL 92 CO 0.06 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.88 2k8i n GLY 93 N 2.47 2.88 3.64 4.51 0.00 0.32 -4.99 105.19 114.02 2k8i n GLY 93 Ca 0.07 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.64 2k8i n GLY 93 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2k8i n MET 94 N -0.29 1.78 -5.05 1.61 2.81 -1.02 -4.53 117.12 112.43 2k8i n MET 94 Ca 0.00 0.63 -0.32 0.00 -1.81 0.00 0.00 57.70 56.20 2k8i n MET 94 Cb 0.00 -2.22 -0.15 0.00 -0.71 0.00 0.00 33.22 30.14 2k8i n MET 94 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2k8i s ARG 95 N -0.61 2.57 0.19 0.03 0.52 -1.26 -0.03 118.95 120.35 2k8i s ARG 95 Ca 0.68 -0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 54.86 2k8i s ARG 95 Cb -0.70 -2.30 0.05 0.00 0.52 0.00 0.00 34.95 32.53 2k8i s ARG 95 CO 0.52 0.49 0.81 -0.59 0.02 0.00 0.00 175.30 176.55 2k8i s PHE 96 N -0.41 -0.23 0.26 -0.53 -0.12 -0.79 -5.01 117.98 111.15 2k8i s PHE 96 Ca 0.04 -0.10 -0.24 0.00 -0.05 0.00 0.00 56.93 56.58 2k8i s PHE 96 Cb -0.12 0.65 -0.09 0.00 -0.63 0.00 0.00 43.02 42.82 2k8i s PHE 96 CO 0.02 -0.96 0.84 -1.17 -0.05 0.00 0.00 175.22 173.90 2k8i s LEU 97 N -2.86 4.38 0.05 -1.99 2.96 -1.26 -1.03 118.68 118.93 2k8i s LEU 97 Ca 0.09 1.66 0.04 0.00 -0.22 0.00 0.00 54.13 55.70 2k8i s LEU 97 Cb -0.03 -3.75 -0.02 0.00 0.50 0.00 0.00 46.19 42.89 2k8i s LEU 97 CO 0.01 0.01 -0.12 0.00 -1.32 0.00 0.00 176.35 174.93 2k8i s ALA 98 N -1.51 1.01 -0.03 5.97 0.00 -0.77 -4.92 121.76 121.52 2k8i s ALA 98 Ca 0.45 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.50 2k8i s ALA 98 Cb -0.19 -0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.78 2k8i s ALA 98 CO 0.23 0.15 0.25 -1.21 0.00 0.00 0.00 175.76 175.18 2k8i s GLU 99 N -1.35 3.59 0.22 0.00 2.02 -1.26 0.11 118.70 122.02 2k8i s GLU 99 Ca -0.02 -0.02 -0.01 0.00 0.02 0.00 0.00 54.97 54.94 2k8i s GLU 99 Cb -0.09 -3.13 0.01 0.00 0.10 0.00 0.00 34.13 31.02 2k8i s GLU 99 CO 0.01 0.69 0.31 0.25 0.02 0.00 0.00 175.26 176.54 2k8i n THR 100 N 1.46 0.00 0.25 3.63 -2.24 -0.71 -4.91 114.28 111.76 2k8i n THR 100 Ca -0.14 -1.08 0.09 0.00 -2.27 0.00 0.00 64.05 60.65 2k8i n THR 100 Cb 0.53 0.67 0.63 0.00 -2.10 0.00 0.00 70.33 70.07 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 1.22 0.00 -0.35 3.42 5.19 -1.99 -2.56 116.42 121.35 2k8i h ASP 101 Ca -0.17 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.16 2k8i h ASP 101 Cb 0.73 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.19 2k8i h ASP 101 CO 0.23 0.14 0.10 0.00 -3.12 0.00 0.00 179.24 176.59 2k8i n GLN 102 N -4.00 2.50 -0.14 3.56 1.13 -1.26 -5.02 117.38 114.15 2k8i n GLN 102 Ca -0.02 -1.52 0.02 0.00 -1.94 0.00 0.00 57.00 53.54 2k8i n GLN 102 Cb 0.23 -1.78 -0.00 0.00 0.11 0.00 0.00 30.24 28.79 2k8i n GLN 102 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2k8i n GLY 103 N 0.11 -1.95 3.69 1.08 0.00 -0.97 -4.74 105.19 102.41 2k8i n GLY 103 Ca 0.19 -1.37 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 2k8i n GLY 103 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2k8i n PRO 104 N -0.99 2.73 -3.98 1.61 -0.02 -1.26 -1.73 135.00 131.36 2k8i n PRO 104 Ca 0.00 0.99 -0.31 0.00 -2.02 0.00 0.00 63.50 62.16 2k8i n PRO 104 Cb 0.06 -2.88 -0.15 0.00 -0.02 0.00 0.00 33.50 30.51 2k8i n PRO 104 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2k8i s VAL 105 N 2.58 1.78 -0.39 -1.45 1.01 0.29 -4.91 120.40 119.31 2k8i s VAL 105 Ca 0.82 -1.43 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 2k8i s VAL 105 Cb -0.50 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 2k8i s VAL 105 CO 0.38 -0.11 1.91 -2.84 0.00 0.00 0.00 175.10 174.43 2k8i s PRO 106 N 1.27 3.07 0.49 2.72 0.02 -1.26 -1.84 135.00 139.47 2k8i s PRO 106 Ca -0.06 1.33 0.03 0.00 0.02 0.00 0.00 61.00 62.33 2k8i s PRO 106 Cb -0.19 -4.29 -0.02 0.00 0.02 0.00 0.00 34.50 30.02 2k8i s PRO 106 CO -0.06 -2.17 0.09 0.14 -0.33 0.00 0.00 177.00 174.66 2k8i s VAL 107 N 7.91 1.49 -0.03 3.83 -7.23 -0.19 -4.95 120.40 121.23 2k8i s VAL 107 Ca 0.81 -1.89 0.01 0.00 -1.81 0.00 0.00 61.98 59.10 2k8i s VAL 107 Cb -0.21 -2.38 0.03 0.00 0.56 0.00 0.00 36.38 34.38 2k8i s VAL 107 CO 0.31 0.00 -0.01 -0.70 -0.31 0.00 0.00 175.10 174.39 2k8i s GLU 108 N -3.92 0.41 -0.06 4.82 2.12 -1.26 -1.88 118.70 118.94 2k8i s GLU 108 Ca 0.18 0.04 -0.30 0.00 0.36 0.00 0.00 54.97 55.26 2k8i s GLU 108 Cb 0.03 -0.56 -0.04 0.00 0.26 0.00 0.00 34.13 33.81 2k8i s GLU 108 CO 0.10 -0.13 1.43 0.42 -0.54 0.00 0.00 175.26 176.54 2k8i s ILE 109 N 1.01 3.83 -1.24 -3.70 1.01 0.95 -2.76 121.20 120.30 2k8i s ILE 109 Ca -0.10 1.12 0.18 0.00 0.00 0.00 0.00 60.65 61.85 2k8i s ILE 109 Cb -0.14 -3.72 -0.10 0.00 0.01 0.00 0.00 42.46 38.51 2k8i s ILE 109 CO -0.01 -0.05 0.84 0.35 0.00 0.00 0.00 174.94 176.06 2k8i n THR 110 N 5.04 0.00 -3.58 2.92 -2.24 0.46 0.12 114.28 117.00 2k8i n THR 110 Ca 0.14 -0.20 -0.06 0.00 -2.27 0.00 0.00 64.05 61.67 2k8i n THR 110 Cb 0.44 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.74 2k8i n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k8i s ALA 111 N -2.38 -2.01 -0.25 6.98 0.00 -1.21 -4.85 121.76 118.04 2k8i s ALA 111 Ca 0.11 1.54 -0.03 0.00 0.00 0.00 0.00 51.96 53.57 2k8i s ALA 111 Cb 0.14 -0.33 0.08 0.00 0.00 0.00 0.00 23.12 23.01 2k8i s ALA 111 CO 0.59 -0.51 0.09 0.08 0.00 0.00 0.00 175.76 176.02 2k8i s VAL 112 N -2.10 0.30 0.00 0.00 1.01 -1.26 -1.63 120.40 116.72 2k8i s VAL 112 Ca 0.06 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.28 2k8i s VAL 112 Cb -0.01 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.28 2k8i s VAL 112 CO -0.05 -0.51 0.00 -0.62 0.00 0.00 0.00 175.10 173.92 2k8i n GLU 113 N 5.11 0.03 0.32 2.72 -0.58 0.13 -4.98 120.64 123.39 2k8i n GLU 113 Ca -0.06 0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.51 2k8i n GLU 113 Cb 0.44 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 31.23 2k8i n GLU 113 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 2k8i h ASP 114 N -0.29 -0.67 0.00 1.62 3.58 -2.02 -3.36 116.42 115.29 2k8i h ASP 114 Ca 0.00 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k8i h ASP 114 Cb 0.00 0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.22 2k8i h ASP 114 CO 0.00 -0.44 -0.14 -0.67 -2.88 0.00 0.00 179.24 175.11 2k8i n ASP 115 N -5.41 1.34 -3.82 2.28 2.03 -1.26 -5.03 116.55 106.68 2k8i n ASP 115 Ca -0.13 -2.33 -0.12 0.00 0.52 0.00 0.00 54.79 52.73 2k8i n ASP 115 Cb 0.33 -0.23 -0.10 0.00 -0.72 0.00 0.00 41.12 40.40 2k8i n ASP 115 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 2k8i s HIS 116 N -1.38 -0.11 0.38 -0.67 -3.43 -1.26 -0.71 115.29 108.12 2k8i s HIS 116 Ca 0.13 0.21 0.08 0.00 -0.80 0.00 0.00 55.06 54.68 2k8i s HIS 116 Cb 0.12 0.03 -0.02 0.00 -1.43 0.00 0.00 32.58 31.28 2k8i s HIS 116 CO 0.01 -0.25 0.39 0.14 -2.00 0.00 0.00 174.74 173.04 2k8i s VAL 117 N -0.83 3.20 -0.11 -5.38 -7.23 0.18 0.17 120.40 110.40 2k8i s VAL 117 Ca -0.09 -1.25 -0.01 0.00 -1.81 0.00 0.00 61.98 58.83 2k8i s VAL 117 Cb -0.05 -3.12 0.03 0.00 0.56 0.00 0.00 36.38 33.80 2k8i s VAL 117 CO 0.02 -0.08 -0.06 -0.69 -0.31 0.00 0.00 175.10 173.98 2k8i s VAL 118 N -2.36 0.88 -0.11 1.32 1.01 -0.64 -1.12 120.40 119.38 2k8i s VAL 118 Ca 0.46 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.23 2k8i s VAL 118 Cb -0.06 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 2k8i s VAL 118 CO 0.29 0.32 -0.14 0.68 0.00 0.00 0.00 175.10 176.25 2k8i s VAL 119 N 1.76 3.01 0.06 2.92 -7.23 -1.17 -0.41 120.40 119.35 2k8i s VAL 119 Ca 0.05 -0.69 0.05 0.00 -1.81 0.00 0.00 61.98 59.58 2k8i s VAL 119 Cb -0.13 -2.24 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 2k8i s VAL 119 CO -0.08 0.54 -0.06 -1.81 -0.31 0.00 0.00 175.10 173.38 2k8i s ASP 120 N 0.16 4.66 -0.03 4.85 1.01 -1.11 -3.07 116.67 123.14 2k8i s ASP 120 Ca -0.07 -0.23 0.04 0.00 0.71 0.00 0.00 52.55 52.99 2k8i s ASP 120 Cb -0.15 -1.03 0.06 0.00 1.01 0.00 0.00 42.92 42.81 2k8i s ASP 120 CO 0.05 0.22 0.91 0.61 0.21 0.00 0.00 175.17 177.16 2k8i n GLY 121 N 1.00 1.55 3.35 0.21 0.00 -1.18 -4.25 105.19 105.86 2k8i n GLY 121 Ca -0.13 -0.24 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 2k8i n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8i s ASN 122 N -1.15 1.89 0.00 1.61 2.20 -1.26 -5.01 114.94 113.22 2k8i s ASN 122 Ca 0.07 -1.25 0.00 0.00 -0.94 0.00 0.00 52.86 50.73 2k8i s ASN 122 Cb 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 41.25 39.31 2k8i s ASN 122 CO 0.01 -0.54 0.00 0.00 -2.94 0.00 0.00 177.10 173.63 2k8i n HIS 123 N -0.47 0.00 1.10 1.54 1.44 -1.26 -4.97 115.22 112.59 2k8i n HIS 123 Ca -0.04 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.80 2k8i n HIS 123 Cb 0.64 0.00 0.53 0.00 0.12 0.00 0.00 29.99 31.28 2k8i n HIS 123 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2k8i n MET 124 N 0.00 0.14 -0.48 -1.40 0.00 -1.26 -3.65 117.12 110.47 2k8i n MET 124 Ca 0.00 -0.04 0.04 0.00 0.00 0.00 0.00 57.70 57.70 2k8i n MET 124 Cb 0.00 -1.50 0.23 0.00 0.00 0.00 0.00 33.22 31.95 2k8i n MET 124 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2k8i n LEU 125 N -1.40 3.56 -4.83 3.17 4.77 -1.26 -4.87 117.00 116.14 2k8i n LEU 125 Ca 0.08 -1.80 -0.31 0.00 -0.03 0.00 0.00 56.01 53.95 2k8i n LEU 125 Cb 0.32 -0.57 -0.05 0.00 -2.33 0.00 0.00 43.42 40.79 2k8i n LEU 125 CO 0.28 0.48 -0.14 0.00 -1.33 0.00 0.00 177.39 176.68 2k8i s ALA 126 N -1.95 4.34 0.00 -1.18 0.00 -1.24 -4.51 121.76 117.23 2k8i s ALA 126 Ca 0.31 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2k8i s ALA 126 Cb 0.23 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.09 2k8i s ALA 126 CO 0.10 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.10 2k8i n GLY 127 N -1.49 0.75 3.63 0.00 0.00 -0.61 -4.99 105.19 102.49 2k8i n GLY 127 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 2k8i n GLY 127 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k8i s GLN 128 N -0.58 4.13 0.70 1.61 1.03 -1.25 -4.67 119.66 120.63 2k8i s GLN 128 Ca 0.00 0.62 -0.11 0.00 0.04 0.00 0.00 55.36 55.91 2k8i s GLN 128 Cb 0.00 -3.64 0.01 0.00 0.03 0.00 0.00 33.01 29.41 2k8i s GLN 128 CO 0.00 -0.41 1.08 0.54 -2.54 0.00 0.00 175.29 173.96 2k8i s ASN 129 N 1.42 5.49 0.08 12.60 2.20 -1.26 -4.15 114.94 131.32 2k8i s ASN 129 Ca 0.28 1.27 0.04 0.00 -0.94 0.00 0.00 52.86 53.51 2k8i s ASN 129 Cb -0.15 -2.13 -0.03 0.00 -2.00 0.00 0.00 41.25 36.93 2k8i s ASN 129 CO 0.08 -1.33 -0.11 -0.76 -2.94 0.00 0.00 177.10 172.04 2k8i s LEU 130 N -5.40 2.32 -0.12 3.54 1.43 -0.87 -4.63 118.68 114.96 2k8i s LEU 130 Ca 0.58 -0.68 -0.01 0.00 -1.03 0.00 0.00 54.13 52.99 2k8i s LEU 130 Cb -0.12 -0.36 -0.02 0.00 0.03 0.00 0.00 46.19 45.72 2k8i s LEU 130 CO 0.53 -0.18 -0.10 -0.54 0.23 0.00 0.00 176.35 176.30 2k8i s LYS 131 N -2.12 3.30 0.01 1.70 1.02 0.13 -2.05 119.74 121.72 2k8i s LYS 131 Ca -0.01 -0.62 0.08 0.00 0.02 0.00 0.00 55.97 55.45 2k8i s LYS 131 Cb -0.07 -2.69 -0.02 0.00 -0.52 0.00 0.00 37.83 34.53 2k8i s LYS 131 CO 0.01 0.33 -0.25 -0.06 -0.92 0.00 0.00 175.35 174.46 2k8i s PHE 132 N 0.08 2.19 -0.37 3.18 0.08 0.12 -0.59 117.98 122.67 2k8i s PHE 132 Ca -0.03 -0.41 -0.07 0.00 0.12 0.00 0.00 56.93 56.53 2k8i s PHE 132 Cb -0.14 -1.36 0.06 0.00 -0.57 0.00 0.00 43.02 41.00 2k8i s PHE 132 CO 0.04 0.04 0.17 -0.80 -0.10 0.00 0.00 175.22 174.56 2k8i s ASN 133 N -0.89 5.44 -0.14 1.36 0.02 0.52 -0.10 114.94 121.14 2k8i s ASN 133 Ca 0.10 -1.31 -0.08 0.00 -1.02 0.00 0.00 52.86 50.55 2k8i s ASN 133 Cb -0.10 -1.91 -0.04 0.00 0.02 0.00 0.00 41.25 39.22 2k8i s ASN 133 CO 0.00 -0.41 0.13 -0.69 0.02 0.00 0.00 177.10 176.15 2k8i s VAL 134 N 1.40 5.44 -0.32 1.60 1.01 -0.94 -0.76 120.40 127.82 2k8i s VAL 134 Ca 0.01 0.19 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 2k8i s VAL 134 Cb -0.21 -3.39 0.11 0.00 0.00 0.00 0.00 36.38 32.89 2k8i s VAL 134 CO 0.02 0.57 0.13 -1.61 0.00 0.00 0.00 175.10 174.22 2k8i s GLU 135 N -0.68 0.65 -0.35 2.72 2.02 0.19 -2.70 118.70 120.56 2k8i s GLU 135 Ca 0.13 -1.08 -0.29 0.00 0.02 0.00 0.00 54.97 53.75 2k8i s GLU 135 Cb -0.12 -1.80 0.01 0.00 0.10 0.00 0.00 34.13 32.33 2k8i s GLU 135 CO 0.02 -1.03 1.17 0.54 0.02 0.00 0.00 175.26 175.98 2k8i s VAL 136 N 1.54 4.32 -0.04 2.63 0.11 -1.04 0.38 120.40 128.30 2k8i s VAL 136 Ca 0.11 1.48 -0.26 0.00 -2.93 0.00 0.00 61.98 60.38 2k8i s VAL 136 Cb -0.18 -4.37 -0.21 0.00 -1.53 0.00 0.00 36.38 30.09 2k8i s VAL 136 CO -0.23 -0.59 1.16 0.58 -3.33 0.00 0.00 175.10 172.69 2k8i h VAL 137 N 5.92 1.42 -2.24 2.04 2.07 -1.17 0.20 116.25 124.49 2k8i h VAL 137 Ca -0.23 -1.35 0.01 0.00 0.82 0.00 0.00 66.70 65.95 2k8i h VAL 137 Cb 1.07 2.33 -0.17 0.00 -1.52 0.00 0.00 31.29 33.00 2k8i h VAL 137 CO 1.05 0.34 0.31 0.00 0.02 0.00 0.00 177.57 179.30 2k8i s ALA 138 N -3.88 -1.76 -0.01 1.67 0.00 -0.25 -4.46 121.76 113.07 2k8i s ALA 138 Ca -0.16 1.09 0.03 0.00 0.00 0.00 0.00 51.96 52.91 2k8i s ALA 138 Cb 0.01 0.19 -0.00 0.00 0.00 0.00 0.00 23.12 23.31 2k8i s ALA 138 CO 0.66 -0.52 -0.09 0.42 0.00 0.00 0.00 175.76 176.23 2k8i s ILE 139 N -2.21 0.72 -0.11 0.00 1.01 -1.26 -0.89 121.20 118.45 2k8i s ILE 139 Ca -0.03 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 2k8i s ILE 139 Cb -0.01 -0.61 0.03 0.00 0.01 0.00 0.00 42.46 41.88 2k8i s ILE 139 CO -0.01 0.21 0.33 -0.60 0.00 0.00 0.00 174.94 174.87 2k8i s ARG 140 N -0.11 0.41 -0.14 2.79 3.52 0.91 -4.99 118.95 121.34 2k8i s ARG 140 Ca 0.02 0.40 -0.23 0.00 -0.13 0.00 0.00 55.73 55.79 2k8i s ARG 140 Cb -0.05 0.20 -0.03 0.00 -1.56 0.00 0.00 34.95 33.51 2k8i s ARG 140 CO -0.00 -0.06 0.70 -1.83 -0.81 0.00 0.00 175.30 173.30 2k8i s GLU 141 N 0.04 4.33 0.98 5.12 -1.05 -1.26 -0.73 118.70 126.11 2k8i s GLU 141 Ca -0.01 0.81 -0.12 0.00 -0.15 0.00 0.00 54.97 55.50 2k8i s GLU 141 Cb -0.03 -3.52 0.18 0.00 -0.44 0.00 0.00 34.13 30.32 2k8i s GLU 141 CO 0.01 -0.13 1.08 0.00 0.95 0.00 0.00 175.26 177.17 2k8i s ALA 142 N 1.49 0.98 -0.86 -0.84 0.00 -1.15 -4.88 121.76 116.51 2k8i s ALA 142 Ca 0.34 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.26 2k8i s ALA 142 Cb -0.17 -3.22 0.08 0.00 0.00 0.00 0.00 23.12 19.82 2k8i s ALA 142 CO 0.14 -2.82 0.66 0.25 0.00 0.00 0.00 175.76 173.99 2k8i n THR 143 N -4.21 0.36 0.00 0.00 -2.24 -1.26 -4.82 114.28 102.10 2k8i n THR 143 Ca 0.06 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2k8i n THR 143 Cb 0.55 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 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 0.08 0.00 -0.12 -0.78 1.02 -1.26 -4.50 120.64 115.08 2k8i n GLU 144 Ca 0.03 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.07 2k8i n GLU 144 Cb 0.37 -0.50 -0.02 0.00 -0.02 0.00 0.00 31.44 31.27 2k8i n GLU 144 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2k8i h GLU 145 N 0.00 0.56 -0.52 3.49 5.08 -1.98 0.44 114.58 121.65 2k8i h GLU 145 Ca 0.00 -0.13 0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2k8i h GLU 145 Cb 0.00 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2k8i h GLU 145 CO 0.00 0.59 0.34 0.93 -1.00 0.00 0.00 179.01 179.88 2k8i h GLU 146 N 0.42 0.64 -0.06 2.33 5.08 -1.79 0.28 114.58 121.48 2k8i h GLU 146 Ca 0.11 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.30 2k8i h GLU 146 Cb 0.27 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2k8i h GLU 146 CO -0.00 0.42 -0.49 -0.07 -1.00 0.00 0.00 179.01 177.87 2k8i h LEU 147 N 0.66 0.54 -1.76 1.33 3.38 -1.68 0.22 115.31 118.00 2k8i h LEU 147 Ca 0.20 -0.68 -0.03 0.00 0.09 0.00 0.00 57.88 57.46 2k8i h LEU 147 Cb -0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 2k8i h LEU 147 CO -0.05 1.14 -0.13 0.00 0.09 0.00 0.00 178.44 179.49 2k8i h ALA 148 N 0.42 1.74 0.01 1.53 0.00 0.42 -2.90 119.26 120.48 2k8i h ALA 148 Ca -0.04 -0.12 -0.34 0.00 0.00 0.00 0.00 54.91 54.41 2k8i h ALA 148 Cb 1.16 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 2k8i h ALA 148 CO 0.10 0.16 -2.08 0.72 0.00 0.00 0.00 179.25 178.15 2k8i n HIS 149 N -4.33 0.54 0.00 0.00 8.25 0.04 -5.01 115.22 114.71 2k8i n HIS 149 Ca -0.03 0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.61 2k8i n HIS 149 Cb 0.20 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 30.22 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 1.75 1.03 3.63 -1.41 0.00 0.67 -5.08 105.19 105.78 2k8i n GLY 150 Ca -0.28 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 0.32 0.14 1.61 -3.43 -0.63 -4.87 115.29 106.42 2k8i s HIS 151 Ca 0.00 -0.70 -0.30 0.00 -0.80 0.00 0.00 55.06 53.26 2k8i s HIS 151 Cb 0.00 0.28 -0.07 0.00 -1.43 0.00 0.00 32.58 31.36 2k8i s HIS 151 CO 0.00 -1.06 1.01 0.08 -2.00 0.00 0.00 174.74 172.77 2k8i s VAL 152 N -3.87 4.24 -0.21 -5.38 1.01 -1.26 -4.48 120.40 110.45 2k8i s VAL 152 Ca 0.21 1.90 0.07 0.00 0.00 0.00 0.00 61.98 64.15 2k8i s VAL 152 Cb -0.02 -4.21 -0.21 0.00 0.00 0.00 0.00 36.38 31.94 2k8i s VAL 152 CO 0.10 0.31 0.01 1.57 0.00 0.00 0.00 175.10 177.09 2k8i n HIS 153 N 2.58 0.25 -3.66 5.22 -0.00 -1.26 -4.89 115.22 113.45 2k8i n HIS 153 Ca 0.02 0.06 -0.26 0.00 -0.00 0.00 0.00 57.72 57.54 2k8i n HIS 153 Cb 0.48 -1.04 -0.17 0.00 -0.00 0.00 0.00 29.99 29.26 2k8i n HIS 153 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 2k8i s GLY 154 N -5.97 0.48 0.25 1.57 0.00 -1.26 -4.95 107.32 97.44 2k8i s GLY 154 Ca -0.23 -0.44 0.00 0.00 0.00 0.00 0.00 44.72 44.05 2k8i s GLY 154 CO 0.71 1.60 0.00 0.00 0.00 0.00 0.00 173.10 175.41 2k8i n ALA 155 N 5.19 1.30 -3.89 3.20 0.00 -1.26 -5.03 120.51 120.01 2k8i n ALA 155 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 2k8i n ALA 155 Cb 0.48 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.80 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 -2.00 3.20 0.00 0.00 3.76 -1.26 -4.99 115.29 114.00 2k8i s HIS 156 Ca 0.00 -3.17 0.00 0.00 -0.15 0.00 0.00 55.06 51.74 2k8i s HIS 156 Cb 0.00 -2.64 0.00 0.00 1.11 0.00 0.00 32.58 31.05 2k8i s HIS 156 CO 0.00 -0.66 0.00 -0.25 -0.85 0.00 0.00 174.74 172.98 2k8i n ASP 157 N 2.63 0.00 -0.61 1.40 8.00 -1.26 -5.07 116.55 121.63 2k8i n ASP 157 Ca 0.13 0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.97 2k8i n ASP 157 Cb 0.34 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.99 2k8i n ASP 157 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2k8i n HIS 158 N -1.95 -1.57 -3.10 1.24 8.25 -1.26 -4.98 115.22 111.83 2k8i n HIS 158 Ca 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.33 2k8i n HIS 158 Cb 0.00 0.20 0.07 0.00 1.12 0.00 0.00 29.99 31.38 2k8i n HIS 158 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k8i n HIS 159 N -1.23 -1.72 0.73 4.41 8.25 -1.26 -4.90 115.22 119.51 2k8i n HIS 159 Ca 0.00 0.73 0.09 0.00 -0.26 0.00 0.00 57.72 58.28 2k8i n HIS 159 Cb 0.00 -4.38 0.42 0.00 1.12 0.00 0.00 29.99 27.15 2k8i n HIS 159 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k8i n HIS 160 N -3.42 0.00 -0.22 4.41 -0.00 -1.26 -2.85 115.22 111.88 2k8i n HIS 160 Ca -0.22 0.00 0.01 0.00 0.46 0.00 0.00 57.72 57.97 2k8i n HIS 160 Cb 0.63 -0.41 0.12 0.00 -0.12 0.00 0.00 29.99 30.21 2k8i n HIS 160 CO 0.00 0.00 0.00 0.22 0.46 0.00 0.00 176.34 177.02 2k8i h ASP 161 N 0.00 0.35 -3.15 0.26 3.58 -2.04 -2.99 116.42 112.43 2k8i h ASP 161 Ca 0.00 0.07 -0.77 0.00 0.42 0.00 0.00 57.03 56.74 2k8i h ASP 161 Cb 0.25 0.01 -0.24 0.00 1.72 0.00 0.00 39.33 41.08 2k8i h ASP 161 CO 0.00 0.20 0.66 -1.00 -2.88 0.00 0.00 179.24 176.23 2k8i s HIS 162 N -6.08 3.89 -0.21 0.28 3.76 -1.13 -5.00 115.29 110.80 2k8i s HIS 162 Ca -0.13 -2.32 -0.29 0.00 -0.15 0.00 0.00 55.06 52.18 2k8i s HIS 162 Cb 0.17 -4.00 -0.04 0.00 1.11 0.00 0.00 32.58 29.82 2k8i s HIS 162 CO 0.75 -1.12 1.99 0.16 -0.85 0.00 0.00 174.74 175.67 2k8i s ASP 163 N 2.05 5.84 -1.51 1.40 -4.77 -1.13 -4.85 116.67 113.70 2k8i s ASP 163 Ca 0.32 1.81 -0.12 0.00 -3.30 0.00 0.00 52.55 51.26 2k8i s ASP 163 Cb -0.08 -2.52 -0.03 0.00 -1.09 0.00 0.00 42.92 39.20 2k8i s ASP 163 CO -0.06 -1.67 2.60 0.00 0.70 0.00 0.00 175.17 176.74 2k8i n HIS 164 N 10.28 2.85 0.28 2.11 1.44 -1.26 -4.72 115.22 126.21 2k8i n HIS 164 Ca 0.25 -2.98 -0.16 0.00 -2.01 0.00 0.00 57.72 52.82 2k8i n HIS 164 Cb 0.45 -2.48 -0.08 0.00 0.12 0.00 0.00 29.99 28.00 2k8i n HIS 164 CO 0.00 0.00 0.00 0.22 -2.81 0.00 0.00 176.34 173.75 2k8i h ASP 165 N 5.55 -0.84 -1.13 4.39 3.58 -2.01 -3.37 116.42 122.59 2k8i h ASP 165 Ca 0.72 0.06 -0.66 0.00 0.42 0.00 0.00 57.03 57.56 2k8i h ASP 165 Cb 0.44 0.26 -0.10 0.00 1.72 0.00 0.00 39.33 41.65 2k8i h ASP 165 CO 1.83 -0.50 1.85 -1.00 -2.88 0.00 0.00 179.24 178.53 2k8i s HIS 166 N -6.03 2.79 -0.50 0.28 3.76 -1.26 -4.79 115.29 109.54 2k8i s HIS 166 Ca -0.17 -1.43 0.04 0.00 -0.15 0.00 0.00 55.06 53.34 2k8i s HIS 166 Cb 0.05 -4.68 0.16 0.00 1.11 0.00 0.00 32.58 29.22 2k8i s HIS 166 CO 0.63 -1.79 0.36 -3.38 -0.85 0.00 0.00 174.74 169.71 2k8i s HIS 167 N 4.12 1.97 0.29 1.40 -3.43 -1.26 -5.11 115.29 113.27 2k8i s HIS 167 Ca 0.50 -2.62 -0.30 0.00 -0.80 0.00 0.00 55.06 51.84 2k8i s HIS 167 Cb 0.02 -1.62 -0.11 0.00 -1.43 0.00 0.00 32.58 29.44 2k8i s HIS 167 CO 0.01 -0.73 1.56 -3.38 -2.00 0.00 0.00 174.74 170.20 2k8i s HIS 168 N -0.31 2.80 -1.20 0.38 -3.43 -1.26 -4.87 115.29 107.40 2k8i s HIS 168 Ca 0.27 0.84 -0.18 0.00 -0.80 0.00 0.00 55.06 55.19 2k8i s HIS 168 Cb -0.05 -4.02 0.10 0.00 -1.43 0.00 0.00 32.58 27.18 2k8i s HIS 168 CO -0.15 -3.40 1.56 -1.01 -2.00 0.00 0.00 174.74 169.74 2k8i s HIS 169 N -0.04 2.96 -0.01 0.38 3.76 -1.26 -4.65 115.29 116.43 2k8i s HIS 169 Ca 0.62 -1.61 -0.02 0.00 -0.15 0.00 0.00 55.06 53.90 2k8i s HIS 169 Cb -0.47 -4.59 0.01 0.00 1.11 0.00 0.00 32.58 28.64 2k8i s HIS 169 CO 0.47 -1.69 0.03 1.58 -0.85 0.00 0.00 174.74 174.28 2k8i n HIS 170 N 7.59 -2.73 -0.49 1.40 -0.00 -1.26 -5.36 115.22 114.37 2k8i n HIS 170 Ca 0.41 1.62 0.00 0.00 -0.00 0.00 0.00 57.72 59.74 2k8i n HIS 170 Cb 0.46 -3.02 0.00 0.00 -0.00 0.00 0.00 29.99 27.43 2k8i n HIS 170 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92