#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 2.86 0.10 3.17 -2.85 -1.26 -4.64 119.74 117.12 2k8i s LYS 2 Ca 0.00 -0.94 -0.31 0.00 -1.00 0.00 0.00 55.97 53.72 2k8i s LYS 2 Cb 0.00 -2.60 -0.09 0.00 -2.06 0.00 0.00 37.83 33.08 2k8i s LYS 2 CO 0.00 0.46 1.62 0.54 0.10 0.00 0.00 175.35 178.07 2k8i s VAL 3 N -1.85 2.89 0.00 1.79 0.11 -0.72 -4.94 120.40 117.69 2k8i s VAL 3 Ca 0.31 0.48 0.00 0.00 -2.93 0.00 0.00 61.98 59.84 2k8i s VAL 3 Cb -0.09 -3.31 0.00 0.00 -1.53 0.00 0.00 36.38 31.45 2k8i s VAL 3 CO 0.23 0.01 0.00 0.00 -3.33 0.00 0.00 175.10 172.02 2k8i n ALA 4 N 4.98 0.00 -1.45 1.54 0.00 -1.26 -3.02 120.51 121.30 2k8i n ALA 4 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.25 2k8i n ALA 4 Cb 0.40 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.93 2.46 0.00 0.00 2.20 -1.26 -2.92 119.74 118.28 2k8i s LYS 5 Ca 0.00 1.64 0.00 0.00 -0.36 0.00 0.00 55.97 57.25 2k8i s LYS 5 Cb 0.00 -1.88 0.00 0.00 -1.51 0.00 0.00 37.83 34.44 2k8i s LYS 5 CO 0.00 -1.56 0.00 -0.25 -0.36 0.00 0.00 175.35 173.18 2k8i n ASP 6 N -2.48 -2.13 -4.88 1.43 8.00 -0.85 -4.93 116.55 110.72 2k8i n ASP 6 Ca 0.12 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.30 2k8i n ASP 6 Cb 0.51 -1.94 -0.05 0.00 -0.02 0.00 0.00 41.12 39.62 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 4.23 0.00 0.64 1.43 -1.15 -2.96 118.68 120.87 2k8i s LEU 7 Ca 0.00 0.79 0.06 0.00 -1.03 0.00 0.00 54.13 53.95 2k8i s LEU 7 Cb 0.00 -3.47 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 2k8i s LEU 7 CO 0.00 0.00 -0.17 0.54 0.23 0.00 0.00 176.35 176.95 2k8i s VAL 8 N -1.71 2.85 0.04 -1.59 0.11 0.17 -1.50 120.40 118.77 2k8i s VAL 8 Ca 0.43 -1.01 -0.04 0.00 -2.93 0.00 0.00 61.98 58.44 2k8i s VAL 8 Cb -0.12 -2.16 -0.02 0.00 -1.53 0.00 0.00 36.38 32.55 2k8i s VAL 8 CO 0.22 0.44 0.05 0.68 -3.33 0.00 0.00 175.10 173.16 2k8i s VAL 9 N -0.84 0.15 -0.21 2.04 -7.23 -0.71 -0.69 120.40 112.91 2k8i s VAL 9 Ca 0.13 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 59.04 2k8i s VAL 9 Cb -0.11 -0.98 0.02 0.00 0.56 0.00 0.00 36.38 35.87 2k8i s VAL 9 CO 0.03 -0.70 -0.14 -0.44 -0.31 0.00 0.00 175.10 173.55 2k8i s SER 10 N -2.27 3.72 0.17 4.85 0.01 -0.88 -2.14 113.70 117.16 2k8i s SER 10 Ca -0.03 -0.77 0.07 0.00 1.31 0.00 0.00 55.95 56.53 2k8i s SER 10 Cb 0.00 -1.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.62 2k8i s SER 10 CO -0.06 -0.06 -0.14 -1.48 0.41 0.00 0.00 173.24 171.92 2k8i s LEU 11 N 1.30 2.51 -0.21 2.44 -0.00 -0.68 -0.79 118.68 123.25 2k8i s LEU 11 Ca 0.02 -0.96 0.01 0.00 -0.00 0.00 0.00 54.13 53.20 2k8i s LEU 11 Cb -0.15 -0.61 0.05 0.00 -0.00 0.00 0.00 46.19 45.48 2k8i s LEU 11 CO -0.09 -0.18 -0.08 0.00 -0.00 0.00 0.00 176.35 176.00 2k8i s ALA 12 N -2.79 1.99 0.22 1.48 0.00 0.91 0.11 121.76 123.67 2k8i s ALA 12 Ca 0.18 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 50.94 2k8i s ALA 12 Cb -0.01 -1.35 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 2k8i s ALA 12 CO 0.05 -0.98 -0.13 1.52 0.00 0.00 0.00 175.76 176.23 2k8i s TYR 13 N 1.39 1.74 -0.13 0.00 1.13 -0.75 0.27 117.35 121.01 2k8i s TYR 13 Ca -0.03 -0.60 -0.00 0.00 -1.41 0.00 0.00 57.07 55.02 2k8i s TYR 13 Cb -0.17 -0.85 0.03 0.00 -1.10 0.00 0.00 41.96 39.87 2k8i s TYR 13 CO -0.07 0.33 -0.07 -1.14 -2.51 0.00 0.00 175.55 172.09 2k8i s GLN 14 N -3.66 1.48 -0.23 -3.49 0.74 -0.45 0.06 119.66 114.11 2k8i s GLN 14 Ca 0.24 -0.32 -0.07 0.00 0.05 0.00 0.00 55.36 55.26 2k8i s GLN 14 Cb 0.00 -1.69 -0.03 0.00 1.10 0.00 0.00 33.01 32.39 2k8i s GLN 14 CO 0.08 -0.31 0.05 0.54 -0.55 0.00 0.00 175.29 175.10 2k8i s VAL 15 N 1.69 4.30 0.08 1.34 0.11 -0.44 -0.35 120.40 127.12 2k8i s VAL 15 Ca 0.04 -0.18 -0.00 0.00 -2.93 0.00 0.00 61.98 58.90 2k8i s VAL 15 Cb -0.13 -2.99 -0.04 0.00 -1.53 0.00 0.00 36.38 31.69 2k8i s VAL 15 CO -0.08 0.38 -0.02 0.00 -3.33 0.00 0.00 175.10 172.05 2k8i s ARG 16 N 1.30 0.73 0.72 1.54 1.70 0.23 -1.17 118.95 124.00 2k8i s ARG 16 Ca 0.05 -1.29 -0.03 0.00 -0.47 0.00 0.00 55.73 53.99 2k8i s ARG 16 Cb -0.15 0.13 0.11 0.00 -0.57 0.00 0.00 34.95 34.48 2k8i s ARG 16 CO 0.03 -0.12 1.00 0.95 -1.08 0.00 0.00 175.30 176.07 2k8i s THR 17 N -3.89 2.21 0.45 4.99 -4.23 -0.29 0.81 115.64 115.69 2k8i s THR 17 Ca 0.12 -0.51 0.37 0.00 -1.18 0.00 0.00 61.69 60.48 2k8i s THR 17 Cb 0.07 -2.69 0.39 0.00 1.34 0.00 0.00 72.50 71.61 2k8i s THR 17 CO -0.06 0.00 2.19 -0.33 -0.54 0.00 0.00 174.62 175.88 2k8i h GLU 18 N -0.56 0.00 0.00 3.99 5.08 -1.89 -1.01 114.58 120.18 2k8i h GLU 18 Ca -0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 2k8i h GLU 18 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2k8i h GLU 18 CO 0.44 0.03 0.00 -0.44 -1.00 0.00 0.00 179.01 178.04 2k8i h ASP 19 N 0.00 0.00 0.00 1.42 3.32 -1.90 -3.47 116.42 115.79 2k8i h ASP 19 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2k8i h ASP 19 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2k8i h ASP 19 CO 0.00 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.13 2k8i n GLY 20 N 0.37 2.18 3.75 2.75 0.00 -0.38 -4.43 105.19 109.43 2k8i n GLY 20 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.47 4.06 0.11 1.61 0.11 -1.26 -4.69 120.40 117.87 2k8i s VAL 21 Ca 0.00 1.99 -0.30 0.00 -2.93 0.00 0.00 61.98 60.74 2k8i s VAL 21 Cb 0.00 -4.27 -0.06 0.00 -1.53 0.00 0.00 36.38 30.53 2k8i s VAL 21 CO 0.00 0.44 0.97 -0.22 -3.33 0.00 0.00 175.10 172.96 2k8i s LEU 22 N -0.96 4.49 -0.14 2.54 2.96 -1.26 -1.13 118.68 125.18 2k8i s LEU 22 Ca 0.43 1.80 0.02 0.00 -0.22 0.00 0.00 54.13 56.17 2k8i s LEU 22 Cb -0.26 -3.59 -0.10 0.00 0.50 0.00 0.00 46.19 42.74 2k8i s LEU 22 CO 0.33 -0.09 -0.10 1.33 -1.32 0.00 0.00 176.35 176.50 2k8i n VAL 23 N 2.84 0.80 -3.85 1.68 0.24 -0.32 -4.97 118.33 114.75 2k8i n VAL 23 Ca 0.03 -0.34 -0.08 0.00 -2.04 0.00 0.00 64.34 61.91 2k8i n VAL 23 Cb 0.49 -0.96 -0.03 0.00 -1.47 0.00 0.00 33.84 31.87 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 -5.22 -0.23 -0.28 -1.34 -1.08 -1.05 -5.05 116.67 102.42 2k8i s ASP 24 Ca -0.17 -0.64 -0.23 0.00 -0.52 0.00 0.00 52.55 50.99 2k8i s ASP 24 Cb 0.05 0.66 0.11 0.00 -1.46 0.00 0.00 42.92 42.27 2k8i s ASP 24 CO 0.35 -1.22 0.92 -0.70 0.52 0.00 0.00 175.17 175.04 2k8i s GLU 25 N -3.93 0.58 -0.30 4.34 2.12 -1.26 -1.33 118.70 118.92 2k8i s GLU 25 Ca 0.13 0.76 -0.03 0.00 0.36 0.00 0.00 54.97 56.19 2k8i s GLU 25 Cb -0.03 0.25 0.04 0.00 0.26 0.00 0.00 34.13 34.64 2k8i s GLU 25 CO 0.05 -0.08 0.02 -1.12 -0.54 0.00 0.00 175.26 173.58 2k8i s SER 26 N 0.57 4.90 0.94 -1.70 0.01 0.11 -5.00 113.70 113.53 2k8i s SER 26 Ca -0.01 -1.11 -0.12 0.00 1.31 0.00 0.00 55.95 56.02 2k8i s SER 26 Cb -0.05 -1.75 0.15 0.00 0.21 0.00 0.00 66.02 64.58 2k8i s SER 26 CO -0.07 -0.24 1.09 -2.16 0.41 0.00 0.00 173.24 172.26 2k8i s PRO 27 N 1.32 0.91 0.33 12.44 0.04 -1.22 -1.80 135.00 147.01 2k8i s PRO 27 Ca -0.03 0.82 0.26 0.00 0.04 0.00 0.00 61.00 62.10 2k8i s PRO 27 Cb -0.19 -1.77 1.03 0.00 0.04 0.00 0.00 34.50 33.61 2k8i s PRO 27 CO -0.00 -2.48 1.78 -0.39 0.04 0.00 0.00 177.00 175.94 2k8i h VAL 28 N -1.72 0.00 0.08 -0.36 -1.51 -1.95 -2.80 116.25 107.99 2k8i h VAL 28 Ca -0.51 -0.35 -0.25 0.00 -1.23 0.00 0.00 66.70 64.36 2k8i h VAL 28 Cb 1.29 1.19 -0.00 0.00 -2.13 0.00 0.00 31.29 31.63 2k8i h VAL 28 CO 0.54 0.00 -1.13 0.77 -1.23 0.00 0.00 177.57 176.52 2k8i h SER 29 N 0.00 0.33 -2.94 4.19 4.64 -2.01 -3.43 113.55 114.33 2k8i h SER 29 Ca 0.00 -0.33 -0.38 0.00 -0.47 0.00 0.00 61.79 60.61 2k8i h SER 29 Cb 0.46 -0.10 -0.38 0.00 -0.31 0.00 0.00 62.40 62.07 2k8i h SER 29 CO 0.00 1.23 -0.69 0.00 -0.87 0.00 0.00 176.83 176.50 2k8i s ALA 30 N -2.78 0.10 0.88 5.18 0.00 -1.06 -5.15 121.76 118.93 2k8i s ALA 30 Ca -0.03 0.07 -0.12 0.00 0.00 0.00 0.00 51.96 51.88 2k8i s ALA 30 Cb 0.08 -1.03 0.12 0.00 0.00 0.00 0.00 23.12 22.30 2k8i s ALA 30 CO 0.86 -0.99 1.14 -2.14 0.00 0.00 0.00 175.76 174.63 2k8i s PRO 31 N 2.22 1.38 -0.11 0.00 0.02 -1.23 -3.43 135.00 133.84 2k8i s PRO 31 Ca 0.04 0.32 -0.26 0.00 0.02 0.00 0.00 61.00 61.12 2k8i s PRO 31 Cb -0.15 -1.86 -0.02 0.00 0.02 0.00 0.00 34.50 32.49 2k8i s PRO 31 CO -0.09 -2.04 0.83 -1.17 -0.33 0.00 0.00 177.00 174.20 2k8i s LEU 32 N -5.94 4.24 -0.25 -5.54 2.96 0.29 -4.85 118.68 109.59 2k8i s LEU 32 Ca 0.63 1.27 -0.08 0.00 -0.22 0.00 0.00 54.13 55.73 2k8i s LEU 32 Cb -0.14 -3.26 -0.03 0.00 0.50 0.00 0.00 46.19 43.25 2k8i s LEU 32 CO 0.53 -0.31 0.09 -1.81 -1.32 0.00 0.00 176.35 173.54 2k8i s ASP 33 N 1.04 5.33 0.07 3.68 1.01 -1.26 -1.68 116.67 124.86 2k8i s ASP 33 Ca 0.41 -0.15 -0.13 0.00 0.71 0.00 0.00 52.55 53.38 2k8i s ASP 33 Cb -0.18 -1.96 0.02 0.00 1.01 0.00 0.00 42.92 41.81 2k8i s ASP 33 CO 0.16 -0.03 0.31 -0.72 0.21 0.00 0.00 175.17 175.11 2k8i s TYR 34 N 1.57 -0.08 -0.33 4.23 1.13 -0.91 -4.87 117.35 118.09 2k8i s TYR 34 Ca 0.06 -0.17 -0.11 0.00 -1.41 0.00 0.00 57.07 55.44 2k8i s TYR 34 Cb -0.15 0.11 -0.01 0.00 -1.10 0.00 0.00 41.96 40.81 2k8i s TYR 34 CO 0.05 -0.57 0.20 -1.17 -2.51 0.00 0.00 175.55 171.55 2k8i s LEU 35 N -2.44 4.37 0.37 -3.49 2.96 -1.26 -1.74 118.68 117.44 2k8i s LEU 35 Ca -0.01 -0.57 -0.27 0.00 -0.22 0.00 0.00 54.13 53.07 2k8i s LEU 35 Cb 0.01 -2.06 -0.09 0.00 0.50 0.00 0.00 46.19 44.55 2k8i s LEU 35 CO -0.07 -0.24 1.20 -2.28 -1.32 0.00 0.00 176.35 173.63 2k8i s HIS 36 N 1.65 3.12 0.00 5.38 5.65 -0.56 -3.11 115.29 127.41 2k8i s HIS 36 Ca 0.05 1.53 0.00 0.00 0.25 0.00 0.00 55.06 56.89 2k8i s HIS 36 Cb -0.18 -3.47 0.00 0.00 -1.18 0.00 0.00 32.58 27.76 2k8i s HIS 36 CO 0.08 -1.39 0.00 0.41 -0.65 0.00 0.00 174.74 173.19 2k8i n GLY 37 N 0.76 0.47 0.00 1.59 0.00 -1.26 -2.01 105.19 104.74 2k8i n GLY 37 Ca 0.02 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -3.23 0.00 -2.01 1.61 -0.00 -1.18 -4.80 115.22 105.61 2k8i n HIS 38 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2k8i n HIS 38 Cb 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.17 2k8i n HIS 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2k8i n GLY 39 N 0.42 0.90 0.23 -1.41 0.00 -1.26 -5.00 105.19 99.07 2k8i n GLY 39 Ca 0.00 -0.54 -0.14 0.00 0.00 0.00 0.00 46.02 45.34 2k8i n GLY 39 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2k8i h SER 40 N 0.00 0.87 0.00 1.61 0.02 -1.94 -3.45 113.55 110.66 2k8i h SER 40 Ca 0.00 -0.49 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2k8i h SER 40 Cb 0.82 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.11 2k8i h SER 40 CO 0.00 1.27 0.00 0.00 -1.14 0.00 0.00 176.83 176.96 2k8i n LEU 41 N -3.97 0.00 0.00 5.07 -0.00 -1.26 -5.06 117.00 111.78 2k8i n LEU 41 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.96 2k8i n LEU 41 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.07 2k8i n LEU 41 CO 0.50 0.00 0.00 2.30 -0.00 0.00 0.00 177.39 180.19 2k8i n ILE 42 N 0.00 0.00 -0.12 1.47 -5.35 -1.26 -5.09 119.36 109.01 2k8i n ILE 42 Ca 0.00 0.00 -0.25 0.00 -0.27 0.00 0.00 62.75 62.23 2k8i n ILE 42 Cb 0.00 -0.18 -0.11 0.00 -1.74 0.00 0.00 39.64 37.61 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 -0.50 1.92 0.12 7.28 2.88 -0.05 -4.35 113.62 120.93 2k8i n SER 43 Ca 0.00 0.35 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 2k8i n SER 43 Cb 0.00 -0.87 0.02 0.00 -0.75 0.00 0.00 64.21 62.61 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 -0.76 0.00 0.28 0.46 0.00 -0.78 -3.37 103.07 98.90 2k8i h GLY 44 Ca -0.52 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 2k8i h GLY 44 CO -0.29 0.00 -0.04 1.41 0.00 0.00 0.00 176.54 177.63 2k8i h LEU 45 N 0.00 -0.09 -0.48 3.11 3.38 -1.78 -2.61 115.31 116.84 2k8i h LEU 45 Ca -0.01 -0.52 0.10 0.00 0.09 0.00 0.00 57.88 57.54 2k8i h LEU 45 Cb 1.44 0.02 -0.09 0.00 0.09 0.00 0.00 40.66 42.12 2k8i h LEU 45 CO 0.08 0.56 -0.10 -0.33 0.09 0.00 0.00 178.44 178.74 2k8i h GLU 46 N -0.83 0.01 -0.13 1.13 5.08 -1.76 0.41 114.58 118.50 2k8i h GLU 46 Ca -0.01 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2k8i h GLU 46 Cb 0.60 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2k8i h GLU 46 CO 0.02 0.01 -0.18 1.15 -1.00 0.00 0.00 179.01 179.01 2k8i h THR 47 N 0.02 1.19 -0.24 1.13 2.02 -1.71 -0.77 112.91 114.54 2k8i h THR 47 Ca 0.23 -0.87 -0.19 0.00 0.77 0.00 0.00 66.41 66.35 2k8i h THR 47 Cb 0.36 1.29 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 2k8i h THR 47 CO -0.48 0.27 -0.59 0.00 0.37 0.00 0.00 175.52 175.09 2k8i h ALA 48 N 1.63 0.40 -0.31 6.16 0.00 -0.58 -3.04 119.26 123.52 2k8i h ALA 48 Ca 0.04 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.40 2k8i h ALA 48 Cb 0.43 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2k8i h ALA 48 CO 0.03 0.64 0.12 -0.07 0.00 0.00 0.00 179.25 179.97 2k8i h LEU 49 N 0.59 0.39 -9.70 0.00 3.38 0.34 -3.45 115.31 106.85 2k8i h LEU 49 Ca -0.00 -0.03 -0.56 0.00 0.09 0.00 0.00 57.88 57.37 2k8i h LEU 49 Cb 1.21 -0.10 0.18 0.00 0.09 0.00 0.00 40.66 42.04 2k8i h LEU 49 CO 0.13 0.36 -0.27 -0.62 0.09 0.00 0.00 178.44 178.13 2k8i n GLU 50 N -4.40 0.40 0.00 1.13 1.02 -0.35 -2.34 120.64 116.10 2k8i n GLU 50 Ca 0.01 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 2k8i n GLU 50 Cb 0.14 -1.91 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 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 1.54 2.71 3.90 0.62 0.00 -1.17 -4.99 105.19 107.81 2k8i n GLY 51 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 2k8i n GLY 51 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k8i s HIS 52 N -0.70 3.31 0.20 1.61 3.76 -0.99 -4.71 115.29 117.77 2k8i s HIS 52 Ca 0.00 0.89 0.07 0.00 -0.15 0.00 0.00 55.06 55.87 2k8i s HIS 52 Cb 0.00 -2.92 -0.05 0.00 1.11 0.00 0.00 32.58 30.72 2k8i s HIS 52 CO 0.00 -1.02 -0.13 -1.21 -0.85 0.00 0.00 174.74 171.54 2k8i s GLU 53 N -5.20 1.31 0.40 1.40 2.02 -1.26 -1.76 118.70 115.61 2k8i s GLU 53 Ca 0.56 -1.59 -0.24 0.00 0.02 0.00 0.00 54.97 53.72 2k8i s GLU 53 Cb -0.11 -1.05 -0.12 0.00 0.10 0.00 0.00 34.13 32.95 2k8i s GLU 53 CO 0.49 0.16 0.83 1.33 0.02 0.00 0.00 175.26 178.09 2k8i n VAL 54 N -0.37 2.16 0.00 2.63 0.24 -1.26 -2.49 118.33 119.23 2k8i n VAL 54 Ca -0.08 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.72 2k8i n VAL 54 Cb 0.61 -0.88 0.00 0.00 -1.47 0.00 0.00 33.84 32.10 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 1.43 2.18 3.73 7.63 0.00 0.13 -5.02 105.19 115.27 2k8i n GLY 55 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.61 6.92 -0.06 1.61 -1.08 -1.04 -4.84 116.67 116.57 2k8i s ASP 56 Ca 0.00 2.36 0.01 0.00 -0.52 0.00 0.00 52.55 54.41 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 -0.52 -0.07 -0.75 0.52 0.00 0.00 175.17 174.35 2k8i s LYS 57 N 0.02 1.17 -0.01 4.34 2.36 -1.26 -2.60 119.74 123.77 2k8i s LYS 57 Ca 0.57 -0.21 -0.28 0.00 -2.55 0.00 0.00 55.97 53.49 2k8i s LYS 57 Cb -0.36 -1.09 0.10 0.00 -1.05 0.00 0.00 37.83 35.43 2k8i s LYS 57 CO 0.37 -0.06 0.83 -0.59 1.55 0.00 0.00 175.35 177.45 2k8i s PHE 58 N 0.92 -0.42 -0.03 4.03 -0.71 -0.92 -4.98 117.98 115.87 2k8i s PHE 58 Ca -0.11 0.41 -0.10 0.00 -1.04 0.00 0.00 56.93 56.09 2k8i s PHE 58 Cb -0.15 0.51 -0.05 0.00 -1.21 0.00 0.00 43.02 42.13 2k8i s PHE 58 CO 0.01 -0.57 0.29 0.16 -1.34 0.00 0.00 175.22 173.77 2k8i s ASP 59 N -2.15 6.59 0.03 1.98 -4.77 -1.26 -0.06 116.67 117.04 2k8i s ASP 59 Ca 0.01 0.70 0.07 0.00 -3.30 0.00 0.00 52.55 50.04 2k8i s ASP 59 Cb -0.01 -2.15 -0.03 0.00 -1.09 0.00 0.00 42.92 39.64 2k8i s ASP 59 CO -0.06 0.32 -0.20 -0.69 0.70 0.00 0.00 175.17 175.24 2k8i s VAL 60 N -1.14 2.61 -0.21 2.11 1.01 0.24 -4.89 120.40 120.13 2k8i s VAL 60 Ca 0.23 -1.17 0.00 0.00 0.00 0.00 0.00 61.98 61.04 2k8i s VAL 60 Cb -0.14 -2.06 0.05 0.00 0.00 0.00 0.00 36.38 34.23 2k8i s VAL 60 CO 0.11 0.39 -0.06 0.00 0.00 0.00 0.00 175.10 175.55 2k8i s ALA 61 N -0.85 1.83 -0.03 5.51 0.00 -1.26 0.03 121.76 126.99 2k8i s ALA 61 Ca 0.13 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 50.96 2k8i s ALA 61 Cb -0.10 -1.33 -0.01 0.00 0.00 0.00 0.00 23.12 21.68 2k8i s ALA 61 CO 0.03 -1.03 -0.18 0.08 0.00 0.00 0.00 175.76 174.66 2k8i s VAL 62 N 1.47 1.46 0.63 0.00 1.01 -0.46 -4.92 120.40 119.59 2k8i s VAL 62 Ca -0.03 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.02 2k8i s VAL 62 Cb -0.17 -1.23 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 2k8i s VAL 62 CO -0.07 0.42 1.14 -0.83 0.00 0.00 0.00 175.10 175.76 2k8i s GLY 63 N -0.20 2.39 0.65 4.51 0.00 -1.26 -0.08 107.32 113.34 2k8i s GLY 63 Ca 0.02 0.74 0.28 0.00 0.00 0.00 0.00 44.72 45.76 2k8i s GLY 63 CO 0.01 1.11 1.87 0.00 0.00 0.00 0.00 173.10 176.09 2k8i h ALA 64 N 0.41 1.50 -0.02 3.20 0.00 -1.24 0.10 119.26 123.21 2k8i h ALA 64 Ca -0.48 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 2k8i h ALA 64 Cb 1.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2k8i h ALA 64 CO 0.54 -0.42 -0.36 -0.97 0.00 0.00 0.00 179.25 178.04 2k8i h ASN 65 N 0.00 0.04 -0.04 0.00 -1.24 -1.86 -3.16 115.58 109.32 2k8i h ASN 65 Ca 0.03 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.03 2k8i h ASN 65 Cb 0.81 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 39.85 2k8i h ASN 65 CO -0.00 0.39 0.00 0.47 -1.29 0.00 0.00 177.43 177.00 2k8i n ASP 66 N -4.11 1.95 0.00 1.15 9.92 0.28 -4.98 116.55 120.77 2k8i n ASP 66 Ca -0.02 -1.83 0.00 0.00 -0.53 0.00 0.00 54.79 52.41 2k8i n ASP 66 Cb 0.40 -0.03 0.00 0.00 -0.64 0.00 0.00 41.12 40.85 2k8i n ASP 66 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k8i n ALA 67 N -0.27 0.00 -1.05 2.24 0.00 -0.80 0.02 120.51 120.65 2k8i n ALA 67 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2k8i n ALA 67 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 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 -3.71 0.00 0.00 4.02 -1.26 -4.80 117.16 111.40 2k8i n TYR 68 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2k8i n TYR 68 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2k8i n TYR 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2k8i n GLY 69 N 5.00 1.15 3.46 2.72 0.00 -1.26 -4.03 105.19 112.22 2k8i n GLY 69 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.79 -2.29 -1.67 1.61 1.13 -1.26 -4.69 117.38 108.42 2k8i n GLN 70 Ca 0.00 -0.64 -0.60 0.00 -1.94 0.00 0.00 57.00 53.83 2k8i n GLN 70 Cb 0.00 -2.12 -0.08 0.00 0.11 0.00 0.00 30.24 28.15 2k8i n GLN 70 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 2k8i n TYR 71 N -4.89 1.69 -3.84 1.08 9.36 -1.21 -4.96 117.16 114.38 2k8i n TYR 71 Ca 0.03 0.79 -0.28 0.00 3.32 0.00 0.00 57.90 61.77 2k8i n TYR 71 Cb 0.55 -2.32 -0.16 0.00 -0.63 0.00 0.00 39.34 36.77 2k8i n TYR 71 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2k8i s ASP 72 N 2.38 2.91 0.00 2.98 2.15 -1.26 -5.01 116.67 120.83 2k8i s ASP 72 Ca 0.97 -0.74 0.23 0.00 0.43 0.00 0.00 52.55 53.44 2k8i s ASP 72 Cb -1.20 -0.83 1.30 0.00 -0.30 0.00 0.00 42.92 41.89 2k8i s ASP 72 CO 0.66 -0.23 1.77 -1.84 -0.17 0.00 0.00 175.17 175.36 2k8i n GLU 73 N 4.91 0.56 0.05 4.34 0.28 -1.26 -1.60 120.64 127.92 2k8i n GLU 73 Ca -0.11 0.03 0.13 0.00 -0.16 0.00 0.00 57.16 57.05 2k8i n GLU 73 Cb 0.47 -1.50 0.49 0.00 1.43 0.00 0.00 31.44 32.33 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 -1.13 0.37 -0.00 -1.84 3.02 -1.26 -3.10 115.26 111.32 2k8i n ASN 74 Ca 0.15 0.55 0.12 0.00 -0.03 0.00 0.00 54.58 55.36 2k8i n ASN 74 Cb 0.13 -0.64 0.18 0.00 -0.61 0.00 0.00 39.78 38.84 2k8i n ASN 74 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2k8i n LEU 75 N -1.86 0.59 -4.60 3.41 7.94 -0.63 -4.82 117.00 117.04 2k8i n LEU 75 Ca 0.06 -0.09 -0.34 0.00 -1.11 0.00 0.00 56.01 54.52 2k8i n LEU 75 Cb 0.34 -0.21 -0.10 0.00 0.53 0.00 0.00 43.42 43.98 2k8i n LEU 75 CO 0.26 0.15 -0.30 0.54 -1.11 0.00 0.00 177.39 176.93 2k8i s VAL 76 N -3.00 4.36 0.36 1.96 0.11 -1.18 -3.38 120.40 119.63 2k8i s VAL 76 Ca 0.10 -0.20 -0.14 0.00 -2.93 0.00 0.00 61.98 58.81 2k8i s VAL 76 Cb 0.17 -2.91 0.04 0.00 -1.53 0.00 0.00 36.38 32.15 2k8i s VAL 76 CO 0.73 0.51 0.73 0.00 -3.33 0.00 0.00 175.10 173.74 2k8i s GLN 77 N 0.03 2.11 -0.26 1.54 0.00 -0.99 -4.99 119.66 117.11 2k8i s GLN 77 Ca 0.03 -1.42 -0.01 0.00 -0.00 0.00 0.00 55.36 53.95 2k8i s GLN 77 Cb -0.13 0.59 0.03 0.00 0.00 0.00 0.00 33.01 33.51 2k8i s GLN 77 CO 0.02 -0.97 -0.05 1.03 0.00 0.00 0.00 175.29 175.31 2k8i s ARG 78 N -2.67 2.76 -0.14 9.60 3.00 -1.26 -2.65 118.95 127.58 2k8i s ARG 78 Ca 0.17 -1.03 -0.04 0.00 0.00 0.00 0.00 55.73 54.83 2k8i s ARG 78 Cb -0.04 -3.01 -0.03 0.00 0.00 0.00 0.00 34.95 31.87 2k8i s ARG 78 CO 0.12 -0.44 0.01 0.08 0.00 0.00 0.00 175.30 175.07 2k8i s VAL 79 N 1.31 4.34 0.23 3.52 1.01 -0.75 -4.89 120.40 125.18 2k8i s VAL 79 Ca -0.01 -0.21 -0.32 0.00 0.00 0.00 0.00 61.98 61.45 2k8i s VAL 79 Cb -0.17 -2.90 -0.12 0.00 0.00 0.00 0.00 36.38 33.19 2k8i s VAL 79 CO -0.04 0.52 1.66 -2.65 0.00 0.00 0.00 175.10 174.58 2k8i n PRO 80 N 3.11 2.67 0.27 2.72 -0.02 -1.26 -0.89 135.00 141.60 2k8i n PRO 80 Ca -0.17 0.96 0.17 0.00 -2.02 0.00 0.00 63.50 62.43 2k8i n PRO 80 Cb 0.53 -2.77 0.92 0.00 -0.02 0.00 0.00 33.50 32.16 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 5.94 0.00 -0.70 -0.52 1.57 -0.98 -2.15 116.57 119.72 2k8i h LYS 81 Ca -0.45 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.38 2k8i h LYS 81 Cb 1.22 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.48 2k8i h LYS 81 CO 0.89 0.00 0.42 0.22 -0.57 0.00 0.00 179.45 180.41 2k8i h ASP 82 N 0.00 0.67 -0.60 0.86 3.58 -1.90 -2.17 116.42 116.86 2k8i h ASP 82 Ca 0.04 0.01 0.12 0.00 0.42 0.00 0.00 57.03 57.62 2k8i h ASP 82 Cb 0.24 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.13 2k8i h ASP 82 CO -0.00 0.45 0.41 -0.37 -2.88 0.00 0.00 179.24 176.85 2k8i h VAL 83 N 0.81 0.84 -0.54 2.25 -1.51 -1.77 -2.17 116.25 114.16 2k8i h VAL 83 Ca 0.30 -0.11 -0.36 0.00 -1.23 0.00 0.00 66.70 65.30 2k8i h VAL 83 Cb 0.10 0.51 -0.15 0.00 -2.13 0.00 0.00 31.29 29.61 2k8i h VAL 83 CO -0.14 0.06 0.47 0.49 -1.23 0.00 0.00 177.57 177.21 2k8i n PHE 84 N -4.45 1.72 0.15 5.19 3.72 -0.82 -4.59 117.46 118.38 2k8i n PHE 84 Ca 0.10 -2.08 0.14 0.00 -0.05 0.00 0.00 57.45 55.57 2k8i n PHE 84 Cb 0.45 -1.02 0.70 0.00 -0.94 0.00 0.00 39.48 38.67 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 1.57 0.00 0.00 -1.08 -0.00 -1.52 -0.38 114.93 113.51 2k8i h MET 85 Ca 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 60.03 2k8i h MET 85 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.50 2k8i h MET 85 CO 0.85 0.00 -0.08 0.78 -0.00 0.00 0.00 176.91 178.46 2k8i h GLY 86 N 0.00 0.00 -3.42 -3.00 0.00 -1.88 -3.46 103.07 91.31 2k8i h GLY 86 Ca 0.11 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.94 2k8i h GLY 86 CO -0.00 0.00 0.47 0.14 0.00 0.00 0.00 176.54 177.15 2k8i s VAL 87 N -3.12 3.43 0.01 4.60 1.01 -0.16 -4.98 120.40 121.19 2k8i s VAL 87 Ca 0.10 1.30 -0.07 0.00 0.00 0.00 0.00 61.98 63.31 2k8i s VAL 87 Cb 0.12 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 2k8i s VAL 87 CO 0.62 0.21 1.05 -0.78 0.00 0.00 0.00 175.10 176.20 2k8i h ASP 88 N 3.24 -0.22 -3.00 3.32 3.58 -1.88 -3.44 116.42 118.01 2k8i h ASP 88 Ca -0.48 0.01 -0.35 0.00 0.42 0.00 0.00 57.03 56.63 2k8i h ASP 88 Cb 1.22 0.06 -0.38 0.00 1.72 0.00 0.00 39.33 41.95 2k8i h ASP 88 CO 0.65 -0.15 -0.68 -1.61 -2.88 0.00 0.00 179.24 174.57 2k8i s GLU 89 N -3.46 0.05 -0.61 0.28 2.02 -1.26 -5.09 118.70 110.64 2k8i s GLU 89 Ca -0.04 0.31 -0.26 0.00 0.02 0.00 0.00 54.97 55.00 2k8i s GLU 89 Cb 0.00 -0.87 -0.04 0.00 0.10 0.00 0.00 34.13 33.32 2k8i s GLU 89 CO 0.11 -0.47 2.05 -0.51 0.02 0.00 0.00 175.26 176.47 2k8i s LEU 90 N 2.24 3.30 0.34 1.80 1.43 -1.26 -4.93 118.68 121.60 2k8i s LEU 90 Ca 0.04 0.47 0.08 0.00 -1.03 0.00 0.00 54.13 53.69 2k8i s LEU 90 Cb -0.14 -2.52 -0.07 0.00 0.03 0.00 0.00 46.19 43.49 2k8i s LEU 90 CO -0.07 -2.62 -0.07 -1.58 0.23 0.00 0.00 176.35 172.24 2k8i s GLN 91 N 7.48 1.77 0.23 1.70 0.74 -1.26 -4.91 119.66 125.41 2k8i s GLN 91 Ca 0.77 -1.93 -0.30 0.00 0.05 0.00 0.00 55.36 53.96 2k8i s GLN 91 Cb -0.13 -1.55 -0.09 0.00 1.10 0.00 0.00 33.01 32.34 2k8i s GLN 91 CO 0.20 0.08 0.93 0.08 -0.55 0.00 0.00 175.29 176.04 2k8i s VAL 92 N -2.73 4.10 0.00 1.34 1.01 -1.26 -3.20 120.40 119.66 2k8i s VAL 92 Ca 0.32 2.07 0.00 0.00 0.00 0.00 0.00 61.98 64.37 2k8i s VAL 92 Cb 0.04 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 32.10 2k8i s VAL 92 CO 0.16 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.36 2k8i n GLY 93 N 1.52 0.77 3.76 4.51 0.00 0.24 -4.98 105.19 111.01 2k8i n GLY 93 Ca -0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.45 4.37 -0.07 1.61 -1.94 -1.19 -4.83 119.30 116.80 2k8i s MET 94 Ca 0.00 0.84 0.01 0.00 -1.71 0.00 0.00 55.69 54.83 2k8i s MET 94 Cb 0.00 -3.34 -0.03 0.00 2.01 0.00 0.00 34.83 33.47 2k8i s MET 94 CO 0.00 0.36 -0.08 1.03 -0.01 0.00 0.00 175.02 176.32 2k8i s ARG 95 N -0.22 2.73 -0.02 2.03 0.52 -1.26 -1.05 118.95 121.67 2k8i s ARG 95 Ca 0.33 -0.58 -0.29 0.00 -0.52 0.00 0.00 55.73 54.68 2k8i s ARG 95 Cb -0.19 -2.56 0.09 0.00 0.52 0.00 0.00 34.95 32.81 2k8i s ARG 95 CO 0.19 0.64 0.78 -0.59 0.02 0.00 0.00 175.30 176.34 2k8i s PHE 96 N -0.75 -0.50 0.05 -0.53 -0.12 -1.12 -5.05 117.98 109.97 2k8i s PHE 96 Ca 0.11 0.64 -0.30 0.00 -0.05 0.00 0.00 56.93 57.33 2k8i s PHE 96 Cb -0.11 0.48 -0.05 0.00 -0.63 0.00 0.00 43.02 42.71 2k8i s PHE 96 CO 0.01 -0.59 1.06 -1.17 -0.05 0.00 0.00 175.22 174.49 2k8i s LEU 97 N -1.80 4.40 -0.06 -1.99 2.96 -1.26 -2.61 118.68 118.32 2k8i s LEU 97 Ca -0.03 1.84 0.06 0.00 -0.22 0.00 0.00 54.13 55.78 2k8i s LEU 97 Cb -0.01 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.10 2k8i s LEU 97 CO -0.01 -0.30 -0.25 0.00 -1.32 0.00 0.00 176.35 174.48 2k8i s ALA 98 N 0.75 2.18 0.03 5.97 0.00 -0.63 -4.93 121.76 125.14 2k8i s ALA 98 Ca 0.53 -1.04 -0.20 0.00 0.00 0.00 0.00 51.96 51.25 2k8i s ALA 98 Cb -0.25 -0.70 -0.06 0.00 0.00 0.00 0.00 23.12 22.12 2k8i s ALA 98 CO 0.29 0.41 0.59 -1.21 0.00 0.00 0.00 175.76 175.84 2k8i s GLU 99 N -0.13 4.28 0.22 0.00 2.02 -1.26 0.13 118.70 123.95 2k8i s GLU 99 Ca -0.05 0.75 0.01 0.00 0.02 0.00 0.00 54.97 55.71 2k8i s GLU 99 Cb -0.14 -3.30 -0.00 0.00 0.10 0.00 0.00 34.13 30.79 2k8i s GLU 99 CO 0.04 0.49 0.26 0.25 0.02 0.00 0.00 175.26 176.32 2k8i n THR 100 N 2.26 0.00 -0.19 3.63 -2.24 -0.35 -4.92 114.28 112.47 2k8i n THR 100 Ca -0.08 -1.30 0.12 0.00 -2.27 0.00 0.00 64.05 60.52 2k8i n THR 100 Cb 0.51 0.73 0.43 0.00 -2.10 0.00 0.00 70.33 69.90 2k8i n THR 100 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 2k8i h ASP 101 N 1.28 0.54 -0.73 3.42 3.58 -2.02 -2.28 116.42 120.21 2k8i h ASP 101 Ca -0.17 0.02 -0.26 0.00 0.42 0.00 0.00 57.03 57.05 2k8i h ASP 101 Cb 0.76 -0.09 -0.15 0.00 1.72 0.00 0.00 39.33 41.57 2k8i h ASP 101 CO 0.23 0.30 0.32 0.00 -2.88 0.00 0.00 179.24 177.21 2k8i n GLN 102 N -4.50 3.23 0.00 0.28 6.02 -1.26 -5.03 117.38 116.11 2k8i n GLN 102 Ca 0.14 -2.78 0.00 0.00 -0.01 0.00 0.00 57.00 54.35 2k8i n GLN 102 Cb 0.42 -2.13 0.00 0.00 1.02 0.00 0.00 30.24 29.56 2k8i n GLN 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k8i n GLY 103 N -0.28 -2.20 3.68 1.08 0.00 -0.86 -4.79 105.19 101.82 2k8i n GLY 103 Ca 0.41 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.32 2.70 -3.98 1.61 -0.02 -1.26 -1.21 135.00 132.52 2k8i n PRO 104 Ca 0.00 0.98 -0.30 0.00 -2.02 0.00 0.00 63.50 62.16 2k8i n PRO 104 Cb 0.00 -2.88 -0.16 0.00 -0.02 0.00 0.00 33.50 30.45 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 3.10 1.61 -0.60 -1.45 1.01 0.34 -4.17 120.40 120.25 2k8i s VAL 105 Ca 0.84 -1.05 -0.27 0.00 0.00 0.00 0.00 61.98 61.51 2k8i s VAL 105 Cb -0.51 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.13 2k8i s VAL 105 CO 0.40 0.11 1.71 -2.84 0.00 0.00 0.00 175.10 174.48 2k8i s PRO 106 N 1.40 2.86 0.45 2.72 0.02 -1.26 -1.61 135.00 139.58 2k8i s PRO 106 Ca -0.02 0.52 0.05 0.00 0.02 0.00 0.00 61.00 61.57 2k8i s PRO 106 Cb -0.17 -4.31 -0.04 0.00 0.02 0.00 0.00 34.50 30.00 2k8i s PRO 106 CO -0.08 -2.47 0.08 0.14 -0.33 0.00 0.00 177.00 174.34 2k8i s VAL 107 N 7.99 1.78 -0.02 3.83 -7.23 -1.07 -4.76 120.40 120.93 2k8i s VAL 107 Ca 0.61 -1.89 0.01 0.00 -1.81 0.00 0.00 61.98 58.91 2k8i s VAL 107 Cb -0.12 -2.67 0.01 0.00 0.56 0.00 0.00 36.38 34.15 2k8i s VAL 107 CO 0.21 0.00 -0.04 -0.70 -0.31 0.00 0.00 175.10 174.26 2k8i s GLU 108 N -3.85 0.48 0.02 4.82 2.12 -1.23 -2.78 118.70 118.27 2k8i s GLU 108 Ca 0.27 -0.13 -0.30 0.00 0.36 0.00 0.00 54.97 55.17 2k8i s GLU 108 Cb 0.05 -0.50 -0.04 0.00 0.26 0.00 0.00 34.13 33.90 2k8i s GLU 108 CO 0.15 0.04 1.08 0.42 -0.54 0.00 0.00 175.26 176.40 2k8i s ILE 109 N 0.26 4.51 -0.74 -3.70 1.01 -0.22 -2.60 121.20 119.72 2k8i s ILE 109 Ca -0.03 1.80 0.06 0.00 0.00 0.00 0.00 60.65 62.48 2k8i s ILE 109 Cb -0.06 -4.15 0.07 0.00 0.01 0.00 0.00 42.46 38.32 2k8i s ILE 109 CO -0.00 0.13 0.77 0.35 0.00 0.00 0.00 174.94 176.18 2k8i n THR 110 N 3.97 0.16 0.00 2.92 -2.24 0.16 0.80 114.28 120.04 2k8i n THR 110 Ca 0.07 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 2k8i n THR 110 Cb 0.49 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 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 0.31 0.00 -3.61 6.98 0.00 -1.20 -4.90 120.51 118.08 2k8i n ALA 111 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.22 2k8i n ALA 111 Cb 0.19 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.02 0.00 0.00 1.01 -1.26 -0.09 120.40 118.04 2k8i s VAL 112 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.69 2k8i s VAL 112 Cb 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2k8i s VAL 112 CO 0.00 -0.34 0.00 -0.62 0.00 0.00 0.00 175.10 174.14 2k8i n GLU 113 N 5.25 2.39 -0.15 2.72 -0.58 0.64 -4.98 120.64 125.93 2k8i n GLU 113 Ca -0.07 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.58 2k8i n GLU 113 Cb 0.48 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 31.35 2k8i n GLU 113 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2k8i h ASP 114 N 0.00 0.66 0.00 1.62 5.19 -2.03 -3.39 116.42 118.48 2k8i h ASP 114 Ca 0.00 -0.22 0.00 0.00 -0.62 0.00 0.00 57.03 56.19 2k8i h ASP 114 Cb 0.00 -0.17 0.00 0.00 0.18 0.00 0.00 39.33 39.34 2k8i h ASP 114 CO 0.00 0.71 -0.21 -0.90 -3.12 0.00 0.00 179.24 175.72 2k8i n ASP 115 N -4.53 1.03 -4.15 6.45 5.75 -1.26 -5.05 116.55 114.79 2k8i n ASP 115 Ca 0.00 -0.10 -0.10 0.00 -0.01 0.00 0.00 54.79 54.58 2k8i n ASP 115 Cb 0.20 0.40 -0.10 0.00 -1.03 0.00 0.00 41.12 40.59 2k8i n ASP 115 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2k8i s HIS 116 N -0.61 0.81 0.30 2.11 -3.43 -1.26 -0.30 115.29 112.91 2k8i s HIS 116 Ca 0.00 -0.91 0.09 0.00 -0.80 0.00 0.00 55.06 53.44 2k8i s HIS 116 Cb 0.00 -0.48 -0.04 0.00 -1.43 0.00 0.00 32.58 30.62 2k8i s HIS 116 CO 0.00 -0.19 0.05 0.14 -2.00 0.00 0.00 174.74 172.75 2k8i s VAL 117 N -3.52 3.24 -0.27 -5.38 -7.23 -0.07 -0.26 120.40 106.92 2k8i s VAL 117 Ca 0.09 -1.83 -0.06 0.00 -1.81 0.00 0.00 61.98 58.37 2k8i s VAL 117 Cb 0.05 -2.90 0.00 0.00 0.56 0.00 0.00 36.38 34.09 2k8i s VAL 117 CO -0.05 -0.29 0.04 -0.69 -0.31 0.00 0.00 175.10 173.80 2k8i s VAL 118 N -2.38 3.80 -0.03 1.32 1.01 0.87 -1.80 120.40 123.20 2k8i s VAL 118 Ca 0.34 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.77 2k8i s VAL 118 Cb -0.04 -2.89 -0.01 0.00 0.00 0.00 0.00 36.38 33.43 2k8i s VAL 118 CO 0.21 0.19 -0.22 0.68 0.00 0.00 0.00 175.10 175.95 2k8i s VAL 119 N 1.50 1.78 -0.11 2.92 -7.23 -1.08 0.36 120.40 118.54 2k8i s VAL 119 Ca 0.03 -0.95 0.02 0.00 -1.81 0.00 0.00 61.98 59.27 2k8i s VAL 119 Cb -0.16 -1.49 0.01 0.00 0.56 0.00 0.00 36.38 35.30 2k8i s VAL 119 CO 0.01 0.50 -0.17 -0.62 -0.31 0.00 0.00 175.10 174.51 2k8i s ASP 120 N -0.41 2.55 0.49 4.85 2.15 -1.07 -2.36 116.67 122.86 2k8i s ASP 120 Ca 0.05 -0.46 0.28 0.00 0.43 0.00 0.00 52.55 52.86 2k8i s ASP 120 Cb -0.10 -1.15 1.06 0.00 -0.30 0.00 0.00 42.92 42.42 2k8i s ASP 120 CO 0.00 0.05 1.87 1.23 -0.17 0.00 0.00 175.17 178.15 2k8i h GLY 121 N 7.26 0.00 -6.89 2.66 0.00 -1.85 -3.27 103.07 100.98 2k8i h GLY 121 Ca -0.30 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 46.42 2k8i h GLY 121 CO 0.50 0.00 0.43 -1.31 0.00 0.00 0.00 176.54 176.15 2k8i s ASN 122 N -5.99 6.47 0.00 0.19 0.01 -1.24 -4.30 114.94 110.09 2k8i s ASN 122 Ca 0.01 0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.24 2k8i s ASN 122 Cb 0.09 -2.41 0.00 0.00 0.41 0.00 0.00 41.25 39.35 2k8i s ASN 122 CO 0.60 -0.91 0.00 1.57 -1.51 0.00 0.00 177.10 176.85 2k8i n HIS 123 N 6.77 0.00 0.04 2.20 -0.00 0.42 -4.74 115.22 119.90 2k8i n HIS 123 Ca 0.04 0.00 -0.03 0.00 0.46 0.00 0.00 57.72 58.19 2k8i n HIS 123 Cb 0.48 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.34 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 -0.17 0.00 1.57 -0.00 -1.96 -3.42 114.93 110.95 2k8i h MET 124 Ca 0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 59.70 59.71 2k8i h MET 124 Cb 0.00 0.04 -0.00 0.00 -0.00 0.00 0.00 31.60 31.64 2k8i h MET 124 CO 0.00 -0.11 -1.05 1.28 -0.00 0.00 0.00 176.91 177.03 2k8i n LEU 125 N -4.35 0.00 0.00 -0.10 4.32 -1.26 -4.99 117.00 110.63 2k8i n LEU 125 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.97 2k8i n LEU 125 Cb 0.07 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.87 2k8i n LEU 125 CO 0.05 0.00 0.00 0.00 -1.22 0.00 0.00 177.39 176.22 2k8i n ALA 126 N -1.56 0.00 0.00 -1.18 0.00 -1.26 -3.30 120.51 113.22 2k8i n ALA 126 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k8i n ALA 126 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.50 2k8i n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8i n GLY 127 N 0.00 2.57 3.69 0.00 0.00 -1.26 -0.44 105.19 109.75 2k8i n GLY 127 Ca 0.00 -0.10 -0.44 0.00 0.00 0.00 0.00 46.02 45.48 2k8i n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k8i n GLN 128 N 0.00 2.16 -3.04 1.61 10.64 -1.26 -4.29 117.38 123.20 2k8i n GLN 128 Ca 0.00 0.77 -0.28 0.00 -1.83 0.00 0.00 57.00 55.65 2k8i n GLN 128 Cb 0.00 -2.42 -0.02 0.00 -0.86 0.00 0.00 30.24 26.94 2k8i n GLN 128 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 2k8i s ASN 129 N 0.14 6.41 0.06 2.61 0.02 -1.26 -1.08 114.94 121.84 2k8i s ASN 129 Ca 0.64 0.86 0.06 0.00 -1.02 0.00 0.00 52.86 53.40 2k8i s ASN 129 Cb -0.60 -2.21 -0.04 0.00 0.02 0.00 0.00 41.25 38.42 2k8i s ASN 129 CO 0.53 -0.35 -0.09 -0.76 0.02 0.00 0.00 177.10 176.45 2k8i s LEU 130 N -3.98 3.05 -0.18 0.60 1.43 0.89 -3.15 118.68 117.33 2k8i s LEU 130 Ca 0.46 -0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 53.25 2k8i s LEU 130 Cb -0.10 -1.81 -0.00 0.00 0.03 0.00 0.00 46.19 44.31 2k8i s LEU 130 CO 0.34 0.22 -0.11 -0.54 0.23 0.00 0.00 176.35 176.49 2k8i s LYS 131 N -1.86 3.26 -0.19 1.70 1.02 0.24 -1.36 119.74 122.56 2k8i s LYS 131 Ca 0.19 -0.70 -0.02 0.00 0.02 0.00 0.00 55.97 55.47 2k8i s LYS 131 Cb -0.11 -2.78 0.00 0.00 -0.52 0.00 0.00 37.83 34.42 2k8i s LYS 131 CO 0.11 -0.09 -0.11 -0.06 -0.92 0.00 0.00 175.35 174.28 2k8i s PHE 132 N 1.12 2.87 -0.48 3.18 0.08 0.10 -0.60 117.98 124.25 2k8i s PHE 132 Ca 0.01 -1.17 -0.20 0.00 0.12 0.00 0.00 56.93 55.68 2k8i s PHE 132 Cb -0.14 -2.00 0.04 0.00 -0.57 0.00 0.00 43.02 40.35 2k8i s PHE 132 CO -0.03 -0.61 0.65 -0.80 -0.10 0.00 0.00 175.22 174.33 2k8i s ASN 133 N 1.28 6.26 -0.12 1.36 0.02 0.52 0.83 114.94 125.10 2k8i s ASN 133 Ca 0.03 -0.66 -0.07 0.00 -1.02 0.00 0.00 52.86 51.13 2k8i s ASN 133 Cb -0.14 -2.31 -0.04 0.00 0.02 0.00 0.00 41.25 38.78 2k8i s ASN 133 CO -0.06 -0.87 0.15 -0.69 0.02 0.00 0.00 177.10 175.66 2k8i s VAL 134 N 2.79 5.48 -0.40 1.60 1.01 0.92 -1.34 120.40 130.46 2k8i s VAL 134 Ca 0.19 0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.42 2k8i s VAL 134 Cb -0.17 -3.42 0.13 0.00 0.00 0.00 0.00 36.38 32.93 2k8i s VAL 134 CO 0.15 0.61 0.22 -1.61 0.00 0.00 0.00 175.10 174.47 2k8i s GLU 135 N -0.99 1.01 -0.37 2.72 2.02 0.14 -2.16 118.70 121.06 2k8i s GLU 135 Ca 0.15 -1.72 -0.28 0.00 0.02 0.00 0.00 54.97 53.15 2k8i s GLU 135 Cb -0.12 -1.99 -0.03 0.00 0.10 0.00 0.00 34.13 32.09 2k8i s GLU 135 CO 0.04 -1.16 1.90 0.54 0.02 0.00 0.00 175.26 176.61 2k8i s VAL 136 N 0.68 3.37 -0.01 2.63 0.11 -1.07 -0.06 120.40 126.05 2k8i s VAL 136 Ca 0.17 0.35 -0.23 0.00 -2.93 0.00 0.00 61.98 59.33 2k8i s VAL 136 Cb -0.23 -3.57 -0.20 0.00 -1.53 0.00 0.00 36.38 30.85 2k8i s VAL 136 CO -0.02 -0.41 1.19 0.58 -3.33 0.00 0.00 175.10 173.11 2k8i h VAL 137 N 6.92 1.44 -2.68 2.04 2.07 -1.29 0.37 116.25 125.13 2k8i h VAL 137 Ca -0.33 -1.55 -0.02 0.00 0.82 0.00 0.00 66.70 65.62 2k8i h VAL 137 Cb 1.18 2.33 -0.14 0.00 -1.52 0.00 0.00 31.29 33.14 2k8i h VAL 137 CO 1.06 0.43 0.23 0.00 0.02 0.00 0.00 177.57 179.31 2k8i s ALA 138 N -3.78 -1.66 -0.02 1.67 0.00 -0.77 -4.55 121.76 112.65 2k8i s ALA 138 Ca -0.15 0.75 0.01 0.00 0.00 0.00 0.00 51.96 52.57 2k8i s ALA 138 Cb 0.03 0.61 0.01 0.00 0.00 0.00 0.00 23.12 23.77 2k8i s ALA 138 CO 0.73 -0.65 -0.01 0.42 0.00 0.00 0.00 175.76 176.24 2k8i s ILE 139 N -3.01 0.20 -0.03 0.00 1.01 -1.26 -2.07 121.20 116.04 2k8i s ILE 139 Ca -0.02 -0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.57 2k8i s ILE 139 Cb -0.01 -0.24 0.01 0.00 0.01 0.00 0.00 42.46 42.23 2k8i s ILE 139 CO -0.07 0.11 0.12 -0.60 0.00 0.00 0.00 174.94 174.50 2k8i s ARG 140 N 0.53 0.23 -0.08 2.79 3.52 0.13 -5.01 118.95 121.06 2k8i s ARG 140 Ca -0.05 0.00 -0.30 0.00 -0.13 0.00 0.00 55.73 55.25 2k8i s ARG 140 Cb -0.08 0.10 -0.02 0.00 -1.56 0.00 0.00 34.95 33.39 2k8i s ARG 140 CO -0.01 -0.04 1.01 -1.83 -0.81 0.00 0.00 175.30 173.62 2k8i s GLU 141 N -0.34 4.45 0.99 5.12 -1.05 -1.26 0.43 118.70 127.03 2k8i s GLU 141 Ca -0.04 1.42 -0.12 0.00 -0.15 0.00 0.00 54.97 56.08 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 0.00 -0.26 1.08 0.00 0.95 0.00 0.00 175.26 177.03 2k8i s ALA 142 N 1.79 0.91 -0.46 -0.84 0.00 -1.15 -4.86 121.76 117.15 2k8i s ALA 142 Ca 0.50 -0.08 0.07 0.00 0.00 0.00 0.00 51.96 52.44 2k8i s ALA 142 Cb -0.19 -3.21 0.48 0.00 0.00 0.00 0.00 23.12 20.19 2k8i s ALA 142 CO 0.21 -2.87 1.36 0.25 0.00 0.00 0.00 175.76 174.71 2k8i n THR 143 N -4.24 1.90 0.00 0.00 -2.24 -1.26 -4.88 114.28 103.56 2k8i n THR 143 Ca 0.06 -0.95 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 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 0.11 0.00 -0.22 -0.78 1.02 -1.26 -4.49 120.64 115.02 2k8i n GLU 144 Ca 0.23 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.30 2k8i n GLU 144 Cb 0.95 -0.19 0.03 0.00 -0.02 0.00 0.00 31.44 32.22 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 0.93 -0.45 3.49 5.08 -1.97 0.42 114.58 122.08 2k8i h GLU 145 Ca 0.00 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 2k8i h GLU 145 Cb 0.00 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 2k8i h GLU 145 CO 0.00 0.79 0.19 0.93 -1.00 0.00 0.00 179.01 179.93 2k8i h GLU 146 N 0.86 0.63 -0.05 2.33 5.08 -1.79 0.66 114.58 122.31 2k8i h GLU 146 Ca 0.20 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2k8i h GLU 146 Cb 0.22 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2k8i h GLU 146 CO -0.01 0.51 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.16 2k8i h LEU 147 N 0.63 0.33 -1.78 1.33 3.38 -1.58 0.27 115.31 117.90 2k8i h LEU 147 Ca 0.16 -0.66 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 2k8i h LEU 147 Cb 0.11 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2k8i h LEU 147 CO -0.02 0.94 0.10 0.00 0.09 0.00 0.00 178.44 179.55 2k8i h ALA 148 N 0.40 1.83 0.01 1.53 0.00 0.19 -2.75 119.26 120.49 2k8i h ALA 148 Ca -0.02 -0.03 -0.33 0.00 0.00 0.00 0.00 54.91 54.53 2k8i h ALA 148 Cb 0.93 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.59 2k8i h ALA 148 CO 0.06 0.15 -1.97 0.72 0.00 0.00 0.00 179.25 178.20 2k8i n HIS 149 N -4.49 0.71 0.00 0.00 8.25 0.19 -5.00 115.22 114.88 2k8i n HIS 149 Ca -0.00 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.69 2k8i n HIS 149 Cb 0.09 -1.12 0.00 0.00 1.12 0.00 0.00 29.99 30.08 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 1.70 1.00 3.82 -1.41 0.00 0.82 -5.06 105.19 106.05 2k8i n GLY 150 Ca -0.25 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 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 0.12 0.64 1.61 -3.43 -0.37 -4.74 115.29 107.13 2k8i s HIS 151 Ca 0.00 -0.76 -0.17 0.00 -0.80 0.00 0.00 55.06 53.34 2k8i s HIS 151 Cb 0.00 0.82 -0.01 0.00 -1.43 0.00 0.00 32.58 31.96 2k8i s HIS 151 CO 0.00 -1.47 1.15 0.08 -2.00 0.00 0.00 174.74 172.51 2k8i s VAL 152 N -2.22 2.90 -0.69 -5.38 1.01 -1.26 -4.29 120.40 110.46 2k8i s VAL 152 Ca 0.17 0.47 0.08 0.00 0.00 0.00 0.00 61.98 62.70 2k8i s VAL 152 Cb -0.05 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 2k8i s VAL 152 CO 0.10 -0.20 0.54 0.00 0.00 0.00 0.00 175.10 175.54 2k8i n HIS 153 N -2.11 0.00 -2.70 5.22 -0.00 -1.26 -4.79 115.22 109.58 2k8i n HIS 153 Ca 0.12 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.78 2k8i n HIS 153 Cb 0.51 0.00 0.08 0.00 -0.00 0.00 0.00 29.99 30.58 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 0.82 -0.69 0.10 -1.39 0.00 -1.26 -5.02 105.19 97.75 2k8i n GLY 154 Ca 0.03 0.53 -0.13 0.00 0.00 0.00 0.00 46.02 46.44 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 0.98 1.57 -2.62 4.61 0.00 -1.26 -4.93 120.51 118.85 2k8i n ALA 155 Ca 0.02 -0.90 -0.43 0.00 0.00 0.00 0.00 53.44 52.14 2k8i n ALA 155 Cb 0.70 0.01 -0.02 0.00 0.00 0.00 0.00 19.45 20.14 2k8i n ALA 155 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2k8i s HIS 156 N -2.40 3.34 0.48 0.00 2.46 -1.26 -5.02 115.29 112.89 2k8i s HIS 156 Ca -0.25 1.44 -0.06 0.00 0.47 0.00 0.00 55.06 56.66 2k8i s HIS 156 Cb 0.07 -3.28 -0.04 0.00 -0.13 0.00 0.00 32.58 29.20 2k8i s HIS 156 CO 0.50 -0.60 0.80 0.34 -2.47 0.00 0.00 174.74 173.30 2k8i s ASP 157 N 1.27 6.29 0.00 9.88 2.15 -1.26 -5.00 116.67 130.01 2k8i s ASP 157 Ca 0.48 0.99 0.24 0.00 0.43 0.00 0.00 52.55 54.69 2k8i s ASP 157 Cb -0.18 -2.27 0.33 0.00 -0.30 0.00 0.00 42.92 40.49 2k8i s ASP 157 CO 0.14 -0.57 1.30 1.41 -0.17 0.00 0.00 175.17 177.28 2k8i n HIS 158 N -2.16 0.00 0.00 -5.34 8.25 -1.26 -4.80 115.22 109.91 2k8i n HIS 158 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2k8i n HIS 158 Cb 0.55 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.62 2k8i n HIS 158 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k8i n HIS 159 N 0.00 -0.86 0.00 4.41 -0.00 -1.26 -5.07 115.22 112.44 2k8i n HIS 159 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.84 2k8i n HIS 159 Cb 0.44 0.49 0.00 0.00 -0.00 0.00 0.00 29.99 30.93 2k8i n HIS 159 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2k8i n HIS 160 N -2.48 0.00 -3.43 1.57 -0.00 -1.26 -5.14 115.22 104.49 2k8i n HIS 160 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.60 2k8i n HIS 160 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 29.97 2k8i n HIS 160 CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.34 176.50 2k8i s ASP 161 N 0.00 -0.56 -0.03 0.26 -4.77 -1.26 -5.09 116.67 105.22 2k8i s ASP 161 Ca 0.00 0.01 -0.01 0.00 -3.30 0.00 0.00 52.55 49.25 2k8i s ASP 161 Cb 0.00 0.59 -0.02 0.00 -1.09 0.00 0.00 42.92 42.40 2k8i s ASP 161 CO 0.00 -0.95 -0.04 1.41 0.70 0.00 0.00 175.17 176.30 2k8i n HIS 162 N -0.36 0.00 -1.16 2.11 8.25 -1.26 -4.82 115.22 117.98 2k8i n HIS 162 Ca -0.17 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.11 2k8i n HIS 162 Cb 0.65 -0.12 -0.08 0.00 1.12 0.00 0.00 29.99 31.56 2k8i n HIS 162 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2k8i n ASP 163 N -2.94 5.97 -4.68 0.41 8.00 -1.26 -4.90 116.55 117.16 2k8i n ASP 163 Ca -0.06 -2.88 -0.42 0.00 0.71 0.00 0.00 54.79 52.14 2k8i n ASP 163 Cb 0.55 -1.26 -0.03 0.00 -0.02 0.00 0.00 41.12 40.37 2k8i n ASP 163 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 2k8i s HIS 164 N -0.69 2.93 0.01 1.24 -3.43 -1.26 -5.01 115.29 109.09 2k8i s HIS 164 Ca 0.53 1.00 0.02 0.00 -0.80 0.00 0.00 55.06 55.80 2k8i s HIS 164 Cb 0.31 -3.53 -0.01 0.00 -1.43 0.00 0.00 32.58 27.92 2k8i s HIS 164 CO -0.10 -1.85 -0.06 0.34 -2.00 0.00 0.00 174.74 171.07 2k8i s ASP 165 N 1.84 0.64 -0.09 7.38 2.15 -1.26 -5.02 116.67 122.30 2k8i s ASP 165 Ca 0.58 -0.20 0.13 0.00 0.43 0.00 0.00 52.55 53.49 2k8i s ASP 165 Cb -0.26 -0.04 0.24 0.00 -0.30 0.00 0.00 42.92 42.56 2k8i s ASP 165 CO 0.21 -0.01 1.12 0.00 -0.17 0.00 0.00 175.17 176.33 2k8i n HIS 166 N 2.59 0.00 -2.94 -5.34 1.44 -1.26 -5.05 115.22 104.65 2k8i n HIS 166 Ca -0.15 -0.73 0.00 0.00 -2.01 0.00 0.00 57.72 54.83 2k8i n HIS 166 Cb 0.57 -0.14 0.00 0.00 0.12 0.00 0.00 29.99 30.55 2k8i n HIS 166 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2k8i n HIS 167 N -0.74 -1.27 -3.11 -1.40 8.25 -1.26 -5.06 115.22 110.63 2k8i n HIS 167 Ca 0.11 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 57.12 2k8i n HIS 167 Cb 0.72 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.79 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 0.86 3.00 0.02 4.41 3.76 -1.26 -4.90 115.29 121.18 2k8i s HIS 168 Ca 0.00 -0.91 0.24 0.00 -0.15 0.00 0.00 55.06 54.24 2k8i s HIS 168 Cb 0.00 -3.96 0.80 0.00 1.11 0.00 0.00 32.58 30.53 2k8i s HIS 168 CO 0.00 -1.27 1.77 1.25 -0.85 0.00 0.00 174.74 175.64 2k8i h HIS 169 N 9.17 0.00 -3.38 1.40 2.76 -1.98 -3.41 115.15 119.72 2k8i h HIS 169 Ca -0.29 0.00 -0.55 0.00 -2.20 0.00 0.00 60.37 57.32 2k8i h HIS 169 Cb 1.09 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.00 2k8i h HIS 169 CO 0.83 0.20 0.14 -3.38 -1.30 0.00 0.00 177.93 174.42 2k8i s HIS 170 N -3.51 3.62 0.00 5.26 -3.43 -1.26 -5.27 115.29 110.70 2k8i s HIS 170 Ca 0.02 1.35 0.00 0.00 -0.80 0.00 0.00 55.06 55.63 2k8i s HIS 170 Cb 0.09 -2.85 0.00 0.00 -1.43 0.00 0.00 32.58 28.39 2k8i s HIS 170 CO 0.64 0.11 0.00 1.58 -2.00 0.00 0.00 174.74 175.07