#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 2.28 -0.14 3.17 -2.85 -1.26 -4.60 119.74 116.34 2k8i s LYS 2 Ca 0.00 -1.94 -0.26 0.00 -1.00 0.00 0.00 55.97 52.77 2k8i s LYS 2 Cb 0.00 -2.04 -0.02 0.00 -2.06 0.00 0.00 37.83 33.71 2k8i s LYS 2 CO 0.00 -0.37 0.86 0.54 0.10 0.00 0.00 175.35 176.48 2k8i s VAL 3 N -2.69 4.88 0.04 1.79 0.11 -0.56 -4.97 120.40 119.00 2k8i s VAL 3 Ca 0.35 1.72 0.00 0.00 -2.93 0.00 0.00 61.98 61.12 2k8i s VAL 3 Cb -0.00 -4.17 -0.00 0.00 -1.53 0.00 0.00 36.38 30.68 2k8i s VAL 3 CO 0.21 0.05 0.05 0.00 -3.33 0.00 0.00 175.10 172.08 2k8i n ALA 4 N 4.95 -0.00 -1.65 1.54 0.00 -1.26 -2.50 120.51 121.59 2k8i n ALA 4 Ca 0.05 -0.19 -0.36 0.00 0.00 0.00 0.00 53.44 52.94 2k8i n ALA 4 Cb 0.49 0.16 0.05 0.00 0.00 0.00 0.00 19.45 20.15 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 -2.11 2.69 0.00 0.00 2.20 -1.26 -2.34 119.74 118.92 2k8i s LYS 5 Ca 0.04 1.84 0.00 0.00 -0.36 0.00 0.00 55.97 57.48 2k8i s LYS 5 Cb -0.00 -1.89 0.00 0.00 -1.51 0.00 0.00 37.83 34.43 2k8i s LYS 5 CO 0.03 -1.43 0.00 -0.25 -0.36 0.00 0.00 175.35 173.34 2k8i n ASP 6 N -1.94 -3.00 -4.31 1.43 8.00 -0.09 -4.90 116.55 111.74 2k8i n ASP 6 Ca 0.14 0.00 -0.45 0.00 0.71 0.00 0.00 54.79 55.18 2k8i n ASP 6 Cb 0.50 -2.23 -0.06 0.00 -0.02 0.00 0.00 41.12 39.31 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 6.10 0.34 0.64 1.43 -0.99 -2.95 118.68 123.25 2k8i s LEU 7 Ca 0.00 -1.76 -0.28 0.00 -1.03 0.00 0.00 54.13 51.06 2k8i s LEU 7 Cb 0.00 -2.19 -0.10 0.00 0.03 0.00 0.00 46.19 43.93 2k8i s LEU 7 CO 0.00 -0.83 1.22 0.54 0.23 0.00 0.00 176.35 177.51 2k8i s VAL 8 N 1.58 3.03 0.09 -1.59 0.11 0.29 -3.96 120.40 119.94 2k8i s VAL 8 Ca 0.03 0.99 0.01 0.00 -2.93 0.00 0.00 61.98 60.09 2k8i s VAL 8 Cb -0.29 -3.61 -0.04 0.00 -1.53 0.00 0.00 36.38 30.91 2k8i s VAL 8 CO 0.03 0.20 -0.06 0.68 -3.33 0.00 0.00 175.10 172.62 2k8i s VAL 9 N -1.22 0.61 -0.21 2.04 -7.23 -1.21 -0.64 120.40 112.55 2k8i s VAL 9 Ca 0.50 -1.83 -0.00 0.00 -1.81 0.00 0.00 61.98 58.83 2k8i s VAL 9 Cb -0.35 -1.55 0.02 0.00 0.56 0.00 0.00 36.38 35.05 2k8i s VAL 9 CO 0.46 -0.85 -0.13 -0.44 -0.31 0.00 0.00 175.10 173.83 2k8i s SER 10 N -2.88 3.71 0.12 4.85 0.01 -0.93 -3.31 113.70 115.26 2k8i s SER 10 Ca 0.09 -0.70 0.02 0.00 1.31 0.00 0.00 55.95 56.67 2k8i s SER 10 Cb 0.04 -1.58 -0.04 0.00 0.21 0.00 0.00 66.02 64.65 2k8i s SER 10 CO -0.05 -0.04 -0.05 -1.48 0.41 0.00 0.00 173.24 172.02 2k8i s LEU 11 N 1.32 2.41 -0.27 2.44 -0.00 -0.75 -0.61 118.68 123.22 2k8i s LEU 11 Ca 0.03 -1.05 0.03 0.00 -0.00 0.00 0.00 54.13 53.14 2k8i s LEU 11 Cb -0.15 -0.11 0.07 0.00 -0.00 0.00 0.00 46.19 46.01 2k8i s LEU 11 CO -0.09 -0.47 -0.06 0.00 -0.00 0.00 0.00 176.35 175.73 2k8i s ALA 12 N -3.59 2.51 0.25 1.48 0.00 0.27 0.12 121.76 122.81 2k8i s ALA 12 Ca 0.16 -1.85 0.12 0.00 0.00 0.00 0.00 51.96 50.38 2k8i s ALA 12 Cb 0.05 -1.64 -0.05 0.00 0.00 0.00 0.00 23.12 21.48 2k8i s ALA 12 CO -0.02 -1.30 -0.21 1.52 0.00 0.00 0.00 175.76 175.75 2k8i s TYR 13 N 1.12 2.25 -0.13 0.00 1.13 -1.01 -0.73 117.35 119.98 2k8i s TYR 13 Ca -0.04 -0.35 -0.00 0.00 -1.41 0.00 0.00 57.07 55.26 2k8i s TYR 13 Cb -0.20 -1.01 0.03 0.00 -1.10 0.00 0.00 41.96 39.68 2k8i s TYR 13 CO -0.06 0.64 -0.10 -1.14 -2.51 0.00 0.00 175.55 172.37 2k8i s GLN 14 N -3.30 1.85 -0.27 -3.49 0.74 -0.38 0.50 119.66 115.30 2k8i s GLN 14 Ca 0.27 -0.42 -0.10 0.00 0.05 0.00 0.00 55.36 55.16 2k8i s GLN 14 Cb -0.05 -1.86 -0.04 0.00 1.10 0.00 0.00 33.01 32.15 2k8i s GLN 14 CO 0.13 -0.27 0.15 0.54 -0.55 0.00 0.00 175.29 175.29 2k8i s VAL 15 N 1.60 4.99 0.03 1.34 0.11 0.49 -0.89 120.40 128.07 2k8i s VAL 15 Ca 0.04 0.05 0.03 0.00 -2.93 0.00 0.00 61.98 59.17 2k8i s VAL 15 Cb -0.13 -3.37 -0.02 0.00 -1.53 0.00 0.00 36.38 31.34 2k8i s VAL 15 CO -0.09 0.27 -0.09 -0.60 -3.33 0.00 0.00 175.10 171.27 2k8i s ARG 16 N 1.71 0.60 0.85 1.54 3.52 0.77 -1.62 118.95 126.32 2k8i s ARG 16 Ca 0.07 -0.59 -0.07 0.00 -0.13 0.00 0.00 55.73 55.01 2k8i s ARG 16 Cb -0.16 -0.49 0.18 0.00 -1.56 0.00 0.00 34.95 32.92 2k8i s ARG 16 CO 0.09 0.11 1.16 0.95 -0.81 0.00 0.00 175.30 176.80 2k8i s THR 17 N -0.87 2.02 0.44 4.11 -4.23 -0.85 0.29 115.64 116.54 2k8i s THR 17 Ca -0.04 -0.36 0.14 0.00 -1.18 0.00 0.00 61.69 60.26 2k8i s THR 17 Cb -0.07 -2.66 0.17 0.00 1.34 0.00 0.00 72.50 71.28 2k8i s THR 17 CO 0.00 0.00 1.97 -0.33 -0.54 0.00 0.00 174.62 175.73 2k8i h GLU 18 N -1.08 0.00 0.00 3.99 4.39 -1.91 -1.91 114.58 118.06 2k8i h GLU 18 Ca -0.39 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.31 2k8i h GLU 18 Cb 1.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2k8i h GLU 18 CO 0.36 0.20 0.00 0.22 -1.16 0.00 0.00 179.01 178.63 2k8i h ASP 19 N 0.00 0.00 0.00 1.42 3.58 -1.95 -3.45 116.42 116.02 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 0.36 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.41 2k8i h ASP 19 CO 0.03 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 177.00 2k8i n GLY 20 N -0.59 0.66 3.76 -0.78 0.00 -0.72 -5.05 105.19 102.47 2k8i n GLY 20 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.44 4.77 -0.15 1.61 0.11 -1.26 -4.83 120.40 118.20 2k8i s VAL 21 Ca 0.00 1.48 -0.26 0.00 -2.93 0.00 0.00 61.98 60.27 2k8i s VAL 21 Cb 0.00 -4.04 -0.01 0.00 -1.53 0.00 0.00 36.38 30.79 2k8i s VAL 21 CO 0.00 0.41 0.87 -0.22 -3.33 0.00 0.00 175.10 172.82 2k8i s LEU 22 N -0.24 4.20 -0.17 2.54 0.20 -1.26 -2.02 118.68 121.92 2k8i s LEU 22 Ca 0.35 1.25 -0.02 0.00 0.69 0.00 0.00 54.13 56.41 2k8i s LEU 22 Cb -0.20 -3.30 -0.23 0.00 -0.43 0.00 0.00 46.19 42.04 2k8i s LEU 22 CO 0.21 -0.40 0.14 1.33 -0.29 0.00 0.00 176.35 177.34 2k8i n VAL 23 N 4.66 1.65 -3.46 1.68 0.24 -0.64 -5.00 118.33 117.47 2k8i n VAL 23 Ca 0.05 -0.64 -0.11 0.00 -2.04 0.00 0.00 64.34 61.61 2k8i n VAL 23 Cb 0.49 -1.54 -0.02 0.00 -1.47 0.00 0.00 33.84 31.30 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 -6.75 -0.50 -0.15 -1.34 -1.08 -1.11 -5.06 116.67 100.69 2k8i s ASP 24 Ca -0.26 0.03 -0.29 0.00 -0.52 0.00 0.00 52.55 51.51 2k8i s ASP 24 Cb 0.08 0.52 0.11 0.00 -1.46 0.00 0.00 42.92 42.16 2k8i s ASP 24 CO 0.71 -0.82 0.91 -1.83 0.52 0.00 0.00 175.17 174.65 2k8i s GLU 25 N -3.40 0.71 -0.34 4.34 -1.05 -1.26 -0.38 118.70 117.32 2k8i s GLU 25 Ca 0.02 0.28 -0.12 0.00 -0.15 0.00 0.00 54.97 55.00 2k8i s GLU 25 Cb -0.01 0.34 -0.00 0.00 -0.44 0.00 0.00 34.13 34.02 2k8i s GLU 25 CO -0.11 -0.20 0.21 -1.12 0.95 0.00 0.00 175.26 174.99 2k8i s SER 26 N -0.88 5.82 0.93 0.83 0.01 0.18 -4.97 113.70 115.62 2k8i s SER 26 Ca -0.03 -0.61 -0.11 0.00 1.31 0.00 0.00 55.95 56.50 2k8i s SER 26 Cb -0.01 -2.07 0.15 0.00 0.21 0.00 0.00 66.02 64.30 2k8i s SER 26 CO 0.03 -0.27 1.09 -2.16 0.41 0.00 0.00 173.24 172.34 2k8i s PRO 27 N 1.65 0.96 0.23 12.44 0.04 -1.22 -2.40 135.00 146.69 2k8i s PRO 27 Ca 0.05 1.07 0.21 0.00 0.04 0.00 0.00 61.00 62.36 2k8i s PRO 27 Cb -0.18 -1.76 0.93 0.00 0.04 0.00 0.00 34.50 33.54 2k8i s PRO 27 CO 0.08 -2.52 1.63 1.33 0.04 0.00 0.00 177.00 177.57 2k8i n VAL 28 N -4.10 0.96 0.05 -0.36 0.24 -1.26 -1.87 118.33 111.98 2k8i n VAL 28 Ca 0.08 0.36 -0.08 0.00 -2.04 0.00 0.00 64.34 62.66 2k8i n VAL 28 Cb 0.54 -1.29 -0.13 0.00 -1.47 0.00 0.00 33.84 31.50 2k8i n VAL 28 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2k8i h SER 29 N 0.00 0.04 -2.93 -1.34 4.64 -2.01 -3.44 113.55 108.51 2k8i h SER 29 Ca 0.00 -0.05 -0.34 0.00 -0.47 0.00 0.00 61.79 60.93 2k8i h SER 29 Cb 0.25 -0.01 -0.37 0.00 -0.31 0.00 0.00 62.40 61.96 2k8i h SER 29 CO 0.00 1.04 -0.66 0.00 -0.87 0.00 0.00 176.83 176.33 2k8i s ALA 30 N -2.68 -0.04 0.58 5.18 0.00 -0.78 -5.15 121.76 118.86 2k8i s ALA 30 Ca -0.01 0.26 -0.16 0.00 0.00 0.00 0.00 51.96 52.05 2k8i s ALA 30 Cb 0.09 -1.00 -0.04 0.00 0.00 0.00 0.00 23.12 22.17 2k8i s ALA 30 CO 0.83 -0.88 1.05 -2.14 0.00 0.00 0.00 175.76 174.61 2k8i s PRO 31 N 2.26 3.43 0.15 0.00 0.02 -1.25 -3.46 135.00 136.15 2k8i s PRO 31 Ca 0.04 1.18 -0.30 0.00 0.02 0.00 0.00 61.00 61.94 2k8i s PRO 31 Cb -0.14 -2.05 -0.07 0.00 0.02 0.00 0.00 34.50 32.26 2k8i s PRO 31 CO -0.08 -0.72 1.07 -1.17 -0.33 0.00 0.00 177.00 175.78 2k8i s LEU 32 N -4.38 4.48 -0.23 -5.54 2.96 0.33 -4.77 118.68 111.54 2k8i s LEU 32 Ca 0.63 2.00 -0.05 0.00 -0.22 0.00 0.00 54.13 56.50 2k8i s LEU 32 Cb -0.15 -3.60 -0.02 0.00 0.50 0.00 0.00 46.19 42.93 2k8i s LEU 32 CO 0.35 -0.21 -0.01 -1.81 -1.32 0.00 0.00 176.35 173.36 2k8i s ASP 33 N 0.04 4.57 -0.04 3.68 1.01 -1.26 -1.81 116.67 122.86 2k8i s ASP 33 Ca 0.50 -0.33 -0.16 0.00 0.71 0.00 0.00 52.55 53.27 2k8i s ASP 33 Cb -0.28 -1.80 0.03 0.00 1.01 0.00 0.00 42.92 41.89 2k8i s ASP 33 CO 0.33 -0.02 0.36 -0.72 0.21 0.00 0.00 175.17 175.33 2k8i s TYR 34 N 1.49 -0.27 -0.47 4.23 1.13 -1.21 -4.98 117.35 117.27 2k8i s TYR 34 Ca 0.06 0.47 -0.28 0.00 -1.41 0.00 0.00 57.07 55.91 2k8i s TYR 34 Cb -0.14 0.14 0.03 0.00 -1.10 0.00 0.00 41.96 40.88 2k8i s TYR 34 CO -0.01 -0.38 1.08 -1.17 -2.51 0.00 0.00 175.55 172.56 2k8i s LEU 35 N -1.07 3.73 0.31 -3.49 2.96 -1.26 -3.34 118.68 116.53 2k8i s LEU 35 Ca -0.11 0.38 -0.28 0.00 -0.22 0.00 0.00 54.13 53.89 2k8i s LEU 35 Cb -0.04 -3.46 -0.10 0.00 0.50 0.00 0.00 46.19 43.09 2k8i s LEU 35 CO 0.04 -1.20 1.16 -2.28 -1.32 0.00 0.00 176.35 172.76 2k8i s HIS 36 N 4.27 3.35 0.00 5.38 5.65 -1.25 -2.24 115.29 130.45 2k8i s HIS 36 Ca 0.45 1.60 0.00 0.00 0.25 0.00 0.00 55.06 57.36 2k8i s HIS 36 Cb -0.08 -3.40 0.00 0.00 -1.18 0.00 0.00 32.58 27.92 2k8i s HIS 36 CO 0.30 -1.02 0.00 0.41 -0.65 0.00 0.00 174.74 173.78 2k8i n GLY 37 N 0.97 2.23 2.66 1.59 0.00 -1.26 -0.91 105.19 110.47 2k8i n GLY 37 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 2k8i n GLY 37 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2k8i n HIS 38 N -0.35 -0.48 0.00 1.61 1.44 -1.24 -4.89 115.22 111.31 2k8i n HIS 38 Ca 0.00 -0.77 0.00 0.00 -2.01 0.00 0.00 57.72 54.94 2k8i n HIS 38 Cb 0.00 1.19 0.00 0.00 0.12 0.00 0.00 29.99 31.30 2k8i n HIS 38 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 2k8i n GLY 39 N 0.03 2.53 0.77 -1.39 0.00 -0.95 -4.64 105.19 101.53 2k8i n GLY 39 Ca -0.15 -0.34 -0.06 0.00 0.00 0.00 0.00 46.02 45.48 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 0.94 -4.75 1.61 7.64 -1.24 -4.96 113.62 112.85 2k8i n SER 40 Ca 0.00 0.14 -0.41 0.00 1.01 0.00 0.00 58.87 59.61 2k8i n SER 40 Cb 0.00 -0.34 -0.02 0.00 -1.01 0.00 0.00 64.21 62.84 2k8i n SER 40 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2k8i s LEU 41 N -6.83 4.39 1.15 -3.43 1.43 -1.26 -4.99 118.68 109.15 2k8i s LEU 41 Ca -0.10 2.69 -0.17 0.00 -1.03 0.00 0.00 54.13 55.52 2k8i s LEU 41 Cb 0.03 -3.63 0.20 0.00 0.03 0.00 0.00 46.19 42.82 2k8i s LEU 41 CO 0.13 -0.67 0.38 2.30 0.23 0.00 0.00 176.35 178.72 2k8i n ILE 42 N 1.86 0.00 -0.03 -0.59 -5.35 -1.26 -4.70 119.36 109.30 2k8i n ILE 42 Ca 0.05 -0.16 -0.12 0.00 -0.27 0.00 0.00 62.75 62.25 2k8i n ILE 42 Cb 0.41 -0.67 -0.07 0.00 -1.74 0.00 0.00 39.64 37.57 2k8i n ILE 42 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2k8i h SER 43 N -2.69 0.17 -0.41 7.28 0.02 -1.88 -2.19 113.55 113.85 2k8i h SER 43 Ca -0.40 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.22 2k8i h SER 43 Cb 1.12 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.59 2k8i h SER 43 CO 0.28 0.44 0.20 1.23 -1.14 0.00 0.00 176.83 177.84 2k8i h GLY 44 N -0.11 0.62 0.27 -3.77 0.00 -1.51 -1.04 103.07 97.53 2k8i h GLY 44 Ca 0.03 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 2k8i h GLY 44 CO 0.01 0.29 -0.04 -2.00 0.00 0.00 0.00 176.54 174.79 2k8i h LEU 45 N 0.52 -0.10 -0.90 3.11 5.85 -1.80 -3.05 115.31 118.93 2k8i h LEU 45 Ca 0.14 -0.48 0.22 0.00 0.84 0.00 0.00 57.88 58.60 2k8i h LEU 45 Cb 0.10 0.03 -0.12 0.00 0.37 0.00 0.00 40.66 41.04 2k8i h LEU 45 CO -0.02 0.53 0.41 -0.33 -0.34 0.00 0.00 178.44 178.70 2k8i h GLU 46 N -0.85 0.42 0.00 1.25 5.08 -1.39 0.47 114.58 119.56 2k8i h GLU 46 Ca -0.01 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 2k8i h GLU 46 Cb 0.58 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2k8i h GLU 46 CO 0.02 0.28 -0.27 1.15 -1.00 0.00 0.00 179.01 179.19 2k8i h THR 47 N 0.43 1.17 0.04 1.13 2.02 -1.23 0.16 112.91 116.62 2k8i h THR 47 Ca 0.56 -0.93 -0.26 0.00 0.77 0.00 0.00 66.41 66.55 2k8i h THR 47 Cb 1.05 1.51 0.01 0.00 -1.74 0.00 0.00 68.15 68.98 2k8i h THR 47 CO -0.51 0.26 -1.06 0.00 0.37 0.00 0.00 175.52 174.58 2k8i h ALA 48 N 1.73 0.20 -0.56 6.16 0.00 -0.06 -3.17 119.26 123.56 2k8i h ALA 48 Ca -0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 54.91 54.09 2k8i h ALA 48 Cb 0.48 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2k8i h ALA 48 CO 0.03 0.77 0.03 -0.07 0.00 0.00 0.00 179.25 180.01 2k8i h LEU 49 N 0.27 0.91 -9.79 0.00 3.38 -0.45 -3.46 115.31 106.16 2k8i h LEU 49 Ca -0.12 -0.23 -0.56 0.00 0.09 0.00 0.00 57.88 57.06 2k8i h LEU 49 Cb 1.71 -0.24 0.18 0.00 0.09 0.00 0.00 40.66 42.40 2k8i h LEU 49 CO 0.19 0.95 -0.15 -0.62 0.09 0.00 0.00 178.44 178.91 2k8i n GLU 50 N -4.20 0.41 0.00 1.13 1.02 0.51 -2.62 120.64 116.89 2k8i n GLU 50 Ca 0.03 0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2k8i n GLU 50 Cb 0.31 -2.02 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 2.59 3.93 0.62 0.00 -1.04 -4.97 105.19 107.71 2k8i n GLY 51 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.85 3.19 0.28 1.61 3.76 -1.08 -4.74 115.29 116.45 2k8i s HIS 52 Ca 0.00 0.46 0.09 0.00 -0.15 0.00 0.00 55.06 55.45 2k8i s HIS 52 Cb 0.00 -2.65 -0.05 0.00 1.11 0.00 0.00 32.58 30.98 2k8i s HIS 52 CO 0.00 -0.74 -0.12 -1.21 -0.85 0.00 0.00 174.74 171.82 2k8i s GLU 53 N -4.87 1.60 0.36 1.40 2.02 -1.26 -1.50 118.70 116.45 2k8i s GLU 53 Ca 0.53 -1.77 -0.24 0.00 0.02 0.00 0.00 54.97 53.50 2k8i s GLU 53 Cb -0.10 -1.43 -0.13 0.00 0.10 0.00 0.00 34.13 32.56 2k8i s GLU 53 CO 0.42 0.17 0.66 1.33 0.02 0.00 0.00 175.26 177.87 2k8i n VAL 54 N -0.60 1.87 -0.25 2.63 0.24 -1.26 -2.81 118.33 118.15 2k8i n VAL 54 Ca -0.06 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 2k8i n VAL 54 Cb 0.62 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 32.39 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 1.67 0.78 3.73 7.63 0.00 0.18 -5.00 105.19 114.18 2k8i n GLY 55 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.91 7.34 -0.04 1.61 1.01 -1.12 -4.89 116.67 117.65 2k8i s ASP 56 Ca 0.00 1.60 0.01 0.00 0.71 0.00 0.00 52.55 54.87 2k8i s ASP 56 Cb 0.00 -2.52 0.02 0.00 1.01 0.00 0.00 42.92 41.43 2k8i s ASP 56 CO 0.00 -0.05 -0.03 -0.75 0.21 0.00 0.00 175.17 174.55 2k8i s LYS 57 N 0.09 0.69 0.32 8.23 2.36 -1.26 -2.33 119.74 127.84 2k8i s LYS 57 Ca 0.43 -0.04 -0.08 0.00 -2.55 0.00 0.00 55.97 53.73 2k8i s LYS 57 Cb -0.22 -0.77 0.03 0.00 -1.05 0.00 0.00 37.83 35.82 2k8i s LYS 57 CO 0.26 -0.12 0.56 1.97 1.55 0.00 0.00 175.35 179.58 2k8i n PHE 58 N 4.18 -1.81 -4.36 4.03 -1.74 -1.00 -5.01 117.46 111.75 2k8i n PHE 58 Ca -0.23 -1.72 -0.29 0.00 -0.56 0.00 0.00 57.45 54.64 2k8i n PHE 58 Cb 0.51 0.65 -0.12 0.00 1.52 0.00 0.00 39.48 42.04 2k8i n PHE 58 CO 0.00 0.00 0.00 0.16 -0.56 0.00 0.00 176.76 176.36 2k8i s ASP 59 N -2.77 3.65 0.01 5.98 -4.77 -1.26 -1.55 116.67 115.96 2k8i s ASP 59 Ca 0.18 -0.63 0.01 0.00 -3.30 0.00 0.00 52.55 48.81 2k8i s ASP 59 Cb -0.03 -0.41 -0.01 0.00 -1.09 0.00 0.00 42.92 41.38 2k8i s ASP 59 CO 0.13 0.18 -0.04 -0.69 0.70 0.00 0.00 175.17 175.45 2k8i s VAL 60 N -1.10 0.29 -0.16 2.11 1.01 0.13 -4.97 120.40 117.72 2k8i s VAL 60 Ca 0.16 -0.36 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 2k8i s VAL 60 Cb -0.10 -0.29 0.05 0.00 0.00 0.00 0.00 36.38 36.04 2k8i s VAL 60 CO 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 175.10 175.13 2k8i s ALA 61 N -0.42 1.14 -0.08 5.51 0.00 -1.26 0.43 121.76 127.09 2k8i s ALA 61 Ca -0.02 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.33 2k8i s ALA 61 Cb -0.03 -1.09 -0.00 0.00 0.00 0.00 0.00 23.12 21.99 2k8i s ALA 61 CO -0.00 -0.92 -0.23 0.08 0.00 0.00 0.00 175.76 174.69 2k8i s VAL 62 N 1.79 1.93 0.59 0.00 1.01 0.31 -5.00 120.40 121.03 2k8i s VAL 62 Ca 0.00 -0.97 -0.16 0.00 0.00 0.00 0.00 61.98 60.85 2k8i s VAL 62 Cb -0.16 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2k8i s VAL 62 CO -0.07 0.54 1.06 -0.83 0.00 0.00 0.00 175.10 175.80 2k8i s GLY 63 N 0.13 2.19 0.59 4.51 0.00 -1.26 -1.39 107.32 112.08 2k8i s GLY 63 Ca -0.11 0.44 0.29 0.00 0.00 0.00 0.00 44.72 45.35 2k8i s GLY 63 CO 0.06 0.77 1.78 0.00 0.00 0.00 0.00 173.10 175.70 2k8i h ALA 64 N 0.55 2.42 -0.03 3.20 0.00 -1.85 0.24 119.26 123.79 2k8i h ALA 64 Ca -0.47 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.23 2k8i h ALA 64 Cb 1.22 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2k8i h ALA 64 CO 0.57 -0.99 -0.80 -2.95 0.00 0.00 0.00 179.25 175.09 2k8i h ASN 65 N 0.00 0.38 0.57 0.00 -1.07 -1.91 -2.74 115.58 110.81 2k8i h ASN 65 Ca 0.30 -0.27 -0.14 0.00 0.07 0.00 0.00 56.30 56.26 2k8i h ASN 65 Cb 1.61 -0.11 -0.02 0.00 -2.07 0.00 0.00 38.32 37.73 2k8i h ASN 65 CO -0.00 1.03 -1.54 0.47 0.07 0.00 0.00 177.43 177.46 2k8i n ASP 66 N -3.76 0.63 0.00 6.14 8.00 -0.17 -4.88 116.55 122.52 2k8i n ASP 66 Ca -0.04 0.27 0.00 0.00 0.71 0.00 0.00 54.79 55.73 2k8i n ASP 66 Cb 0.75 0.58 0.00 0.00 -0.02 0.00 0.00 41.12 42.43 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 -2.38 0.00 -1.00 2.24 0.00 0.68 -1.24 120.51 118.81 2k8i n ALA 67 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2k8i n ALA 67 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.24 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 0.00 0.00 0.00 4.01 -1.23 -4.82 117.16 115.12 2k8i n TYR 68 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2k8i n TYR 68 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 2.11 2.46 3.27 2.72 0.00 -1.04 -4.67 105.19 110.05 2k8i n GLY 69 Ca 0.00 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 0.23 -1.44 1.61 3.00 -1.26 -2.88 117.38 116.64 2k8i n GLN 70 Ca 0.00 -2.40 -0.43 0.00 -0.01 0.00 0.00 57.00 54.16 2k8i n GLN 70 Cb 0.00 -0.44 -0.00 0.00 0.00 0.00 0.00 30.24 29.80 2k8i n GLN 70 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 2k8i n TYR 71 N -2.43 -0.49 -2.96 1.08 4.11 -1.26 -3.96 117.16 111.26 2k8i n TYR 71 Ca 0.14 0.67 -0.44 0.00 -0.00 0.00 0.00 57.90 58.27 2k8i n TYR 71 Cb 0.50 -1.99 -0.03 0.00 -0.00 0.00 0.00 39.34 37.81 2k8i n TYR 71 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 2k8i s ASP 72 N -0.91 6.35 0.00 9.48 2.15 -1.26 -4.84 116.67 127.63 2k8i s ASP 72 Ca 0.62 -1.51 0.13 0.00 0.43 0.00 0.00 52.55 52.22 2k8i s ASP 72 Cb -0.67 -2.38 0.74 0.00 -0.30 0.00 0.00 42.92 40.31 2k8i s ASP 72 CO 0.59 -1.21 1.20 -1.84 -0.17 0.00 0.00 175.17 173.74 2k8i n GLU 73 N 6.86 0.37 0.02 4.34 0.28 -1.26 -0.95 120.64 130.30 2k8i n GLU 73 Ca 0.05 0.02 0.13 0.00 -0.16 0.00 0.00 57.16 57.20 2k8i n GLU 73 Cb 0.46 -1.50 0.34 0.00 1.43 0.00 0.00 31.44 32.17 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 -1.04 0.45 0.00 -1.84 3.02 -1.26 -2.67 115.26 111.92 2k8i n ASN 74 Ca 0.09 0.11 0.13 0.00 -0.03 0.00 0.00 54.58 54.88 2k8i n ASN 74 Cb 0.05 -0.07 0.37 0.00 -0.61 0.00 0.00 39.78 39.53 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 -1.72 0.34 -4.78 3.41 7.94 -0.13 -4.66 117.00 117.40 2k8i n LEU 75 Ca 0.05 0.18 -0.36 0.00 -1.11 0.00 0.00 56.01 54.77 2k8i n LEU 75 Cb 0.37 -0.33 -0.02 0.00 0.53 0.00 0.00 43.42 43.96 2k8i n LEU 75 CO 0.33 0.07 0.77 -0.69 -1.11 0.00 0.00 177.39 176.76 2k8i s VAL 76 N -3.01 3.45 0.25 1.96 1.01 -1.09 -3.87 120.40 119.11 2k8i s VAL 76 Ca 0.12 1.06 -0.14 0.00 0.00 0.00 0.00 61.98 63.01 2k8i s VAL 76 Cb 0.18 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 2k8i s VAL 76 CO 0.64 -0.05 0.52 0.00 0.00 0.00 0.00 175.10 176.21 2k8i s GLN 77 N -2.73 1.59 -0.08 2.72 0.00 -0.38 -4.95 119.66 115.82 2k8i s GLN 77 Ca 0.62 -1.21 -0.08 0.00 -0.00 0.00 0.00 55.36 54.69 2k8i s GLN 77 Cb -0.24 0.49 -0.04 0.00 0.00 0.00 0.00 33.01 33.22 2k8i s GLN 77 CO 0.29 -0.67 0.20 1.03 0.00 0.00 0.00 175.29 176.14 2k8i s ARG 78 N -4.00 3.53 -0.05 9.60 0.52 -1.26 -1.10 118.95 126.19 2k8i s ARG 78 Ca 0.21 -0.05 -0.00 0.00 -0.52 0.00 0.00 55.73 55.36 2k8i s ARG 78 Cb -0.02 -3.18 0.03 0.00 0.52 0.00 0.00 34.95 32.30 2k8i s ARG 78 CO 0.09 0.75 -0.01 0.08 0.02 0.00 0.00 175.30 176.23 2k8i s VAL 79 N -1.08 0.34 0.16 3.52 1.01 -0.28 -4.97 120.40 119.09 2k8i s VAL 79 Ca 0.18 0.07 -0.31 0.00 0.00 0.00 0.00 61.98 61.92 2k8i s VAL 79 Cb -0.13 -0.45 -0.11 0.00 0.00 0.00 0.00 36.38 35.69 2k8i s VAL 79 CO 0.08 0.22 1.80 -2.84 0.00 0.00 0.00 175.10 174.36 2k8i s PRO 80 N 1.47 4.13 0.49 2.72 0.02 -1.26 -1.38 135.00 141.19 2k8i s PRO 80 Ca -0.03 2.62 0.31 0.00 0.02 0.00 0.00 61.00 63.91 2k8i s PRO 80 Cb -0.13 -3.41 1.67 0.00 0.02 0.00 0.00 34.50 32.65 2k8i s PRO 80 CO -0.03 -0.82 1.93 0.87 -0.33 0.00 0.00 177.00 178.62 2k8i h LYS 81 N 7.98 0.00 0.00 5.54 1.57 -1.66 0.32 116.57 130.32 2k8i h LYS 81 Ca -0.45 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.28 2k8i h LYS 81 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 2k8i h LYS 81 CO 0.95 0.00 -0.24 0.22 -0.57 0.00 0.00 179.45 179.82 2k8i h ASP 82 N 0.00 0.00 -0.25 0.86 3.58 -1.89 -3.16 116.42 115.57 2k8i h ASP 82 Ca 0.00 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 57.40 2k8i h ASP 82 Cb 0.11 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.15 2k8i h ASP 82 CO 0.00 0.24 -0.04 0.58 -2.88 0.00 0.00 179.24 177.14 2k8i h VAL 83 N 0.00 1.28 -0.42 2.25 2.07 -0.71 -3.23 116.25 117.49 2k8i h VAL 83 Ca -0.00 -1.02 -0.28 0.00 0.82 0.00 0.00 66.70 66.23 2k8i h VAL 83 Cb 0.42 1.44 -0.12 0.00 -1.52 0.00 0.00 31.29 31.52 2k8i h VAL 83 CO 0.03 0.32 0.33 0.49 0.02 0.00 0.00 177.57 178.75 2k8i n PHE 84 N -4.58 1.25 -0.18 1.57 3.72 -1.19 -4.58 117.46 113.46 2k8i n PHE 84 Ca -0.04 -1.79 0.29 0.00 -0.05 0.00 0.00 57.45 55.86 2k8i n PHE 84 Cb 0.28 -0.92 0.73 0.00 -0.94 0.00 0.00 39.48 38.63 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 1.53 0.00 -0.14 -1.08 -0.00 -1.71 0.26 114.93 113.79 2k8i h MET 85 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.94 2k8i h MET 85 Cb 0.93 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.53 2k8i h MET 85 CO 0.63 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 177.95 2k8i n GLY 86 N -1.71 -0.15 3.87 -3.00 0.00 -1.26 -4.87 105.19 98.06 2k8i n GLY 86 Ca 0.19 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.82 5.09 0.00 1.61 1.01 0.08 -5.04 120.40 121.33 2k8i s VAL 87 Ca 0.25 0.43 0.00 0.00 0.00 0.00 0.00 61.98 62.66 2k8i s VAL 87 Cb 0.13 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2k8i s VAL 87 CO 0.19 0.27 0.78 -0.67 0.00 0.00 0.00 175.10 175.68 2k8i n ASP 88 N 0.84 0.00 -3.63 3.32 2.03 -1.26 -4.76 116.55 113.09 2k8i n ASP 88 Ca -0.07 0.78 -0.20 0.00 0.52 0.00 0.00 54.79 55.82 2k8i n ASP 88 Cb 0.52 -0.28 -0.16 0.00 -0.72 0.00 0.00 41.12 40.48 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 -2.14 0.03 -0.36 -0.67 2.02 -1.26 -5.09 118.70 111.23 2k8i s GLU 89 Ca 0.00 0.35 -0.27 0.00 0.02 0.00 0.00 54.97 55.07 2k8i s GLU 89 Cb 0.00 -0.74 -0.05 0.00 0.10 0.00 0.00 34.13 33.44 2k8i s GLU 89 CO 0.00 -0.43 2.18 -0.51 0.02 0.00 0.00 175.26 176.52 2k8i s LEU 90 N 2.24 3.42 0.27 1.80 1.43 -1.26 -4.93 118.68 121.65 2k8i s LEU 90 Ca 0.04 1.40 0.05 0.00 -1.03 0.00 0.00 54.13 54.58 2k8i s LEU 90 Cb -0.13 -3.11 -0.06 0.00 0.03 0.00 0.00 46.19 42.92 2k8i s LEU 90 CO -0.06 -2.25 -0.01 -1.58 0.23 0.00 0.00 176.35 172.68 2k8i s GLN 91 N 6.91 1.47 0.30 1.70 0.74 -1.26 -4.96 119.66 124.55 2k8i s GLN 91 Ca 0.93 -1.76 -0.27 0.00 0.05 0.00 0.00 55.36 54.31 2k8i s GLN 91 Cb -0.24 -0.84 -0.09 0.00 1.10 0.00 0.00 33.01 32.93 2k8i s GLN 91 CO 0.31 -0.07 0.96 0.08 -0.55 0.00 0.00 175.29 176.02 2k8i s VAL 92 N -3.26 4.06 0.00 1.34 1.01 -1.26 -3.35 120.40 118.94 2k8i s VAL 92 Ca 0.30 1.84 0.00 0.00 0.00 0.00 0.00 61.98 64.13 2k8i s VAL 92 Cb 0.06 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.35 2k8i s VAL 92 CO 0.11 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.09 2k8i n GLY 93 N 0.90 0.74 3.76 4.51 0.00 0.16 -4.99 105.19 110.28 2k8i n GLY 93 Ca 0.01 0.00 -0.39 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 -0.53 4.30 -0.08 1.61 -1.94 -1.21 -4.83 119.30 116.62 2k8i s MET 94 Ca 0.00 0.71 0.03 0.00 -1.71 0.00 0.00 55.69 54.71 2k8i s MET 94 Cb 0.00 -3.34 -0.02 0.00 2.01 0.00 0.00 34.83 33.48 2k8i s MET 94 CO 0.00 0.38 -0.16 1.03 -0.01 0.00 0.00 175.02 176.25 2k8i s ARG 95 N -0.20 2.81 0.19 2.03 0.52 -1.26 -0.65 118.95 122.39 2k8i s ARG 95 Ca 0.30 -0.74 -0.23 0.00 -0.52 0.00 0.00 55.73 54.54 2k8i s ARG 95 Cb -0.18 -2.41 0.06 0.00 0.52 0.00 0.00 34.95 32.93 2k8i s ARG 95 CO 0.17 0.43 0.91 -0.59 0.02 0.00 0.00 175.30 176.24 2k8i s PHE 96 N -0.23 -0.11 0.11 -0.53 -0.12 -0.67 -5.02 117.98 111.41 2k8i s PHE 96 Ca 0.00 -0.26 -0.01 0.00 -0.05 0.00 0.00 56.93 56.61 2k8i s PHE 96 Cb -0.13 0.67 -0.05 0.00 -0.63 0.00 0.00 43.02 42.88 2k8i s PHE 96 CO 0.03 -0.96 0.29 -1.17 -0.05 0.00 0.00 175.22 173.37 2k8i s LEU 97 N -2.99 4.31 -0.37 -1.99 2.96 -1.26 -1.46 118.68 117.88 2k8i s LEU 97 Ca 0.13 0.39 0.03 0.00 -0.22 0.00 0.00 54.13 54.46 2k8i s LEU 97 Cb -0.03 -3.10 0.16 0.00 0.50 0.00 0.00 46.19 43.72 2k8i s LEU 97 CO 0.04 0.09 0.39 0.00 -1.32 0.00 0.00 176.35 175.55 2k8i s ALA 98 N -1.63 -0.57 -0.36 5.97 0.00 -0.77 -4.92 121.76 119.49 2k8i s ALA 98 Ca 0.37 -0.85 -0.37 0.00 0.00 0.00 0.00 51.96 51.11 2k8i s ALA 98 Cb -0.12 -2.09 -0.13 0.00 0.00 0.00 0.00 23.12 20.78 2k8i s ALA 98 CO 0.27 -2.12 2.13 0.39 0.00 0.00 0.00 175.76 176.44 2k8i n GLU 99 N 4.32 0.94 -2.33 0.00 1.02 -1.26 -0.81 120.64 122.53 2k8i n GLU 99 Ca 0.10 0.27 -0.08 0.00 -0.02 0.00 0.00 57.16 57.44 2k8i n GLU 99 Cb 0.46 -2.28 -0.01 0.00 -0.02 0.00 0.00 31.44 29.59 2k8i n GLU 99 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2k8i n THR 100 N 6.81 0.00 -0.27 2.62 -2.24 0.10 -4.82 114.28 116.48 2k8i n THR 100 Ca 0.42 -0.61 0.21 0.00 -2.27 0.00 0.00 64.05 61.79 2k8i n THR 100 Cb 0.18 -0.21 0.52 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.23 0.41 -0.86 3.42 5.19 -2.03 0.11 116.42 122.87 2k8i h ASP 101 Ca -0.10 0.05 -0.40 0.00 -0.62 0.00 0.00 57.03 55.96 2k8i h ASP 101 Cb 0.35 -0.02 -0.24 0.00 0.18 0.00 0.00 39.33 39.60 2k8i h ASP 101 CO 0.16 0.13 0.51 0.00 -3.12 0.00 0.00 179.24 176.92 2k8i n GLN 102 N -4.53 2.58 0.00 3.56 10.64 -1.26 -5.04 117.38 123.32 2k8i n GLN 102 Ca 0.22 -2.82 0.00 0.00 -1.83 0.00 0.00 57.00 52.57 2k8i n GLN 102 Cb 0.78 -2.12 0.00 0.00 -0.86 0.00 0.00 30.24 28.04 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 -0.76 -2.82 3.67 2.61 0.00 0.36 -4.86 105.19 103.40 2k8i n GLY 103 Ca 0.51 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.35 2k8i n GLY 103 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k8i s PRO 104 N -0.73 4.23 -0.25 1.61 0.04 -1.26 0.01 135.00 138.65 2k8i s PRO 104 Ca 0.00 2.01 -0.03 0.00 0.04 0.00 0.00 61.00 63.02 2k8i s PRO 104 Cb 0.00 -3.79 0.01 0.00 0.04 0.00 0.00 34.50 30.77 2k8i s PRO 104 CO 0.00 -0.72 -0.02 0.08 0.04 0.00 0.00 177.00 176.37 2k8i s VAL 105 N 3.32 3.25 0.03 -0.36 1.01 0.01 -4.78 120.40 122.88 2k8i s VAL 105 Ca 0.66 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 61.51 2k8i s VAL 105 Cb -0.31 -2.62 -0.08 0.00 0.00 0.00 0.00 36.38 33.37 2k8i s VAL 105 CO 0.25 0.22 1.87 -2.84 0.00 0.00 0.00 175.10 174.60 2k8i s PRO 106 N 1.40 4.15 0.03 2.72 0.02 -1.26 -1.84 135.00 140.22 2k8i s PRO 106 Ca 0.02 2.52 -0.04 0.00 0.02 0.00 0.00 61.00 63.51 2k8i s PRO 106 Cb -0.16 -4.03 -0.01 0.00 0.02 0.00 0.00 34.50 30.32 2k8i s PRO 106 CO -0.03 -0.91 0.06 0.14 -0.33 0.00 0.00 177.00 175.94 2k8i s VAL 107 N 4.06 0.13 -0.07 3.83 -7.23 -0.53 -4.81 120.40 115.79 2k8i s VAL 107 Ca 0.84 -1.11 0.01 0.00 -1.81 0.00 0.00 61.98 59.91 2k8i s VAL 107 Cb -0.41 -0.82 0.02 0.00 0.56 0.00 0.00 36.38 35.73 2k8i s VAL 107 CO 0.38 -0.61 -0.09 -0.70 -0.31 0.00 0.00 175.10 173.77 2k8i s GLU 108 N -2.46 1.43 0.13 4.82 2.12 -1.26 -1.67 118.70 121.80 2k8i s GLU 108 Ca -0.06 -0.29 -0.31 0.00 0.36 0.00 0.00 54.97 54.66 2k8i s GLU 108 Cb -0.02 -1.29 -0.09 0.00 0.26 0.00 0.00 34.13 32.99 2k8i s GLU 108 CO -0.04 -0.06 1.52 0.42 -0.54 0.00 0.00 175.26 176.56 2k8i s ILE 109 N 0.95 2.92 -0.54 -3.70 1.01 0.17 -2.54 121.20 119.48 2k8i s ILE 109 Ca -0.10 0.62 0.04 0.00 0.00 0.00 0.00 60.65 61.22 2k8i s ILE 109 Cb -0.15 -3.40 0.04 0.00 0.01 0.00 0.00 42.46 38.97 2k8i s ILE 109 CO 0.00 0.04 0.67 0.35 0.00 0.00 0.00 174.94 176.00 2k8i n THR 110 N 4.10 0.07 -3.61 2.92 -2.24 0.21 0.38 114.28 116.11 2k8i n THR 110 Ca 0.13 -0.54 -0.05 0.00 -2.27 0.00 0.00 64.05 61.33 2k8i n THR 110 Cb 0.40 1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 69.64 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 -0.41 -2.06 -0.16 6.98 0.00 -1.20 -4.88 121.76 120.04 2k8i s ALA 111 Ca 0.05 1.74 -0.05 0.00 0.00 0.00 0.00 51.96 53.71 2k8i s ALA 111 Cb 0.04 -0.95 0.06 0.00 0.00 0.00 0.00 23.12 22.27 2k8i s ALA 111 CO 0.06 -0.35 0.08 0.08 0.00 0.00 0.00 175.76 175.63 2k8i s VAL 112 N -1.41 -0.06 0.00 0.00 1.01 -1.26 0.08 120.40 118.77 2k8i s VAL 112 Ca 0.06 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.93 2k8i s VAL 112 Cb -0.01 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 35.83 2k8i s VAL 112 CO -0.05 -0.22 0.00 -0.62 0.00 0.00 0.00 175.10 174.22 2k8i n GLU 113 N 5.27 0.85 0.17 2.72 1.02 0.27 -4.97 120.64 125.96 2k8i n GLU 113 Ca -0.07 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.93 2k8i n GLU 113 Cb 0.49 0.00 -0.08 0.00 -0.02 0.00 0.00 31.44 31.83 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 -0.34 0.03 1.62 5.19 -2.02 -3.35 116.42 117.55 2k8i h ASP 114 Ca 0.00 -0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.31 2k8i h ASP 114 Cb 0.00 0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.60 2k8i h ASP 114 CO 0.00 -0.11 -1.80 0.47 -3.12 0.00 0.00 179.24 174.68 2k8i n ASP 115 N -5.19 0.19 -3.88 6.45 8.00 -1.26 -4.96 116.55 115.89 2k8i n ASP 115 Ca -0.10 -0.16 -0.11 0.00 0.71 0.00 0.00 54.79 55.13 2k8i n ASP 115 Cb 0.23 1.79 -0.11 0.00 -0.02 0.00 0.00 41.12 43.01 2k8i n ASP 115 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 2k8i s HIS 116 N -3.43 0.03 0.53 1.24 -3.43 -1.26 -1.63 115.29 107.35 2k8i s HIS 116 Ca -0.05 -0.07 0.00 0.00 -0.80 0.00 0.00 55.06 54.14 2k8i s HIS 116 Cb 0.14 -0.05 0.02 0.00 -1.43 0.00 0.00 32.58 31.27 2k8i s HIS 116 CO 0.90 -0.19 0.77 0.14 -2.00 0.00 0.00 174.74 174.35 2k8i s VAL 117 N -0.94 3.08 -0.23 -5.38 -7.23 -0.48 -0.57 120.40 108.66 2k8i s VAL 117 Ca -0.10 -0.56 -0.01 0.00 -1.81 0.00 0.00 61.98 59.50 2k8i s VAL 117 Cb -0.06 -3.16 0.06 0.00 0.56 0.00 0.00 36.38 33.78 2k8i s VAL 117 CO 0.01 -0.12 -0.00 -0.69 -0.31 0.00 0.00 175.10 173.98 2k8i s VAL 118 N -2.74 1.08 -0.02 1.32 1.01 0.11 -1.13 120.40 120.04 2k8i s VAL 118 Ca 0.55 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.59 2k8i s VAL 118 Cb -0.10 -1.50 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2k8i s VAL 118 CO 0.39 -0.20 -0.17 0.68 0.00 0.00 0.00 175.10 175.79 2k8i s VAL 119 N 1.59 2.82 0.25 2.92 -7.23 -0.26 0.66 120.40 121.16 2k8i s VAL 119 Ca -0.02 -0.93 -0.16 0.00 -1.81 0.00 0.00 61.98 59.06 2k8i s VAL 119 Cb -0.18 -2.11 -0.08 0.00 0.56 0.00 0.00 36.38 34.56 2k8i s VAL 119 CO -0.09 0.51 0.68 -0.62 -0.31 0.00 0.00 175.10 175.27 2k8i s ASP 120 N -0.93 6.86 0.00 4.85 2.15 -1.05 -1.25 116.67 127.29 2k8i s ASP 120 Ca 0.12 1.25 0.00 0.00 0.43 0.00 0.00 52.55 54.36 2k8i s ASP 120 Cb -0.10 -2.36 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 2k8i s ASP 120 CO 0.02 -0.05 0.38 0.61 -0.17 0.00 0.00 175.17 175.95 2k8i n GLY 121 N 0.24 -1.86 3.89 2.66 0.00 -1.25 -4.23 105.19 104.64 2k8i n GLY 121 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.02 5.23 0.26 1.61 2.20 -1.26 -4.96 114.94 118.00 2k8i s ASN 122 Ca 0.00 -0.61 0.02 0.00 -0.94 0.00 0.00 52.86 51.33 2k8i s ASN 122 Cb 0.00 -0.73 -0.05 0.00 -2.00 0.00 0.00 41.25 38.46 2k8i s ASN 122 CO 0.00 -0.56 0.07 -1.00 -2.94 0.00 0.00 177.10 172.67 2k8i s HIS 123 N -2.39 1.61 -2.00 1.54 3.76 -1.26 -4.98 115.29 111.56 2k8i s HIS 123 Ca 0.47 -1.10 0.12 0.00 -0.15 0.00 0.00 55.06 54.39 2k8i s HIS 123 Cb -0.05 -0.96 0.69 0.00 1.11 0.00 0.00 32.58 33.36 2k8i s HIS 123 CO 0.28 -0.23 1.12 0.00 -0.85 0.00 0.00 174.74 175.06 2k8i n MET 124 N -0.49 0.37 -0.24 1.40 0.00 -1.26 -3.11 117.12 113.79 2k8i n MET 124 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.70 2k8i n MET 124 Cb 0.66 -1.49 0.10 0.00 0.00 0.00 0.00 33.22 32.50 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 -0.99 2.33 0.00 3.17 4.32 -1.26 -4.62 117.00 119.95 2k8i n LEU 125 Ca 0.09 -1.18 0.00 0.00 -0.02 0.00 0.00 56.01 54.90 2k8i n LEU 125 Cb 0.04 -0.55 0.00 0.00 -1.62 0.00 0.00 43.42 41.29 2k8i n LEU 125 CO 0.06 0.36 0.00 0.00 -1.22 0.00 0.00 177.39 176.60 2k8i n ALA 126 N 0.16 0.00 -0.84 -1.18 0.00 -1.18 -4.84 120.51 112.64 2k8i n ALA 126 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2k8i n ALA 126 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 3.27 0.86 3.71 0.00 0.00 -1.14 -4.99 105.19 106.90 2k8i n GLY 127 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2k8i n GLY 127 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k8i s GLN 128 N -0.16 4.52 0.33 1.61 -0.21 -1.26 -4.73 119.66 119.76 2k8i s GLN 128 Ca 0.00 1.51 -0.26 0.00 0.02 0.00 0.00 55.36 56.63 2k8i s GLN 128 Cb 0.00 -3.43 -0.10 0.00 1.00 0.00 0.00 33.01 30.48 2k8i s GLN 128 CO 0.00 -0.11 0.99 0.54 -2.12 0.00 0.00 175.29 174.59 2k8i s ASN 129 N 1.03 7.20 0.09 5.90 6.03 -1.26 -4.32 114.94 129.61 2k8i s ASN 129 Ca 0.54 1.95 0.05 0.00 -1.03 0.00 0.00 52.86 54.37 2k8i s ASN 129 Cb -0.23 -2.59 -0.03 0.00 -3.03 0.00 0.00 41.25 35.36 2k8i s ASN 129 CO 0.28 -0.17 -0.13 -0.76 -2.03 0.00 0.00 177.10 174.28 2k8i s LEU 130 N -2.07 2.35 -0.09 3.54 1.43 -0.49 -4.31 118.68 119.03 2k8i s LEU 130 Ca 0.51 -0.72 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2k8i s LEU 130 Cb -0.22 -0.49 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 2k8i s LEU 130 CO 0.28 -0.13 -0.16 -0.54 0.23 0.00 0.00 176.35 176.02 2k8i s LYS 131 N -2.27 2.97 0.01 1.70 1.02 0.14 -0.53 119.74 122.79 2k8i s LYS 131 Ca 0.03 -0.73 0.08 0.00 0.02 0.00 0.00 55.97 55.37 2k8i s LYS 131 Cb -0.07 -2.46 -0.02 0.00 -0.52 0.00 0.00 37.83 34.76 2k8i s LYS 131 CO 0.02 0.36 -0.25 -0.06 -0.92 0.00 0.00 175.35 174.50 2k8i s PHE 132 N -0.06 2.21 -0.38 3.18 0.08 0.17 -0.16 117.98 123.02 2k8i s PHE 132 Ca -0.04 -0.41 -0.07 0.00 0.12 0.00 0.00 56.93 56.53 2k8i s PHE 132 Cb -0.14 -1.38 0.06 0.00 -0.57 0.00 0.00 43.02 41.00 2k8i s PHE 132 CO 0.04 0.04 0.18 -0.80 -0.10 0.00 0.00 175.22 174.57 2k8i s ASN 133 N -0.88 5.44 -0.11 1.36 0.02 -0.07 0.21 114.94 120.90 2k8i s ASN 133 Ca 0.10 -1.39 -0.06 0.00 -1.02 0.00 0.00 52.86 50.48 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 -0.44 0.12 -0.69 0.02 0.00 0.00 177.10 176.12 2k8i s VAL 134 N 1.38 5.36 -0.29 1.60 1.01 -0.59 -1.25 120.40 127.62 2k8i s VAL 134 Ca 0.01 0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.10 2k8i s VAL 134 Cb -0.21 -3.33 0.10 0.00 0.00 0.00 0.00 36.38 32.93 2k8i s VAL 134 CO 0.02 0.60 0.12 -1.61 0.00 0.00 0.00 175.10 174.23 2k8i s GLU 135 N -1.05 0.31 -0.47 2.72 2.02 0.10 -2.38 118.70 119.95 2k8i s GLU 135 Ca 0.15 -0.62 -0.29 0.00 0.02 0.00 0.00 54.97 54.23 2k8i s GLU 135 Cb -0.12 -1.39 0.03 0.00 0.10 0.00 0.00 34.13 32.75 2k8i s GLU 135 CO 0.04 -0.99 1.12 0.54 0.02 0.00 0.00 175.26 175.99 2k8i s VAL 136 N 1.99 4.25 0.08 2.63 0.11 -0.98 0.97 120.40 129.45 2k8i s VAL 136 Ca 0.09 1.22 -0.13 0.00 -2.93 0.00 0.00 61.98 60.23 2k8i s VAL 136 Cb -0.16 -4.58 -0.23 0.00 -1.53 0.00 0.00 36.38 29.88 2k8i s VAL 136 CO -0.33 -0.96 1.20 -0.37 -3.33 0.00 0.00 175.10 171.32 2k8i h VAL 137 N 6.19 1.29 -2.49 2.04 -1.51 -1.21 0.52 116.25 121.08 2k8i h VAL 137 Ca -0.23 -2.27 0.01 0.00 -1.23 0.00 0.00 66.70 62.98 2k8i h VAL 137 Cb 1.06 2.38 -0.15 0.00 -2.13 0.00 0.00 31.29 32.45 2k8i h VAL 137 CO 1.11 0.70 0.30 0.00 -1.23 0.00 0.00 177.57 178.45 2k8i s ALA 138 N -3.31 -1.72 -0.03 5.19 0.00 -1.01 -4.48 121.76 116.40 2k8i s ALA 138 Ca -0.09 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.76 2k8i s ALA 138 Cb 0.07 0.45 0.02 0.00 0.00 0.00 0.00 23.12 23.66 2k8i s ALA 138 CO 0.92 -0.62 -0.02 0.42 0.00 0.00 0.00 175.76 176.45 2k8i s ILE 139 N -2.81 0.31 -0.08 0.00 1.01 -1.26 -2.19 121.20 116.17 2k8i s ILE 139 Ca -0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 60.65 60.53 2k8i s ILE 139 Cb -0.01 -0.35 0.02 0.00 0.01 0.00 0.00 42.46 42.13 2k8i s ILE 139 CO -0.06 0.16 0.24 -0.60 0.00 0.00 0.00 174.94 174.68 2k8i s ARG 140 N 0.75 0.32 -0.16 2.79 3.52 0.19 -5.01 118.95 121.35 2k8i s ARG 140 Ca -0.08 0.25 -0.22 0.00 -0.13 0.00 0.00 55.73 55.55 2k8i s ARG 140 Cb -0.11 0.15 -0.03 0.00 -1.56 0.00 0.00 34.95 33.40 2k8i s ARG 140 CO -0.01 -0.05 0.68 -1.83 -0.81 0.00 0.00 175.30 173.28 2k8i s GLU 141 N -0.07 4.29 1.02 5.12 -1.05 -1.26 -0.55 118.70 126.19 2k8i s GLU 141 Ca -0.02 0.75 -0.12 0.00 -0.15 0.00 0.00 54.97 55.44 2k8i s GLU 141 Cb -0.02 -3.54 0.20 0.00 -0.44 0.00 0.00 34.13 30.33 2k8i s GLU 141 CO 0.01 -0.17 1.08 0.00 0.95 0.00 0.00 175.26 177.13 2k8i s ALA 142 N 1.64 0.67 -1.46 -0.84 0.00 -1.15 -4.86 121.76 115.75 2k8i s ALA 142 Ca 0.33 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.37 2k8i s ALA 142 Cb -0.16 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.67 2k8i s ALA 142 CO 0.12 -3.10 0.71 0.25 0.00 0.00 0.00 175.76 173.75 2k8i n THR 143 N -4.42 0.00 0.00 0.00 -2.24 -1.26 -4.82 114.28 101.54 2k8i n THR 143 Ca 0.07 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.85 2k8i n THR 143 Cb 0.54 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 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 -0.23 0.00 -0.08 -0.78 1.02 -1.26 -4.58 120.64 114.74 2k8i n GLU 144 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 2k8i n GLU 144 Cb 0.13 -0.57 -0.03 0.00 -0.02 0.00 0.00 31.44 30.95 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 0.39 -0.59 3.49 5.08 -1.98 0.43 114.58 121.39 2k8i h GLU 145 Ca 0.00 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2k8i h GLU 145 Cb 0.00 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 2k8i h GLU 145 CO 0.00 0.37 0.39 0.93 -1.00 0.00 0.00 179.01 179.70 2k8i h GLU 146 N 0.31 0.71 -0.08 2.33 5.08 -1.81 0.17 114.58 121.29 2k8i h GLU 146 Ca 0.09 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 2k8i h GLU 146 Cb 0.11 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2k8i h GLU 146 CO -0.01 0.47 -0.19 -0.07 -1.00 0.00 0.00 179.01 178.20 2k8i h LEU 147 N 0.73 0.30 -1.72 1.33 3.38 -1.68 -1.09 115.31 116.57 2k8i h LEU 147 Ca 0.23 -0.58 0.02 0.00 0.09 0.00 0.00 57.88 57.64 2k8i h LEU 147 Cb 0.03 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2k8i h LEU 147 CO -0.06 0.83 0.22 0.00 0.09 0.00 0.00 178.44 179.53 2k8i h ALA 148 N 0.48 1.84 0.00 1.53 0.00 0.44 -0.86 119.26 122.70 2k8i h ALA 148 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2k8i h ALA 148 Cb 0.79 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2k8i h ALA 148 CO 0.04 0.12 -0.53 0.72 0.00 0.00 0.00 179.25 179.60 2k8i n HIS 149 N -4.49 0.21 -0.69 0.00 8.25 -0.01 -4.94 115.22 113.56 2k8i n HIS 149 Ca 0.03 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 2k8i n HIS 149 Cb 0.12 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.81 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 1.44 0.76 3.63 -1.41 0.00 -0.33 -4.96 105.19 104.32 2k8i n GLY 150 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.80 -0.08 0.00 1.61 -3.43 -0.49 -4.49 115.29 105.61 2k8i s HIS 151 Ca 0.00 -0.03 0.00 0.00 -0.80 0.00 0.00 55.06 54.23 2k8i s HIS 151 Cb 0.00 0.55 0.00 0.00 -1.43 0.00 0.00 32.58 31.70 2k8i s HIS 151 CO 0.00 -0.34 0.80 0.28 -2.00 0.00 0.00 174.74 173.48 2k8i n VAL 152 N -0.39 0.00 -3.85 -5.38 0.31 -1.26 -4.56 118.33 103.19 2k8i n VAL 152 Ca -0.06 1.30 -0.24 0.00 -0.01 0.00 0.00 64.34 65.32 2k8i n VAL 152 Cb 0.62 -2.20 0.00 0.00 -0.91 0.00 0.00 33.84 31.35 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 -1.56 -1.80 0.00 3.52 -0.00 -1.26 -4.64 115.22 109.48 2k8i n HIS 153 Ca 0.00 0.80 0.00 0.00 -0.00 0.00 0.00 57.72 58.52 2k8i n HIS 153 Cb 0.00 -4.00 0.00 0.00 -0.00 0.00 0.00 29.99 25.99 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 -1.77 -1.50 3.19 1.57 0.00 -1.26 -5.07 105.19 100.35 2k8i n GLY 154 Ca -0.27 0.73 -0.08 0.00 0.00 0.00 0.00 46.02 46.40 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 0.00 -2.64 -3.40 4.61 0.00 -1.26 -5.02 120.51 112.81 2k8i n ALA 155 Ca 0.00 0.17 -0.20 0.00 0.00 0.00 0.00 53.44 53.42 2k8i n ALA 155 Cb 0.00 -1.79 -0.09 0.00 0.00 0.00 0.00 19.45 17.57 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 -2.84 -0.15 -0.10 0.00 5.65 -1.26 -5.12 115.29 111.47 2k8i s HIS 156 Ca 0.07 -0.78 0.01 0.00 0.25 0.00 0.00 55.06 54.60 2k8i s HIS 156 Cb -0.01 -0.53 0.02 0.00 -1.18 0.00 0.00 32.58 30.88 2k8i s HIS 156 CO 0.79 -0.93 -0.11 0.34 -0.65 0.00 0.00 174.74 174.19 2k8i s ASP 157 N 1.66 2.16 -0.38 9.88 2.15 -1.26 -5.01 116.67 125.87 2k8i s ASP 157 Ca 0.15 -0.34 0.12 0.00 0.43 0.00 0.00 52.55 52.91 2k8i s ASP 157 Cb -0.16 -0.91 0.38 0.00 -0.30 0.00 0.00 42.92 41.93 2k8i s ASP 157 CO -0.12 -0.05 0.99 1.41 -0.17 0.00 0.00 175.17 177.22 2k8i n HIS 158 N 4.51 -0.67 -0.30 -5.34 8.25 -1.26 -4.96 115.22 115.45 2k8i n HIS 158 Ca -0.17 -2.84 0.00 0.00 -0.26 0.00 0.00 57.72 54.46 2k8i n HIS 158 Cb 0.51 0.39 0.13 0.00 1.12 0.00 0.00 29.99 32.14 2k8i n HIS 158 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2k8i h HIS 159 N 2.82 0.95 -2.90 4.41 3.86 -2.08 -3.10 115.15 119.11 2k8i h HIS 159 Ca -0.07 0.03 -0.73 0.00 -1.16 0.00 0.00 60.37 58.44 2k8i h HIS 159 Cb 1.11 -0.31 -0.34 0.00 1.06 0.00 0.00 27.41 28.94 2k8i h HIS 159 CO 0.38 0.49 0.18 1.58 0.86 0.00 0.00 177.93 181.42 2k8i n HIS 160 N -4.63 3.42 -3.89 2.45 -0.00 -1.26 -4.99 115.22 106.32 2k8i n HIS 160 Ca 0.12 -3.52 -0.11 0.00 -0.00 0.00 0.00 57.72 54.20 2k8i n HIS 160 Cb 0.16 -1.09 -0.13 0.00 -0.00 0.00 0.00 29.99 28.93 2k8i n HIS 160 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2k8i s ASP 161 N -1.24 0.03 -0.44 0.26 -1.08 -1.18 -5.11 116.67 107.91 2k8i s ASP 161 Ca 0.32 -0.07 0.06 0.00 -0.52 0.00 0.00 52.55 52.35 2k8i s ASP 161 Cb 0.03 0.06 0.20 0.00 -1.46 0.00 0.00 42.92 41.75 2k8i s ASP 161 CO -0.00 -0.07 0.55 1.57 0.52 0.00 0.00 175.17 177.73 2k8i n HIS 162 N 2.74 -1.85 -2.79 -5.34 -0.00 -1.26 -5.11 115.22 101.62 2k8i n HIS 162 Ca -0.15 -2.68 -0.32 0.00 0.46 0.00 0.00 57.72 55.03 2k8i n HIS 162 Cb 0.59 0.60 -0.06 0.00 -0.12 0.00 0.00 29.99 31.01 2k8i n HIS 162 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 2k8i s ASP 163 N -0.27 6.79 -0.07 0.26 2.15 -1.26 -5.07 116.67 119.20 2k8i s ASP 163 Ca 0.33 1.53 -0.01 0.00 0.43 0.00 0.00 52.55 54.83 2k8i s ASP 163 Cb 0.09 -2.48 0.03 0.00 -0.30 0.00 0.00 42.92 40.25 2k8i s ASP 163 CO -0.15 -0.39 -0.02 -1.38 -0.17 0.00 0.00 175.17 173.06 2k8i s HIS 164 N -2.26 0.82 -0.10 -5.34 -3.43 -1.26 -5.00 115.29 98.71 2k8i s HIS 164 Ca 0.59 -0.27 0.15 0.00 -0.80 0.00 0.00 55.06 54.73 2k8i s HIS 164 Cb -0.10 -0.84 -0.09 0.00 -1.43 0.00 0.00 32.58 30.12 2k8i s HIS 164 CO 0.20 -0.32 1.04 -0.44 -2.00 0.00 0.00 174.74 173.21 2k8i h ASP 165 N 8.01 0.00 -3.30 7.38 3.32 -2.07 -3.43 116.42 126.34 2k8i h ASP 165 Ca -0.26 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 56.07 2k8i h ASP 165 Cb 1.13 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.47 2k8i h ASP 165 CO 0.34 0.64 -0.21 -1.00 -1.72 0.00 0.00 179.24 177.28 2k8i s HIS 166 N -2.88 3.18 -0.11 4.55 3.76 -1.26 -5.02 115.29 117.50 2k8i s HIS 166 Ca -0.01 -0.79 0.00 0.00 -0.15 0.00 0.00 55.06 54.12 2k8i s HIS 166 Cb 0.08 -3.26 0.02 0.00 1.11 0.00 0.00 32.58 30.53 2k8i s HIS 166 CO 0.79 -0.86 -0.09 -3.38 -0.85 0.00 0.00 174.74 170.35 2k8i s HIS 167 N 1.96 1.60 -0.26 1.40 -3.43 -1.26 -5.04 115.29 110.26 2k8i s HIS 167 Ca 0.08 -0.79 -0.15 0.00 -0.80 0.00 0.00 55.06 53.39 2k8i s HIS 167 Cb -0.22 -1.27 -0.12 0.00 -1.43 0.00 0.00 32.58 29.53 2k8i s HIS 167 CO 0.08 -0.51 -0.27 -2.39 -2.00 0.00 0.00 174.74 169.66 2k8i n HIS 168 N 4.75 0.18 -4.14 0.38 1.44 -1.26 -5.04 115.22 111.53 2k8i n HIS 168 Ca -0.15 0.08 -0.09 0.00 -2.01 0.00 0.00 57.72 55.55 2k8i n HIS 168 Cb 0.50 -0.96 -0.10 0.00 0.12 0.00 0.00 29.99 29.55 2k8i n HIS 168 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k8i s HIS 169 N -2.52 0.74 -0.69 -1.40 3.76 -1.26 -4.92 115.29 109.00 2k8i s HIS 169 Ca -0.36 -0.99 -0.03 0.00 -0.15 0.00 0.00 55.06 53.54 2k8i s HIS 169 Cb 0.12 -0.46 0.00 0.00 1.11 0.00 0.00 32.58 33.35 2k8i s HIS 169 CO 0.49 -0.25 0.68 0.72 -0.85 0.00 0.00 174.74 175.53 2k8i n HIS 170 N 0.02 -3.01 -0.63 1.40 8.25 -1.26 -5.27 115.22 114.72 2k8i n HIS 170 Ca -0.13 1.16 0.00 0.00 -0.26 0.00 0.00 57.72 58.50 2k8i n HIS 170 Cb 0.61 -4.00 0.00 0.00 1.12 0.00 0.00 29.99 27.72 2k8i n HIS 170 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56