#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ao8 s ALA 2 N 0.00 -0.90 0.31 2.41 0.00 0.11 -4.12 121.76 119.57 1ao8 s ALA 2 Ca 0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.66 1ao8 s ALA 2 Cb 0.00 -1.97 -0.10 0.00 0.00 0.00 0.00 23.12 21.05 1ao8 s ALA 2 CO 0.00 -1.75 1.22 -0.06 0.00 0.00 0.00 175.76 175.17 1ao8 s PHE 3 N 2.46 3.26 -0.24 0.00 0.40 -0.22 -0.62 117.98 123.01 1ao8 s PHE 3 Ca 0.10 1.53 -0.04 0.00 -0.60 0.00 0.00 56.93 57.92 1ao8 s PHE 3 Cb -0.13 -3.51 0.13 0.00 0.51 0.00 0.00 43.02 40.02 1ao8 s PHE 3 CO -0.31 -1.32 0.41 -1.17 0.70 0.00 0.00 175.22 173.53 1ao8 s LEU 4 N -1.69 -0.73 0.21 -0.37 2.96 -0.83 -0.43 118.68 117.81 1ao8 s LEU 4 Ca 0.47 0.49 -0.14 0.00 -0.22 0.00 0.00 54.13 54.73 1ao8 s LEU 4 Cb -0.36 1.30 0.01 0.00 0.50 0.00 0.00 46.19 47.64 1ao8 s LEU 4 CO 0.48 -0.28 0.47 -1.66 -1.32 0.00 0.00 176.35 174.04 1ao8 s TRP 5 N 2.60 0.15 -0.08 5.38 -2.14 -0.98 -4.46 118.94 119.41 1ao8 s TRP 5 Ca 0.10 -0.51 0.05 0.00 2.66 0.00 0.00 56.10 58.39 1ao8 s TRP 5 Cb -0.15 0.25 -0.01 0.00 -3.10 0.00 0.00 33.47 30.47 1ao8 s TRP 5 CO -0.16 -0.93 -0.22 0.00 -2.66 0.00 0.00 176.95 172.98 1ao8 s ALA 6 N -3.95 2.28 0.14 2.67 0.00 -1.26 -2.15 121.76 119.49 1ao8 s ALA 6 Ca 0.16 -1.00 -0.09 0.00 0.00 0.00 0.00 51.96 51.03 1ao8 s ALA 6 Cb -0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 1ao8 s ALA 6 CO 0.03 0.38 0.24 1.14 0.00 0.00 0.00 175.76 177.55 1ao8 s GLN 7 N -0.04 1.03 0.09 0.00 1.03 -1.02 -4.30 119.66 116.45 1ao8 s GLN 7 Ca -0.06 -1.10 0.01 0.00 0.04 0.00 0.00 55.36 54.24 1ao8 s GLN 7 Cb -0.15 0.36 0.01 0.00 0.03 0.00 0.00 33.01 33.26 1ao8 s GLN 7 CO 0.05 -0.36 0.07 -0.40 -2.54 0.00 0.00 175.29 172.11 1ao8 n ASP 8 N -0.15 1.19 0.20 12.60 5.75 -1.23 -2.11 116.55 132.79 1ao8 n ASP 8 Ca -0.10 -1.30 0.06 0.00 -0.01 0.00 0.00 54.79 53.44 1ao8 n ASP 8 Cb 0.63 -0.01 0.54 0.00 -1.03 0.00 0.00 41.12 41.25 1ao8 n ASP 8 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1ao8 h ARG 9 N 0.00 0.10 -0.33 0.11 0.11 -1.80 -2.31 114.38 110.27 1ao8 h ARG 9 Ca -0.05 -0.01 -0.13 0.00 0.10 0.00 0.00 59.98 59.89 1ao8 h ARG 9 Cb 0.20 -0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.26 1ao8 h ARG 9 CO 0.09 0.14 -0.29 -0.44 0.10 0.00 0.00 179.97 179.57 1ao8 h ASP 10 N 0.10 0.82 0.00 0.08 3.32 -1.90 -3.47 116.42 115.37 1ao8 h ASP 10 Ca 0.03 -0.46 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1ao8 h ASP 10 Cb 0.12 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.44 1ao8 h ASP 10 CO 0.00 1.11 0.00 0.61 -1.72 0.00 0.00 179.24 179.24 1ao8 n GLY 11 N 0.12 1.92 3.76 2.75 0.00 -0.87 -5.06 105.19 107.80 1ao8 n GLY 11 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.63 1ao8 n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ao8 s LEU 12 N 0.00 4.28 -0.13 0.99 2.96 -1.26 -2.74 118.68 122.77 1ao8 s LEU 12 Ca 0.00 0.49 0.12 0.00 -0.22 0.00 0.00 54.13 54.52 1ao8 s LEU 12 Cb 0.00 -2.30 -0.17 0.00 0.50 0.00 0.00 46.19 44.22 1ao8 s LEU 12 CO 0.00 0.18 0.05 2.30 -1.32 0.00 0.00 176.35 177.55 1ao8 n ILE 13 N 3.20 0.92 -3.75 6.68 -5.35 -0.72 -3.53 119.36 116.81 1ao8 n ILE 13 Ca -0.14 -0.57 -0.09 0.00 -0.27 0.00 0.00 62.75 61.68 1ao8 n ILE 13 Cb 0.52 -0.64 0.01 0.00 -1.74 0.00 0.00 39.64 37.79 1ao8 n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ao8 n GLY 14 N 2.16 1.53 3.26 3.28 0.00 -1.18 -4.83 105.19 109.41 1ao8 n GLY 14 Ca -0.22 -1.33 0.02 0.00 0.00 0.00 0.00 46.02 44.50 1ao8 n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ao8 s LYS 15 N -2.26 0.56 -1.82 1.61 2.20 0.25 -3.40 119.74 116.88 1ao8 s LYS 15 Ca 0.16 1.10 0.00 0.00 -0.36 0.00 0.00 55.97 56.87 1ao8 s LYS 15 Cb -0.03 0.60 0.00 0.00 -1.51 0.00 0.00 37.83 36.89 1ao8 s LYS 15 CO 0.12 -0.52 0.00 -0.25 -0.36 0.00 0.00 175.35 174.34 1ao8 n ASP 16 N 5.43 -5.55 0.00 1.43 9.92 -1.26 -1.83 116.55 124.69 1ao8 n ASP 16 Ca -0.04 0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.38 1ao8 n ASP 16 Cb 0.51 -4.71 0.00 0.00 -0.64 0.00 0.00 41.12 36.27 1ao8 n ASP 16 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ao8 n GLY 17 N -0.81 2.53 3.95 0.44 0.00 -1.26 -5.00 105.19 105.04 1ao8 n GLY 17 Ca -0.23 -0.60 -0.24 0.00 0.00 0.00 0.00 46.02 44.96 1ao8 n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ao8 s HIS 18 N -0.42 3.22 0.43 1.61 -3.43 -0.76 -4.82 115.29 111.12 1ao8 s HIS 18 Ca 0.00 0.32 -0.12 0.00 -0.80 0.00 0.00 55.06 54.46 1ao8 s HIS 18 Cb 0.00 -2.41 -0.07 0.00 -1.43 0.00 0.00 32.58 28.67 1ao8 s HIS 18 CO 0.00 -0.46 0.82 -0.51 -2.00 0.00 0.00 174.74 172.59 1ao8 s LEU 19 N -4.65 3.77 -0.05 5.38 1.43 -1.26 -0.58 118.68 122.72 1ao8 s LEU 19 Ca 0.50 1.24 -0.21 0.00 -1.03 0.00 0.00 54.13 54.62 1ao8 s LEU 19 Cb -0.10 -4.13 -0.31 0.00 0.03 0.00 0.00 46.19 41.67 1ao8 s LEU 19 CO 0.39 -0.45 0.87 1.55 0.23 0.00 0.00 176.35 178.95 1ao8 h PRO 20 N 1.15 0.31 0.00 1.29 0.13 -1.89 -3.46 132.00 129.54 1ao8 h PRO 20 Ca -0.47 -0.53 -0.15 0.00 -0.87 0.00 0.00 66.00 63.98 1ao8 h PRO 20 Cb 1.19 0.20 0.03 0.00 0.13 0.00 0.00 31.00 32.54 1ao8 h PRO 20 CO 0.63 1.25 0.04 -2.67 -0.23 0.00 0.00 178.00 177.02 1ao8 n TRP 21 N -4.09 -3.22 -3.45 1.56 2.14 -1.26 -5.09 117.44 104.03 1ao8 n TRP 21 Ca -0.15 -0.58 -0.29 0.00 2.07 0.00 0.00 57.50 58.55 1ao8 n TRP 21 Cb 0.85 -0.24 -0.12 0.00 -0.81 0.00 0.00 31.31 30.99 1ao8 n TRP 21 CO 0.00 0.00 0.00 -1.58 2.07 0.00 0.00 177.69 178.18 1ao8 s HIS 22 N -0.83 0.71 -0.28 -2.67 2.46 -1.26 -5.10 115.29 108.31 1ao8 s HIS 22 Ca 0.22 -1.65 -0.03 0.00 0.47 0.00 0.00 55.06 54.07 1ao8 s HIS 22 Cb -0.01 -0.89 0.03 0.00 -0.13 0.00 0.00 32.58 31.58 1ao8 s HIS 22 CO 0.14 -0.83 -0.01 -1.17 -2.47 0.00 0.00 174.74 170.40 1ao8 s LEU 23 N 1.00 3.63 0.18 8.88 2.96 -1.26 -4.96 118.68 129.11 1ao8 s LEU 23 Ca 0.19 -1.04 0.09 0.00 -0.22 0.00 0.00 54.13 53.16 1ao8 s LEU 23 Cb -0.21 -1.72 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 1ao8 s LEU 23 CO -0.01 -0.20 1.37 1.55 -1.32 0.00 0.00 176.35 177.74 1ao8 h PRO 24 N 8.05 0.00 -0.08 0.98 0.13 -1.99 -3.23 132.00 135.85 1ao8 h PRO 24 Ca -0.27 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.76 1ao8 h PRO 24 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1ao8 h PRO 24 CO 0.56 0.84 -0.39 0.22 -0.23 0.00 0.00 178.00 179.00 1ao8 h ASP 25 N 0.00 0.18 0.55 1.44 1.82 -2.00 -2.61 116.42 115.80 1ao8 h ASP 25 Ca -0.01 -0.07 -0.15 0.00 -0.39 0.00 0.00 57.03 56.41 1ao8 h ASP 25 Cb 1.58 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 41.53 1ao8 h ASP 25 CO 0.11 0.56 -0.66 -0.78 -1.61 0.00 0.00 179.24 176.86 1ao8 h ASP 26 N 0.15 0.11 0.22 2.28 3.58 -1.99 -2.97 116.42 117.81 1ao8 h ASP 26 Ca 0.01 -0.07 -0.13 0.00 0.42 0.00 0.00 57.03 57.26 1ao8 h ASP 26 Cb 0.76 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 1ao8 h ASP 26 CO 0.06 0.74 -0.50 -0.07 -2.88 0.00 0.00 179.24 176.59 1ao8 h LEU 27 N 0.07 0.35 -0.73 2.28 3.38 -1.52 -2.50 115.31 116.64 1ao8 h LEU 27 Ca -0.01 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 1ao8 h LEU 27 Cb 1.18 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1ao8 h LEU 27 CO 0.09 0.79 -0.33 0.45 0.09 0.00 0.00 178.44 179.54 1ao8 h HIS 28 N 0.25 0.70 -0.02 1.13 3.86 -1.36 -2.74 115.15 116.98 1ao8 h HIS 28 Ca 0.01 -0.18 -0.12 0.00 -1.16 0.00 0.00 60.37 58.92 1ao8 h HIS 28 Cb 0.97 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 29.26 1ao8 h HIS 28 CO 0.02 0.86 -0.57 -0.92 0.86 0.00 0.00 177.93 178.18 1ao8 h TYR 29 N 0.51 0.07 -0.30 2.45 3.20 -1.37 -2.98 116.97 118.56 1ao8 h TYR 29 Ca 0.06 -0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 1ao8 h TYR 29 Cb 0.81 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.06 1ao8 h TYR 29 CO 0.03 0.61 -0.02 0.35 -1.64 0.00 0.00 178.16 177.50 1ao8 h PHE 30 N 0.04 0.59 0.00 -3.82 3.57 -1.17 -1.81 116.94 114.34 1ao8 h PHE 30 Ca -0.00 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.37 1ao8 h PHE 30 Cb 1.02 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 1ao8 h PHE 30 CO 0.00 0.69 -0.10 -0.09 -2.23 0.00 0.00 178.31 176.58 1ao8 h ARG 31 N 0.32 0.00 0.00 1.11 2.43 -1.43 -1.53 114.38 115.28 1ao8 h ARG 31 Ca 0.08 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.08 1ao8 h ARG 31 Cb 0.46 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1ao8 h ARG 31 CO 0.02 0.10 -0.80 0.00 -1.51 0.00 0.00 179.97 177.78 1ao8 h ALA 32 N 1.90 0.60 -0.98 2.80 0.00 -1.32 -2.68 119.26 119.58 1ao8 h ALA 32 Ca -0.00 -0.73 -0.63 0.00 0.00 0.00 0.00 54.91 53.55 1ao8 h ALA 32 Cb 0.18 -0.13 -0.30 0.00 0.00 0.00 0.00 17.79 17.55 1ao8 h ALA 32 CO 0.01 1.00 0.77 1.04 0.00 0.00 0.00 179.25 182.07 1ao8 n GLN 33 N -3.47 2.61 0.00 0.00 1.13 -0.59 -4.41 117.38 112.64 1ao8 n GLN 33 Ca -0.00 -3.25 0.00 0.00 -1.94 0.00 0.00 57.00 51.81 1ao8 n GLN 33 Cb 0.80 -2.26 0.00 0.00 0.11 0.00 0.00 30.24 28.89 1ao8 n GLN 33 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1ao8 n THR 34 N -0.97 0.00 -1.74 5.09 -2.24 -1.10 -4.98 114.28 108.34 1ao8 n THR 34 Ca 0.61 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.97 1ao8 n THR 34 Cb 0.90 -0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.97 1ao8 n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ao8 s VAL 35 N -1.54 3.07 0.00 2.28 -7.23 -1.01 -1.79 120.40 114.17 1ao8 s VAL 35 Ca 0.00 0.16 0.00 0.00 -1.81 0.00 0.00 61.98 60.33 1ao8 s VAL 35 Cb 0.00 -3.10 0.00 0.00 0.56 0.00 0.00 36.38 33.84 1ao8 s VAL 35 CO 0.00 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1ao8 n GLY 36 N 4.43 1.01 3.28 2.32 0.00 -1.25 -4.99 105.19 109.99 1ao8 n GLY 36 Ca 0.19 -0.54 -0.11 0.00 0.00 0.00 0.00 46.02 45.57 1ao8 n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ao8 n LYS 37 N -1.04 0.85 -3.57 1.61 5.02 -0.74 -4.51 118.16 115.76 1ao8 n LYS 37 Ca 0.00 -2.31 -0.39 0.00 -2.02 0.00 0.00 58.31 53.58 1ao8 n LYS 37 Cb 0.29 2.52 -0.11 0.00 -0.02 0.00 0.00 35.03 37.71 1ao8 n LYS 37 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ao8 s ILE 38 N -2.48 5.12 -0.32 -0.18 1.01 -0.63 -3.35 121.20 120.35 1ao8 s ILE 38 Ca 0.21 -0.19 -0.18 0.00 0.00 0.00 0.00 60.65 60.49 1ao8 s ILE 38 Cb -0.03 -3.59 -0.01 0.00 0.01 0.00 0.00 42.46 38.85 1ao8 s ILE 38 CO 0.15 0.06 0.52 -0.32 0.00 0.00 0.00 174.94 175.35 1ao8 s MET 39 N 1.70 3.76 -0.34 2.79 1.75 -0.73 -1.42 119.30 126.81 1ao8 s MET 39 Ca 0.06 -0.01 -0.12 0.00 -1.25 0.00 0.00 55.69 54.37 1ao8 s MET 39 Cb -0.17 -3.76 -0.01 0.00 2.84 0.00 0.00 34.83 33.73 1ao8 s MET 39 CO 0.10 -0.56 0.22 0.08 -0.65 0.00 0.00 175.02 174.20 1ao8 s VAL 40 N 2.39 5.05 0.02 10.11 1.01 -0.75 -1.29 120.40 136.94 1ao8 s VAL 40 Ca 0.20 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1ao8 s VAL 40 Cb -0.15 -3.63 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 1ao8 s VAL 40 CO 0.12 -0.03 -0.07 0.68 0.00 0.00 0.00 175.10 175.79 1ao8 s VAL 41 N 1.68 0.56 0.00 2.92 -7.23 -1.01 -2.38 120.40 114.94 1ao8 s VAL 41 Ca 0.05 -0.63 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 1ao8 s VAL 41 Cb -0.18 -0.53 0.00 0.00 0.56 0.00 0.00 36.38 36.23 1ao8 s VAL 41 CO 0.09 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.42 1ao8 n GLY 42 N 2.29 -1.49 0.14 2.32 0.00 -0.66 -2.22 105.19 105.57 1ao8 n GLY 42 Ca -0.17 -1.55 -0.23 0.00 0.00 0.00 0.00 46.02 44.08 1ao8 n GLY 42 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ao8 h ARG 43 N 0.00 0.45 -0.63 1.61 2.43 -1.93 -2.07 114.38 114.24 1ao8 h ARG 43 Ca 0.00 -0.74 -0.09 0.00 -0.81 0.00 0.00 59.98 58.34 1ao8 h ARG 43 Cb 0.00 0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1ao8 h ARG 43 CO 0.00 1.35 0.05 0.00 -1.51 0.00 0.00 179.97 179.86 1ao8 h ARG 44 N -0.06 1.09 -0.03 0.20 2.47 -1.93 -2.18 114.38 113.93 1ao8 h ARG 44 Ca -0.20 -0.32 -0.15 0.00 -1.26 0.00 0.00 59.98 58.05 1ao8 h ARG 44 Cb 1.91 -0.11 -0.02 0.00 -1.65 0.00 0.00 29.97 30.11 1ao8 h ARG 44 CO 0.22 1.03 -0.66 1.15 0.56 0.00 0.00 179.97 182.27 1ao8 h THR 45 N 1.00 1.44 -0.47 2.04 2.02 -1.92 -2.74 112.91 114.27 1ao8 h THR 45 Ca 0.19 -2.17 -0.09 0.00 0.77 0.00 0.00 66.41 65.11 1ao8 h THR 45 Cb 0.50 2.15 -0.02 0.00 -1.74 0.00 0.00 68.15 69.04 1ao8 h THR 45 CO 0.02 0.63 -0.05 0.22 0.37 0.00 0.00 175.52 176.71 1ao8 h TYR 46 N 0.09 0.89 0.00 3.16 3.20 -1.04 -2.49 116.97 120.77 1ao8 h TYR 46 Ca -0.01 -0.15 -0.06 0.00 3.14 0.00 0.00 58.73 61.65 1ao8 h TYR 46 Cb 1.17 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 1ao8 h TYR 46 CO 0.01 0.84 -0.30 0.93 -1.64 0.00 0.00 178.16 178.01 1ao8 h GLU 47 N 0.75 0.00 0.00 1.82 5.08 -1.30 -3.07 114.58 117.86 1ao8 h GLU 47 Ca 0.14 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1ao8 h GLU 47 Cb 0.53 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1ao8 h GLU 47 CO 0.03 0.30 -0.12 0.66 -1.00 0.00 0.00 179.01 178.88 1ao8 h SER 48 N 0.00 0.00 -4.24 1.42 4.64 -1.14 -3.43 113.55 110.81 1ao8 h SER 48 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.79 1ao8 h SER 48 Cb 0.98 0.00 0.17 0.00 -0.31 0.00 0.00 62.40 63.24 1ao8 h SER 48 CO 0.04 0.12 0.32 -0.36 -0.87 0.00 0.00 176.83 176.07 1ao8 s PHE 49 N -4.66 2.00 -0.07 4.77 0.08 -1.16 -4.97 117.98 113.96 1ao8 s PHE 49 Ca -0.04 1.67 -0.00 0.00 0.12 0.00 0.00 56.93 58.67 1ao8 s PHE 49 Cb 0.16 -3.34 -0.00 0.00 -0.57 0.00 0.00 43.02 39.26 1ao8 s PHE 49 CO 0.66 -2.51 -0.01 -1.00 -0.10 0.00 0.00 175.22 172.26 1ao8 h PRO 50 N -1.01 0.00 -4.55 0.24 0.13 -1.89 -3.44 132.00 121.48 1ao8 h PRO 50 Ca -0.45 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.97 1ao8 h PRO 50 Cb 1.27 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.12 1ao8 h PRO 50 CO 0.47 0.00 -0.53 0.21 -0.23 0.00 0.00 178.00 177.92 1ao8 s LYS 51 N -1.41 2.56 -0.07 0.86 2.20 -1.26 -5.08 119.74 117.54 1ao8 s LYS 51 Ca -0.00 -1.37 -0.03 0.00 -0.36 0.00 0.00 55.97 54.21 1ao8 s LYS 51 Cb 0.00 -3.63 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 1ao8 s LYS 51 CO 0.01 -0.84 0.05 1.03 -0.36 0.00 0.00 175.35 175.24 1ao8 s ARG 52 N 1.39 3.10 0.52 4.03 0.52 -1.26 -3.68 118.95 123.57 1ao8 s ARG 52 Ca 0.02 -0.36 -0.10 0.00 -0.52 0.00 0.00 55.73 54.76 1ao8 s ARG 52 Cb -0.21 -2.90 -0.05 0.00 0.52 0.00 0.00 34.95 32.31 1ao8 s ARG 52 CO 0.02 0.71 0.90 -1.25 0.02 0.00 0.00 175.30 175.69 1ao8 s PRO 53 N -1.13 3.68 -0.07 3.54 0.04 -1.26 -5.02 135.00 134.77 1ao8 s PRO 53 Ca 0.16 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.48 1ao8 s PRO 53 Cb -0.12 -2.24 -0.03 0.00 0.04 0.00 0.00 34.50 32.16 1ao8 s PRO 53 CO 0.06 -0.30 1.20 -0.51 0.04 0.00 0.00 177.00 177.48 1ao8 s LEU 54 N -4.58 4.26 0.90 -3.56 1.43 -1.24 -5.03 118.68 110.86 1ao8 s LEU 54 Ca 0.53 1.78 -0.14 0.00 -1.03 0.00 0.00 54.13 55.27 1ao8 s LEU 54 Cb -0.10 -3.56 0.14 0.00 0.03 0.00 0.00 46.19 42.70 1ao8 s LEU 54 CO 0.43 -0.60 1.24 -2.16 0.23 0.00 0.00 176.35 175.48 1ao8 s PRO 55 N 2.39 1.20 -1.73 1.29 0.04 -1.26 -4.19 135.00 132.74 1ao8 s PRO 55 Ca 0.55 -0.11 0.00 0.00 0.04 0.00 0.00 61.00 61.48 1ao8 s PRO 55 Cb -0.24 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1ao8 s PRO 55 CO 0.21 -2.08 0.00 0.39 0.04 0.00 0.00 177.00 175.55 1ao8 n GLU 56 N -3.60 -1.56 -3.63 4.56 1.02 -1.26 -4.92 120.64 111.25 1ao8 n GLU 56 Ca 0.11 0.98 -0.03 0.00 -0.02 0.00 0.00 57.16 58.20 1ao8 n GLU 56 Cb 0.60 -5.55 -0.02 0.00 -0.02 0.00 0.00 31.44 26.45 1ao8 n GLU 56 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1ao8 s ARG 57 N -4.85 0.13 -0.13 3.49 1.70 -1.26 -3.75 118.95 114.28 1ao8 s ARG 57 Ca 0.00 -0.05 -0.18 0.00 -0.47 0.00 0.00 55.73 55.03 1ao8 s ARG 57 Cb 0.00 0.06 -0.04 0.00 -0.57 0.00 0.00 34.95 34.40 1ao8 s ARG 57 CO 0.00 -0.06 0.49 0.99 -1.08 0.00 0.00 175.30 175.64 1ao8 s THR 58 N -2.18 5.17 -0.37 4.99 2.01 -1.21 -4.91 115.64 119.14 1ao8 s THR 58 Ca 0.11 0.97 -0.12 0.00 0.31 0.00 0.00 61.69 62.96 1ao8 s THR 58 Cb -0.01 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.68 1ao8 s THR 58 CO -0.03 0.30 0.23 0.20 -0.69 0.00 0.00 174.62 174.63 1ao8 s ASN 59 N 0.70 5.85 -0.58 3.53 0.01 -1.26 -1.77 114.94 121.42 1ao8 s ASN 59 Ca 0.26 -0.81 -0.10 0.00 -0.71 0.00 0.00 52.86 51.49 1ao8 s ASN 59 Cb -0.15 -2.07 0.15 0.00 0.41 0.00 0.00 41.25 39.58 1ao8 s ASN 59 CO 0.10 -0.35 0.47 -0.69 -1.51 0.00 0.00 177.10 175.12 1ao8 s VAL 60 N 1.62 4.58 0.01 1.60 1.01 -0.41 -0.74 120.40 128.07 1ao8 s VAL 60 Ca 0.04 -2.05 -0.30 0.00 0.00 0.00 0.00 61.98 59.66 1ao8 s VAL 60 Cb -0.19 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1ao8 s VAL 60 CO 0.08 -0.86 0.98 -0.69 0.00 0.00 0.00 175.10 174.61 1ao8 s VAL 61 N 0.95 4.82 -0.26 2.92 1.01 -0.67 -2.39 120.40 126.77 1ao8 s VAL 61 Ca 0.09 2.05 0.01 0.00 0.00 0.00 0.00 61.98 64.13 1ao8 s VAL 61 Cb -0.23 -4.31 0.05 0.00 0.00 0.00 0.00 36.38 31.88 1ao8 s VAL 61 CO -0.02 0.18 -0.08 -0.22 0.00 0.00 0.00 175.10 174.95 1ao8 s LEU 62 N 0.91 3.34 0.24 3.92 2.96 -0.94 -2.08 118.68 127.02 1ao8 s LEU 62 Ca 0.52 -1.16 -0.10 0.00 -0.22 0.00 0.00 54.13 53.16 1ao8 s LEU 62 Cb -0.21 -1.60 -0.01 0.00 0.50 0.00 0.00 46.19 44.86 1ao8 s LEU 62 CO 0.28 -0.17 0.41 0.28 -1.32 0.00 0.00 176.35 175.83 1ao8 s THR 63 N 1.21 0.00 -0.40 3.68 -1.32 -1.26 -3.69 115.64 113.86 1ao8 s THR 63 Ca -0.04 -1.53 0.06 0.00 -1.21 0.00 0.00 61.69 58.96 1ao8 s THR 63 Cb -0.18 -2.27 0.61 0.00 -1.51 0.00 0.00 72.50 69.14 1ao8 s THR 63 CO -0.05 0.00 1.76 1.41 -2.21 0.00 0.00 174.62 175.53 1ao8 n HIS 64 N -0.36 2.38 -4.85 9.09 8.25 -1.26 -4.73 115.22 123.72 1ao8 n HIS 64 Ca -0.01 -1.79 -0.33 0.00 -0.26 0.00 0.00 57.72 55.34 1ao8 n HIS 64 Cb 0.63 -0.79 -0.13 0.00 1.12 0.00 0.00 29.99 30.81 1ao8 n HIS 64 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1ao8 s GLN 65 N -3.29 2.68 -0.41 -0.41 2.00 -1.26 -5.01 119.66 113.96 1ao8 s GLN 65 Ca 0.53 -0.68 0.06 0.00 -2.00 0.00 0.00 55.36 53.26 1ao8 s GLN 65 Cb 0.45 -2.44 0.65 0.00 0.80 0.00 0.00 33.01 32.47 1ao8 s GLN 65 CO 0.07 0.55 1.82 0.39 -0.50 0.00 0.00 175.29 177.62 1ao8 n GLU 66 N 2.52 2.33 -0.33 1.67 1.02 -1.26 -4.26 120.64 122.33 1ao8 n GLU 66 Ca -0.17 -3.05 0.03 0.00 -0.02 0.00 0.00 57.16 53.94 1ao8 n GLU 66 Cb 0.52 -2.11 0.04 0.00 -0.02 0.00 0.00 31.44 29.87 1ao8 n GLU 66 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ao8 n ASP 67 N -1.04 0.76 -4.68 1.62 9.92 -1.26 -5.05 116.55 116.82 1ao8 n ASP 67 Ca 0.53 -2.27 -0.38 0.00 -0.53 0.00 0.00 54.79 52.13 1ao8 n ASP 67 Cb 1.52 -0.25 -0.07 0.00 -0.64 0.00 0.00 41.12 41.68 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1ao8 s TYR 68 N -0.89 3.41 -0.03 1.24 5.04 -1.26 -5.06 117.35 119.79 1ao8 s TYR 68 Ca 0.10 0.70 0.02 0.00 -2.44 0.00 0.00 57.07 55.44 1ao8 s TYR 68 Cb 0.08 -2.54 0.01 0.00 0.35 0.00 0.00 41.96 39.86 1ao8 s TYR 68 CO 0.01 0.03 -0.07 -0.65 -1.34 0.00 0.00 175.55 173.53 1ao8 s GLN 69 N 1.15 0.86 -0.16 4.97 -0.21 -1.26 -4.95 119.66 120.07 1ao8 s GLN 69 Ca 0.21 -0.24 -0.08 0.00 0.02 0.00 0.00 55.36 55.27 1ao8 s GLN 69 Cb -0.15 -0.82 0.06 0.00 1.00 0.00 0.00 33.01 33.10 1ao8 s GLN 69 CO 0.08 0.06 0.38 0.00 -2.12 0.00 0.00 175.29 173.69 1ao8 s ALA 70 N 0.33 -0.95 -0.33 6.09 0.00 -1.26 -5.10 121.76 120.53 1ao8 s ALA 70 Ca -0.05 1.42 -0.29 0.00 0.00 0.00 0.00 51.96 53.04 1ao8 s ALA 70 Cb -0.09 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.15 1ao8 s ALA 70 CO 0.00 -0.27 1.34 -0.65 0.00 0.00 0.00 175.76 176.18 1ao8 s GLN 71 N 1.42 3.81 0.00 0.00 -1.52 -1.26 -2.69 119.66 119.42 1ao8 s GLN 71 Ca -0.09 1.16 0.00 0.00 -1.95 0.00 0.00 55.36 54.47 1ao8 s GLN 71 Cb -0.09 -3.93 0.00 0.00 -0.22 0.00 0.00 33.01 28.77 1ao8 s GLN 71 CO -0.12 -1.26 0.00 0.41 -0.25 0.00 0.00 175.29 174.07 1ao8 n GLY 72 N 4.55 0.97 2.81 3.09 0.00 -1.26 -4.50 105.19 110.86 1ao8 n GLY 72 Ca 0.15 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 1ao8 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ao8 s ALA 73 N -2.00 0.95 -0.37 4.61 0.00 -1.10 -4.38 121.76 119.48 1ao8 s ALA 73 Ca 0.00 -0.34 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 1ao8 s ALA 73 Cb 0.00 -0.86 0.02 0.00 0.00 0.00 0.00 23.12 22.28 1ao8 s ALA 73 CO 0.00 -0.53 1.12 0.08 0.00 0.00 0.00 175.76 176.43 1ao8 s VAL 74 N 1.87 4.36 -0.47 0.00 1.01 0.08 -4.60 120.40 122.65 1ao8 s VAL 74 Ca 0.04 1.52 -0.19 0.00 0.00 0.00 0.00 61.98 63.34 1ao8 s VAL 74 Cb -0.13 -4.46 0.04 0.00 0.00 0.00 0.00 36.38 31.84 1ao8 s VAL 74 CO -0.06 -0.66 0.60 -0.69 0.00 0.00 0.00 175.10 174.29 1ao8 s VAL 75 N 4.02 4.89 0.67 2.92 1.01 -1.26 -1.67 120.40 130.97 1ao8 s VAL 75 Ca 0.47 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 62.16 1ao8 s VAL 75 Cb -0.11 -4.24 0.10 0.00 0.00 0.00 0.00 36.38 32.13 1ao8 s VAL 75 CO 0.22 -0.69 0.93 0.68 0.00 0.00 0.00 175.10 176.23 1ao8 s VAL 76 N 2.62 2.30 -0.18 2.92 -7.23 -0.88 -4.98 120.40 114.97 1ao8 s VAL 76 Ca 0.17 -0.60 0.17 0.00 -1.81 0.00 0.00 61.98 59.91 1ao8 s VAL 76 Cb -0.17 -2.70 0.38 0.00 0.56 0.00 0.00 36.38 34.44 1ao8 s VAL 76 CO 0.14 0.00 1.22 1.41 -0.31 0.00 0.00 175.10 177.56 1ao8 n HIS 77 N -2.69 -0.12 -3.64 2.82 8.25 -1.26 -4.23 115.22 114.34 1ao8 n HIS 77 Ca 0.12 -1.39 -0.03 0.00 -0.26 0.00 0.00 57.72 56.17 1ao8 n HIS 77 Cb 0.60 0.39 -0.07 0.00 1.12 0.00 0.00 29.99 32.04 1ao8 n HIS 77 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1ao8 s ASP 78 N -2.22 -0.33 0.35 0.41 2.15 -1.26 -5.01 116.67 110.76 1ao8 s ASP 78 Ca 0.19 0.55 0.03 0.00 0.43 0.00 0.00 52.55 53.76 1ao8 s ASP 78 Cb 0.32 0.93 0.63 0.00 -0.30 0.00 0.00 42.92 44.50 1ao8 s ASP 78 CO -0.09 -0.09 1.94 0.58 -0.17 0.00 0.00 175.17 177.35 1ao8 h VAL 79 N 4.42 1.17 -0.41 1.11 2.07 -2.00 -1.91 116.25 120.70 1ao8 h VAL 79 Ca -0.28 -0.53 -0.09 0.00 0.82 0.00 0.00 66.70 66.62 1ao8 h VAL 79 Cb 1.18 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.55 1ao8 h VAL 79 CO 0.18 0.21 -0.10 0.00 0.02 0.00 0.00 177.57 177.88 1ao8 h ALA 80 N 1.56 1.06 -0.69 1.67 0.00 -2.00 -2.73 119.26 118.12 1ao8 h ALA 80 Ca 0.16 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1ao8 h ALA 80 Cb 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1ao8 h ALA 80 CO -0.02 0.58 0.18 0.00 0.00 0.00 0.00 179.25 179.99 1ao8 h ALA 81 N 1.23 0.91 -0.05 0.00 0.00 -1.75 -1.02 119.26 118.58 1ao8 h ALA 81 Ca 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1ao8 h ALA 81 Cb 0.56 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ao8 h ALA 81 CO 0.03 0.63 -0.07 0.28 0.00 0.00 0.00 179.25 180.12 1ao8 h VAL 82 N 1.04 1.09 0.02 0.00 2.07 -1.17 -1.81 116.25 117.47 1ao8 h VAL 82 Ca 0.22 -0.37 -0.23 0.00 0.82 0.00 0.00 66.70 67.14 1ao8 h VAL 82 Cb 0.36 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1ao8 h VAL 82 CO 0.00 0.11 -1.11 -0.26 0.02 0.00 0.00 177.57 176.33 1ao8 h PHE 83 N 0.08 0.07 -0.73 1.57 0.04 -1.18 -3.26 116.94 113.52 1ao8 h PHE 83 Ca 0.02 -0.05 -0.06 0.00 2.80 0.00 0.00 57.97 60.68 1ao8 h PHE 83 Cb 0.17 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.29 1ao8 h PHE 83 CO 0.00 1.04 0.23 0.00 -0.60 0.00 0.00 178.31 178.99 1ao8 h ALA 84 N 0.94 1.03 -0.51 2.45 0.00 -0.36 -2.16 119.26 120.65 1ao8 h ALA 84 Ca -0.06 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1ao8 h ALA 84 Cb 1.82 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 1ao8 h ALA 84 CO 0.13 0.65 0.13 -0.92 0.00 0.00 0.00 179.25 179.25 1ao8 h TYR 85 N 1.08 0.80 -0.56 0.00 3.20 -1.52 -2.01 116.97 117.95 1ao8 h TYR 85 Ca 0.24 -0.07 -0.11 0.00 3.14 0.00 0.00 58.73 61.93 1ao8 h TYR 85 Cb 0.29 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1ao8 h TYR 85 CO 0.02 0.67 -0.07 0.00 -1.64 0.00 0.00 178.16 177.14 1ao8 h ALA 86 N 1.39 0.80 -0.45 1.82 0.00 -1.47 -1.29 119.26 120.06 1ao8 h ALA 86 Ca 0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1ao8 h ALA 86 Cb 0.27 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1ao8 h ALA 86 CO -0.00 0.67 0.16 -0.22 0.00 0.00 0.00 179.25 179.85 1ao8 h LYS 87 N 0.93 0.69 0.00 0.00 3.11 -0.94 -2.39 116.57 117.97 1ao8 h LYS 87 Ca 0.15 -0.14 -0.07 0.00 -2.81 0.00 0.00 60.65 57.78 1ao8 h LYS 87 Cb 0.64 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.75 1ao8 h LYS 87 CO 0.04 0.65 -0.32 1.96 -2.81 0.00 0.00 179.45 178.97 1ao8 h GLN 88 N 0.59 0.00 -3.88 1.90 4.20 -1.23 -3.36 115.11 113.34 1ao8 h GLN 88 Ca 0.15 0.00 -0.67 0.00 0.06 0.00 0.00 58.65 58.18 1ao8 h GLN 88 Cb 0.24 0.00 -0.37 0.00 0.30 0.00 0.00 27.48 27.64 1ao8 h GLN 88 CO -0.01 0.32 -0.53 -1.01 -0.67 0.00 0.00 178.83 176.94 1ao8 s HIS 89 N -4.15 3.43 0.14 2.96 3.76 -0.50 -4.91 115.29 116.02 1ao8 s HIS 89 Ca -0.03 -2.83 0.05 0.00 -0.15 0.00 0.00 55.06 52.10 1ao8 s HIS 89 Cb 0.14 -3.06 -0.12 0.00 1.11 0.00 0.00 32.58 30.65 1ao8 s HIS 89 CO 0.70 -0.86 1.31 -1.00 -0.85 0.00 0.00 174.74 174.04 1ao8 h PRO 90 N 7.17 0.08 -0.02 8.40 0.13 -1.72 -3.23 132.00 142.81 1ao8 h PRO 90 Ca -0.06 -0.12 -0.11 0.00 -0.87 0.00 0.00 66.00 64.84 1ao8 h PRO 90 Cb 0.96 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 1ao8 h PRO 90 CO 0.68 0.99 -0.51 0.22 -0.23 0.00 0.00 178.00 179.14 1ao8 h ASP 91 N 0.03 0.05 -3.43 1.44 3.58 -1.91 -3.43 116.42 112.75 1ao8 h ASP 91 Ca -0.04 -0.02 -0.54 0.00 0.42 0.00 0.00 57.03 56.85 1ao8 h ASP 91 Cb 1.68 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 42.68 1ao8 h ASP 91 CO 0.14 0.55 -0.07 -1.10 -2.88 0.00 0.00 179.24 175.88 1ao8 s GLN 92 N -3.88 3.91 0.26 0.28 -1.52 -1.22 -4.99 119.66 112.49 1ao8 s GLN 92 Ca -0.02 0.42 0.03 0.00 -1.95 0.00 0.00 55.36 53.84 1ao8 s GLN 92 Cb 0.13 -2.73 0.03 0.00 -0.22 0.00 0.00 33.01 30.22 1ao8 s GLN 92 CO 0.75 0.36 0.26 0.39 -0.25 0.00 0.00 175.29 176.80 1ao8 n GLU 93 N 0.20 0.99 -3.90 2.91 1.02 -1.26 -4.90 120.64 115.70 1ao8 n GLU 93 Ca -0.01 -1.50 -0.30 0.00 -0.02 0.00 0.00 57.16 55.33 1ao8 n GLU 93 Cb 0.52 0.05 -0.16 0.00 -0.02 0.00 0.00 31.44 31.84 1ao8 n GLU 93 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1ao8 s LEU 94 N 0.00 2.56 -0.13 -4.62 2.96 -1.26 -1.61 118.68 116.58 1ao8 s LEU 94 Ca 0.20 -1.26 -0.02 0.00 -0.22 0.00 0.00 54.13 52.82 1ao8 s LEU 94 Cb -0.02 -1.12 -0.03 0.00 0.50 0.00 0.00 46.19 45.53 1ao8 s LEU 94 CO 0.13 -0.27 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.15 1ao8 s VAL 95 N 1.43 3.82 -0.24 1.68 1.01 -0.51 0.05 120.40 127.64 1ao8 s VAL 95 Ca -0.02 -0.40 -0.10 0.00 0.00 0.00 0.00 61.98 61.45 1ao8 s VAL 95 Cb -0.19 -2.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 1ao8 s VAL 95 CO -0.08 0.53 0.15 -0.63 0.00 0.00 0.00 175.10 175.07 1ao8 s ILE 96 N -0.01 5.28 -0.14 2.22 -1.09 0.21 -1.81 121.20 125.87 1ao8 s ILE 96 Ca 0.00 0.15 0.14 0.00 -2.23 0.00 0.00 60.65 58.71 1ao8 s ILE 96 Cb -0.13 -3.46 -0.19 0.00 -1.58 0.00 0.00 42.46 37.09 1ao8 s ILE 96 CO 0.03 0.34 0.08 0.00 -1.23 0.00 0.00 174.94 174.16 1ao8 n ALA 97 N 4.35 1.72 0.00 9.38 0.00 -1.00 -1.96 120.51 133.01 1ao8 n ALA 97 Ca -0.15 -0.93 0.00 0.00 0.00 0.00 0.00 53.44 52.36 1ao8 n ALA 97 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1ao8 n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ao8 n GLY 98 N 2.03 -0.42 0.00 0.00 0.00 -1.23 -4.84 105.19 100.73 1ao8 n GLY 98 Ca -0.22 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1ao8 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ao8 n GLY 99 N 0.00 -0.12 0.28 -0.02 0.00 -1.26 -1.65 105.19 102.41 1ao8 n GLY 99 Ca 0.00 -1.53 -0.04 0.00 0.00 0.00 0.00 46.02 44.44 1ao8 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ao8 h ALA 100 N -2.00 1.10 -0.05 4.61 0.00 -1.92 -2.19 119.26 118.80 1ao8 h ALA 100 Ca 0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1ao8 h ALA 100 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ao8 h ALA 100 CO 0.00 0.56 -0.19 0.37 0.00 0.00 0.00 179.25 179.99 1ao8 h GLN 101 N 0.68 0.09 -0.01 0.00 4.15 -2.00 -2.25 115.11 115.77 1ao8 h GLN 101 Ca 0.13 -0.02 -0.24 0.00 0.77 0.00 0.00 58.65 59.29 1ao8 h GLN 101 Cb 0.49 -0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.18 1ao8 h GLN 101 CO 0.03 0.28 -0.96 0.82 -1.93 0.00 0.00 178.83 177.07 1ao8 h ILE 102 N 0.08 1.36 -0.72 2.39 1.08 -1.68 -3.08 117.51 116.94 1ao8 h ILE 102 Ca 0.01 -2.36 -0.06 0.00 -0.39 0.00 0.00 64.86 62.07 1ao8 h ILE 102 Cb 0.40 2.38 -0.03 0.00 -3.07 0.00 0.00 36.82 36.49 1ao8 h ILE 102 CO 0.03 0.71 0.21 -0.26 -0.69 0.00 0.00 178.15 178.15 1ao8 h PHE 103 N 0.29 1.18 -0.36 1.37 0.04 -0.96 -2.29 116.94 116.21 1ao8 h PHE 103 Ca -0.09 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.52 1ao8 h PHE 103 Cb 1.60 -0.34 -0.02 0.00 2.20 0.00 0.00 35.95 39.39 1ao8 h PHE 103 CO 0.07 0.94 0.07 1.15 -0.60 0.00 0.00 178.31 179.94 1ao8 h THR 104 N 1.08 1.18 -0.52 -1.55 2.02 -1.43 -1.48 112.91 112.20 1ao8 h THR 104 Ca 0.23 -0.64 -0.12 0.00 0.77 0.00 0.00 66.41 66.65 1ao8 h THR 104 Cb 0.33 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.55 1ao8 h THR 104 CO -0.00 0.23 -0.14 0.00 0.37 0.00 0.00 175.52 175.97 1ao8 h ALA 105 N 1.56 0.72 -0.94 6.16 0.00 -1.33 -2.98 119.26 122.45 1ao8 h ALA 105 Ca 0.12 -0.36 -0.62 0.00 0.00 0.00 0.00 54.91 54.05 1ao8 h ALA 105 Cb 0.23 -0.18 -0.30 0.00 0.00 0.00 0.00 17.79 17.54 1ao8 h ALA 105 CO -0.00 0.66 0.62 1.19 0.00 0.00 0.00 179.25 181.72 1ao8 n PHE 106 N -4.15 3.07 0.08 0.00 3.72 -0.92 -4.50 117.46 114.75 1ao8 n PHE 106 Ca 0.01 -2.69 -0.15 0.00 -0.05 0.00 0.00 57.45 54.56 1ao8 n PHE 106 Cb 0.42 -1.21 -0.14 0.00 -0.94 0.00 0.00 39.48 37.61 1ao8 n PHE 106 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1ao8 h LYS 107 N 1.81 0.23 0.00 -1.08 3.64 -1.12 -3.30 116.57 116.75 1ao8 h LYS 107 Ca 0.57 -0.39 -0.18 0.00 -1.27 0.00 0.00 60.65 59.38 1ao8 h LYS 107 Cb 1.27 0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 33.21 1ao8 h LYS 107 CO 1.38 1.14 -0.85 -0.44 -2.27 0.00 0.00 179.45 178.40 1ao8 h ASP 108 N 0.06 0.02 -2.50 4.20 5.19 -1.82 -3.33 116.42 118.24 1ao8 h ASP 108 Ca -0.17 -0.01 -0.76 0.00 -0.62 0.00 0.00 57.03 55.47 1ao8 h ASP 108 Cb 1.97 -0.01 -0.31 0.00 0.18 0.00 0.00 39.33 41.17 1ao8 h ASP 108 CO 0.18 0.85 0.57 0.47 -3.12 0.00 0.00 179.24 178.19 1ao8 n ASP 109 N -3.54 6.28 -4.10 6.45 9.92 -1.24 -4.98 116.55 125.33 1ao8 n ASP 109 Ca -0.01 -3.56 -0.22 0.00 -0.53 0.00 0.00 54.79 50.47 1ao8 n ASP 109 Cb 0.81 -1.08 -0.15 0.00 -0.64 0.00 0.00 41.12 40.05 1ao8 n ASP 109 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1ao8 s VAL 110 N -3.55 1.08 0.00 2.53 0.11 -1.25 -4.52 120.40 114.79 1ao8 s VAL 110 Ca 0.37 -0.57 0.00 0.00 -2.93 0.00 0.00 61.98 58.85 1ao8 s VAL 110 Cb 0.14 -0.90 0.00 0.00 -1.53 0.00 0.00 36.38 34.09 1ao8 s VAL 110 CO -0.02 0.31 0.00 0.47 -3.33 0.00 0.00 175.10 172.52 1ao8 n ASP 111 N 2.81 0.00 -4.56 3.54 9.92 -1.26 -4.94 116.55 122.05 1ao8 n ASP 111 Ca -0.15 0.00 -0.40 0.00 -0.53 0.00 0.00 54.79 53.71 1ao8 n ASP 111 Cb 0.55 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 41.00 1ao8 n ASP 111 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1ao8 s THR 112 N -0.92 3.54 -0.98 -3.53 2.01 -1.26 -3.44 115.64 111.06 1ao8 s THR 112 Ca 0.00 0.41 -0.14 0.00 0.31 0.00 0.00 61.69 62.26 1ao8 s THR 112 Cb 0.00 -4.14 0.20 0.00 0.01 0.00 0.00 72.50 68.57 1ao8 s THR 112 CO 0.00 -1.01 1.05 -0.76 -0.69 0.00 0.00 174.62 173.21 1ao8 s LEU 113 N 7.53 5.94 -0.05 4.42 1.43 0.37 -1.06 118.68 137.25 1ao8 s LEU 113 Ca 0.61 -2.76 -0.27 0.00 -1.03 0.00 0.00 54.13 50.68 1ao8 s LEU 113 Cb -0.13 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.77 1ao8 s LEU 113 CO 0.23 -0.67 0.84 -0.76 0.23 0.00 0.00 176.35 176.22 1ao8 s LEU 114 N 0.76 4.32 -0.03 1.79 1.43 0.42 -2.32 118.68 125.06 1ao8 s LEU 114 Ca 0.29 1.39 -0.14 0.00 -1.03 0.00 0.00 54.13 54.64 1ao8 s LEU 114 Cb -0.07 -3.32 0.02 0.00 0.03 0.00 0.00 46.19 42.85 1ao8 s LEU 114 CO -0.07 -0.22 0.31 0.54 0.23 0.00 0.00 176.35 177.13 1ao8 s VAL 115 N 1.09 0.05 -0.38 -1.59 0.11 -1.05 -2.33 120.40 116.30 1ao8 s VAL 115 Ca 0.44 -0.41 -0.08 0.00 -2.93 0.00 0.00 61.98 59.00 1ao8 s VAL 115 Cb -0.19 -0.58 0.06 0.00 -1.53 0.00 0.00 36.38 34.14 1ao8 s VAL 115 CO 0.21 -0.23 0.19 -0.89 -3.33 0.00 0.00 175.10 171.06 1ao8 s THR 116 N -1.10 4.06 -0.22 5.04 2.01 -0.91 -1.63 115.64 122.89 1ao8 s THR 116 Ca -0.12 -1.27 -0.28 0.00 0.31 0.00 0.00 61.69 60.33 1ao8 s THR 116 Cb -0.05 -3.41 0.01 0.00 0.01 0.00 0.00 72.50 69.06 1ao8 s THR 116 CO 0.04 -0.36 1.01 -0.13 -0.69 0.00 0.00 174.62 174.48 1ao8 s ARG 117 N 1.42 4.27 0.52 4.92 0.52 -0.96 -2.43 118.95 127.20 1ao8 s ARG 117 Ca 0.01 1.31 0.08 0.00 -0.52 0.00 0.00 55.73 56.61 1ao8 s ARG 117 Cb -0.21 -3.63 0.06 0.00 0.52 0.00 0.00 34.95 31.68 1ao8 s ARG 117 CO 0.03 -0.58 0.71 -0.51 0.02 0.00 0.00 175.30 174.96 1ao8 s LEU 118 N 3.02 3.33 -0.07 2.53 1.02 -0.90 -0.35 118.68 127.27 1ao8 s LEU 118 Ca 0.43 -0.63 0.02 0.00 0.02 0.00 0.00 54.13 53.98 1ao8 s LEU 118 Cb -0.15 -2.11 -0.06 0.00 0.02 0.00 0.00 46.19 43.89 1ao8 s LEU 118 CO 0.07 -1.12 -0.03 0.00 0.02 0.00 0.00 176.35 175.30 1ao8 n ALA 119 N -2.11 1.85 -1.77 4.21 0.00 -0.61 -3.86 120.51 118.21 1ao8 n ALA 119 Ca 0.12 -0.34 -0.40 0.00 0.00 0.00 0.00 53.44 52.83 1ao8 n ALA 119 Cb 0.60 0.25 -0.00 0.00 0.00 0.00 0.00 19.45 20.31 1ao8 n ALA 119 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ao8 s GLY 120 N -4.32 2.93 0.20 0.00 0.00 -0.60 -4.77 107.32 100.76 1ao8 s GLY 120 Ca -0.07 1.31 -0.18 0.00 0.00 0.00 0.00 44.72 45.78 1ao8 s GLY 120 CO 0.19 1.92 0.67 -1.35 0.00 0.00 0.00 173.10 174.53 1ao8 s SER 121 N -0.62 6.98 -0.12 1.64 1.04 -1.26 -4.55 113.70 116.81 1ao8 s SER 121 Ca 0.57 1.31 -0.09 0.00 0.48 0.00 0.00 55.95 58.22 1ao8 s SER 121 Cb -0.40 -2.38 0.04 0.00 0.10 0.00 0.00 66.02 63.38 1ao8 s SER 121 CO 0.52 0.05 0.30 -0.36 0.98 0.00 0.00 173.24 174.73 1ao8 s PHE 122 N -1.52 -0.37 -0.01 5.02 0.08 -1.26 -5.07 117.98 114.85 1ao8 s PHE 122 Ca 0.42 0.87 0.00 0.00 0.12 0.00 0.00 56.93 58.34 1ao8 s PHE 122 Cb -0.16 0.12 -0.04 0.00 -0.57 0.00 0.00 43.02 42.37 1ao8 s PHE 122 CO 0.20 -0.21 0.06 -1.83 -0.10 0.00 0.00 175.22 173.34 1ao8 s GLU 123 N 0.65 2.98 0.00 0.44 -1.05 -1.26 -4.74 118.70 115.72 1ao8 s GLU 123 Ca -0.04 -0.52 0.00 0.00 -0.15 0.00 0.00 54.97 54.26 1ao8 s GLU 123 Cb -0.05 -2.80 0.00 0.00 -0.44 0.00 0.00 34.13 30.83 1ao8 s GLU 123 CO -0.04 0.64 0.00 0.41 0.95 0.00 0.00 175.26 177.22 1ao8 n GLY 124 N 1.27 2.95 0.58 -3.83 0.00 -1.26 -4.97 105.19 99.93 1ao8 n GLY 124 Ca -0.14 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1ao8 n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ao8 n ASP 125 N 0.00 1.37 -4.66 1.61 8.00 -1.26 -5.02 116.55 116.60 1ao8 n ASP 125 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1ao8 n ASP 125 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ao8 s THR 126 N -1.75 4.01 0.24 -3.53 2.01 -1.22 -5.00 115.64 110.40 1ao8 s THR 126 Ca 0.00 1.23 0.07 0.00 0.31 0.00 0.00 61.69 63.30 1ao8 s THR 126 Cb 0.00 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 1ao8 s THR 126 CO 0.00 -0.11 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.17 1ao8 s LYS 127 N 3.68 1.45 0.44 4.92 1.02 -1.26 -1.76 119.74 128.23 1ao8 s LYS 127 Ca 0.62 -1.69 -0.21 0.00 0.02 0.00 0.00 55.97 54.71 1ao8 s LYS 127 Cb -0.26 -1.18 -0.11 0.00 -0.52 0.00 0.00 37.83 35.76 1ao8 s LYS 127 CO 0.20 0.13 0.96 1.41 -0.92 0.00 0.00 175.35 177.13 1ao8 s MET 128 N -3.67 4.19 0.87 1.68 -2.45 -1.11 -4.79 119.30 114.02 1ao8 s MET 128 Ca 0.26 1.13 -0.11 0.00 -1.25 0.00 0.00 55.69 55.72 1ao8 s MET 128 Cb 0.01 -2.17 0.11 0.00 1.25 0.00 0.00 34.83 34.03 1ao8 s MET 128 CO 0.10 -0.07 1.09 0.96 1.05 0.00 0.00 175.02 178.15 1ao8 s ILE 129 N -2.18 2.79 -0.68 10.11 -4.36 -1.26 -4.95 121.20 120.67 1ao8 s ILE 129 Ca 0.62 0.26 -0.27 0.00 -0.26 0.00 0.00 60.65 60.99 1ao8 s ILE 129 Cb -0.10 -2.74 0.03 0.00 1.25 0.00 0.00 42.46 40.91 1ao8 s ILE 129 CO 0.14 -0.33 1.26 -2.16 0.24 0.00 0.00 174.94 174.09 1ao8 s PRO 130 N -4.93 3.30 0.18 0.37 0.04 -1.26 -5.03 135.00 127.68 1ao8 s PRO 130 Ca 0.63 -0.05 0.01 0.00 0.04 0.00 0.00 61.00 61.63 1ao8 s PRO 130 Cb -0.18 -4.13 -0.04 0.00 0.04 0.00 0.00 34.50 30.20 1ao8 s PRO 130 CO 0.57 -1.99 0.34 -0.51 0.04 0.00 0.00 177.00 175.45 1ao8 s LEU 131 N 5.52 4.28 -0.76 -3.56 1.43 -1.26 -5.04 118.68 119.29 1ao8 s LEU 131 Ca 0.38 0.28 -0.21 0.00 -1.03 0.00 0.00 54.13 53.56 1ao8 s LEU 131 Cb -0.08 -3.04 0.10 0.00 0.03 0.00 0.00 46.19 43.20 1ao8 s LEU 131 CO 0.19 -0.00 1.01 0.21 0.23 0.00 0.00 176.35 177.98 1ao8 s ASN 132 N -3.25 6.35 0.41 2.29 2.47 -1.26 -4.85 114.94 117.10 1ao8 s ASN 132 Ca 0.36 -1.42 0.22 0.00 0.42 0.00 0.00 52.86 52.44 1ao8 s ASN 132 Cb -0.11 -2.40 0.83 0.00 -1.45 0.00 0.00 41.25 38.12 1ao8 s ASN 132 CO 0.29 -1.28 1.79 -0.50 -3.72 0.00 0.00 177.10 173.69 1ao8 h TRP 133 N 9.27 0.00 -0.09 0.43 4.06 -1.96 -2.93 115.95 124.73 1ao8 h TRP 133 Ca -0.12 0.00 0.03 0.00 2.06 0.00 0.00 58.89 60.86 1ao8 h TRP 133 Cb 1.05 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.21 1ao8 h TRP 133 CO 1.03 0.28 0.08 -0.44 -3.56 0.00 0.00 178.44 175.84 1ao8 h ASP 134 N 0.00 0.00 -0.93 -3.49 5.19 -2.05 -0.48 116.42 114.66 1ao8 h ASP 134 Ca -0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 1ao8 h ASP 134 Cb 0.80 0.00 -0.28 0.00 0.18 0.00 0.00 39.33 40.03 1ao8 h ASP 134 CO 0.04 0.00 0.67 0.47 -3.12 0.00 0.00 179.24 177.30 1ao8 n ASP 135 N -4.13 4.89 -3.64 6.45 8.00 -1.11 -4.93 116.55 122.07 1ao8 n ASP 135 Ca -0.01 -3.55 -0.14 0.00 0.71 0.00 0.00 54.79 51.80 1ao8 n ASP 135 Cb 0.19 -0.87 -0.06 0.00 -0.02 0.00 0.00 41.12 40.35 1ao8 n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ao8 s PHE 136 N -3.21 1.08 -0.01 1.24 0.40 -0.19 -4.52 117.98 112.76 1ao8 s PHE 136 Ca 0.55 -1.27 -0.16 0.00 -0.60 0.00 0.00 56.93 55.45 1ao8 s PHE 136 Cb 0.45 -0.26 0.03 0.00 0.51 0.00 0.00 43.02 43.75 1ao8 s PHE 136 CO 0.07 -0.94 0.33 0.99 0.70 0.00 0.00 175.22 176.37 1ao8 s THR 137 N -3.58 0.05 0.02 0.64 2.01 -0.87 -4.93 115.64 108.99 1ao8 s THR 137 Ca 0.33 -0.45 -0.18 0.00 0.31 0.00 0.00 61.69 61.70 1ao8 s THR 137 Cb 0.02 -0.64 -0.06 0.00 0.01 0.00 0.00 72.50 71.83 1ao8 s THR 137 CO 0.17 -0.25 0.53 -0.75 -0.69 0.00 0.00 174.62 173.64 1ao8 s LYS 138 N -1.34 4.18 0.01 4.92 2.20 -1.26 -0.85 119.74 127.59 1ao8 s LYS 138 Ca -0.13 0.64 -0.04 0.00 -0.36 0.00 0.00 55.97 56.07 1ao8 s LYS 138 Cb -0.05 -3.28 -0.01 0.00 -1.51 0.00 0.00 37.83 32.98 1ao8 s LYS 138 CO 0.04 0.54 -0.08 0.28 -0.36 0.00 0.00 175.35 175.77 1ao8 n VAL 139 N 2.16 0.95 -4.03 4.02 0.31 -0.80 -4.93 118.33 116.02 1ao8 n VAL 139 Ca -0.10 0.28 -0.22 0.00 -0.01 0.00 0.00 64.34 64.28 1ao8 n VAL 139 Cb 0.51 -1.65 -0.05 0.00 -0.91 0.00 0.00 33.84 31.74 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1ao8 s SER 140 N -5.60 4.94 -0.28 4.52 0.01 -1.23 -5.01 113.70 111.05 1ao8 s SER 140 Ca -0.07 -0.62 -0.24 0.00 1.31 0.00 0.00 55.95 56.33 1ao8 s SER 140 Cb 0.01 -0.88 0.12 0.00 0.21 0.00 0.00 66.02 65.48 1ao8 s SER 140 CO 0.10 -0.26 1.02 -0.55 0.41 0.00 0.00 173.24 173.96 1ao8 s SER 141 N -3.88 -0.46 -0.05 2.44 0.15 -1.26 -1.97 113.70 108.67 1ao8 s SER 141 Ca 0.38 0.87 -0.01 0.00 0.70 0.00 0.00 55.95 57.89 1ao8 s SER 141 Cb -0.04 0.91 0.03 0.00 -1.71 0.00 0.00 66.02 65.21 1ao8 s SER 141 CO 0.24 -0.15 0.01 -0.60 1.20 0.00 0.00 173.24 173.94 1ao8 s ARG 142 N 0.34 0.43 -0.11 5.44 3.52 -0.17 -4.99 118.95 123.40 1ao8 s ARG 142 Ca 0.02 0.12 -0.12 0.00 -0.13 0.00 0.00 55.73 55.62 1ao8 s ARG 142 Cb -0.05 -0.74 -0.05 0.00 -1.56 0.00 0.00 34.95 32.55 1ao8 s ARG 142 CO -0.07 -0.24 0.26 0.99 -0.81 0.00 0.00 175.30 175.43 1ao8 s THR 143 N 1.62 5.31 -0.06 4.11 2.01 -1.26 -1.05 115.64 126.32 1ao8 s THR 143 Ca -0.01 0.49 -0.01 0.00 0.31 0.00 0.00 61.69 62.47 1ao8 s THR 143 Cb -0.13 -3.57 0.03 0.00 0.01 0.00 0.00 72.50 68.84 1ao8 s THR 143 CO -0.03 0.50 0.00 -0.69 -0.69 0.00 0.00 174.62 173.71 1ao8 s VAL 144 N -0.33 0.31 -0.10 3.82 1.01 -0.65 -5.01 120.40 119.44 1ao8 s VAL 144 Ca 0.17 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.22 1ao8 s VAL 144 Cb -0.13 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 1ao8 s VAL 144 CO 0.06 0.23 0.07 -1.61 0.00 0.00 0.00 175.10 173.84 1ao8 s GLU 145 N 1.68 3.20 0.00 2.72 2.02 -1.26 -2.50 118.70 124.56 1ao8 s GLU 145 Ca 0.00 -0.27 0.00 0.00 0.02 0.00 0.00 54.97 54.72 1ao8 s GLU 145 Cb -0.13 -2.99 0.00 0.00 0.10 0.00 0.00 34.13 31.12 1ao8 s GLU 145 CO -0.04 0.74 0.00 -3.47 0.02 0.00 0.00 175.26 172.51 1ao8 n ASP 146 N 2.05 0.28 0.24 -0.19 2.03 -1.26 -4.98 116.55 114.73 1ao8 n ASP 146 Ca -0.19 -0.57 0.07 0.00 0.52 0.00 0.00 54.79 54.62 1ao8 n ASP 146 Cb 0.54 0.00 0.59 0.00 -0.72 0.00 0.00 41.12 41.53 1ao8 n ASP 146 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1ao8 h THR 147 N 0.08 1.01 -1.99 5.18 1.35 -1.99 -3.43 112.91 113.11 1ao8 h THR 147 Ca 0.00 -0.39 -0.61 0.00 -0.55 0.00 0.00 66.41 64.86 1ao8 h THR 147 Cb 0.00 1.21 -0.14 0.00 -1.73 0.00 0.00 68.15 67.50 1ao8 h THR 147 CO 0.00 0.11 -0.68 0.20 -0.25 0.00 0.00 175.52 174.90 1ao8 s ASN 148 N -6.91 3.65 0.13 5.36 0.01 -1.26 -5.04 114.94 110.88 1ao8 s ASN 148 Ca -0.04 -1.20 0.08 0.00 -0.71 0.00 0.00 52.86 50.98 1ao8 s ASN 148 Cb 0.16 -0.33 -0.18 0.00 0.41 0.00 0.00 41.25 41.30 1ao8 s ASN 148 CO 0.67 -0.22 1.30 1.55 -1.51 0.00 0.00 177.10 178.89 1ao8 h PRO 149 N 2.04 0.00 0.00 -0.60 0.13 -2.00 -3.25 132.00 128.32 1ao8 h PRO 149 Ca -0.42 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.64 1ao8 h PRO 149 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1ao8 h PRO 149 CO 0.70 0.96 -0.36 0.00 -0.23 0.00 0.00 178.00 179.07 1ao8 h ALA 150 N 1.04 1.01 -0.87 -0.56 0.00 -1.96 -2.95 119.26 114.96 1ao8 h ALA 150 Ca -0.01 -0.33 -0.49 0.00 0.00 0.00 0.00 54.91 54.08 1ao8 h ALA 150 Cb 1.73 -0.06 -0.26 0.00 0.00 0.00 0.00 17.79 19.20 1ao8 h ALA 150 CO 0.12 0.45 0.62 1.28 0.00 0.00 0.00 179.25 181.73 1ao8 n LEU 151 N -3.53 6.56 -4.83 0.00 4.77 -1.22 -1.56 117.00 117.18 1ao8 n LEU 151 Ca -0.00 -3.52 -0.37 0.00 -0.03 0.00 0.00 56.01 52.09 1ao8 n LEU 151 Cb 0.50 -0.85 -0.06 0.00 -2.33 0.00 0.00 43.42 40.68 1ao8 n LEU 151 CO 0.36 1.09 0.24 -0.89 -1.33 0.00 0.00 177.39 176.86 1ao8 s THR 152 N -3.22 4.83 0.03 -5.08 2.01 -1.11 -4.16 115.64 108.94 1ao8 s THR 152 Ca 0.51 0.97 -0.04 0.00 0.31 0.00 0.00 61.69 63.44 1ao8 s THR 152 Cb 0.42 -3.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.13 1ao8 s THR 152 CO 0.07 0.37 0.05 -1.38 -0.69 0.00 0.00 174.62 173.05 1ao8 s HIS 153 N -1.32 0.25 -0.20 4.92 -3.43 -1.04 -1.58 115.29 112.89 1ao8 s HIS 153 Ca 0.34 -0.58 -0.05 0.00 -0.80 0.00 0.00 55.06 53.98 1ao8 s HIS 153 Cb -0.17 -0.18 0.07 0.00 -1.43 0.00 0.00 32.58 30.87 1ao8 s HIS 153 CO 0.19 -0.33 0.10 0.99 -2.00 0.00 0.00 174.74 173.68 1ao8 s THR 154 N -2.52 -0.03 -0.17 -5.38 2.01 0.52 -1.64 115.64 108.43 1ao8 s THR 154 Ca -0.06 -0.33 -0.29 0.00 0.31 0.00 0.00 61.69 61.32 1ao8 s THR 154 Cb -0.02 -0.70 -0.05 0.00 0.01 0.00 0.00 72.50 71.74 1ao8 s THR 154 CO -0.04 -0.38 1.85 -0.31 -0.69 0.00 0.00 174.62 175.05 1ao8 s TYR 155 N 2.11 1.68 -0.15 4.92 2.02 -0.22 -2.27 117.35 125.43 1ao8 s TYR 155 Ca 0.03 0.33 -0.01 0.00 -0.37 0.00 0.00 57.07 57.05 1ao8 s TYR 155 Cb -0.16 -4.03 -0.01 0.00 -0.40 0.00 0.00 41.96 37.35 1ao8 s TYR 155 CO -0.15 -3.80 -0.10 -1.21 -1.57 0.00 0.00 175.55 168.72 1ao8 s GLU 156 N 5.08 3.42 -0.48 -0.62 2.02 -0.64 -1.00 118.70 126.48 1ao8 s GLU 156 Ca 0.83 -0.65 -0.10 0.00 0.02 0.00 0.00 54.97 55.06 1ao8 s GLU 156 Cb -0.31 -2.75 0.12 0.00 0.10 0.00 0.00 34.13 31.29 1ao8 s GLU 156 CO 0.33 0.13 0.36 0.08 0.02 0.00 0.00 175.26 176.19 1ao8 s VAL 157 N 0.60 4.39 0.04 2.63 1.01 -0.83 -2.52 120.40 125.72 1ao8 s VAL 157 Ca -0.06 -1.70 -0.14 0.00 0.00 0.00 0.00 61.98 60.08 1ao8 s VAL 157 Cb -0.15 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1ao8 s VAL 157 CO 0.03 -0.77 0.44 0.26 0.00 0.00 0.00 175.10 175.06 1ao8 s TRP 158 N 1.41 3.69 0.02 5.22 0.52 -0.98 -1.90 118.94 126.92 1ao8 s TRP 158 Ca 0.05 0.99 0.02 0.00 0.02 0.00 0.00 56.10 57.18 1ao8 s TRP 158 Cb -0.27 -2.29 -0.01 0.00 -1.15 0.00 0.00 33.47 29.75 1ao8 s TRP 158 CO 0.00 0.58 -0.06 -0.65 0.02 0.00 0.00 176.95 176.84 1ao8 s GLN 159 N -1.38 0.46 0.39 4.98 -1.52 -0.03 -0.48 119.66 122.08 1ao8 s GLN 159 Ca 0.28 -0.44 -0.24 0.00 -1.95 0.00 0.00 55.36 53.01 1ao8 s GLN 159 Cb -0.16 -0.34 -0.09 0.00 -0.22 0.00 0.00 33.01 32.19 1ao8 s GLN 159 CO 0.16 0.08 1.01 0.21 -0.25 0.00 0.00 175.29 176.50 1ao8 s LYS 160 N -0.78 4.25 -0.09 2.91 2.20 -1.22 -2.05 119.74 124.96 1ao8 s LYS 160 Ca -0.04 1.41 -0.27 0.00 -0.36 0.00 0.00 55.97 56.71 1ao8 s LYS 160 Cb -0.06 -2.52 -0.24 0.00 -1.51 0.00 0.00 37.83 33.50 1ao8 s LYS 160 CO 0.00 -0.05 0.94 0.87 -0.36 0.00 0.00 175.35 176.76 1ao8 h LYS 161 N 2.51 0.03 0.00 4.03 1.57 -1.92 -3.47 116.57 119.32 1ao8 h LYS 161 Ca -0.48 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1ao8 h LYS 161 Cb 1.20 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1ao8 h LYS 161 CO 0.63 0.86 0.00 0.00 -0.57 0.00 0.00 179.45 180.36