#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 -2.15 0.46 6.98 0.00 0.50 -4.19 121.76 123.36 1ao8 s ALA 2 Ca 0.00 2.30 -0.22 0.00 0.00 0.00 0.00 51.96 54.04 1ao8 s ALA 2 Cb 0.00 -1.83 -0.08 0.00 0.00 0.00 0.00 23.12 21.22 1ao8 s ALA 2 CO 0.00 -0.94 1.11 -0.06 0.00 0.00 0.00 175.76 175.87 1ao8 s PHE 3 N 2.83 2.97 -0.27 0.00 0.40 -0.72 -1.15 117.98 122.03 1ao8 s PHE 3 Ca -0.05 1.57 -0.03 0.00 -0.60 0.00 0.00 56.93 57.82 1ao8 s PHE 3 Cb -0.11 -3.25 0.16 0.00 0.51 0.00 0.00 43.02 40.33 1ao8 s PHE 3 CO -0.19 -1.17 0.53 -1.17 0.70 0.00 0.00 175.22 173.92 1ao8 s LEU 4 N -3.11 -1.07 0.10 -0.37 2.96 -0.70 -0.99 118.68 115.49 1ao8 s LEU 4 Ca 0.64 0.80 -0.20 0.00 -0.22 0.00 0.00 54.13 55.15 1ao8 s LEU 4 Cb -0.24 1.81 0.05 0.00 0.50 0.00 0.00 46.19 48.31 1ao8 s LEU 4 CO 0.29 -0.26 0.49 -1.66 -1.32 0.00 0.00 176.35 173.89 1ao8 s TRP 5 N 2.75 -0.36 -0.13 5.38 -2.14 -0.95 -4.29 118.94 119.21 1ao8 s TRP 5 Ca 0.13 0.23 -0.02 0.00 2.66 0.00 0.00 56.10 59.10 1ao8 s TRP 5 Cb -0.14 0.35 -0.03 0.00 -3.10 0.00 0.00 33.47 30.55 1ao8 s TRP 5 CO -0.18 -0.70 -0.05 0.00 -2.66 0.00 0.00 176.95 173.35 1ao8 s ALA 6 N -3.17 2.97 0.24 2.67 0.00 -1.26 -2.27 121.76 120.93 1ao8 s ALA 6 Ca -0.01 -0.84 -0.05 0.00 0.00 0.00 0.00 51.96 51.05 1ao8 s ALA 6 Cb 0.00 -1.43 -0.02 0.00 0.00 0.00 0.00 23.12 21.67 1ao8 s ALA 6 CO -0.08 0.33 0.30 1.14 0.00 0.00 0.00 175.76 177.45 1ao8 s GLN 7 N -0.00 1.42 0.19 0.00 -2.07 -1.00 -4.48 119.66 113.72 1ao8 s GLN 7 Ca 0.00 -1.51 0.01 0.00 -1.82 0.00 0.00 55.36 52.05 1ao8 s GLN 7 Cb -0.13 0.37 0.01 0.00 -1.09 0.00 0.00 33.01 32.17 1ao8 s GLN 7 CO 0.03 -0.53 0.12 -0.40 -1.32 0.00 0.00 175.29 173.18 1ao8 n ASP 8 N -0.46 1.80 0.25 12.60 5.68 -1.23 -1.95 116.55 133.23 1ao8 n ASP 8 Ca 0.01 -1.70 0.08 0.00 -0.50 0.00 0.00 54.79 52.67 1ao8 n ASP 8 Cb 0.64 0.01 0.61 0.00 -1.14 0.00 0.00 41.12 41.24 1ao8 n ASP 8 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1ao8 h ARG 9 N 0.00 0.00 -0.26 0.11 0.11 -1.78 -2.27 114.38 110.29 1ao8 h ARG 9 Ca -0.13 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.76 1ao8 h ARG 9 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 1ao8 h ARG 9 CO 0.21 0.10 -0.57 -0.44 0.10 0.00 0.00 179.97 179.37 1ao8 h ASP 10 N 0.00 0.94 0.00 0.08 3.32 -1.89 -3.47 116.42 115.39 1ao8 h ASP 10 Ca -0.00 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.50 1ao8 h ASP 10 Cb 0.18 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1ao8 h ASP 10 CO 0.01 1.32 0.00 0.61 -1.72 0.00 0.00 179.24 179.46 1ao8 n GLY 11 N 0.43 1.77 3.81 2.75 0.00 -0.85 -5.07 105.19 108.04 1ao8 n GLY 11 Ca -0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.59 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 4.41 -0.07 0.99 2.96 -1.26 -2.83 118.68 122.88 1ao8 s LEU 12 Ca 0.00 0.83 0.05 0.00 -0.22 0.00 0.00 54.13 54.79 1ao8 s LEU 12 Cb 0.00 -2.51 -0.08 0.00 0.50 0.00 0.00 46.19 44.10 1ao8 s LEU 12 CO 0.00 0.27 0.00 2.30 -1.32 0.00 0.00 176.35 177.60 1ao8 n ILE 13 N 2.29 0.46 -3.95 6.68 -5.35 -0.57 -3.54 119.36 115.37 1ao8 n ILE 13 Ca -0.14 -0.26 -0.12 0.00 -0.27 0.00 0.00 62.75 61.97 1ao8 n ILE 13 Cb 0.52 -0.82 -0.01 0.00 -1.74 0.00 0.00 39.64 37.59 1ao8 n ILE 13 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ao8 s GLY 14 N -4.02 0.94 -0.30 3.28 0.00 -0.96 -4.89 107.32 101.36 1ao8 s GLY 14 Ca -0.05 -1.14 -0.10 0.00 0.00 0.00 0.00 44.72 43.44 1ao8 s GLY 14 CO 0.25 -0.66 0.73 1.25 0.00 0.00 0.00 173.10 174.67 1ao8 s LYS 15 N -2.75 0.50 -1.68 2.90 2.20 0.47 -3.33 119.74 118.05 1ao8 s LYS 15 Ca 0.23 1.19 0.00 0.00 -0.36 0.00 0.00 55.97 57.03 1ao8 s LYS 15 Cb -0.03 0.71 0.00 0.00 -1.51 0.00 0.00 37.83 37.00 1ao8 s LYS 15 CO 0.16 -0.24 0.00 -0.25 -0.36 0.00 0.00 175.35 174.66 1ao8 n ASP 16 N 5.34 -5.15 0.00 1.43 8.00 -1.26 -1.73 116.55 123.18 1ao8 n ASP 16 Ca -0.10 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.58 1ao8 n ASP 16 Cb 0.50 -4.40 0.00 0.00 -0.02 0.00 0.00 41.12 37.20 1ao8 n ASP 16 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ao8 n GLY 17 N -0.76 2.50 4.00 0.44 0.00 -1.26 -4.99 105.19 105.12 1ao8 n GLY 17 Ca -0.21 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.41 2.17 0.36 1.61 -3.43 -0.71 -4.71 115.29 110.18 1ao8 s HIS 18 Ca 0.00 -0.30 -0.07 0.00 -0.80 0.00 0.00 55.06 53.89 1ao8 s HIS 18 Cb 0.00 -2.65 -0.05 0.00 -1.43 0.00 0.00 32.58 28.44 1ao8 s HIS 18 CO 0.00 -1.11 0.67 -0.51 -2.00 0.00 0.00 174.74 171.79 1ao8 s LEU 19 N -4.79 3.92 0.01 5.38 1.43 -1.26 -0.39 118.68 122.98 1ao8 s LEU 19 Ca 0.61 0.90 -0.16 0.00 -1.03 0.00 0.00 54.13 54.44 1ao8 s LEU 19 Cb -0.08 -3.76 -0.35 0.00 0.03 0.00 0.00 46.19 42.04 1ao8 s LEU 19 CO 0.39 -0.32 0.96 1.55 0.23 0.00 0.00 176.35 179.16 1ao8 h PRO 20 N 1.31 0.51 0.00 1.29 0.13 -1.89 -3.46 132.00 129.89 1ao8 h PRO 20 Ca -0.47 -0.87 -0.21 0.00 -0.87 0.00 0.00 66.00 63.58 1ao8 h PRO 20 Cb 1.19 0.32 0.03 0.00 0.13 0.00 0.00 31.00 32.67 1ao8 h PRO 20 CO 0.64 1.42 0.02 -2.67 -0.23 0.00 0.00 178.00 177.18 1ao8 n TRP 21 N -3.75 -2.98 -3.39 1.56 2.14 -1.26 -5.10 117.44 104.66 1ao8 n TRP 21 Ca -0.17 -0.84 -0.22 0.00 2.07 0.00 0.00 57.50 58.34 1ao8 n TRP 21 Cb 1.08 -0.29 -0.09 0.00 -0.81 0.00 0.00 31.31 31.20 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 -0.95 0.16 -0.27 -2.67 2.46 -1.26 -5.10 115.29 107.65 1ao8 s HIS 22 Ca 0.28 -1.22 -0.02 0.00 0.47 0.00 0.00 55.06 54.57 1ao8 s HIS 22 Cb -0.02 -0.62 0.03 0.00 -0.13 0.00 0.00 32.58 31.84 1ao8 s HIS 22 CO 0.18 -0.91 -0.03 -1.17 -2.47 0.00 0.00 174.74 170.34 1ao8 s LEU 23 N 1.20 3.49 0.18 8.88 2.96 -1.26 -4.97 118.68 129.17 1ao8 s LEU 23 Ca 0.18 -0.99 0.09 0.00 -0.22 0.00 0.00 54.13 53.20 1ao8 s LEU 23 Cb -0.18 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.79 1ao8 s LEU 23 CO -0.02 -0.18 1.38 1.55 -1.32 0.00 0.00 176.35 177.77 1ao8 h PRO 24 N 8.03 0.00 -0.26 0.98 0.13 -1.99 -3.24 132.00 135.65 1ao8 h PRO 24 Ca -0.29 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.77 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 0.82 -0.17 0.22 -0.23 0.00 0.00 178.00 179.21 1ao8 h ASP 25 N 0.00 0.44 0.34 1.44 3.58 -1.98 -2.46 116.42 117.78 1ao8 h ASP 25 Ca -0.01 -0.12 -0.13 0.00 0.42 0.00 0.00 57.03 57.19 1ao8 h ASP 25 Cb 1.55 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 42.47 1ao8 h ASP 25 CO 0.11 0.63 -0.54 -0.78 -2.88 0.00 0.00 179.24 175.79 1ao8 h ASP 26 N 0.42 0.23 -0.32 2.28 3.58 -1.99 -2.90 116.42 117.72 1ao8 h ASP 26 Ca 0.07 -0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.36 1ao8 h ASP 26 Cb 0.54 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.50 1ao8 h ASP 26 CO 0.03 0.73 0.07 -0.07 -2.88 0.00 0.00 179.24 177.12 1ao8 h LEU 27 N 0.17 0.56 -0.71 2.28 3.38 -1.51 -1.54 115.31 117.94 1ao8 h LEU 27 Ca 0.00 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.80 1ao8 h LEU 27 Cb 1.00 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1ao8 h LEU 27 CO 0.08 0.59 0.09 0.45 0.09 0.00 0.00 178.44 179.73 1ao8 h HIS 28 N 0.59 1.15 -0.10 1.13 3.86 -1.37 -1.87 115.15 118.55 1ao8 h HIS 28 Ca 0.13 -0.16 -0.13 0.00 -1.16 0.00 0.00 60.37 59.05 1ao8 h HIS 28 Cb 0.27 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1ao8 h HIS 28 CO 0.01 0.97 -0.52 -0.92 0.86 0.00 0.00 177.93 178.33 1ao8 h TYR 29 N 1.00 0.33 -0.28 2.45 5.03 -1.39 -1.94 116.97 122.18 1ao8 h TYR 29 Ca 0.20 -0.11 -0.11 0.00 2.58 0.00 0.00 58.73 61.28 1ao8 h TYR 29 Cb 0.45 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.66 1ao8 h TYR 29 CO 0.03 0.73 -0.31 0.35 -1.32 0.00 0.00 178.16 177.65 1ao8 h PHE 30 N 0.21 0.66 0.00 -3.82 3.57 -0.92 -2.06 116.94 114.58 1ao8 h PHE 30 Ca 0.01 -0.16 -0.17 0.00 3.53 0.00 0.00 57.97 61.17 1ao8 h PHE 30 Cb 0.99 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.56 1ao8 h PHE 30 CO 0.02 0.82 -0.81 -0.09 -2.23 0.00 0.00 178.31 176.02 1ao8 h ARG 31 N 0.49 0.02 -0.02 1.11 2.43 -1.17 -3.14 114.38 114.10 1ao8 h ARG 31 Ca 0.06 -0.02 -0.14 0.00 -0.81 0.00 0.00 59.98 59.07 1ao8 h ARG 31 Cb 0.78 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 1ao8 h ARG 31 CO 0.06 0.81 -0.63 0.00 -1.51 0.00 0.00 179.97 178.71 1ao8 h ALA 32 N 1.18 0.92 -0.95 2.80 0.00 -1.10 -2.29 119.26 119.83 1ao8 h ALA 32 Ca -0.01 -0.56 -0.62 0.00 0.00 0.00 0.00 54.91 53.72 1ao8 h ALA 32 Cb 1.42 -0.09 -0.28 0.00 0.00 0.00 0.00 17.79 18.84 1ao8 h ALA 32 CO 0.11 0.77 0.79 1.04 0.00 0.00 0.00 179.25 181.96 1ao8 n GLN 33 N -3.82 2.52 0.00 0.00 1.13 -0.80 -4.36 117.38 112.06 1ao8 n GLN 33 Ca -0.02 -3.06 0.00 0.00 -1.94 0.00 0.00 57.00 51.98 1ao8 n GLN 33 Cb 0.62 -2.20 0.00 0.00 0.11 0.00 0.00 30.24 28.77 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 -0.84 0.00 -1.65 5.09 -2.24 -1.16 -4.93 114.28 108.55 1ao8 n THR 34 Ca 0.59 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.94 1ao8 n THR 34 Cb 0.83 -0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.92 1ao8 n THR 34 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1ao8 n VAL 35 N -1.97 0.70 -0.34 2.28 0.24 -0.87 -1.09 118.33 117.28 1ao8 n VAL 35 Ca 0.00 -0.19 0.00 0.00 -2.04 0.00 0.00 64.34 62.11 1ao8 n VAL 35 Cb 0.00 -2.33 0.00 0.00 -1.47 0.00 0.00 33.84 30.04 1ao8 n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ao8 n GLY 36 N 4.75 0.82 0.75 7.63 0.00 -1.26 -5.00 105.19 112.88 1ao8 n GLY 36 Ca 0.22 -0.13 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.34 0.11 -3.78 1.61 4.01 -0.25 -4.48 118.16 113.05 1ao8 n LYS 37 Ca 0.00 -0.74 -0.37 0.00 -0.51 0.00 0.00 58.31 56.69 1ao8 n LYS 37 Cb 0.00 0.63 -0.13 0.00 -0.51 0.00 0.00 35.03 35.03 1ao8 n LYS 37 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1ao8 s ILE 38 N -2.36 4.08 -0.39 -0.18 1.01 -0.87 -3.30 121.20 119.19 1ao8 s ILE 38 Ca 0.09 -0.37 -0.19 0.00 0.00 0.00 0.00 60.65 60.17 1ao8 s ILE 38 Cb 0.00 -2.96 0.01 0.00 0.01 0.00 0.00 42.46 39.52 1ao8 s ILE 38 CO 0.06 0.27 0.58 -0.32 0.00 0.00 0.00 174.94 175.53 1ao8 s MET 39 N 1.56 3.47 -0.15 2.79 1.75 -0.56 -2.29 119.30 125.88 1ao8 s MET 39 Ca 0.05 -0.24 -0.15 0.00 -1.25 0.00 0.00 55.69 54.10 1ao8 s MET 39 Cb -0.16 -3.87 -0.05 0.00 2.84 0.00 0.00 34.83 33.60 1ao8 s MET 39 CO 0.02 -0.81 0.34 0.08 -0.65 0.00 0.00 175.02 174.01 1ao8 s VAL 40 N 2.58 5.27 0.09 10.11 1.01 -0.72 -1.68 120.40 137.07 1ao8 s VAL 40 Ca 0.21 0.66 -0.09 0.00 0.00 0.00 0.00 61.98 62.76 1ao8 s VAL 40 Cb -0.15 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 1ao8 s VAL 40 CO 0.16 0.38 0.20 0.68 0.00 0.00 0.00 175.10 176.51 1ao8 s VAL 41 N 0.48 0.14 0.00 2.92 -7.23 -0.62 -2.34 120.40 113.75 1ao8 s VAL 41 Ca 0.19 -1.18 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 1ao8 s VAL 41 Cb -0.14 -1.36 0.00 0.00 0.56 0.00 0.00 36.38 35.44 1ao8 s VAL 41 CO 0.06 -0.63 0.00 0.61 -0.31 0.00 0.00 175.10 174.83 1ao8 n GLY 42 N -0.07 0.63 0.12 2.32 0.00 -0.05 -2.37 105.19 105.77 1ao8 n GLY 42 Ca -0.15 -1.89 -0.18 0.00 0.00 0.00 0.00 46.02 43.80 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 0.31 -0.01 1.61 2.43 -1.91 -2.14 114.38 114.66 1ao8 h ARG 43 Ca 0.00 -0.53 -0.09 0.00 -0.81 0.00 0.00 59.98 58.55 1ao8 h ARG 43 Cb 0.00 0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1ao8 h ARG 43 CO 0.00 1.21 -0.43 -0.09 -1.51 0.00 0.00 179.97 179.15 1ao8 h ARG 44 N 0.08 0.02 0.05 0.20 9.65 -1.97 -2.61 114.38 119.81 1ao8 h ARG 44 Ca -0.21 -0.01 -0.28 0.00 -1.10 0.00 0.00 59.98 58.39 1ao8 h ARG 44 Cb 2.03 -0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 30.58 1ao8 h ARG 44 CO 0.20 0.45 -1.45 1.15 2.80 0.00 0.00 179.97 183.12 1ao8 h THR 45 N 0.01 1.21 -0.79 0.20 2.02 -1.91 -3.16 112.91 110.49 1ao8 h THR 45 Ca -0.00 -2.93 -0.04 0.00 0.77 0.00 0.00 66.41 64.20 1ao8 h THR 45 Cb 0.77 2.68 -0.04 0.00 -1.74 0.00 0.00 68.15 69.83 1ao8 h THR 45 CO 0.06 0.77 0.32 0.22 0.37 0.00 0.00 175.52 177.26 1ao8 h TYR 46 N 0.03 1.20 0.00 3.16 3.20 -1.22 -2.03 116.97 121.31 1ao8 h TYR 46 Ca -0.19 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.53 1ao8 h TYR 46 Cb 1.95 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 39.85 1ao8 h TYR 46 CO 0.03 0.90 -0.26 0.93 -1.64 0.00 0.00 178.16 178.12 1ao8 h GLU 47 N 1.15 0.00 0.00 1.82 5.08 -1.57 -3.00 114.58 118.05 1ao8 h GLU 47 Ca 0.26 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 1ao8 h GLU 47 Cb 0.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1ao8 h GLU 47 CO -0.02 0.26 -0.11 1.03 -1.00 0.00 0.00 179.01 179.17 1ao8 h SER 48 N 0.00 0.00 -4.16 1.42 0.87 -1.33 -3.43 113.55 106.92 1ao8 h SER 48 Ca -0.00 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.04 1ao8 h SER 48 Cb 0.90 0.00 0.12 0.00 -0.44 0.00 0.00 62.40 62.98 1ao8 h SER 48 CO 0.03 0.11 0.40 -0.36 -0.53 0.00 0.00 176.83 176.49 1ao8 s PHE 49 N -4.65 2.38 -0.09 2.24 0.08 -1.14 -4.90 117.98 111.90 1ao8 s PHE 49 Ca -0.04 1.56 -0.01 0.00 0.12 0.00 0.00 56.93 58.57 1ao8 s PHE 49 Cb 0.15 -3.34 -0.00 0.00 -0.57 0.00 0.00 43.02 39.26 1ao8 s PHE 49 CO 0.65 -2.10 0.03 -1.00 -0.10 0.00 0.00 175.22 172.70 1ao8 h PRO 50 N 0.18 -0.02 -4.34 0.24 0.13 -1.89 -3.43 132.00 122.87 1ao8 h PRO 50 Ca -0.48 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 63.93 1ao8 h PRO 50 Cb 1.27 0.01 -0.29 0.00 0.13 0.00 0.00 31.00 32.12 1ao8 h PRO 50 CO 0.53 -0.01 -0.41 0.21 -0.23 0.00 0.00 178.00 178.08 1ao8 s LYS 51 N -1.61 2.50 -0.10 0.86 2.20 -1.26 -5.07 119.74 117.26 1ao8 s LYS 51 Ca -0.00 -1.68 -0.10 0.00 -0.36 0.00 0.00 55.97 53.83 1ao8 s LYS 51 Cb 0.00 -3.88 -0.05 0.00 -1.51 0.00 0.00 37.83 32.39 1ao8 s LYS 51 CO 0.01 -1.13 0.21 1.03 -0.36 0.00 0.00 175.35 175.12 1ao8 s ARG 52 N 1.38 3.66 0.56 4.03 0.52 -1.26 -4.01 118.95 123.82 1ao8 s ARG 52 Ca 0.05 0.01 -0.08 0.00 -0.52 0.00 0.00 55.73 55.19 1ao8 s ARG 52 Cb -0.25 -3.23 0.12 0.00 0.52 0.00 0.00 34.95 32.11 1ao8 s ARG 52 CO -0.00 0.69 0.76 -0.35 0.02 0.00 0.00 175.30 176.42 1ao8 n PRO 53 N 2.16 -0.57 -3.61 3.54 -0.04 -1.26 -5.06 135.00 130.16 1ao8 n PRO 53 Ca -0.18 -1.32 -0.37 0.00 -0.04 0.00 0.00 63.50 61.59 1ao8 n PRO 53 Cb 0.54 -0.73 -0.09 0.00 -0.04 0.00 0.00 33.50 33.18 1ao8 n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ao8 s LEU 54 N 0.00 4.16 0.83 1.53 1.43 -1.26 -5.08 118.68 120.30 1ao8 s LEU 54 Ca 0.44 0.26 -0.12 0.00 -1.03 0.00 0.00 54.13 53.67 1ao8 s LEU 54 Cb -0.01 -2.21 0.10 0.00 0.03 0.00 0.00 46.19 44.09 1ao8 s LEU 54 CO 0.31 0.06 1.19 -2.16 0.23 0.00 0.00 176.35 175.98 1ao8 s PRO 55 N 0.91 1.76 -1.78 1.29 0.04 -1.26 -4.14 135.00 131.82 1ao8 s PRO 55 Ca 0.11 0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.23 1ao8 s PRO 55 Cb -0.13 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1ao8 s PRO 55 CO 0.04 -1.73 0.00 0.39 0.04 0.00 0.00 177.00 175.74 1ao8 n GLU 56 N -3.40 -1.51 -3.63 4.56 1.02 -1.26 -4.92 120.64 111.50 1ao8 n GLU 56 Ca 0.09 1.01 -0.03 0.00 -0.02 0.00 0.00 57.16 58.21 1ao8 n GLU 56 Cb 0.61 -5.53 -0.02 0.00 -0.02 0.00 0.00 31.44 26.47 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 -4.64 0.10 0.01 3.49 1.70 -1.26 -4.12 118.95 114.23 1ao8 s ARG 57 Ca 0.00 -0.03 -0.16 0.00 -0.47 0.00 0.00 55.73 55.07 1ao8 s ARG 57 Cb 0.00 0.05 -0.06 0.00 -0.57 0.00 0.00 34.95 34.37 1ao8 s ARG 57 CO 0.00 -0.04 0.46 0.99 -1.08 0.00 0.00 175.30 175.63 1ao8 s THR 58 N -1.96 4.97 -0.09 4.99 2.01 -1.21 -4.86 115.64 119.48 1ao8 s THR 58 Ca 0.11 0.96 0.01 0.00 0.31 0.00 0.00 61.69 63.07 1ao8 s THR 58 Cb -0.01 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 1ao8 s THR 58 CO -0.04 0.54 -0.10 0.20 -0.69 0.00 0.00 174.62 174.53 1ao8 s ASN 59 N -0.86 4.30 -0.10 3.53 0.01 -1.26 -1.50 114.94 119.06 1ao8 s ASN 59 Ca 0.25 -0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.23 1ao8 s ASN 59 Cb -0.17 -1.29 0.02 0.00 0.41 0.00 0.00 41.25 40.22 1ao8 s ASN 59 CO 0.15 0.27 -0.09 -0.69 -1.51 0.00 0.00 177.10 175.23 1ao8 s VAL 60 N -0.28 1.04 -0.25 1.60 1.01 -0.68 -2.01 120.40 120.83 1ao8 s VAL 60 Ca 0.03 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 61.60 1ao8 s VAL 60 Cb -0.13 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.19 1ao8 s VAL 60 CO 0.03 0.36 0.10 -0.69 0.00 0.00 0.00 175.10 174.89 1ao8 s VAL 61 N 1.43 4.60 -0.73 2.92 1.01 -0.78 -1.60 120.40 127.25 1ao8 s VAL 61 Ca -0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1ao8 s VAL 61 Cb -0.13 -3.15 0.19 0.00 0.00 0.00 0.00 36.38 33.28 1ao8 s VAL 61 CO -0.05 0.33 0.58 -0.22 0.00 0.00 0.00 175.10 175.74 1ao8 s LEU 62 N 1.48 5.39 -0.01 3.92 2.96 -1.00 -1.62 118.68 129.80 1ao8 s LEU 62 Ca 0.06 -3.21 0.06 0.00 -0.22 0.00 0.00 54.13 50.82 1ao8 s LEU 62 Cb -0.15 -1.88 -0.08 0.00 0.50 0.00 0.00 46.19 44.58 1ao8 s LEU 62 CO 0.05 -0.30 0.16 1.07 -1.32 0.00 0.00 176.35 176.02 1ao8 n THR 63 N 3.01 0.00 -3.37 3.68 5.66 -1.26 -4.58 114.28 117.43 1ao8 n THR 63 Ca 0.13 -0.21 -0.24 0.00 -3.05 0.00 0.00 64.05 60.69 1ao8 n THR 63 Cb 0.38 0.58 0.06 0.00 -1.55 0.00 0.00 70.33 69.80 1ao8 n THR 63 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1ao8 n HIS 64 N -1.51 -2.48 -3.82 1.09 8.25 -1.26 -4.97 115.22 110.52 1ao8 n HIS 64 Ca -0.00 0.81 -0.29 0.00 -0.26 0.00 0.00 57.72 57.97 1ao8 n HIS 64 Cb 0.13 -4.76 -0.16 0.00 1.12 0.00 0.00 29.99 26.32 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 -6.08 1.03 -0.96 -0.41 0.74 -1.26 -5.02 119.66 107.70 1ao8 s GLN 65 Ca 0.47 -0.93 -0.15 0.00 0.05 0.00 0.00 55.36 54.80 1ao8 s GLN 65 Cb -0.21 -2.30 -0.09 0.00 1.10 0.00 0.00 33.01 31.51 1ao8 s GLN 65 CO 0.59 -0.77 2.09 0.39 -0.55 0.00 0.00 175.29 177.03 1ao8 n GLU 66 N 4.80 2.00 0.00 1.67 1.02 -1.26 -3.32 120.64 125.56 1ao8 n GLU 66 Ca -0.06 -1.83 0.00 0.00 -0.02 0.00 0.00 57.16 55.25 1ao8 n GLU 66 Cb 0.44 -2.80 0.00 0.00 -0.02 0.00 0.00 31.44 29.06 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 5.95 0.00 -4.62 1.62 8.00 -1.26 -5.07 116.55 121.17 1ao8 n ASP 67 Ca 0.50 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.57 1ao8 n ASP 67 Cb 0.30 0.31 -0.03 0.00 -0.02 0.00 0.00 41.12 41.68 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1ao8 s TYR 68 N -1.72 1.85 0.04 1.24 5.04 -1.21 -4.98 117.35 117.61 1ao8 s TYR 68 Ca 0.00 0.49 0.01 0.00 -2.44 0.00 0.00 57.07 55.13 1ao8 s TYR 68 Cb 0.00 -4.05 -0.04 0.00 0.35 0.00 0.00 41.96 38.23 1ao8 s TYR 68 CO 0.00 -3.26 0.12 -0.65 -1.34 0.00 0.00 175.55 170.42 1ao8 s GLN 69 N 5.14 3.12 -0.16 4.97 -0.21 -1.26 -5.04 119.66 126.22 1ao8 s GLN 69 Ca 0.78 -0.53 -0.04 0.00 0.02 0.00 0.00 55.36 55.59 1ao8 s GLN 69 Cb -0.26 -2.88 0.07 0.00 1.00 0.00 0.00 33.01 30.94 1ao8 s GLN 69 CO 0.32 0.61 0.17 0.00 -2.12 0.00 0.00 175.29 174.27 1ao8 s ALA 70 N -1.35 -0.04 -0.03 6.09 0.00 -1.26 -5.13 121.76 120.04 1ao8 s ALA 70 Ca 0.28 0.16 -0.28 0.00 0.00 0.00 0.00 51.96 52.13 1ao8 s ALA 70 Cb -0.12 -1.11 -0.03 0.00 0.00 0.00 0.00 23.12 21.86 1ao8 s ALA 70 CO 0.21 -1.04 0.90 -0.65 0.00 0.00 0.00 175.76 175.17 1ao8 s GLN 71 N 2.26 4.51 0.00 0.00 1.11 -1.26 -3.56 119.66 122.72 1ao8 s GLN 71 Ca 0.05 1.25 0.00 0.00 0.01 0.00 0.00 55.36 56.67 1ao8 s GLN 71 Cb -0.15 -3.47 0.00 0.00 -1.01 0.00 0.00 33.01 28.39 1ao8 s GLN 71 CO -0.10 -0.04 0.00 0.41 0.01 0.00 0.00 175.29 175.57 1ao8 n GLY 72 N 2.99 3.00 3.90 3.09 0.00 -1.26 -4.66 105.19 112.25 1ao8 n GLY 72 Ca 0.04 -0.56 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 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 -1.67 3.89 -0.23 4.61 0.00 -1.23 -4.89 121.76 122.24 1ao8 s ALA 73 Ca 0.00 -0.96 -0.20 0.00 0.00 0.00 0.00 51.96 50.80 1ao8 s ALA 73 Cb 0.00 -1.71 -0.02 0.00 0.00 0.00 0.00 23.12 21.38 1ao8 s ALA 73 CO 0.00 0.70 0.60 0.08 0.00 0.00 0.00 175.76 177.13 1ao8 s VAL 74 N -1.59 5.02 -0.26 0.00 1.01 -0.85 -4.78 120.40 118.95 1ao8 s VAL 74 Ca 0.34 1.08 -0.10 0.00 0.00 0.00 0.00 61.98 63.29 1ao8 s VAL 74 Cb -0.12 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 1ao8 s VAL 74 CO 0.27 0.08 0.16 -0.69 0.00 0.00 0.00 175.10 174.91 1ao8 s VAL 75 N 2.22 5.16 0.37 2.92 1.01 -1.26 -1.87 120.40 128.95 1ao8 s VAL 75 Ca 0.26 0.12 0.08 0.00 0.00 0.00 0.00 61.98 62.43 1ao8 s VAL 75 Cb -0.16 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 1ao8 s VAL 75 CO 0.09 0.30 0.14 0.68 0.00 0.00 0.00 175.10 176.31 1ao8 s VAL 76 N 1.48 2.71 -0.01 2.92 -7.23 -0.64 -4.92 120.40 114.71 1ao8 s VAL 76 Ca 0.07 -1.73 0.20 0.00 -1.81 0.00 0.00 61.98 58.71 1ao8 s VAL 76 Cb -0.15 -2.95 0.34 0.00 0.56 0.00 0.00 36.38 34.18 1ao8 s VAL 76 CO 0.08 -0.12 1.13 1.41 -0.31 0.00 0.00 175.10 177.29 1ao8 n HIS 77 N -1.16 0.01 -3.66 2.82 8.25 -1.26 -4.12 115.22 116.11 1ao8 n HIS 77 Ca -0.02 -0.54 -0.08 0.00 -0.26 0.00 0.00 57.72 56.81 1ao8 n HIS 77 Cb 0.62 -0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.65 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 -1.82 -0.75 0.23 0.41 -1.08 -1.26 -4.79 116.67 107.61 1ao8 s ASP 78 Ca 0.26 1.25 -0.05 0.00 -0.52 0.00 0.00 52.55 53.49 1ao8 s ASP 78 Cb 0.31 1.18 0.23 0.00 -1.46 0.00 0.00 42.92 43.18 1ao8 s ASP 78 CO -0.13 -0.22 1.77 0.58 0.52 0.00 0.00 175.17 177.69 1ao8 h VAL 79 N 5.32 1.25 -0.46 1.11 2.07 -2.00 -2.31 116.25 121.23 1ao8 h VAL 79 Ca -0.32 -0.89 -0.04 0.00 0.82 0.00 0.00 66.70 66.27 1ao8 h VAL 79 Cb 1.20 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1ao8 h VAL 79 CO 0.21 0.34 0.11 0.00 0.02 0.00 0.00 177.57 178.25 1ao8 h ALA 80 N 1.20 1.32 -0.58 1.67 0.00 -2.00 -2.41 119.26 118.47 1ao8 h ALA 80 Ca 0.22 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1ao8 h ALA 80 Cb 0.32 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1ao8 h ALA 80 CO -0.00 0.48 0.06 0.00 0.00 0.00 0.00 179.25 179.79 1ao8 h ALA 81 N 1.44 0.78 0.00 0.00 0.00 -1.84 -0.32 119.26 119.32 1ao8 h ALA 81 Ca 0.15 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1ao8 h ALA 81 Cb 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ao8 h ALA 81 CO -0.00 0.56 -0.18 0.28 0.00 0.00 0.00 179.25 179.90 1ao8 h VAL 82 N 0.89 1.11 0.11 0.00 2.07 -1.05 -1.48 116.25 117.90 1ao8 h VAL 82 Ca 0.17 -0.64 -0.16 0.00 0.82 0.00 0.00 66.70 66.90 1ao8 h VAL 82 Cb 0.47 1.34 0.02 0.00 -1.52 0.00 0.00 31.29 31.60 1ao8 h VAL 82 CO 0.02 0.18 -0.68 -0.26 0.02 0.00 0.00 177.57 176.84 1ao8 h PHE 83 N 0.00 0.47 0.00 1.57 0.04 -0.99 -3.27 116.94 114.76 1ao8 h PHE 83 Ca -0.00 -0.34 -0.02 0.00 2.80 0.00 0.00 57.97 60.41 1ao8 h PHE 83 Cb 0.33 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.46 1ao8 h PHE 83 CO 0.00 1.25 -0.08 0.00 -0.60 0.00 0.00 178.31 178.89 1ao8 h ALA 84 N 0.09 1.72 0.28 2.45 0.00 -0.85 -0.76 119.26 122.19 1ao8 h ALA 84 Ca -0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1ao8 h ALA 84 Cb 1.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1ao8 h ALA 84 CO 0.13 0.09 -0.14 -0.92 0.00 0.00 0.00 179.25 178.42 1ao8 h TYR 85 N 0.00 -0.35 0.00 0.00 3.20 -1.32 -2.19 116.97 116.31 1ao8 h TYR 85 Ca -0.00 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1ao8 h TYR 85 Cb 0.15 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.53 1ao8 h TYR 85 CO 0.00 -0.22 -0.04 0.00 -1.64 0.00 0.00 178.16 176.26 1ao8 h ALA 86 N -1.79 1.88 0.00 1.82 0.00 -1.60 -0.85 119.26 118.71 1ao8 h ALA 86 Ca -0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1ao8 h ALA 86 Cb 0.29 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ao8 h ALA 86 CO 0.06 0.05 -0.10 -0.22 0.00 0.00 0.00 179.25 179.04 1ao8 h LYS 87 N 0.00 0.00 0.00 0.00 3.64 -1.01 -1.91 116.57 117.29 1ao8 h LYS 87 Ca -0.00 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.16 1ao8 h LYS 87 Cb 0.07 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.86 1ao8 h LYS 87 CO 0.00 0.10 -1.04 1.96 -2.27 0.00 0.00 179.45 178.21 1ao8 h GLN 88 N 0.00 0.01 -2.92 1.90 4.20 -0.50 -3.38 115.11 114.42 1ao8 h GLN 88 Ca -0.00 -0.01 -0.65 0.00 0.06 0.00 0.00 58.65 58.05 1ao8 h GLN 88 Cb 0.20 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.59 1ao8 h GLN 88 CO 0.01 0.98 -0.38 0.72 -0.67 0.00 0.00 178.83 179.50 1ao8 n HIS 89 N -3.34 3.57 -0.37 2.96 8.25 -0.72 -4.91 115.22 120.65 1ao8 n HIS 89 Ca -0.01 -4.15 0.33 0.00 -0.26 0.00 0.00 57.72 53.64 1ao8 n HIS 89 Cb 0.95 -0.78 0.68 0.00 1.12 0.00 0.00 29.99 31.96 1ao8 n HIS 89 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ao8 h PRO 90 N 5.25 0.12 -0.18 -0.41 0.10 -1.74 0.49 132.00 135.63 1ao8 h PRO 90 Ca 0.17 -0.01 -0.04 0.00 0.10 0.00 0.00 66.00 66.22 1ao8 h PRO 90 Cb 0.74 -0.03 -0.01 0.00 0.10 0.00 0.00 31.00 31.80 1ao8 h PRO 90 CO 0.82 0.08 -0.08 0.22 0.10 0.00 0.00 178.00 179.14 1ao8 h ASP 91 N 0.12 0.26 -3.24 -2.05 1.82 -1.91 -3.41 116.42 108.02 1ao8 h ASP 91 Ca 0.63 -0.05 -0.58 0.00 -0.39 0.00 0.00 57.03 56.65 1ao8 h ASP 91 Cb 2.20 -0.07 -0.05 0.00 0.68 0.00 0.00 39.33 42.09 1ao8 h ASP 91 CO -0.14 0.38 -0.07 -1.10 -1.61 0.00 0.00 179.24 176.70 1ao8 s GLN 92 N -4.83 4.22 0.27 0.28 -0.21 0.17 -4.93 119.66 114.62 1ao8 s GLN 92 Ca -0.06 0.65 0.04 0.00 0.02 0.00 0.00 55.36 56.01 1ao8 s GLN 92 Cb 0.16 -3.30 0.04 0.00 1.00 0.00 0.00 33.01 30.91 1ao8 s GLN 92 CO 0.73 0.48 0.37 0.39 -2.12 0.00 0.00 175.29 175.14 1ao8 n GLU 93 N 2.39 0.81 -3.86 2.91 1.02 -1.26 -4.88 120.64 117.77 1ao8 n GLU 93 Ca -0.09 -1.42 -0.29 0.00 -0.02 0.00 0.00 57.16 55.34 1ao8 n GLU 93 Cb 0.51 -0.11 -0.16 0.00 -0.02 0.00 0.00 31.44 31.66 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 1.79 0.06 -4.62 2.96 -1.26 -2.04 118.68 115.57 1ao8 s LEU 94 Ca 0.28 -0.86 0.05 0.00 -0.22 0.00 0.00 54.13 53.38 1ao8 s LEU 94 Cb -0.02 -0.91 -0.04 0.00 0.50 0.00 0.00 46.19 45.72 1ao8 s LEU 94 CO 0.18 -0.23 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.24 1ao8 s VAL 95 N 1.62 3.73 -0.16 1.68 1.01 -0.97 -0.37 120.40 126.94 1ao8 s VAL 95 Ca -0.02 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 1ao8 s VAL 95 Cb -0.17 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.50 1ao8 s VAL 95 CO -0.07 0.23 -0.12 -0.63 0.00 0.00 0.00 175.10 174.51 1ao8 s ILE 96 N -1.16 2.95 -0.12 2.22 -1.09 -0.30 -1.75 121.20 121.94 1ao8 s ILE 96 Ca 0.21 -0.67 0.13 0.00 -2.23 0.00 0.00 60.65 58.09 1ao8 s ILE 96 Cb -0.11 -2.27 -0.18 0.00 -1.58 0.00 0.00 42.46 38.31 1ao8 s ILE 96 CO 0.13 0.50 0.10 0.00 -1.23 0.00 0.00 174.94 174.43 1ao8 n ALA 97 N 4.08 1.81 0.00 9.38 0.00 -0.99 -1.73 120.51 133.06 1ao8 n ALA 97 Ca -0.19 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.42 1ao8 n ALA 97 Cb 0.52 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 2.05 -0.64 0.00 0.00 0.00 -1.26 -4.84 105.19 100.50 1ao8 n GLY 98 Ca -0.19 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.43 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 -0.25 0.23 -0.02 0.00 -1.26 -0.87 105.19 103.02 1ao8 n GLY 99 Ca 0.00 -1.52 -0.01 0.00 0.00 0.00 0.00 46.02 44.49 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 1.24 -0.12 4.61 0.00 -1.92 -2.39 119.26 118.68 1ao8 h ALA 100 Ca 0.00 -0.31 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 1ao8 h ALA 100 Cb 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ao8 h ALA 100 CO 0.00 0.50 -0.36 1.96 0.00 0.00 0.00 179.25 181.34 1ao8 h GLN 101 N 0.32 0.26 -0.15 0.00 4.20 -1.99 -2.77 115.11 114.98 1ao8 h GLN 101 Ca 0.05 -0.11 -0.20 0.00 0.06 0.00 0.00 58.65 58.45 1ao8 h GLN 101 Cb 0.59 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.36 1ao8 h GLN 101 CO 0.04 0.59 -0.71 0.82 -0.67 0.00 0.00 178.83 178.90 1ao8 h ILE 102 N 0.22 1.31 -0.75 2.54 1.08 -1.71 -3.04 117.51 117.16 1ao8 h ILE 102 Ca 0.03 -1.98 -0.02 0.00 -0.39 0.00 0.00 64.86 62.49 1ao8 h ILE 102 Cb 0.75 1.96 -0.04 0.00 -3.07 0.00 0.00 36.82 36.42 1ao8 h ILE 102 CO 0.06 0.62 0.37 -0.26 -0.69 0.00 0.00 178.15 178.25 1ao8 h PHE 103 N 0.46 1.05 -0.11 1.37 0.04 -1.25 -1.72 116.94 116.78 1ao8 h PHE 103 Ca -0.03 -0.04 -0.06 0.00 2.80 0.00 0.00 57.97 60.64 1ao8 h PHE 103 Cb 1.32 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 39.12 1ao8 h PHE 103 CO 0.07 0.76 -0.21 1.15 -0.60 0.00 0.00 178.31 179.47 1ao8 h THR 104 N 1.06 1.21 -0.27 -1.55 2.02 -1.45 -1.52 112.91 112.41 1ao8 h THR 104 Ca 0.26 -0.96 -0.05 0.00 0.77 0.00 0.00 66.41 66.43 1ao8 h THR 104 Cb 0.08 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1ao8 h THR 104 CO -0.04 0.29 -0.02 0.00 0.37 0.00 0.00 175.52 176.12 1ao8 h ALA 105 N 1.61 0.37 -0.97 6.16 0.00 -1.21 -3.02 119.26 122.20 1ao8 h ALA 105 Ca 0.03 -0.24 -0.61 0.00 0.00 0.00 0.00 54.91 54.09 1ao8 h ALA 105 Cb 0.48 -0.10 -0.30 0.00 0.00 0.00 0.00 17.79 17.88 1ao8 h ALA 105 CO 0.03 0.14 0.70 1.19 0.00 0.00 0.00 179.25 181.31 1ao8 n PHE 106 N -4.57 3.10 0.09 0.00 3.72 -1.02 -4.49 117.46 114.28 1ao8 n PHE 106 Ca -0.03 -2.63 -0.14 0.00 -0.05 0.00 0.00 57.45 54.60 1ao8 n PHE 106 Cb 0.27 -1.23 -0.14 0.00 -0.94 0.00 0.00 39.48 37.44 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 1.70 0.20 -1.07 -1.08 3.64 -1.14 -3.28 116.57 115.54 1ao8 h LYS 107 Ca 0.59 -0.34 -0.55 0.00 -1.27 0.00 0.00 60.65 59.08 1ao8 h LYS 107 Cb 1.44 0.13 -0.26 0.00 -0.41 0.00 0.00 32.23 33.12 1ao8 h LYS 107 CO 1.38 1.14 0.70 -0.25 -2.27 0.00 0.00 179.45 180.15 1ao8 n ASP 108 N -3.47 5.96 -2.75 4.20 9.92 -1.26 -4.55 116.55 124.61 1ao8 n ASP 108 Ca -0.08 -3.55 -0.07 0.00 -0.53 0.00 0.00 54.79 50.56 1ao8 n ASP 108 Cb 1.01 -0.92 0.04 0.00 -0.64 0.00 0.00 41.12 40.61 1ao8 n ASP 108 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1ao8 n ASP 109 N -0.77 -2.95 -3.64 -2.24 8.00 -1.24 -5.13 116.55 108.59 1ao8 n ASP 109 Ca 0.55 -3.11 -0.09 0.00 0.71 0.00 0.00 54.79 52.85 1ao8 n ASP 109 Cb 1.00 1.75 -0.07 0.00 -0.02 0.00 0.00 41.12 43.78 1ao8 n ASP 109 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ao8 s VAL 110 N 0.72 0.00 -0.13 2.53 0.11 -1.26 -4.76 120.40 117.61 1ao8 s VAL 110 Ca 0.31 0.00 0.15 0.00 -2.93 0.00 0.00 61.98 59.51 1ao8 s VAL 110 Cb 0.17 -1.00 0.30 0.00 -1.53 0.00 0.00 36.38 34.32 1ao8 s VAL 110 CO -0.19 0.00 1.15 -0.90 -3.33 0.00 0.00 175.10 171.83 1ao8 n ASP 111 N 3.06 1.86 -3.24 3.54 5.75 -1.26 -4.90 116.55 121.36 1ao8 n ASP 111 Ca -0.16 -3.13 0.03 0.00 -0.01 0.00 0.00 54.79 51.52 1ao8 n ASP 111 Cb 0.57 -0.42 -0.02 0.00 -1.03 0.00 0.00 41.12 40.21 1ao8 n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1ao8 s THR 112 N -2.51 -0.98 -0.48 2.12 2.01 -1.26 -2.98 115.64 111.56 1ao8 s THR 112 Ca 0.30 -0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.19 1ao8 s THR 112 Cb 0.28 -0.99 0.11 0.00 0.01 0.00 0.00 72.50 71.91 1ao8 s THR 112 CO -0.01 -0.00 0.38 -0.76 -0.69 0.00 0.00 174.62 173.54 1ao8 s LEU 113 N 2.85 5.76 -0.20 4.42 1.43 0.63 -1.76 118.68 131.81 1ao8 s LEU 113 Ca 0.16 -1.79 -0.19 0.00 -1.03 0.00 0.00 54.13 51.28 1ao8 s LEU 113 Cb -0.15 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 43.97 1ao8 s LEU 113 CO -0.20 -0.72 0.54 -0.76 0.23 0.00 0.00 176.35 175.44 1ao8 s LEU 114 N 1.45 4.14 -0.02 1.79 1.43 -0.16 -2.11 118.68 125.20 1ao8 s LEU 114 Ca 0.05 0.71 -0.04 0.00 -1.03 0.00 0.00 54.13 53.81 1ao8 s LEU 114 Cb -0.27 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.21 1ao8 s LEU 114 CO 0.01 -0.20 0.09 0.54 0.23 0.00 0.00 176.35 177.01 1ao8 s VAL 115 N 1.71 0.04 -0.45 -1.59 0.11 -1.05 -2.25 120.40 116.92 1ao8 s VAL 115 Ca 0.25 -0.30 -0.10 0.00 -2.93 0.00 0.00 61.98 58.90 1ao8 s VAL 115 Cb -0.16 -0.23 0.10 0.00 -1.53 0.00 0.00 36.38 34.57 1ao8 s VAL 115 CO 0.10 -0.16 0.32 -0.89 -3.33 0.00 0.00 175.10 171.14 1ao8 s THR 116 N -0.51 4.31 -0.13 5.04 2.01 -0.96 -1.99 115.64 123.42 1ao8 s THR 116 Ca -0.06 -1.59 -0.29 0.00 0.31 0.00 0.00 61.69 60.05 1ao8 s THR 116 Cb -0.04 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.71 1ao8 s THR 116 CO 0.00 -0.67 1.11 -0.13 -0.69 0.00 0.00 174.62 174.24 1ao8 s ARG 117 N 1.41 4.33 0.39 4.92 0.52 -0.83 -2.37 118.95 127.32 1ao8 s ARG 117 Ca 0.04 1.51 0.05 0.00 -0.52 0.00 0.00 55.73 56.81 1ao8 s ARG 117 Cb -0.25 -3.61 -0.00 0.00 0.52 0.00 0.00 34.95 31.61 1ao8 s ARG 117 CO 0.01 -0.49 0.55 -0.51 0.02 0.00 0.00 175.30 174.88 1ao8 s LEU 118 N 2.60 3.80 -0.24 2.53 1.02 -0.83 -0.33 118.68 127.22 1ao8 s LEU 118 Ca 0.50 -0.12 0.06 0.00 0.02 0.00 0.00 54.13 54.60 1ao8 s LEU 118 Cb -0.20 -2.83 -0.19 0.00 0.02 0.00 0.00 46.19 42.99 1ao8 s LEU 118 CO 0.16 -0.60 -0.15 0.00 0.02 0.00 0.00 176.35 175.77 1ao8 n ALA 119 N -1.82 1.46 -1.77 4.21 0.00 -0.39 -3.75 120.51 118.44 1ao8 n ALA 119 Ca 0.02 -1.17 -0.36 0.00 0.00 0.00 0.00 53.44 51.93 1ao8 n ALA 119 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -6.25 2.74 0.20 0.00 0.00 -1.09 -4.80 107.32 98.13 1ao8 s GLY 120 Ca -0.28 0.94 -0.04 0.00 0.00 0.00 0.00 44.72 45.34 1ao8 s GLY 120 CO 0.66 1.37 0.43 -0.45 0.00 0.00 0.00 173.10 175.11 1ao8 s SER 121 N -1.47 6.46 -0.04 1.64 0.15 -1.26 -4.45 113.70 114.72 1ao8 s SER 121 Ca 0.68 0.58 -0.15 0.00 0.70 0.00 0.00 55.95 57.77 1ao8 s SER 121 Cb -0.28 -2.09 0.03 0.00 -1.71 0.00 0.00 66.02 61.97 1ao8 s SER 121 CO 0.33 -0.04 0.33 -0.36 1.20 0.00 0.00 173.24 174.70 1ao8 s PHE 122 N -1.83 -0.25 0.14 3.44 0.08 -1.26 -5.08 117.98 113.22 1ao8 s PHE 122 Ca 0.41 0.46 0.09 0.00 0.12 0.00 0.00 56.93 58.01 1ao8 s PHE 122 Cb -0.11 0.12 -0.04 0.00 -0.57 0.00 0.00 43.02 42.41 1ao8 s PHE 122 CO 0.27 -0.35 -0.18 -1.83 -0.10 0.00 0.00 175.22 173.03 1ao8 s GLU 123 N -0.97 1.77 0.00 0.44 -1.05 -1.26 -4.77 118.70 112.86 1ao8 s GLU 123 Ca -0.10 -1.25 0.00 0.00 -0.15 0.00 0.00 54.97 53.46 1ao8 s GLU 123 Cb -0.04 -2.07 0.00 0.00 -0.44 0.00 0.00 34.13 31.57 1ao8 s GLU 123 CO 0.04 0.46 0.00 0.41 0.95 0.00 0.00 175.26 177.12 1ao8 n GLY 124 N 0.61 1.93 0.91 -3.83 0.00 -1.26 -4.96 105.19 98.59 1ao8 n GLY 124 Ca -0.15 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 0.58 -4.61 1.61 9.92 -1.26 -5.02 116.55 117.77 1ao8 n ASP 125 Ca 0.00 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.83 1ao8 n ASP 125 Cb 0.00 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1ao8 s THR 126 N -1.68 3.73 0.36 -3.53 2.01 -1.21 -4.98 115.64 110.33 1ao8 s THR 126 Ca 0.00 0.79 0.08 0.00 0.31 0.00 0.00 61.69 62.86 1ao8 s THR 126 Cb 0.00 -3.86 -0.07 0.00 0.01 0.00 0.00 72.50 68.58 1ao8 s THR 126 CO 0.00 -0.46 -0.03 -0.54 -0.69 0.00 0.00 174.62 172.89 1ao8 s LYS 127 N 4.96 1.82 0.26 4.92 1.02 -1.26 -1.51 119.74 129.95 1ao8 s LYS 127 Ca 0.70 -1.98 -0.20 0.00 0.02 0.00 0.00 55.97 54.51 1ao8 s LYS 127 Cb -0.20 -1.52 -0.09 0.00 -0.52 0.00 0.00 37.83 35.50 1ao8 s LYS 127 CO 0.31 0.02 0.76 1.41 -0.92 0.00 0.00 175.35 176.93 1ao8 s MET 128 N -3.69 4.26 1.02 1.68 -2.45 -1.13 -4.77 119.30 114.22 1ao8 s MET 128 Ca 0.33 0.91 -0.12 0.00 -1.25 0.00 0.00 55.69 55.57 1ao8 s MET 128 Cb 0.06 -2.78 0.20 0.00 1.25 0.00 0.00 34.83 33.56 1ao8 s MET 128 CO 0.16 0.33 1.08 0.96 1.05 0.00 0.00 175.02 178.60 1ao8 s ILE 129 N -1.62 2.21 -0.84 10.11 -4.36 -1.26 -4.90 121.20 120.53 1ao8 s ILE 129 Ca 0.46 0.07 -0.25 0.00 -0.26 0.00 0.00 60.65 60.66 1ao8 s ILE 129 Cb -0.16 -2.24 0.03 0.00 1.25 0.00 0.00 42.46 41.34 1ao8 s ILE 129 CO 0.21 -0.09 1.38 -2.16 0.24 0.00 0.00 174.94 174.51 1ao8 s PRO 130 N -4.66 3.31 0.74 0.37 0.04 -1.26 -5.01 135.00 128.53 1ao8 s PRO 130 Ca 0.67 -0.54 -0.01 0.00 0.04 0.00 0.00 61.00 61.15 1ao8 s PRO 130 Cb -0.22 -4.65 0.14 0.00 0.04 0.00 0.00 34.50 29.81 1ao8 s PRO 130 CO 0.61 -2.22 1.02 -0.51 0.04 0.00 0.00 177.00 175.94 1ao8 s LEU 131 N 5.66 2.94 -0.20 -3.56 1.43 -1.26 -5.08 118.68 118.62 1ao8 s LEU 131 Ca 0.41 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1ao8 s LEU 131 Cb -0.05 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 1ao8 s LEU 131 CO 0.05 -1.96 -0.04 0.21 0.23 0.00 0.00 176.35 174.85 1ao8 s ASN 132 N -4.78 4.48 -0.17 2.29 2.47 -1.26 -4.97 114.94 113.01 1ao8 s ASN 132 Ca 0.67 -0.30 0.18 0.00 0.42 0.00 0.00 52.86 53.84 1ao8 s ASN 132 Cb -0.05 -1.76 -0.26 0.00 -1.45 0.00 0.00 41.25 37.74 1ao8 s ASN 132 CO 0.45 0.05 0.14 0.79 -3.72 0.00 0.00 177.10 174.81 1ao8 n TRP 133 N 4.35 0.00 0.29 0.43 7.02 -1.26 -4.26 117.44 124.02 1ao8 n TRP 133 Ca -0.18 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.45 1ao8 n TRP 133 Cb 0.52 -0.90 0.88 0.00 -2.42 0.00 0.00 31.31 29.39 1ao8 n TRP 133 CO 0.00 0.00 0.00 0.38 -2.02 0.00 0.00 177.69 176.05 1ao8 h ASP 134 N 0.00 0.00 -0.83 -0.99 3.04 -2.04 -1.63 116.42 113.96 1ao8 h ASP 134 Ca -0.45 0.00 -0.51 0.00 -3.24 0.00 0.00 57.03 52.83 1ao8 h ASP 134 Cb 2.02 0.00 -0.25 0.00 -1.04 0.00 0.00 39.33 40.06 1ao8 h ASP 134 CO 0.02 0.02 0.65 0.47 -2.04 0.00 0.00 179.24 178.37 1ao8 n ASP 135 N -3.84 5.69 -3.67 4.15 8.00 -1.26 -4.91 116.55 120.72 1ao8 n ASP 135 Ca -0.03 -3.46 -0.11 0.00 0.71 0.00 0.00 54.79 51.90 1ao8 n ASP 135 Cb 0.10 -0.91 -0.06 0.00 -0.02 0.00 0.00 41.12 40.24 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 -3.00 -0.20 0.10 1.24 0.40 -0.61 -4.67 117.98 111.25 1ao8 s PHE 136 Ca 0.51 -0.01 0.10 0.00 -0.60 0.00 0.00 56.93 56.93 1ao8 s PHE 136 Cb 0.41 0.21 -0.04 0.00 0.51 0.00 0.00 43.02 44.12 1ao8 s PHE 136 CO 0.04 -0.63 -0.24 0.99 0.70 0.00 0.00 175.22 176.07 1ao8 s THR 137 N -3.22 2.39 -0.16 0.64 2.01 -0.90 -4.92 115.64 111.47 1ao8 s THR 137 Ca -0.01 -1.59 -0.22 0.00 0.31 0.00 0.00 61.69 60.19 1ao8 s THR 137 Cb 0.01 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 1ao8 s THR 137 CO -0.08 0.17 0.66 -0.75 -0.69 0.00 0.00 174.62 173.94 1ao8 s LYS 138 N -1.84 4.28 -0.23 4.92 2.20 -1.26 -2.06 119.74 125.74 1ao8 s LYS 138 Ca 0.14 0.71 -0.11 0.00 -0.36 0.00 0.00 55.97 56.36 1ao8 s LYS 138 Cb -0.10 -3.54 -0.11 0.00 -1.51 0.00 0.00 37.83 32.57 1ao8 s LYS 138 CO 0.06 -0.16 -0.29 0.28 -0.36 0.00 0.00 175.35 174.88 1ao8 n VAL 139 N 4.44 1.29 -4.33 4.02 0.31 -1.17 -4.97 118.33 117.91 1ao8 n VAL 139 Ca -0.01 -0.34 -0.20 0.00 -0.01 0.00 0.00 64.34 63.78 1ao8 n VAL 139 Cb 0.50 -1.77 -0.11 0.00 -0.91 0.00 0.00 33.84 31.56 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ao8 s SER 140 N -7.02 2.55 -0.37 4.52 0.15 -1.22 -5.01 113.70 107.30 1ao8 s SER 140 Ca -0.33 -0.94 -0.03 0.00 0.70 0.00 0.00 55.95 55.36 1ao8 s SER 140 Cb 0.12 -0.14 0.19 0.00 -1.71 0.00 0.00 66.02 64.49 1ao8 s SER 140 CO 0.42 -0.12 0.92 -0.55 1.20 0.00 0.00 173.24 175.11 1ao8 s SER 141 N -2.99 -0.75 -0.12 5.45 0.15 -1.25 -2.03 113.70 112.15 1ao8 s SER 141 Ca 0.19 -0.54 -0.12 0.00 0.70 0.00 0.00 55.95 56.17 1ao8 s SER 141 Cb -0.03 0.97 -0.05 0.00 -1.71 0.00 0.00 66.02 65.20 1ao8 s SER 141 CO 0.06 -0.07 0.27 -0.60 1.20 0.00 0.00 173.24 174.11 1ao8 s ARG 142 N 1.61 4.01 -0.23 5.44 3.52 -0.75 -4.94 118.95 127.61 1ao8 s ARG 142 Ca 0.19 0.09 -0.09 0.00 -0.13 0.00 0.00 55.73 55.78 1ao8 s ARG 142 Cb 0.03 -3.33 -0.04 0.00 -1.56 0.00 0.00 34.95 30.04 1ao8 s ARG 142 CO -0.11 0.45 0.11 0.99 -0.81 0.00 0.00 175.30 175.93 1ao8 s THR 143 N -0.16 4.88 -0.13 4.11 2.01 -1.26 -1.29 115.64 123.79 1ao8 s THR 143 Ca 0.17 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.20 1ao8 s THR 143 Cb -0.13 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.12 1ao8 s THR 143 CO 0.05 0.37 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.46 1ao8 s VAL 144 N 1.09 2.33 0.23 3.82 1.01 -0.44 -5.01 120.40 123.43 1ao8 s VAL 144 Ca 0.06 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.03 1ao8 s VAL 144 Cb -0.14 -1.95 -0.07 0.00 0.00 0.00 0.00 36.38 34.22 1ao8 s VAL 144 CO 0.04 0.54 0.57 -0.70 0.00 0.00 0.00 175.10 175.55 1ao8 s GLU 145 N 0.66 3.85 0.15 2.72 2.12 -1.26 -2.45 118.70 124.49 1ao8 s GLU 145 Ca -0.10 0.36 0.01 0.00 0.36 0.00 0.00 54.97 55.60 1ao8 s GLU 145 Cb -0.16 -2.66 0.01 0.00 0.26 0.00 0.00 34.13 31.58 1ao8 s GLU 145 CO 0.02 0.32 0.06 -3.47 -0.54 0.00 0.00 175.26 171.65 1ao8 n ASP 146 N -0.04 1.97 0.02 -1.70 2.03 -1.26 -4.96 116.55 112.61 1ao8 n ASP 146 Ca 0.00 -1.60 -0.02 0.00 0.52 0.00 0.00 54.79 53.69 1ao8 n ASP 146 Cb 0.52 0.05 0.24 0.00 -0.72 0.00 0.00 41.12 41.21 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 0.82 1.25 -3.78 5.18 1.35 -1.99 -3.42 112.91 112.32 1ao8 h THR 147 Ca -0.11 -1.14 -0.68 0.00 -0.55 0.00 0.00 66.41 63.92 1ao8 h THR 147 Cb 0.37 1.27 -0.23 0.00 -1.73 0.00 0.00 68.15 67.83 1ao8 h THR 147 CO 0.18 0.37 -0.75 0.21 -0.25 0.00 0.00 175.52 175.28 1ao8 s ASN 148 N -6.80 4.19 0.36 5.36 3.84 -1.26 -5.01 114.94 115.63 1ao8 s ASN 148 Ca -0.07 -0.18 0.12 0.00 0.21 0.00 0.00 52.86 52.94 1ao8 s ASN 148 Cb 0.14 -1.11 0.91 0.00 -0.55 0.00 0.00 41.25 40.64 1ao8 s ASN 148 CO 0.78 0.30 1.81 -0.65 -2.79 0.00 0.00 177.10 176.56 1ao8 h PRO 149 N 5.66 0.58 0.00 0.43 0.10 -2.01 0.38 132.00 137.13 1ao8 h PRO 149 Ca -0.42 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 65.65 1ao8 h PRO 149 Cb 1.17 -0.13 0.00 0.00 0.10 0.00 0.00 31.00 32.14 1ao8 h PRO 149 CO 0.52 0.38 0.00 0.00 0.10 0.00 0.00 178.00 179.01 1ao8 h ALA 150 N 1.62 1.00 -0.36 -0.75 0.00 -1.94 -2.93 119.26 115.90 1ao8 h ALA 150 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.44 1ao8 h ALA 150 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ao8 h ALA 150 CO -0.28 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.25 1ao8 n LEU 151 N -3.06 3.64 -4.75 0.00 4.77 0.13 -2.67 117.00 115.06 1ao8 n LEU 151 Ca 0.02 -1.84 -0.41 0.00 -0.03 0.00 0.00 56.01 53.75 1ao8 n LEU 151 Cb 0.37 -0.57 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 1ao8 n LEU 151 CO 0.29 0.49 0.75 -0.89 -1.33 0.00 0.00 177.39 176.70 1ao8 s THR 152 N -1.97 3.84 0.05 -5.08 2.01 -1.10 -4.26 115.64 109.12 1ao8 s THR 152 Ca 0.32 1.72 0.00 0.00 0.31 0.00 0.00 61.69 64.05 1ao8 s THR 152 Cb 0.24 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 1ao8 s THR 152 CO 0.11 0.36 -0.05 -1.38 -0.69 0.00 0.00 174.62 172.97 1ao8 s HIS 153 N -0.76 0.54 -0.11 4.92 -3.43 -1.03 -1.27 115.29 114.16 1ao8 s HIS 153 Ca 0.45 -0.78 -0.02 0.00 -0.80 0.00 0.00 55.06 53.92 1ao8 s HIS 153 Cb -0.29 -0.36 0.04 0.00 -1.43 0.00 0.00 32.58 30.54 1ao8 s HIS 153 CO 0.36 -0.23 0.01 0.99 -2.00 0.00 0.00 174.74 173.88 1ao8 s THR 154 N -2.68 0.40 -0.39 -5.38 2.01 0.55 -1.33 115.64 108.83 1ao8 s THR 154 Ca -0.02 -0.09 -0.29 0.00 0.31 0.00 0.00 61.69 61.61 1ao8 s THR 154 Cb -0.01 -0.68 0.01 0.00 0.01 0.00 0.00 72.50 71.83 1ao8 s THR 154 CO -0.04 0.10 1.32 -0.31 -0.69 0.00 0.00 174.62 175.00 1ao8 s TYR 155 N 1.95 2.57 -0.16 4.92 2.02 -0.41 -1.96 117.35 126.27 1ao8 s TYR 155 Ca 0.03 0.75 -0.02 0.00 -0.37 0.00 0.00 57.07 57.46 1ao8 s TYR 155 Cb -0.14 -4.21 -0.02 0.00 -0.40 0.00 0.00 41.96 37.20 1ao8 s TYR 155 CO -0.06 -1.74 -0.07 -1.21 -1.57 0.00 0.00 175.55 170.89 1ao8 s GLU 156 N 4.61 3.49 -0.71 -0.62 2.02 -0.84 -1.81 118.70 124.84 1ao8 s GLU 156 Ca 0.57 -0.61 -0.06 0.00 0.02 0.00 0.00 54.97 54.89 1ao8 s GLU 156 Cb -0.13 -2.84 0.18 0.00 0.10 0.00 0.00 34.13 31.44 1ao8 s GLU 156 CO 0.29 0.11 0.57 0.08 0.02 0.00 0.00 175.26 176.34 1ao8 s VAL 157 N 0.66 4.33 0.18 2.63 1.01 -0.86 -2.53 120.40 125.83 1ao8 s VAL 157 Ca -0.04 -2.91 -0.29 0.00 0.00 0.00 0.00 61.98 58.74 1ao8 s VAL 157 Cb -0.15 -3.75 -0.08 0.00 0.00 0.00 0.00 36.38 32.40 1ao8 s VAL 157 CO 0.02 -0.94 0.90 0.26 0.00 0.00 0.00 175.10 175.34 1ao8 s TRP 158 N -0.13 3.91 0.06 5.22 0.52 -0.90 -3.05 118.94 124.56 1ao8 s TRP 158 Ca 0.18 1.80 0.05 0.00 0.02 0.00 0.00 56.10 58.16 1ao8 s TRP 158 Cb -0.16 -2.94 -0.03 0.00 -1.15 0.00 0.00 33.47 29.19 1ao8 s TRP 158 CO -0.06 0.40 -0.14 -0.65 0.02 0.00 0.00 176.95 176.53 1ao8 s GLN 159 N -0.82 0.86 -0.18 4.98 -0.21 -0.88 -0.27 119.66 123.15 1ao8 s GLN 159 Ca 0.41 -0.85 -0.29 0.00 0.02 0.00 0.00 55.36 54.65 1ao8 s GLN 159 Cb -0.24 -0.86 -0.02 0.00 1.00 0.00 0.00 33.01 32.89 1ao8 s GLN 159 CO 0.30 0.20 1.31 0.21 -2.12 0.00 0.00 175.29 175.19 1ao8 s LYS 160 N -1.44 4.16 0.34 2.91 2.20 -1.16 -2.13 119.74 124.62 1ao8 s LYS 160 Ca -0.01 1.64 -0.29 0.00 -0.36 0.00 0.00 55.97 56.96 1ao8 s LYS 160 Cb -0.09 -3.81 -0.11 0.00 -1.51 0.00 0.00 37.83 32.32 1ao8 s LYS 160 CO 0.02 -0.80 1.38 -1.59 -0.36 0.00 0.00 175.35 174.00 1ao8 s LYS 161 N 3.69 4.26 0.00 4.03 0.00 -1.26 -4.93 119.74 125.52 1ao8 s LYS 161 Ca 0.57 2.35 0.00 0.00 0.00 0.00 0.00 55.97 58.89 1ao8 s LYS 161 Cb -0.22 -3.04 0.00 0.00 0.00 0.00 0.00 37.83 34.57 1ao8 s LYS 161 CO 0.18 -0.33 0.00 0.00 0.00 0.00 0.00 175.35 175.19