#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 -1.51 0.46 6.98 0.00 0.14 -4.39 121.76 123.45 1ao8 s ALA 2 Ca 0.00 1.50 -0.21 0.00 0.00 0.00 0.00 51.96 53.25 1ao8 s ALA 2 Cb 0.00 -1.69 -0.08 0.00 0.00 0.00 0.00 23.12 21.34 1ao8 s ALA 2 CO 0.00 -1.08 1.05 -0.06 0.00 0.00 0.00 175.76 175.68 1ao8 s PHE 3 N 2.69 3.04 -0.29 0.00 0.40 -1.00 -0.26 117.98 122.56 1ao8 s PHE 3 Ca 0.08 1.59 -0.04 0.00 -0.60 0.00 0.00 56.93 57.96 1ao8 s PHE 3 Cb -0.14 -3.12 0.16 0.00 0.51 0.00 0.00 43.02 40.44 1ao8 s PHE 3 CO -0.16 -0.87 0.58 -1.17 0.70 0.00 0.00 175.22 174.30 1ao8 s LEU 4 N -3.25 -1.21 0.20 -0.37 2.96 -0.58 -1.39 118.68 115.04 1ao8 s LEU 4 Ca 0.65 0.99 -0.17 0.00 -0.22 0.00 0.00 54.13 55.38 1ao8 s LEU 4 Cb -0.19 2.04 0.02 0.00 0.50 0.00 0.00 46.19 48.57 1ao8 s LEU 4 CO 0.23 -0.25 0.51 -1.66 -1.32 0.00 0.00 176.35 173.86 1ao8 s TRP 5 N 2.82 -0.04 -0.07 5.38 -2.14 -0.98 -4.31 118.94 119.61 1ao8 s TRP 5 Ca 0.12 -0.32 0.04 0.00 2.66 0.00 0.00 56.10 58.61 1ao8 s TRP 5 Cb -0.14 0.36 -0.00 0.00 -3.10 0.00 0.00 33.47 30.59 1ao8 s TRP 5 CO -0.19 -0.93 -0.21 0.00 -2.66 0.00 0.00 176.95 172.96 1ao8 s ALA 6 N -3.90 1.86 0.29 2.67 0.00 -1.26 -2.13 121.76 119.29 1ao8 s ALA 6 Ca 0.11 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.27 1ao8 s ALA 6 Cb -0.01 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.41 1ao8 s ALA 6 CO -0.01 0.29 0.18 1.14 0.00 0.00 0.00 175.76 177.37 1ao8 s GLN 7 N 0.19 1.54 0.29 0.00 -2.07 -0.96 -4.43 119.66 114.23 1ao8 s GLN 7 Ca -0.11 -1.87 0.01 0.00 -1.82 0.00 0.00 55.36 51.57 1ao8 s GLN 7 Cb -0.15 0.11 0.01 0.00 -1.09 0.00 0.00 33.01 31.89 1ao8 s GLN 7 CO 0.05 -0.49 0.06 -0.40 -1.32 0.00 0.00 175.29 173.19 1ao8 n ASP 8 N -0.94 2.57 0.32 12.60 5.75 -1.15 -2.12 116.55 133.59 1ao8 n ASP 8 Ca 0.03 -2.20 0.20 0.00 -0.01 0.00 0.00 54.79 52.81 1ao8 n ASP 8 Cb 0.64 0.14 1.06 0.00 -1.03 0.00 0.00 41.12 41.94 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 0.00 0.00 0.11 0.11 -1.79 -0.04 114.38 112.77 1ao8 h ARG 9 Ca -0.23 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.78 1ao8 h ARG 9 Cb 0.71 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.78 1ao8 h ARG 9 CO 0.37 0.00 -0.86 -0.44 0.10 0.00 0.00 179.97 179.14 1ao8 h ASP 10 N 0.00 0.00 0.00 0.08 3.32 -1.92 -3.48 116.42 114.42 1ao8 h ASP 10 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ao8 h ASP 10 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1ao8 h ASP 10 CO -0.00 0.27 0.00 0.61 -1.72 0.00 0.00 179.24 178.40 1ao8 n GLY 11 N 1.24 1.37 3.69 2.75 0.00 -0.03 -5.03 105.19 109.17 1ao8 n GLY 11 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1ao8 n GLY 11 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ao8 n LEU 12 N 0.00 4.73 -1.11 0.99 7.94 -1.26 -2.90 117.00 125.38 1ao8 n LEU 12 Ca 0.00 0.90 0.04 0.00 -1.11 0.00 0.00 56.01 55.84 1ao8 n LEU 12 Cb 0.00 -1.49 0.05 0.00 0.53 0.00 0.00 43.42 42.51 1ao8 n LEU 12 CO 0.00 -1.16 0.17 2.30 -1.11 0.00 0.00 177.39 177.58 1ao8 n ILE 13 N -1.36 0.46 0.00 1.96 -5.35 -0.39 -2.91 119.36 111.76 1ao8 n ILE 13 Ca 0.12 -1.27 0.00 0.00 -0.27 0.00 0.00 62.75 61.33 1ao8 n ILE 13 Cb 0.45 0.65 0.00 0.00 -1.74 0.00 0.00 39.64 39.00 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 0.05 0.02 3.59 3.28 0.00 -1.25 -4.90 105.19 105.99 1ao8 n GLY 14 Ca 0.08 -1.63 -0.03 0.00 0.00 0.00 0.00 46.02 44.44 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 -1.52 0.56 -1.67 1.61 2.20 0.17 -3.35 119.74 117.75 1ao8 s LYS 15 Ca 0.00 1.35 0.00 0.00 -0.36 0.00 0.00 55.97 56.96 1ao8 s LYS 15 Cb 0.00 0.67 0.00 0.00 -1.51 0.00 0.00 37.83 36.99 1ao8 s LYS 15 CO 0.00 -0.20 0.00 -0.25 -0.36 0.00 0.00 175.35 174.54 1ao8 n ASP 16 N 5.24 -5.27 0.00 1.43 9.92 -1.26 -1.70 116.55 124.91 1ao8 n ASP 16 Ca -0.13 0.13 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1ao8 n ASP 16 Cb 0.51 -4.47 0.00 0.00 -0.64 0.00 0.00 41.12 36.52 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 -0.83 2.52 3.93 0.44 0.00 -1.26 -5.00 105.19 105.00 1ao8 n GLY 17 Ca -0.21 -0.60 -0.25 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 3.43 0.40 1.61 -3.43 -0.69 -4.91 115.29 111.28 1ao8 s HIS 18 Ca 0.00 0.48 -0.23 0.00 -0.80 0.00 0.00 55.06 54.50 1ao8 s HIS 18 Cb 0.00 -2.17 -0.10 0.00 -1.43 0.00 0.00 32.58 28.88 1ao8 s HIS 18 CO 0.00 -0.18 0.99 -0.51 -2.00 0.00 0.00 174.74 173.05 1ao8 s LEU 19 N -4.54 4.11 0.07 5.38 1.43 -1.26 0.46 118.68 124.33 1ao8 s LEU 19 Ca 0.45 1.88 -0.10 0.00 -1.03 0.00 0.00 54.13 55.33 1ao8 s LEU 19 Cb -0.10 -4.27 -0.27 0.00 0.03 0.00 0.00 46.19 41.58 1ao8 s LEU 19 CO 0.40 -0.37 1.13 1.55 0.23 0.00 0.00 176.35 179.28 1ao8 h PRO 20 N 2.43 0.48 0.00 1.29 0.13 -1.85 -3.45 132.00 131.03 1ao8 h PRO 20 Ca -0.48 -0.69 -0.20 0.00 -0.87 0.00 0.00 66.00 63.76 1ao8 h PRO 20 Cb 1.20 0.24 0.00 0.00 0.13 0.00 0.00 31.00 32.57 1ao8 h PRO 20 CO 0.62 1.30 -0.06 -2.67 -0.23 0.00 0.00 178.00 176.97 1ao8 n TRP 21 N -3.70 -2.14 -3.55 1.56 2.14 -1.26 -5.10 117.44 105.40 1ao8 n TRP 21 Ca -0.12 -0.84 -0.28 0.00 2.07 0.00 0.00 57.50 58.33 1ao8 n TRP 21 Cb 0.99 -0.20 -0.15 0.00 -0.81 0.00 0.00 31.31 31.14 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 -0.63 0.29 -0.83 -2.67 2.46 -1.26 -5.06 115.29 107.59 1ao8 s HIS 22 Ca 0.19 -0.76 0.01 0.00 0.47 0.00 0.00 55.06 54.97 1ao8 s HIS 22 Cb -0.02 -0.85 0.21 0.00 -0.13 0.00 0.00 32.58 31.79 1ao8 s HIS 22 CO 0.12 -0.77 0.72 -0.11 -2.47 0.00 0.00 174.74 172.24 1ao8 n LEU 23 N 5.26 3.91 -0.37 8.88 7.94 -1.26 -4.91 117.00 136.44 1ao8 n LEU 23 Ca -0.06 -5.19 0.31 0.00 -1.11 0.00 0.00 56.01 49.95 1ao8 n LEU 23 Cb 0.43 -0.97 0.62 0.00 0.53 0.00 0.00 43.42 44.04 1ao8 n LEU 23 CO 0.05 1.67 1.26 -0.65 -1.11 0.00 0.00 177.39 178.62 1ao8 h PRO 24 N 5.61 0.20 -0.84 1.96 0.10 -1.99 0.26 132.00 137.30 1ao8 h PRO 24 Ca 0.16 -0.01 -0.03 0.00 0.10 0.00 0.00 66.00 66.22 1ao8 h PRO 24 Cb 0.77 -0.04 -0.04 0.00 0.10 0.00 0.00 31.00 31.79 1ao8 h PRO 24 CO 0.83 0.13 0.40 0.22 0.10 0.00 0.00 178.00 179.68 1ao8 h ASP 25 N 0.20 1.10 0.39 -2.05 1.82 -1.99 -1.96 116.42 113.93 1ao8 h ASP 25 Ca 0.66 -0.14 -0.08 0.00 -0.39 0.00 0.00 57.03 57.08 1ao8 h ASP 25 Cb 2.05 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 41.77 1ao8 h ASP 25 CO -0.24 0.93 -0.37 -0.78 -1.61 0.00 0.00 179.24 177.17 1ao8 h ASP 26 N 1.20 0.00 0.15 2.28 1.82 -0.91 -2.48 116.42 118.48 1ao8 h ASP 26 Ca 0.29 0.00 -0.06 0.00 -0.39 0.00 0.00 57.03 56.87 1ao8 h ASP 26 Cb 0.13 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.13 1ao8 h ASP 26 CO -0.04 0.37 -0.21 -0.07 -1.61 0.00 0.00 179.24 177.68 1ao8 h LEU 27 N 0.00 0.13 -1.00 2.28 3.38 -1.20 -1.92 115.31 116.97 1ao8 h LEU 27 Ca -0.00 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 1ao8 h LEU 27 Cb 0.67 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1ao8 h LEU 27 CO 0.05 0.35 -0.46 0.45 0.09 0.00 0.00 178.44 178.92 1ao8 h HIS 28 N 0.12 0.00 0.02 1.13 3.86 -1.26 -2.82 115.15 116.21 1ao8 h HIS 28 Ca 0.02 0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.01 1ao8 h HIS 28 Cb 0.45 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.90 1ao8 h HIS 28 CO 0.00 0.46 -1.06 -0.92 0.86 0.00 0.00 177.93 177.28 1ao8 h TYR 29 N 0.00 0.09 -0.45 2.45 3.20 -1.36 -3.19 116.97 117.70 1ao8 h TYR 29 Ca -0.00 -0.07 -0.08 0.00 3.14 0.00 0.00 58.73 61.71 1ao8 h TYR 29 Cb 0.89 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 1ao8 h TYR 29 CO 0.00 1.05 -0.05 0.35 -1.64 0.00 0.00 178.16 177.88 1ao8 h PHE 30 N 0.01 0.92 -0.25 -3.82 3.57 -1.21 -1.33 116.94 114.83 1ao8 h PHE 30 Ca -0.04 -0.18 -0.04 0.00 3.53 0.00 0.00 57.97 61.25 1ao8 h PHE 30 Cb 1.81 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 40.30 1ao8 h PHE 30 CO 0.01 0.90 -0.01 -0.09 -2.23 0.00 0.00 178.31 176.90 1ao8 h ARG 31 N 0.68 0.37 0.00 1.11 2.43 -1.57 -2.10 114.38 115.29 1ao8 h ARG 31 Ca 0.12 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 59.10 1ao8 h ARG 31 Cb 0.57 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1ao8 h ARG 31 CO 0.03 0.41 -0.60 0.00 -1.51 0.00 0.00 179.97 178.30 1ao8 h ALA 32 N 1.64 0.64 -0.93 2.80 0.00 -1.47 -2.57 119.26 119.36 1ao8 h ALA 32 Ca 0.08 -0.55 -0.53 0.00 0.00 0.00 0.00 54.91 53.91 1ao8 h ALA 32 Cb 0.26 -0.10 -0.28 0.00 0.00 0.00 0.00 17.79 17.67 1ao8 h ALA 32 CO 0.01 0.76 0.67 1.04 0.00 0.00 0.00 179.25 181.73 1ao8 n GLN 33 N -3.30 2.28 0.00 0.00 1.13 -0.53 -4.44 117.38 112.52 1ao8 n GLN 33 Ca 0.01 -2.88 0.00 0.00 -1.94 0.00 0.00 57.00 52.19 1ao8 n GLN 33 Cb 0.75 -2.13 0.00 0.00 0.11 0.00 0.00 30.24 28.97 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 -0.95 0.00 -1.69 5.09 -2.24 -1.11 -4.98 114.28 108.40 1ao8 n THR 34 Ca 0.57 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.92 1ao8 n THR 34 Cb 1.32 -0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 69.32 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 -2.33 0.36 0.00 2.28 0.24 -0.97 -1.14 118.33 116.77 1ao8 n VAL 35 Ca 0.00 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 1ao8 n VAL 35 Cb 0.00 -2.11 0.00 0.00 -1.47 0.00 0.00 33.84 30.26 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 4.22 3.25 1.44 7.63 0.00 -0.97 -4.96 105.19 115.79 1ao8 n GLY 36 Ca 0.18 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.12 1.27 -3.63 1.61 5.02 -0.29 -4.74 118.16 116.28 1ao8 n LYS 37 Ca 0.00 -1.34 -0.37 0.00 -2.02 0.00 0.00 58.31 54.58 1ao8 n LYS 37 Cb 0.00 0.20 -0.09 0.00 -0.02 0.00 0.00 35.03 35.12 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 -1.20 5.34 -0.06 -0.18 1.01 -0.96 -3.50 121.20 121.65 1ao8 s ILE 38 Ca 0.09 0.27 -0.16 0.00 0.00 0.00 0.00 60.65 60.85 1ao8 s ILE 38 Cb -0.01 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 1ao8 s ILE 38 CO 0.06 0.35 0.41 -0.32 0.00 0.00 0.00 174.94 175.44 1ao8 s MET 39 N 0.99 4.10 -0.25 2.79 1.75 -1.01 -2.28 119.30 125.38 1ao8 s MET 39 Ca 0.10 0.38 0.00 0.00 -1.25 0.00 0.00 55.69 54.92 1ao8 s MET 39 Cb -0.13 -3.31 0.04 0.00 2.84 0.00 0.00 34.83 34.26 1ao8 s MET 39 CO 0.04 0.47 -0.09 0.08 -0.65 0.00 0.00 175.02 174.87 1ao8 s VAL 40 N -0.35 2.53 0.10 10.11 1.01 -0.43 -1.50 120.40 131.88 1ao8 s VAL 40 Ca 0.23 -1.30 0.04 0.00 0.00 0.00 0.00 61.98 60.96 1ao8 s VAL 40 Cb -0.16 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1ao8 s VAL 40 CO 0.11 0.11 -0.12 0.68 0.00 0.00 0.00 175.10 175.88 1ao8 s VAL 41 N 1.23 1.06 0.00 2.92 -7.23 -0.47 -2.21 120.40 115.70 1ao8 s VAL 41 Ca -0.03 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 1ao8 s VAL 41 Cb -0.18 -1.35 0.00 0.00 0.56 0.00 0.00 36.38 35.41 1ao8 s VAL 41 CO -0.05 -0.47 0.00 0.61 -0.31 0.00 0.00 175.10 174.88 1ao8 n GLY 42 N 0.67 0.34 0.13 2.32 0.00 -0.33 -2.23 105.19 106.08 1ao8 n GLY 42 Ca -0.17 -1.81 -0.21 0.00 0.00 0.00 0.00 46.02 43.84 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 0.38 -0.02 1.61 2.43 -1.91 -1.88 114.38 114.99 1ao8 h ARG 43 Ca 0.00 -0.66 -0.10 0.00 -0.81 0.00 0.00 59.98 58.42 1ao8 h ARG 43 Cb 0.00 0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1ao8 h ARG 43 CO 0.00 1.29 -0.45 -0.09 -1.51 0.00 0.00 179.97 179.21 1ao8 h ARG 44 N 0.10 0.05 0.01 0.20 2.43 -1.94 -2.63 114.38 112.61 1ao8 h ARG 44 Ca -0.24 -0.02 -0.26 0.00 -0.81 0.00 0.00 59.98 58.64 1ao8 h ARG 44 Cb 2.08 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 31.59 1ao8 h ARG 44 CO 0.21 0.49 -1.40 1.15 -1.51 0.00 0.00 179.97 178.92 1ao8 h THR 45 N 0.04 1.24 -0.15 0.20 2.02 -1.89 -2.99 112.91 111.38 1ao8 h THR 45 Ca -0.00 -3.01 -0.01 0.00 0.77 0.00 0.00 66.41 64.16 1ao8 h THR 45 Cb 0.82 2.63 -0.01 0.00 -1.74 0.00 0.00 68.15 69.85 1ao8 h THR 45 CO 0.06 0.72 0.04 0.22 0.37 0.00 0.00 175.52 176.94 1ao8 h TYR 46 N 0.01 0.24 0.00 3.16 3.20 -1.17 -2.61 116.97 119.79 1ao8 h TYR 46 Ca -0.17 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.64 1ao8 h TYR 46 Cb 1.91 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 40.11 1ao8 h TYR 46 CO 0.01 0.35 -0.17 0.93 -1.64 0.00 0.00 178.16 177.64 1ao8 h GLU 47 N 0.05 0.00 0.00 1.82 5.08 -1.60 -2.94 114.58 116.99 1ao8 h GLU 47 Ca 0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1ao8 h GLU 47 Cb 0.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1ao8 h GLU 47 CO -0.00 0.17 -0.09 1.03 -1.00 0.00 0.00 179.01 179.12 1ao8 h SER 48 N 0.00 0.00 -4.03 1.42 0.87 -1.30 -3.42 113.55 107.08 1ao8 h SER 48 Ca -0.00 0.00 -0.50 0.00 -1.23 0.00 0.00 61.79 60.06 1ao8 h SER 48 Cb 0.76 0.00 0.06 0.00 -0.44 0.00 0.00 62.40 62.77 1ao8 h SER 48 CO 0.02 0.09 0.45 -0.36 -0.53 0.00 0.00 176.83 176.51 1ao8 s PHE 49 N -4.57 2.87 -0.11 2.24 0.08 -1.11 -4.98 117.98 112.40 1ao8 s PHE 49 Ca -0.04 1.55 -0.12 0.00 0.12 0.00 0.00 56.93 58.44 1ao8 s PHE 49 Cb 0.15 -3.30 -0.11 0.00 -0.57 0.00 0.00 43.02 39.19 1ao8 s PHE 49 CO 0.62 -1.37 0.36 -1.00 -0.10 0.00 0.00 175.22 173.73 1ao8 h PRO 50 N 1.81 -0.03 -4.70 0.24 0.13 -1.89 -3.43 132.00 124.12 1ao8 h PRO 50 Ca -0.49 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.95 1ao8 h PRO 50 Cb 1.25 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.19 1ao8 h PRO 50 CO 0.59 0.36 -0.43 0.21 -0.23 0.00 0.00 178.00 178.51 1ao8 s LYS 51 N -1.97 3.36 0.03 0.86 2.20 -1.26 -5.07 119.74 117.90 1ao8 s LYS 51 Ca -0.08 -0.71 0.08 0.00 -0.36 0.00 0.00 55.97 54.90 1ao8 s LYS 51 Cb -0.01 -3.86 -0.02 0.00 -1.51 0.00 0.00 37.83 32.43 1ao8 s LYS 51 CO 0.29 -0.55 -0.23 1.03 -0.36 0.00 0.00 175.35 175.53 1ao8 s ARG 52 N 1.77 1.58 0.90 4.03 0.52 -1.26 -4.11 118.95 122.38 1ao8 s ARG 52 Ca 0.07 -0.97 -0.13 0.00 -0.52 0.00 0.00 55.73 54.18 1ao8 s ARG 52 Cb -0.18 -1.69 0.13 0.00 0.52 0.00 0.00 34.95 33.74 1ao8 s ARG 52 CO 0.11 0.44 1.16 -1.25 0.02 0.00 0.00 175.30 175.78 1ao8 s PRO 53 N -1.10 1.25 -0.31 3.54 0.05 -1.26 -5.10 135.00 132.07 1ao8 s PRO 53 Ca 0.09 0.17 -0.21 0.00 0.05 0.00 0.00 61.00 61.10 1ao8 s PRO 53 Cb -0.09 -1.86 -0.01 0.00 0.05 0.00 0.00 34.50 32.59 1ao8 s PRO 53 CO 0.01 -2.10 0.66 -0.51 0.05 0.00 0.00 177.00 175.11 1ao8 s LEU 54 N -5.93 4.15 0.97 -3.56 1.43 -1.26 -5.06 118.68 109.43 1ao8 s LEU 54 Ca 0.64 0.42 -0.16 0.00 -1.03 0.00 0.00 54.13 54.01 1ao8 s LEU 54 Cb -0.13 -2.85 0.20 0.00 0.03 0.00 0.00 46.19 43.44 1ao8 s LEU 54 CO 0.52 -0.52 1.30 -2.16 0.23 0.00 0.00 176.35 175.72 1ao8 s PRO 55 N 2.68 0.58 0.00 1.29 0.04 -1.26 -4.29 135.00 134.05 1ao8 s PRO 55 Ca 0.26 -0.34 0.00 0.00 0.04 0.00 0.00 61.00 60.96 1ao8 s PRO 55 Cb -0.15 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1ao8 s PRO 55 CO 0.12 -2.47 0.00 0.39 0.04 0.00 0.00 177.00 175.09 1ao8 n GLU 56 N -3.82 0.00 -3.55 4.56 1.02 -1.26 -4.94 120.64 112.65 1ao8 n GLU 56 Ca 0.14 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.20 1ao8 n GLU 56 Cb 0.60 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.60 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 -0.03 1.14 0.49 3.49 1.04 -1.26 -2.30 118.95 121.52 1ao8 s ARG 57 Ca 0.00 -0.49 -0.21 0.00 -1.04 0.00 0.00 55.73 53.99 1ao8 s ARG 57 Cb 0.00 0.48 -0.07 0.00 -2.04 0.00 0.00 34.95 33.32 1ao8 s ARG 57 CO 0.00 -0.51 1.13 0.99 -0.04 0.00 0.00 175.30 176.87 1ao8 s THR 58 N -3.45 3.24 -0.19 4.99 2.01 -1.23 -4.91 115.64 116.11 1ao8 s THR 58 Ca 0.05 0.85 -0.05 0.00 0.31 0.00 0.00 61.69 62.86 1ao8 s THR 58 Cb -0.02 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 1ao8 s THR 58 CO -0.07 -0.09 -0.00 0.20 -0.69 0.00 0.00 174.62 173.97 1ao8 s ASN 59 N -1.59 4.87 -0.30 3.53 0.02 -1.26 -2.40 114.94 117.80 1ao8 s ASN 59 Ca 0.67 -0.17 0.03 0.00 -1.02 0.00 0.00 52.86 52.37 1ao8 s ASN 59 Cb -0.25 -1.82 0.08 0.00 0.02 0.00 0.00 41.25 39.28 1ao8 s ASN 59 CO 0.30 0.10 0.00 -0.69 0.02 0.00 0.00 177.10 176.83 1ao8 s VAL 60 N 0.81 1.99 -0.17 1.60 1.01 -0.56 -2.17 120.40 122.91 1ao8 s VAL 60 Ca 0.00 -1.91 -0.12 0.00 0.00 0.00 0.00 61.98 59.95 1ao8 s VAL 60 Cb -0.14 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 1ao8 s VAL 60 CO 0.02 -0.40 0.22 -0.69 0.00 0.00 0.00 175.10 174.25 1ao8 s VAL 61 N 1.10 5.35 -0.14 2.92 1.01 -0.91 -1.37 120.40 128.36 1ao8 s VAL 61 Ca 0.04 0.40 -0.00 0.00 0.00 0.00 0.00 61.98 62.41 1ao8 s VAL 61 Cb -0.19 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1ao8 s VAL 61 CO -0.09 0.44 -0.09 -0.22 0.00 0.00 0.00 175.10 175.14 1ao8 s LEU 62 N 0.23 1.46 0.33 3.92 2.96 -0.95 -2.42 118.68 124.22 1ao8 s LEU 62 Ca 0.13 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.61 1ao8 s LEU 62 Cb -0.12 -0.96 -0.01 0.00 0.50 0.00 0.00 46.19 45.59 1ao8 s LEU 62 CO 0.02 -0.12 0.38 0.28 -1.32 0.00 0.00 176.35 175.59 1ao8 s THR 63 N 1.62 0.00 -0.44 3.68 -1.32 -1.25 -3.94 115.64 114.00 1ao8 s THR 63 Ca 0.04 -1.78 0.04 0.00 -1.21 0.00 0.00 61.69 58.78 1ao8 s THR 63 Cb -0.13 -2.58 0.64 0.00 -1.51 0.00 0.00 72.50 68.91 1ao8 s THR 63 CO -0.09 0.00 1.86 1.41 -2.21 0.00 0.00 174.62 175.59 1ao8 n HIS 64 N -0.58 2.82 -4.27 9.09 8.25 -1.26 -4.70 115.22 124.57 1ao8 n HIS 64 Ca 0.04 -1.88 -0.29 0.00 -0.26 0.00 0.00 57.72 55.32 1ao8 n HIS 64 Cb 0.62 -0.91 -0.11 0.00 1.12 0.00 0.00 29.99 30.71 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 -3.32 1.91 -0.24 -0.41 2.00 -1.26 -5.03 119.66 113.31 1ao8 s GLN 65 Ca 0.56 -1.12 0.10 0.00 -2.00 0.00 0.00 55.36 52.90 1ao8 s GLN 65 Cb 0.47 -2.19 0.44 0.00 0.80 0.00 0.00 33.01 32.54 1ao8 s GLN 65 CO 0.09 0.49 1.20 0.39 -0.50 0.00 0.00 175.29 176.96 1ao8 n GLU 66 N 0.74 2.40 -1.52 1.67 1.02 -1.26 -4.65 120.64 119.03 1ao8 n GLU 66 Ca -0.15 -3.63 -0.01 0.00 -0.02 0.00 0.00 57.16 53.36 1ao8 n GLU 66 Cb 0.53 -1.84 -0.00 0.00 -0.02 0.00 0.00 31.44 30.11 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 -0.86 0.21 -4.93 1.62 8.00 -1.26 -5.12 116.55 114.21 1ao8 n ASP 67 Ca 0.29 -2.02 -0.25 0.00 0.71 0.00 0.00 54.79 53.52 1ao8 n ASP 67 Cb 0.83 -0.05 0.01 0.00 -0.02 0.00 0.00 41.12 41.90 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 -0.34 3.36 -0.03 1.24 5.04 -1.26 -5.10 117.35 120.25 1ao8 s TYR 68 Ca 0.20 0.54 -0.05 0.00 -2.44 0.00 0.00 57.07 55.32 1ao8 s TYR 68 Cb 0.25 -2.40 0.01 0.00 0.35 0.00 0.00 41.96 40.17 1ao8 s TYR 68 CO -0.10 -0.43 0.13 -0.65 -1.34 0.00 0.00 175.55 173.17 1ao8 s GLN 69 N -4.72 0.28 -0.30 4.97 -0.21 -1.26 -5.08 119.66 113.34 1ao8 s GLN 69 Ca 0.49 -0.05 -0.06 0.00 0.02 0.00 0.00 55.36 55.76 1ao8 s GLN 69 Cb -0.10 0.12 0.18 0.00 1.00 0.00 0.00 33.01 34.21 1ao8 s GLN 69 CO 0.42 -0.05 0.79 0.00 -2.12 0.00 0.00 175.29 174.32 1ao8 s ALA 70 N -0.50 -2.73 -0.67 6.09 0.00 -1.26 -5.08 121.76 117.61 1ao8 s ALA 70 Ca -0.06 1.70 -0.27 0.00 0.00 0.00 0.00 51.96 53.34 1ao8 s ALA 70 Cb -0.04 -2.29 0.03 0.00 0.00 0.00 0.00 23.12 20.83 1ao8 s ALA 70 CO 0.01 -1.36 1.20 -0.65 0.00 0.00 0.00 175.76 174.96 1ao8 s GLN 71 N 2.89 3.31 0.00 0.00 1.11 -1.26 -3.36 119.66 122.34 1ao8 s GLN 71 Ca 0.11 -0.11 0.00 0.00 0.01 0.00 0.00 55.36 55.37 1ao8 s GLN 71 Cb -0.13 -4.12 0.00 0.00 -1.01 0.00 0.00 33.01 27.75 1ao8 s GLN 71 CO -0.17 -1.92 0.00 0.41 0.01 0.00 0.00 175.29 173.62 1ao8 n GLY 72 N 5.25 1.78 3.94 3.09 0.00 -1.26 -4.77 105.19 113.21 1ao8 n GLY 72 Ca 0.04 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.48 3.66 -0.18 4.61 0.00 -1.21 -4.78 121.76 123.38 1ao8 s ALA 73 Ca 0.00 -0.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.97 1ao8 s ALA 73 Cb 0.00 -2.18 -0.05 0.00 0.00 0.00 0.00 23.12 20.89 1ao8 s ALA 73 CO 0.00 -0.10 0.22 0.08 0.00 0.00 0.00 175.76 175.96 1ao8 s VAL 74 N -2.40 5.35 -0.32 0.00 1.01 -0.92 -4.81 120.40 118.31 1ao8 s VAL 74 Ca 0.42 0.40 -0.09 0.00 0.00 0.00 0.00 61.98 62.70 1ao8 s VAL 74 Cb -0.10 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.73 1ao8 s VAL 74 CO 0.37 0.41 0.14 -0.69 0.00 0.00 0.00 175.10 175.34 1ao8 s VAL 75 N 0.42 4.40 0.17 2.92 1.01 -1.26 -2.14 120.40 125.92 1ao8 s VAL 75 Ca 0.13 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.55 1ao8 s VAL 75 Cb -0.12 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.91 1ao8 s VAL 75 CO 0.01 -0.01 -0.12 0.68 0.00 0.00 0.00 175.10 175.66 1ao8 s VAL 76 N 1.56 1.40 -0.17 2.92 -7.23 -1.02 -5.02 120.40 112.85 1ao8 s VAL 76 Ca 0.03 -2.12 0.21 0.00 -1.81 0.00 0.00 61.98 58.29 1ao8 s VAL 76 Cb -0.18 -1.92 0.43 0.00 0.56 0.00 0.00 36.38 35.27 1ao8 s VAL 76 CO 0.05 -0.68 1.18 1.41 -0.31 0.00 0.00 175.10 176.74 1ao8 n HIS 77 N -0.27 0.32 -3.73 2.82 8.25 -1.26 -3.77 115.22 117.59 1ao8 n HIS 77 Ca -0.09 -1.43 -0.12 0.00 -0.26 0.00 0.00 57.72 55.81 1ao8 n HIS 77 Cb 0.60 0.09 -0.11 0.00 1.12 0.00 0.00 29.99 31.69 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 -2.65 -0.38 0.19 0.41 -1.08 -1.26 -5.00 116.67 106.91 1ao8 s ASP 78 Ca 0.24 0.70 -0.10 0.00 -0.52 0.00 0.00 52.55 52.87 1ao8 s ASP 78 Cb 0.33 0.64 0.12 0.00 -1.46 0.00 0.00 42.92 42.55 1ao8 s ASP 78 CO -0.09 -0.15 1.77 0.58 0.52 0.00 0.00 175.17 177.80 1ao8 h VAL 79 N 5.22 1.24 -0.17 1.11 2.07 -2.00 -2.06 116.25 121.65 1ao8 h VAL 79 Ca -0.33 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 1ao8 h VAL 79 Cb 1.18 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1ao8 h VAL 79 CO 0.32 0.28 -0.13 0.00 0.02 0.00 0.00 177.57 178.06 1ao8 h ALA 80 N 1.15 1.47 -0.17 1.67 0.00 -1.99 -2.11 119.26 119.28 1ao8 h ALA 80 Ca 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ao8 h ALA 80 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ao8 h ALA 80 CO -0.03 0.37 0.06 0.00 0.00 0.00 0.00 179.25 179.66 1ao8 h ALA 81 N 1.62 0.23 -0.13 0.00 0.00 -1.79 0.93 119.26 120.11 1ao8 h ALA 81 Ca 0.05 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1ao8 h ALA 81 Cb 0.39 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1ao8 h ALA 81 CO 0.02 -0.17 -0.16 0.28 0.00 0.00 0.00 179.25 179.22 1ao8 h VAL 82 N 0.12 1.19 -0.10 0.00 2.07 -1.19 -1.52 116.25 116.80 1ao8 h VAL 82 Ca 0.06 -0.84 -0.10 0.00 0.82 0.00 0.00 66.70 66.64 1ao8 h VAL 82 Cb 0.20 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1ao8 h VAL 82 CO -0.00 0.26 -0.31 -0.26 0.02 0.00 0.00 177.57 177.27 1ao8 h PHE 83 N 0.20 0.51 -0.51 1.57 -1.00 -0.95 -2.21 116.94 114.54 1ao8 h PHE 83 Ca 0.04 -0.21 -0.03 0.00 2.81 0.00 0.00 57.97 60.58 1ao8 h PHE 83 Cb 0.41 -0.09 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 1ao8 h PHE 83 CO 0.01 0.92 0.18 0.00 -1.61 0.00 0.00 178.31 177.81 1ao8 h ALA 84 N 0.49 1.36 -0.30 2.45 0.00 -0.58 0.13 119.26 122.81 1ao8 h ALA 84 Ca -0.01 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1ao8 h ALA 84 Cb 0.93 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1ao8 h ALA 84 CO 0.07 0.48 -0.33 -0.92 0.00 0.00 0.00 179.25 178.54 1ao8 h TYR 85 N 0.74 0.76 -0.03 0.00 3.20 -1.25 -1.89 116.97 118.49 1ao8 h TYR 85 Ca 0.17 -0.20 -0.24 0.00 3.14 0.00 0.00 58.73 61.61 1ao8 h TYR 85 Cb 0.18 -0.17 0.01 0.00 1.54 0.00 0.00 36.73 38.29 1ao8 h TYR 85 CO 0.01 0.90 -0.93 0.00 -1.64 0.00 0.00 178.16 176.50 1ao8 h ALA 86 N 1.08 0.30 -0.27 1.82 0.00 -0.74 -3.16 119.26 118.28 1ao8 h ALA 86 Ca 0.06 -0.68 -0.06 0.00 0.00 0.00 0.00 54.91 54.23 1ao8 h ALA 86 Cb 0.83 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1ao8 h ALA 86 CO 0.07 0.74 -0.10 -0.22 0.00 0.00 0.00 179.25 179.74 1ao8 h LYS 87 N 0.34 0.45 0.00 0.00 3.64 -0.64 -2.00 116.57 118.36 1ao8 h LYS 87 Ca -0.09 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.16 1ao8 h LYS 87 Cb 1.57 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.33 1ao8 h LYS 87 CO 0.17 0.56 -0.08 0.37 -2.27 0.00 0.00 179.45 178.20 1ao8 h GLN 88 N 0.42 0.00 -4.44 1.90 5.75 -1.31 -3.36 115.11 114.07 1ao8 h GLN 88 Ca 0.08 0.00 -0.72 0.00 -0.15 0.00 0.00 58.65 57.87 1ao8 h GLN 88 Cb 0.44 0.00 -0.28 0.00 1.07 0.00 0.00 27.48 28.71 1ao8 h GLN 88 CO 0.02 0.08 -0.46 -1.01 -2.65 0.00 0.00 178.83 174.81 1ao8 s HIS 89 N -4.60 3.36 -0.00 3.99 3.76 -0.75 -4.93 115.29 116.12 1ao8 s HIS 89 Ca -0.04 -1.62 0.17 0.00 -0.15 0.00 0.00 55.06 53.42 1ao8 s HIS 89 Cb 0.15 -3.03 0.36 0.00 1.11 0.00 0.00 32.58 31.17 1ao8 s HIS 89 CO 0.62 -0.87 1.58 -1.00 -0.85 0.00 0.00 174.74 174.22 1ao8 h PRO 90 N 8.39 0.00 -0.87 8.40 0.14 -1.77 -3.16 132.00 143.13 1ao8 h PRO 90 Ca -0.22 0.00 -0.27 0.00 0.14 0.00 0.00 66.00 65.65 1ao8 h PRO 90 Cb 1.08 0.00 -0.16 0.00 0.14 0.00 0.00 31.00 32.06 1ao8 h PRO 90 CO 0.77 0.45 0.35 -0.25 0.14 0.00 0.00 178.00 179.45 1ao8 n ASP 91 N -3.35 4.10 -4.13 1.44 9.92 -1.26 -4.91 116.55 118.36 1ao8 n ASP 91 Ca 0.01 -3.13 -0.09 0.00 -0.53 0.00 0.00 54.79 51.06 1ao8 n ASP 91 Cb 0.63 -0.74 -0.10 0.00 -0.64 0.00 0.00 41.12 40.28 1ao8 n ASP 91 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1ao8 s GLN 92 N -2.63 0.73 0.11 -1.24 -0.21 -1.20 -4.87 119.66 110.36 1ao8 s GLN 92 Ca 0.46 -1.29 0.06 0.00 0.02 0.00 0.00 55.36 54.61 1ao8 s GLN 92 Cb 0.38 0.06 -0.04 0.00 1.00 0.00 0.00 33.01 34.41 1ao8 s GLN 92 CO 0.11 -0.09 -0.14 -1.21 -2.12 0.00 0.00 175.29 171.84 1ao8 s GLU 93 N -3.90 0.98 -0.38 2.91 0.41 -1.26 -4.93 118.70 112.53 1ao8 s GLU 93 Ca 0.11 -1.20 -0.23 0.00 -0.41 0.00 0.00 54.97 53.24 1ao8 s GLU 93 Cb 0.07 -0.85 0.01 0.00 -1.78 0.00 0.00 34.13 31.58 1ao8 s GLU 93 CO -0.07 0.16 0.77 -1.17 -0.49 0.00 0.00 175.26 174.47 1ao8 s LEU 94 N -2.38 4.15 -0.24 1.80 2.96 -1.26 -2.28 118.68 121.44 1ao8 s LEU 94 Ca 0.07 0.28 -0.08 0.00 -0.22 0.00 0.00 54.13 54.19 1ao8 s LEU 94 Cb -0.05 -3.00 -0.03 0.00 0.50 0.00 0.00 46.19 43.60 1ao8 s LEU 94 CO 0.03 -0.75 0.08 -0.69 -1.32 0.00 0.00 176.35 173.69 1ao8 s VAL 95 N 3.10 4.51 -0.41 1.68 1.01 -0.97 0.29 120.40 129.61 1ao8 s VAL 95 Ca 0.31 -0.11 -0.17 0.00 0.00 0.00 0.00 61.98 62.00 1ao8 s VAL 95 Cb -0.13 -3.09 0.02 0.00 0.00 0.00 0.00 36.38 33.17 1ao8 s VAL 95 CO 0.18 0.36 0.45 -0.63 0.00 0.00 0.00 175.10 175.46 1ao8 s ILE 96 N 1.33 5.07 -0.19 2.22 -1.09 0.64 -1.31 121.20 127.86 1ao8 s ILE 96 Ca 0.05 -0.21 -0.14 0.00 -2.23 0.00 0.00 60.65 58.12 1ao8 s ILE 96 Cb -0.15 -4.02 -0.20 0.00 -1.58 0.00 0.00 42.46 36.51 1ao8 s ILE 96 CO 0.04 -0.38 0.15 0.00 -1.23 0.00 0.00 174.94 173.51 1ao8 n ALA 97 N 5.64 0.93 0.00 9.38 0.00 -0.94 -1.53 120.51 133.99 1ao8 n ALA 97 Ca -0.07 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1ao8 n ALA 97 Cb 0.48 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.46 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 1.65 -1.05 0.00 0.00 0.00 -1.25 -4.68 105.19 99.86 1ao8 n GLY 98 Ca -0.36 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.53 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 -0.00 0.23 -0.02 0.00 -1.26 -1.19 105.19 102.95 1ao8 n GLY 99 Ca 0.00 -1.52 0.01 0.00 0.00 0.00 0.00 46.02 44.51 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 1.37 -0.46 4.61 0.00 -1.92 -2.33 119.26 118.54 1ao8 h ALA 100 Ca 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 1ao8 h ALA 100 Cb 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1ao8 h ALA 100 CO 0.00 0.43 0.09 0.37 0.00 0.00 0.00 179.25 180.14 1ao8 h GLN 101 N 0.24 0.70 -0.06 0.00 5.75 -1.99 -2.08 115.11 117.68 1ao8 h GLN 101 Ca 0.04 -0.14 -0.21 0.00 -0.15 0.00 0.00 58.65 58.20 1ao8 h GLN 101 Cb 0.50 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 28.94 1ao8 h GLN 101 CO 0.03 0.65 -0.82 0.82 -2.65 0.00 0.00 178.83 176.87 1ao8 h ILE 102 N 0.68 1.37 -0.61 2.39 1.08 -1.69 -3.11 117.51 117.62 1ao8 h ILE 102 Ca 0.15 -2.22 -0.04 0.00 -0.39 0.00 0.00 64.86 62.36 1ao8 h ILE 102 Cb 0.28 2.20 -0.03 0.00 -3.07 0.00 0.00 36.82 36.21 1ao8 h ILE 102 CO 0.00 0.67 0.22 -0.26 -0.69 0.00 0.00 178.15 178.10 1ao8 h PHE 103 N 0.30 0.90 -0.32 1.37 0.04 -0.99 -2.03 116.94 116.21 1ao8 h PHE 103 Ca -0.05 -0.06 -0.06 0.00 2.80 0.00 0.00 57.97 60.60 1ao8 h PHE 103 Cb 1.42 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 39.28 1ao8 h PHE 103 CO 0.06 0.71 -0.06 1.15 -0.60 0.00 0.00 178.31 179.57 1ao8 h THR 104 N 0.88 1.21 -0.20 -1.55 2.02 -1.35 -2.86 112.91 111.06 1ao8 h THR 104 Ca 0.20 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.46 1ao8 h THR 104 Cb 0.20 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1ao8 h THR 104 CO -0.02 0.30 0.04 0.00 0.37 0.00 0.00 175.52 176.22 1ao8 h ALA 105 N 1.45 0.27 -0.87 6.16 0.00 -1.31 -3.13 119.26 121.82 1ao8 h ALA 105 Ca 0.10 -0.17 -0.72 0.00 0.00 0.00 0.00 54.91 54.12 1ao8 h ALA 105 Cb 0.41 -0.08 -0.20 0.00 0.00 0.00 0.00 17.79 17.92 1ao8 h ALA 105 CO 0.02 -0.07 1.42 1.19 0.00 0.00 0.00 179.25 181.81 1ao8 n PHE 106 N -4.75 2.53 -0.05 0.00 3.72 -1.03 -4.49 117.46 113.39 1ao8 n PHE 106 Ca -0.04 -2.51 -0.08 0.00 -0.05 0.00 0.00 57.45 54.77 1ao8 n PHE 106 Cb 0.18 -1.46 -0.14 0.00 -0.94 0.00 0.00 39.48 37.12 1ao8 n PHE 106 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1ao8 n LYS 107 N 0.68 0.66 -1.18 -1.08 3.00 -1.19 -4.16 118.16 114.88 1ao8 n LYS 107 Ca 0.54 0.15 -0.26 0.00 -0.00 0.00 0.00 58.31 58.74 1ao8 n LYS 107 Cb 0.30 -1.67 0.13 0.00 0.00 0.00 0.00 35.03 33.79 1ao8 n LYS 107 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1ao8 n ASP 108 N -2.88 5.27 -2.74 3.14 8.00 -1.26 -4.59 116.55 121.48 1ao8 n ASP 108 Ca -0.23 -3.55 -0.05 0.00 0.71 0.00 0.00 54.79 51.67 1ao8 n ASP 108 Cb 1.07 -0.89 0.03 0.00 -0.02 0.00 0.00 41.12 41.31 1ao8 n ASP 108 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ao8 n ASP 109 N -0.88 -2.88 -3.64 -2.24 8.00 -1.26 -5.13 116.55 108.52 1ao8 n ASP 109 Ca 0.56 -2.63 -0.05 0.00 0.71 0.00 0.00 54.79 53.37 1ao8 n ASP 109 Cb 1.19 1.55 -0.06 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 0.79 -0.15 -0.05 2.53 0.11 -1.26 -4.79 120.40 117.59 1ao8 s VAL 110 Ca 0.29 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.34 1ao8 s VAL 110 Cb 0.09 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 1ao8 s VAL 110 CO -0.11 0.00 -0.04 -0.90 -3.33 0.00 0.00 175.10 170.72 1ao8 n ASP 111 N 4.41 3.00 -4.83 3.54 5.75 -1.26 -4.97 116.55 122.19 1ao8 n ASP 111 Ca -0.18 -0.01 -0.37 0.00 -0.01 0.00 0.00 54.79 54.22 1ao8 n ASP 111 Cb 0.57 -0.09 -0.06 0.00 -1.03 0.00 0.00 41.12 40.51 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 -2.09 5.37 -0.34 2.12 2.01 -1.26 -2.66 115.64 118.79 1ao8 s THR 112 Ca -0.06 0.38 0.02 0.00 0.31 0.00 0.00 61.69 62.34 1ao8 s THR 112 Cb 0.02 -3.51 0.10 0.00 0.01 0.00 0.00 72.50 69.13 1ao8 s THR 112 CO 0.10 0.55 0.09 -0.76 -0.69 0.00 0.00 174.62 173.91 1ao8 s LEU 113 N -0.62 3.49 -0.14 4.42 1.43 -0.72 -2.37 118.68 124.17 1ao8 s LEU 113 Ca 0.16 -1.98 -0.20 0.00 -1.03 0.00 0.00 54.13 51.09 1ao8 s LEU 113 Cb -0.13 -1.25 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 1ao8 s LEU 113 CO 0.05 -0.39 0.55 -0.76 0.23 0.00 0.00 176.35 176.04 1ao8 s LEU 114 N 1.16 4.23 -0.01 1.79 1.43 -0.48 -2.49 118.68 124.31 1ao8 s LEU 114 Ca 0.11 0.85 -0.07 0.00 -1.03 0.00 0.00 54.13 53.99 1ao8 s LEU 114 Cb -0.19 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.24 1ao8 s LEU 114 CO -0.15 -0.11 0.14 0.54 0.23 0.00 0.00 176.35 177.00 1ao8 s VAL 115 N 1.10 0.07 -0.36 -1.59 0.11 -1.05 -2.31 120.40 116.38 1ao8 s VAL 115 Ca 0.28 -0.61 -0.03 0.00 -2.93 0.00 0.00 61.98 58.69 1ao8 s VAL 115 Cb -0.16 -0.41 0.08 0.00 -1.53 0.00 0.00 36.38 34.36 1ao8 s VAL 115 CO 0.11 -0.33 0.11 -0.89 -3.33 0.00 0.00 175.10 170.77 1ao8 s THR 116 N -1.21 3.23 -0.19 5.04 2.01 -0.90 -1.33 115.64 122.29 1ao8 s THR 116 Ca -0.13 -1.67 -0.26 0.00 0.31 0.00 0.00 61.69 59.94 1ao8 s THR 116 Cb -0.07 -3.03 -0.01 0.00 0.01 0.00 0.00 72.50 69.41 1ao8 s THR 116 CO 0.01 -0.39 0.88 -0.13 -0.69 0.00 0.00 174.62 174.30 1ao8 s ARG 117 N 1.22 4.28 0.32 4.92 0.52 -0.89 -2.27 118.95 127.05 1ao8 s ARG 117 Ca 0.02 1.09 -0.00 0.00 -0.52 0.00 0.00 55.73 56.32 1ao8 s ARG 117 Cb -0.21 -3.60 0.06 0.00 0.52 0.00 0.00 34.95 31.73 1ao8 s ARG 117 CO -0.02 -0.41 0.44 1.28 0.02 0.00 0.00 175.30 176.61 1ao8 n LEU 118 N 5.54 0.00 0.00 2.53 4.32 -0.90 -1.03 117.00 127.46 1ao8 n LEU 118 Ca 0.06 -0.92 0.00 0.00 -0.02 0.00 0.00 56.01 55.13 1ao8 n LEU 118 Cb 0.48 -0.29 0.00 0.00 -1.62 0.00 0.00 43.42 41.99 1ao8 n LEU 118 CO 0.49 -0.72 -0.48 0.00 -1.22 0.00 0.00 177.39 175.46 1ao8 n ALA 119 N -2.97 2.39 -1.76 -1.18 0.00 -0.87 -4.19 120.51 111.94 1ao8 n ALA 119 Ca -0.07 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.99 1ao8 n ALA 119 Cb 0.26 0.48 0.00 0.00 0.00 0.00 0.00 19.45 20.19 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 -4.37 2.81 0.41 0.00 0.00 -0.78 -4.71 107.32 100.69 1ao8 s GLY 120 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 44.72 45.71 1ao8 s GLY 120 CO 0.00 1.52 0.71 -1.35 0.00 0.00 0.00 173.10 173.98 1ao8 s SER 121 N -1.25 6.35 0.18 1.64 1.04 -1.26 -4.49 113.70 115.91 1ao8 s SER 121 Ca 0.66 0.86 -0.11 0.00 0.48 0.00 0.00 55.95 57.83 1ao8 s SER 121 Cb -0.32 -2.21 -0.00 0.00 0.10 0.00 0.00 66.02 63.59 1ao8 s SER 121 CO 0.38 -0.44 0.36 -0.36 0.98 0.00 0.00 173.24 174.17 1ao8 s PHE 122 N -2.49 0.29 0.04 5.02 0.08 -1.26 -5.10 117.98 114.55 1ao8 s PHE 122 Ca 0.46 -0.64 0.06 0.00 0.12 0.00 0.00 56.93 56.93 1ao8 s PHE 122 Cb -0.10 0.07 -0.03 0.00 -0.57 0.00 0.00 43.02 42.38 1ao8 s PHE 122 CO 0.38 -0.80 -0.15 -2.00 -0.10 0.00 0.00 175.22 172.56 1ao8 s GLU 123 N -3.95 2.18 0.00 0.44 2.12 -1.26 -4.95 118.70 113.28 1ao8 s GLU 123 Ca 0.16 -0.93 0.00 0.00 0.36 0.00 0.00 54.97 54.56 1ao8 s GLU 123 Cb 0.02 -2.27 0.00 0.00 0.26 0.00 0.00 34.13 32.14 1ao8 s GLU 123 CO 0.01 0.55 0.00 0.41 -0.54 0.00 0.00 175.26 175.69 1ao8 n GLY 124 N 1.44 -0.89 0.04 -1.50 0.00 -1.26 -4.91 105.19 98.12 1ao8 n GLY 124 Ca -0.16 -1.01 -0.02 0.00 0.00 0.00 0.00 46.02 44.83 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 2.75 -4.68 1.61 9.92 -1.26 -4.96 116.55 119.93 1ao8 n ASP 125 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.84 1ao8 n ASP 125 Cb 0.00 0.88 -0.03 0.00 -0.64 0.00 0.00 41.12 41.33 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 -2.32 3.78 0.32 -3.53 2.01 -1.21 -5.00 115.64 109.68 1ao8 s THR 126 Ca -0.04 1.10 0.04 0.00 0.31 0.00 0.00 61.69 63.09 1ao8 s THR 126 Cb 0.03 -3.71 -0.06 0.00 0.01 0.00 0.00 72.50 68.77 1ao8 s THR 126 CO 0.38 -0.03 0.06 -0.54 -0.69 0.00 0.00 174.62 173.80 1ao8 s LYS 127 N 2.81 1.64 0.14 4.92 1.02 -1.26 -1.26 119.74 127.74 1ao8 s LYS 127 Ca 0.64 -1.91 -0.13 0.00 0.02 0.00 0.00 55.97 54.59 1ao8 s LYS 127 Cb -0.30 -0.84 -0.07 0.00 -0.52 0.00 0.00 37.83 36.11 1ao8 s LYS 127 CO 0.25 -0.19 0.52 1.41 -0.92 0.00 0.00 175.35 176.41 1ao8 s MET 128 N -3.90 3.92 1.02 1.68 -2.45 -1.14 -4.73 119.30 113.70 1ao8 s MET 128 Ca 0.37 0.40 -0.12 0.00 -1.25 0.00 0.00 55.69 55.09 1ao8 s MET 128 Cb 0.09 -2.93 0.20 0.00 1.25 0.00 0.00 34.83 33.45 1ao8 s MET 128 CO 0.15 0.49 1.08 0.96 1.05 0.00 0.00 175.02 178.75 1ao8 s ILE 129 N -1.47 2.21 -0.56 10.11 -4.36 -1.26 -4.93 121.20 120.94 1ao8 s ILE 129 Ca 0.37 0.07 -0.28 0.00 -0.26 0.00 0.00 60.65 60.55 1ao8 s ILE 129 Cb -0.14 -2.28 0.03 0.00 1.25 0.00 0.00 42.46 41.32 1ao8 s ILE 129 CO 0.19 -0.09 1.21 -2.16 0.24 0.00 0.00 174.94 174.33 1ao8 s PRO 130 N -4.68 3.53 0.31 0.37 0.05 -1.26 -5.03 135.00 128.29 1ao8 s PRO 130 Ca 0.66 0.33 0.08 0.00 0.05 0.00 0.00 61.00 62.12 1ao8 s PRO 130 Cb -0.22 -4.01 -0.04 0.00 0.05 0.00 0.00 34.50 30.28 1ao8 s PRO 130 CO 0.60 -1.66 0.17 -0.51 0.05 0.00 0.00 177.00 175.65 1ao8 s LEU 131 N 5.01 3.43 -0.35 -3.56 1.43 -1.26 -5.09 118.68 118.28 1ao8 s LEU 131 Ca 0.45 -0.59 -0.14 0.00 -1.03 0.00 0.00 54.13 52.82 1ao8 s LEU 131 Cb -0.08 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.17 1ao8 s LEU 131 CO 0.26 -0.22 0.28 0.21 0.23 0.00 0.00 176.35 177.12 1ao8 s ASN 132 N -3.85 6.10 0.00 2.29 3.84 -1.26 -4.93 114.94 117.12 1ao8 s ASN 132 Ca 0.37 -0.44 0.20 0.00 0.21 0.00 0.00 52.86 53.20 1ao8 s ASN 132 Cb -0.05 -2.16 0.54 0.00 -0.55 0.00 0.00 41.25 39.03 1ao8 s ASN 132 CO 0.24 -0.29 1.45 0.79 -2.79 0.00 0.00 177.10 176.50 1ao8 n TRP 133 N 5.19 0.70 0.02 0.43 7.02 -1.26 -4.15 117.44 125.38 1ao8 n TRP 133 Ca -0.12 -0.35 -0.06 0.00 -1.02 0.00 0.00 57.50 55.96 1ao8 n TRP 133 Cb 0.49 0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.27 1ao8 n TRP 133 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 1ao8 h ASP 134 N 3.69 0.00 -0.86 -0.99 3.58 -2.04 -3.33 116.42 116.46 1ao8 h ASP 134 Ca 0.00 0.00 -0.56 0.00 0.42 0.00 0.00 57.03 56.89 1ao8 h ASP 134 Cb 0.83 0.00 -0.25 0.00 1.72 0.00 0.00 39.33 41.63 1ao8 h ASP 134 CO 0.00 0.88 0.73 0.47 -2.88 0.00 0.00 179.24 178.43 1ao8 n ASP 135 N -3.09 6.74 -4.09 2.28 9.92 -1.26 -4.92 116.55 122.13 1ao8 n ASP 135 Ca -0.11 -3.56 -0.10 0.00 -0.53 0.00 0.00 54.79 50.49 1ao8 n ASP 135 Cb 0.96 -0.96 -0.08 0.00 -0.64 0.00 0.00 41.12 40.40 1ao8 n ASP 135 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1ao8 s PHE 136 N -3.22 0.75 -0.02 1.24 0.40 -1.25 -4.17 117.98 111.70 1ao8 s PHE 136 Ca 0.55 -1.05 -0.04 0.00 -0.60 0.00 0.00 56.93 55.79 1ao8 s PHE 136 Cb 0.44 -0.22 0.00 0.00 0.51 0.00 0.00 43.02 43.75 1ao8 s PHE 136 CO 0.01 -0.76 0.09 0.99 0.70 0.00 0.00 175.22 176.25 1ao8 s THR 137 N -4.07 0.03 -0.26 0.64 2.01 -0.07 -4.89 115.64 109.02 1ao8 s THR 137 Ca 0.29 -0.25 -0.13 0.00 0.31 0.00 0.00 61.69 61.91 1ao8 s THR 137 Cb 0.04 -0.22 -0.04 0.00 0.01 0.00 0.00 72.50 72.28 1ao8 s THR 137 CO 0.08 -0.14 0.26 -0.75 -0.69 0.00 0.00 174.62 173.39 1ao8 s LYS 138 N -0.41 4.01 -0.08 4.92 2.20 -1.26 -0.81 119.74 128.31 1ao8 s LYS 138 Ca -0.05 -0.15 0.07 0.00 -0.36 0.00 0.00 55.97 55.49 1ao8 s LYS 138 Cb -0.03 -3.63 -0.10 0.00 -1.51 0.00 0.00 37.83 32.56 1ao8 s LYS 138 CO 0.00 -0.16 0.03 1.33 -0.36 0.00 0.00 175.35 176.19 1ao8 n VAL 139 N 4.88 0.58 -4.97 4.02 0.24 -1.19 -4.99 118.33 116.91 1ao8 n VAL 139 Ca -0.12 -0.36 -0.32 0.00 -2.04 0.00 0.00 64.34 61.50 1ao8 n VAL 139 Cb 0.51 -0.78 -0.14 0.00 -1.47 0.00 0.00 33.84 31.97 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1ao8 s SER 140 N -4.06 3.81 -0.29 -1.34 0.15 -1.25 -5.06 113.70 105.66 1ao8 s SER 140 Ca -0.04 -0.28 -0.03 0.00 0.70 0.00 0.00 55.95 56.30 1ao8 s SER 140 Cb 0.03 -0.89 0.17 0.00 -1.71 0.00 0.00 66.02 63.62 1ao8 s SER 140 CO 0.35 0.31 0.59 -0.55 1.20 0.00 0.00 173.24 175.13 1ao8 s SER 141 N -0.51 -1.22 -0.16 5.45 0.15 -1.26 -2.14 113.70 114.01 1ao8 s SER 141 Ca 0.07 0.95 0.01 0.00 0.70 0.00 0.00 55.95 57.67 1ao8 s SER 141 Cb -0.12 2.10 0.02 0.00 -1.71 0.00 0.00 66.02 66.32 1ao8 s SER 141 CO 0.01 -0.26 -0.18 -0.60 1.20 0.00 0.00 173.24 173.42 1ao8 s ARG 142 N 2.84 2.71 -0.05 5.44 3.52 -0.95 -5.02 118.95 127.44 1ao8 s ARG 142 Ca 0.16 -0.72 -0.20 0.00 -0.13 0.00 0.00 55.73 54.84 1ao8 s ARG 142 Cb -0.15 -2.35 -0.05 0.00 -1.56 0.00 0.00 34.95 30.85 1ao8 s ARG 142 CO -0.20 -0.18 0.56 0.99 -0.81 0.00 0.00 175.30 175.66 1ao8 s THR 143 N 1.27 5.03 -0.10 4.11 2.01 -1.26 -1.80 115.64 124.90 1ao8 s THR 143 Ca 0.03 1.16 -0.00 0.00 0.31 0.00 0.00 61.69 63.18 1ao8 s THR 143 Cb -0.13 -3.90 0.02 0.00 0.01 0.00 0.00 72.50 68.50 1ao8 s THR 143 CO -0.10 0.37 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.44 1ao8 s VAL 144 N 0.17 0.95 0.31 3.82 1.01 -0.70 -5.00 120.40 120.96 1ao8 s VAL 144 Ca 0.30 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.99 1ao8 s VAL 144 Cb -0.17 -0.97 -0.05 0.00 0.00 0.00 0.00 36.38 35.20 1ao8 s VAL 144 CO 0.15 0.35 0.55 -1.61 0.00 0.00 0.00 175.10 174.54 1ao8 s GLU 145 N 1.55 3.58 0.00 2.72 2.02 -1.26 -2.41 118.70 124.90 1ao8 s GLU 145 Ca 0.02 -0.10 0.00 0.00 0.02 0.00 0.00 54.97 54.90 1ao8 s GLU 145 Cb -0.13 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1ao8 s GLU 145 CO -0.06 0.19 0.00 -3.47 0.02 0.00 0.00 175.26 171.94 1ao8 n ASP 146 N -1.20 1.56 -0.23 -0.19 -0.08 -1.26 -4.94 116.55 110.22 1ao8 n ASP 146 Ca -0.03 -0.71 -0.07 0.00 -1.51 0.00 0.00 54.79 52.48 1ao8 n ASP 146 Cb 0.54 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.04 1ao8 n ASP 146 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1ao8 h THR 147 N 0.55 1.24 -1.76 5.18 1.35 -1.99 -3.44 112.91 114.03 1ao8 h THR 147 Ca 0.00 -0.74 -0.47 0.00 -0.55 0.00 0.00 66.41 64.65 1ao8 h THR 147 Cb 0.00 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 66.94 1ao8 h THR 147 CO 0.00 0.29 -0.38 0.20 -0.25 0.00 0.00 175.52 175.38 1ao8 s ASN 148 N -6.15 5.57 0.15 5.36 -0.87 -1.26 -5.03 114.94 112.71 1ao8 s ASN 148 Ca -0.13 -0.39 0.09 0.00 -1.57 0.00 0.00 52.86 50.86 1ao8 s ASN 148 Cb 0.13 -1.01 -0.16 0.00 -0.02 0.00 0.00 41.25 40.19 1ao8 s ASN 148 CO 0.80 -0.45 1.29 1.55 -2.57 0.00 0.00 177.10 177.73 1ao8 h PRO 149 N 1.03 0.00 0.00 -0.60 0.13 -2.01 -3.25 132.00 127.29 1ao8 h PRO 149 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1ao8 h PRO 149 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1ao8 h PRO 149 CO 0.55 0.89 -0.04 0.00 -0.23 0.00 0.00 178.00 179.17 1ao8 h ALA 150 N 1.10 0.98 -0.82 -0.56 0.00 -1.95 -3.24 119.26 114.76 1ao8 h ALA 150 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 54.45 1ao8 h ALA 150 Cb 1.70 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 19.24 1ao8 h ALA 150 CO 0.12 0.00 0.56 1.28 0.00 0.00 0.00 179.25 181.21 1ao8 n LEU 151 N -3.07 6.22 -4.78 0.00 4.77 -1.23 -1.87 117.00 117.03 1ao8 n LEU 151 Ca 0.04 -3.31 -0.37 0.00 -0.03 0.00 0.00 56.01 52.33 1ao8 n LEU 151 Cb 0.53 -0.81 -0.06 0.00 -2.33 0.00 0.00 43.42 40.75 1ao8 n LEU 151 CO 0.34 1.00 0.59 -0.89 -1.33 0.00 0.00 177.39 177.10 1ao8 s THR 152 N -2.85 4.28 0.03 -5.08 2.01 -1.22 -4.18 115.64 108.62 1ao8 s THR 152 Ca 0.47 1.74 -0.01 0.00 0.31 0.00 0.00 61.69 64.20 1ao8 s THR 152 Cb 0.40 -4.03 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1ao8 s THR 152 CO 0.08 0.24 -0.00 -1.38 -0.69 0.00 0.00 174.62 172.86 1ao8 s HIS 153 N -1.50 0.28 -0.09 4.92 -3.43 -1.01 -2.04 115.29 112.41 1ao8 s HIS 153 Ca 0.46 -0.59 -0.02 0.00 -0.80 0.00 0.00 55.06 54.12 1ao8 s HIS 153 Cb -0.20 -0.21 0.03 0.00 -1.43 0.00 0.00 32.58 30.78 1ao8 s HIS 153 CO 0.24 -0.25 0.02 0.99 -2.00 0.00 0.00 174.74 173.74 1ao8 s THR 154 N -2.01 0.32 -0.24 -5.38 2.01 -0.19 -1.72 115.64 108.42 1ao8 s THR 154 Ca -0.11 0.05 -0.29 0.00 0.31 0.00 0.00 61.69 61.65 1ao8 s THR 154 Cb -0.06 -0.56 -0.01 0.00 0.01 0.00 0.00 72.50 71.88 1ao8 s THR 154 CO -0.03 0.16 1.28 -0.31 -0.69 0.00 0.00 174.62 175.03 1ao8 s TYR 155 N 1.99 2.76 -0.05 4.92 2.02 -0.75 -2.10 117.35 126.15 1ao8 s TYR 155 Ca 0.04 0.94 0.02 0.00 -0.37 0.00 0.00 57.07 57.71 1ao8 s TYR 155 Cb -0.13 -3.72 -0.03 0.00 -0.40 0.00 0.00 41.96 37.68 1ao8 s TYR 155 CO -0.06 -1.69 -0.10 -1.21 -1.57 0.00 0.00 175.55 170.93 1ao8 s GLU 156 N 3.86 2.61 -0.28 -0.62 0.41 -0.44 -2.24 118.70 122.00 1ao8 s GLU 156 Ca 0.55 -0.64 0.01 0.00 -0.41 0.00 0.00 54.97 54.49 1ao8 s GLU 156 Cb -0.19 -2.49 0.08 0.00 -1.78 0.00 0.00 34.13 29.75 1ao8 s GLU 156 CO 0.19 0.64 0.00 0.08 -0.49 0.00 0.00 175.26 175.68 1ao8 s VAL 157 N -0.82 1.56 0.11 2.63 1.01 -0.91 -2.53 120.40 121.46 1ao8 s VAL 157 Ca 0.13 -1.52 -0.01 0.00 0.00 0.00 0.00 61.98 60.58 1ao8 s VAL 157 Cb -0.11 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1ao8 s VAL 157 CO 0.02 -0.34 0.28 0.26 0.00 0.00 0.00 175.10 175.32 1ao8 s TRP 158 N 1.33 3.50 0.03 5.22 0.52 -1.04 -3.15 118.94 125.35 1ao8 s TRP 158 Ca 0.01 0.31 -0.02 0.00 0.02 0.00 0.00 56.10 56.43 1ao8 s TRP 158 Cb -0.19 -1.81 -0.02 0.00 -1.15 0.00 0.00 33.47 30.30 1ao8 s TRP 158 CO -0.11 0.52 0.01 -0.65 0.02 0.00 0.00 176.95 176.74 1ao8 s GLN 159 N -2.74 0.46 0.50 4.98 -0.21 0.01 -1.75 119.66 120.91 1ao8 s GLN 159 Ca 0.37 -0.79 -0.21 0.00 0.02 0.00 0.00 55.36 54.75 1ao8 s GLN 159 Cb -0.12 0.17 -0.07 0.00 1.00 0.00 0.00 33.01 33.98 1ao8 s GLN 159 CO 0.27 -0.09 1.10 0.21 -2.12 0.00 0.00 175.29 174.67 1ao8 s LYS 160 N -2.35 3.62 -0.00 2.91 2.47 -1.09 -0.90 119.74 124.41 1ao8 s LYS 160 Ca -0.08 1.57 -0.24 0.00 -1.56 0.00 0.00 55.97 55.67 1ao8 s LYS 160 Cb -0.03 -2.15 -0.18 0.00 -1.46 0.00 0.00 37.83 34.01 1ao8 s LYS 160 CO -0.04 -0.62 1.27 0.87 0.16 0.00 0.00 175.35 176.99 1ao8 h LYS 161 N 1.56 0.16 0.00 4.03 1.57 -1.91 -3.45 116.57 118.53 1ao8 h LYS 161 Ca -0.50 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 1ao8 h LYS 161 Cb 1.24 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1ao8 h LYS 161 CO 0.59 0.64 0.00 0.00 -0.57 0.00 0.00 179.45 180.10