#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 0.04 0.27 2.41 0.00 -0.27 -4.10 121.76 120.13 1ao8 s ALA 2 Ca 0.00 0.20 -0.29 0.00 0.00 0.00 0.00 51.96 51.87 1ao8 s ALA 2 Cb 0.00 -0.94 -0.09 0.00 0.00 0.00 0.00 23.12 22.08 1ao8 s ALA 2 CO 0.00 -0.85 1.05 -0.06 0.00 0.00 0.00 175.76 175.90 1ao8 s PHE 3 N 2.24 3.69 -0.21 0.00 0.40 -0.92 -1.27 117.98 121.90 1ao8 s PHE 3 Ca 0.04 1.76 -0.04 0.00 -0.60 0.00 0.00 56.93 58.09 1ao8 s PHE 3 Cb -0.14 -3.19 0.11 0.00 0.51 0.00 0.00 43.02 40.32 1ao8 s PHE 3 CO -0.07 -0.25 0.35 -1.17 0.70 0.00 0.00 175.22 174.78 1ao8 s LEU 4 N -1.43 -0.54 0.10 -0.37 2.96 -0.75 -0.68 118.68 117.98 1ao8 s LEU 4 Ca 0.44 0.39 -0.16 0.00 -0.22 0.00 0.00 54.13 54.58 1ao8 s LEU 4 Cb -0.30 1.03 0.03 0.00 0.50 0.00 0.00 46.19 47.46 1ao8 s LEU 4 CO 0.38 -0.28 0.39 -1.66 -1.32 0.00 0.00 176.35 173.86 1ao8 s TRP 5 N 2.52 -0.20 -0.12 5.38 -2.14 -0.98 -4.37 118.94 119.03 1ao8 s TRP 5 Ca 0.07 -0.05 -0.00 0.00 2.66 0.00 0.00 56.10 58.78 1ao8 s TRP 5 Cb -0.14 0.23 -0.02 0.00 -3.10 0.00 0.00 33.47 30.44 1ao8 s TRP 5 CO -0.14 -0.66 -0.11 0.00 -2.66 0.00 0.00 176.95 173.39 1ao8 s ALA 6 N -3.47 2.74 0.15 2.67 0.00 -1.26 -2.19 121.76 120.41 1ao8 s ALA 6 Ca 0.01 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 1ao8 s ALA 6 Cb 0.01 -1.26 -0.04 0.00 0.00 0.00 0.00 23.12 21.83 1ao8 s ALA 6 CO -0.10 0.31 0.11 1.14 0.00 0.00 0.00 175.76 177.22 1ao8 s GLN 7 N 0.13 1.03 0.16 0.00 1.03 -1.01 -4.33 119.66 116.68 1ao8 s GLN 7 Ca -0.05 -1.45 0.01 0.00 0.04 0.00 0.00 55.36 53.92 1ao8 s GLN 7 Cb -0.14 0.27 0.01 0.00 0.03 0.00 0.00 33.01 33.18 1ao8 s GLN 7 CO 0.04 -0.32 0.09 -0.40 -2.54 0.00 0.00 175.29 172.16 1ao8 n ASP 8 N -0.16 1.77 0.17 12.60 5.68 -1.22 -2.35 116.55 133.04 1ao8 n ASP 8 Ca -0.04 -1.60 0.06 0.00 -0.50 0.00 0.00 54.79 52.71 1ao8 n ASP 8 Cb 0.64 0.02 0.55 0.00 -1.14 0.00 0.00 41.12 41.20 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 0.18 -0.19 0.11 0.11 -1.80 -2.04 114.38 110.75 1ao8 h ARG 9 Ca -0.11 -0.01 -0.21 0.00 0.10 0.00 0.00 59.98 59.74 1ao8 h ARG 9 Cb 0.39 -0.04 0.01 0.00 1.11 0.00 0.00 29.97 31.43 1ao8 h ARG 9 CO 0.18 0.14 -0.72 -0.44 0.10 0.00 0.00 179.97 179.23 1ao8 h ASP 10 N 0.19 0.96 0.00 0.08 3.32 -1.90 -3.48 116.42 115.59 1ao8 h ASP 10 Ca 0.05 -0.60 0.00 0.00 0.02 0.00 0.00 57.03 56.50 1ao8 h ASP 10 Cb 0.01 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1ao8 h ASP 10 CO -0.01 1.40 0.00 0.61 -1.72 0.00 0.00 179.24 179.52 1ao8 n GLY 11 N 0.62 1.55 3.80 2.75 0.00 -0.77 -5.05 105.19 108.08 1ao8 n GLY 11 Ca -0.07 0.00 -0.36 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 4.30 -0.09 0.99 2.96 -1.26 -2.79 118.68 122.79 1ao8 s LEU 12 Ca 0.00 0.41 0.08 0.00 -0.22 0.00 0.00 54.13 54.40 1ao8 s LEU 12 Cb 0.00 -2.15 -0.12 0.00 0.50 0.00 0.00 46.19 44.43 1ao8 s LEU 12 CO 0.00 0.27 0.03 2.30 -1.32 0.00 0.00 176.35 177.64 1ao8 n ILE 13 N 2.78 0.65 -3.57 6.68 -5.35 -0.92 -3.45 119.36 116.18 1ao8 n ILE 13 Ca -0.17 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 61.91 1ao8 n ILE 13 Cb 0.53 -0.75 0.00 0.00 -1.74 0.00 0.00 39.64 37.68 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 2.42 3.61 3.15 3.28 0.00 -1.21 -4.88 105.19 111.57 1ao8 n GLY 14 Ca -0.16 -1.44 0.05 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.57 0.29 -1.81 1.61 2.20 -0.59 -4.18 119.74 115.69 1ao8 s LYS 15 Ca 0.00 0.33 0.00 0.00 -0.36 0.00 0.00 55.97 55.94 1ao8 s LYS 15 Cb 0.00 0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.48 1ao8 s LYS 15 CO 0.00 -0.50 0.00 -0.25 -0.36 0.00 0.00 175.35 174.24 1ao8 n ASP 16 N 5.27 -5.63 0.00 1.43 8.00 -1.26 -1.82 116.55 122.54 1ao8 n ASP 16 Ca 0.05 0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.67 1ao8 n ASP 16 Cb 0.56 -4.76 0.00 0.00 -0.02 0.00 0.00 41.12 36.90 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 -0.85 2.57 3.90 0.44 0.00 -1.26 -5.00 105.19 104.99 1ao8 n GLY 17 Ca -0.23 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.48 3.49 0.51 1.61 -3.43 -0.75 -4.90 115.29 111.33 1ao8 s HIS 18 Ca 0.00 0.76 -0.19 0.00 -0.80 0.00 0.00 55.06 54.83 1ao8 s HIS 18 Cb 0.00 -2.21 -0.07 0.00 -1.43 0.00 0.00 32.58 28.86 1ao8 s HIS 18 CO 0.00 0.03 1.05 -0.51 -2.00 0.00 0.00 174.74 173.31 1ao8 s LEU 19 N -3.83 3.77 0.09 5.38 1.43 -1.26 -1.54 118.68 122.72 1ao8 s LEU 19 Ca 0.46 1.92 -0.01 0.00 -1.03 0.00 0.00 54.13 55.47 1ao8 s LEU 19 Cb -0.10 -4.56 -0.25 0.00 0.03 0.00 0.00 46.19 41.31 1ao8 s LEU 19 CO 0.32 -0.88 1.19 1.55 0.23 0.00 0.00 176.35 178.77 1ao8 h PRO 20 N 1.31 0.20 0.00 1.29 0.13 -1.87 -3.46 132.00 129.60 1ao8 h PRO 20 Ca -0.49 -0.33 -0.24 0.00 -0.87 0.00 0.00 66.00 64.07 1ao8 h PRO 20 Cb 1.22 0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 1ao8 h PRO 20 CO 0.59 1.15 -0.12 -2.67 -0.23 0.00 0.00 178.00 176.71 1ao8 n TRP 21 N -3.50 -0.85 -3.46 1.56 2.14 -1.26 -5.08 117.44 106.99 1ao8 n TRP 21 Ca -0.06 -0.95 -0.29 0.00 2.07 0.00 0.00 57.50 58.28 1ao8 n TRP 21 Cb 0.99 -0.17 -0.12 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 -1.20 0.88 -0.30 -2.67 2.46 -1.26 -5.09 115.29 108.11 1ao8 s HIS 22 Ca 0.10 -1.84 -0.02 0.00 0.47 0.00 0.00 55.06 53.77 1ao8 s HIS 22 Cb -0.01 -0.97 0.05 0.00 -0.13 0.00 0.00 32.58 31.52 1ao8 s HIS 22 CO 0.06 -0.83 0.01 -1.17 -2.47 0.00 0.00 174.74 170.35 1ao8 s LEU 23 N 0.77 3.90 0.19 8.88 2.96 -1.26 -4.96 118.68 129.16 1ao8 s LEU 23 Ca 0.22 -1.24 0.09 0.00 -0.22 0.00 0.00 54.13 52.98 1ao8 s LEU 23 Cb -0.16 -1.73 0.00 0.00 0.50 0.00 0.00 46.19 44.80 1ao8 s LEU 23 CO -0.04 -0.26 1.40 1.55 -1.32 0.00 0.00 176.35 177.68 1ao8 h PRO 24 N 8.02 0.00 -0.55 0.98 0.13 -2.00 -3.24 132.00 135.35 1ao8 h PRO 24 Ca -0.22 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 1ao8 h PRO 24 Cb 1.07 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.17 1ao8 h PRO 24 CO 0.54 0.82 0.17 0.22 -0.23 0.00 0.00 178.00 179.52 1ao8 h ASP 25 N 0.00 0.75 0.31 1.44 3.58 -2.00 -2.01 116.42 118.50 1ao8 h ASP 25 Ca -0.01 -0.12 -0.13 0.00 0.42 0.00 0.00 57.03 57.20 1ao8 h ASP 25 Cb 1.52 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 42.36 1ao8 h ASP 25 CO 0.11 0.72 -0.51 -0.78 -2.88 0.00 0.00 179.24 175.89 1ao8 h ASP 26 N 0.80 0.25 0.18 2.28 3.58 -1.99 -2.83 116.42 118.68 1ao8 h ASP 26 Ca 0.18 -0.12 -0.10 0.00 0.42 0.00 0.00 57.03 57.41 1ao8 h ASP 26 Cb 0.24 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1ao8 h ASP 26 CO -0.01 0.72 -0.36 -0.07 -2.88 0.00 0.00 179.24 176.64 1ao8 h LEU 27 N 0.18 0.26 -0.69 2.28 3.38 -1.44 -2.59 115.31 116.70 1ao8 h LEU 27 Ca 0.01 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.76 1ao8 h LEU 27 Cb 0.96 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 1ao8 h LEU 27 CO 0.08 0.61 -0.21 0.45 0.09 0.00 0.00 178.44 179.46 1ao8 h HIS 28 N 0.22 0.90 -0.03 1.13 3.86 -1.18 -2.68 115.15 117.38 1ao8 h HIS 28 Ca 0.03 -0.20 -0.10 0.00 -1.16 0.00 0.00 60.37 58.93 1ao8 h HIS 28 Cb 0.74 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.98 1ao8 h HIS 28 CO 0.01 0.93 -0.45 -0.92 0.86 0.00 0.00 177.93 178.36 1ao8 h TYR 29 N 0.70 0.08 -0.51 2.45 3.20 -1.38 -2.82 116.97 118.68 1ao8 h TYR 29 Ca 0.10 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.87 1ao8 h TYR 29 Cb 0.72 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.95 1ao8 h TYR 29 CO 0.04 0.51 0.03 0.35 -1.64 0.00 0.00 178.16 177.44 1ao8 h PHE 30 N 0.06 0.89 -0.24 -3.82 3.57 -1.13 -2.16 116.94 114.11 1ao8 h PHE 30 Ca 0.00 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.32 1ao8 h PHE 30 Cb 0.82 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 1ao8 h PHE 30 CO 0.00 0.80 -0.12 -0.09 -2.23 0.00 0.00 178.31 176.68 1ao8 h ARG 31 N 0.79 0.40 -0.01 1.11 2.43 -1.32 -2.38 114.38 115.39 1ao8 h ARG 31 Ca 0.16 -0.11 -0.15 0.00 -0.81 0.00 0.00 59.98 59.07 1ao8 h ARG 31 Cb 0.44 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 1ao8 h ARG 31 CO 0.02 0.53 -0.70 0.00 -1.51 0.00 0.00 179.97 178.31 1ao8 h ALA 32 N 1.50 0.81 -0.88 2.80 0.00 -1.38 -2.73 119.26 119.38 1ao8 h ALA 32 Ca 0.07 -0.62 -0.59 0.00 0.00 0.00 0.00 54.91 53.77 1ao8 h ALA 32 Cb 0.44 -0.10 -0.26 0.00 0.00 0.00 0.00 17.79 17.88 1ao8 h ALA 32 CO 0.03 0.84 0.76 1.04 0.00 0.00 0.00 179.25 181.92 1ao8 n GLN 33 N -3.75 2.47 0.00 0.00 1.13 -0.86 -4.31 117.38 112.06 1ao8 n GLN 33 Ca -0.02 -2.88 0.00 0.00 -1.94 0.00 0.00 57.00 52.16 1ao8 n GLN 33 Cb 0.68 -2.13 0.00 0.00 0.11 0.00 0.00 30.24 28.90 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 -0.65 0.00 -1.70 5.09 -2.24 -1.15 -4.98 114.28 108.65 1ao8 n THR 34 Ca 0.55 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.90 1ao8 n THR 34 Cb 0.69 -0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.76 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 -1.98 0.09 -1.98 2.28 0.24 -1.04 -1.28 118.33 114.66 1ao8 n VAL 35 Ca 0.00 -0.02 -0.08 0.00 -2.04 0.00 0.00 64.34 62.20 1ao8 n VAL 35 Cb 0.00 -1.93 -0.01 0.00 -1.47 0.00 0.00 33.84 30.43 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 3.93 0.22 2.85 7.63 0.00 -1.26 -5.01 105.19 113.55 1ao8 n GLY 36 Ca 0.17 -0.57 -0.15 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.96 0.46 -3.55 1.61 5.02 -0.41 -4.43 118.16 114.89 1ao8 n LYS 37 Ca -0.09 -2.73 -0.41 0.00 -2.02 0.00 0.00 58.31 53.06 1ao8 n LYS 37 Cb 0.51 2.38 -0.08 0.00 -0.02 0.00 0.00 35.03 37.82 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 -3.02 4.31 -0.48 -0.18 1.01 -0.59 -3.37 121.20 118.88 1ao8 s ILE 38 Ca 0.31 -2.05 -0.28 0.00 0.00 0.00 0.00 60.65 58.64 1ao8 s ILE 38 Cb 0.01 -3.81 -0.00 0.00 0.01 0.00 0.00 42.46 38.66 1ao8 s ILE 38 CO 0.22 -0.82 1.60 -0.32 0.00 0.00 0.00 174.94 175.62 1ao8 s MET 39 N 1.01 3.23 -0.26 2.79 1.75 -0.52 -2.05 119.30 125.23 1ao8 s MET 39 Ca 0.09 0.83 -0.11 0.00 -1.25 0.00 0.00 55.69 55.25 1ao8 s MET 39 Cb -0.23 -4.18 -0.05 0.00 2.84 0.00 0.00 34.83 33.21 1ao8 s MET 39 CO -0.02 -2.01 0.19 0.08 -0.65 0.00 0.00 175.02 172.61 1ao8 s VAL 40 N 6.77 5.32 0.12 10.11 1.01 -0.65 -1.69 120.40 141.39 1ao8 s VAL 40 Ca 0.64 0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.83 1ao8 s VAL 40 Cb -0.15 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1ao8 s VAL 40 CO 0.28 0.29 -0.02 0.68 0.00 0.00 0.00 175.10 176.33 1ao8 s VAL 41 N 1.47 0.52 0.00 2.92 -7.23 -0.98 -2.51 120.40 114.60 1ao8 s VAL 41 Ca 0.08 -1.93 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 1ao8 s VAL 41 Cb -0.15 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.92 1ao8 s VAL 41 CO 0.08 -0.69 0.00 0.61 -0.31 0.00 0.00 175.10 174.80 1ao8 n GLY 42 N -0.10 0.31 0.12 2.32 0.00 0.11 -2.32 105.19 105.64 1ao8 n GLY 42 Ca -0.09 -1.82 -0.21 0.00 0.00 0.00 0.00 46.02 43.89 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 0.33 -0.15 1.61 2.43 -1.92 -1.96 114.38 114.72 1ao8 h ARG 43 Ca 0.00 -0.56 -0.06 0.00 -0.81 0.00 0.00 59.98 58.54 1ao8 h ARG 43 Cb 0.00 0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1ao8 h ARG 43 CO 0.00 1.27 -0.20 -0.09 -1.51 0.00 0.00 179.97 179.44 1ao8 h ARG 44 N -0.26 0.25 0.02 0.20 2.43 -1.95 -2.23 114.38 112.85 1ao8 h ARG 44 Ca -0.21 -0.07 -0.23 0.00 -0.81 0.00 0.00 59.98 58.66 1ao8 h ARG 44 Cb 1.77 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 31.27 1ao8 h ARG 44 CO 0.15 0.45 -1.11 1.15 -1.51 0.00 0.00 179.97 179.10 1ao8 h THR 45 N 0.24 1.60 -0.21 0.20 2.02 -1.91 -2.86 112.91 111.98 1ao8 h THR 45 Ca 0.04 -3.30 -0.09 0.00 0.77 0.00 0.00 66.41 63.83 1ao8 h THR 45 Cb 0.49 2.83 -0.01 0.00 -1.74 0.00 0.00 68.15 69.71 1ao8 h THR 45 CO 0.03 0.92 -0.27 0.22 0.37 0.00 0.00 175.52 176.79 1ao8 h TYR 46 N 0.01 0.46 0.00 3.16 3.20 -0.93 -2.64 116.97 120.22 1ao8 h TYR 46 Ca -0.06 -0.10 -0.06 0.00 3.14 0.00 0.00 58.73 61.66 1ao8 h TYR 46 Cb 1.83 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.98 1ao8 h TYR 46 CO 0.01 0.65 -0.42 0.93 -1.64 0.00 0.00 178.16 177.69 1ao8 h GLU 47 N 0.36 0.00 0.00 1.82 5.08 -1.46 -3.24 114.58 117.14 1ao8 h GLU 47 Ca 0.05 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1ao8 h GLU 47 Cb 0.67 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 1ao8 h GLU 47 CO 0.05 0.22 -0.12 0.66 -1.00 0.00 0.00 179.01 178.82 1ao8 h SER 48 N 0.00 0.00 -4.07 1.42 4.64 -1.23 -3.43 113.55 110.89 1ao8 h SER 48 Ca -0.02 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.77 1ao8 h SER 48 Cb 1.20 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 63.40 1ao8 h SER 48 CO 0.03 0.12 0.51 -0.36 -0.87 0.00 0.00 176.83 176.26 1ao8 s PHE 49 N -4.72 2.42 -0.10 4.77 0.08 -1.22 -4.97 117.98 114.24 1ao8 s PHE 49 Ca -0.04 1.48 -0.10 0.00 0.12 0.00 0.00 56.93 58.39 1ao8 s PHE 49 Cb 0.16 -3.56 -0.08 0.00 -0.57 0.00 0.00 43.02 38.97 1ao8 s PHE 49 CO 0.67 -2.32 0.31 -1.00 -0.10 0.00 0.00 175.22 172.79 1ao8 h PRO 50 N 1.20 -0.08 -4.45 0.24 0.13 -1.91 -3.42 132.00 123.70 1ao8 h PRO 50 Ca -0.50 0.01 -0.71 0.00 -0.87 0.00 0.00 66.00 63.92 1ao8 h PRO 50 Cb 1.29 0.02 -0.30 0.00 0.13 0.00 0.00 31.00 32.14 1ao8 h PRO 50 CO 0.56 0.17 -0.48 0.21 -0.23 0.00 0.00 178.00 178.23 1ao8 s LYS 51 N -2.09 2.44 -0.00 0.86 2.20 -1.26 -5.08 119.74 116.81 1ao8 s LYS 51 Ca -0.06 -1.59 0.01 0.00 -0.36 0.00 0.00 55.97 53.97 1ao8 s LYS 51 Cb -0.00 -3.73 -0.04 0.00 -1.51 0.00 0.00 37.83 32.55 1ao8 s LYS 51 CO 0.21 -1.01 0.01 1.03 -0.36 0.00 0.00 175.35 175.24 1ao8 s ARG 52 N 1.34 2.83 0.53 4.03 0.52 -1.26 -3.85 118.95 123.08 1ao8 s ARG 52 Ca 0.04 -0.59 -0.11 0.00 -0.52 0.00 0.00 55.73 54.55 1ao8 s ARG 52 Cb -0.23 -2.70 -0.05 0.00 0.52 0.00 0.00 34.95 32.49 1ao8 s ARG 52 CO -0.00 0.63 0.93 -1.25 0.02 0.00 0.00 175.30 175.63 1ao8 s PRO 53 N -1.55 3.71 -0.13 3.54 0.04 -1.26 -5.05 135.00 134.30 1ao8 s PRO 53 Ca 0.20 0.65 -0.29 0.00 0.04 0.00 0.00 61.00 61.59 1ao8 s PRO 53 Cb -0.12 -2.21 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 1ao8 s PRO 53 CO 0.10 -0.33 1.28 -0.51 0.04 0.00 0.00 177.00 177.59 1ao8 s LEU 54 N -4.56 4.21 0.91 -3.56 1.43 -1.25 -5.02 118.68 110.84 1ao8 s LEU 54 Ca 0.54 1.77 -0.14 0.00 -1.03 0.00 0.00 54.13 55.26 1ao8 s LEU 54 Cb -0.10 -3.54 0.15 0.00 0.03 0.00 0.00 46.19 42.73 1ao8 s LEU 54 CO 0.42 -0.74 1.24 -2.16 0.23 0.00 0.00 176.35 175.35 1ao8 s PRO 55 N 3.24 1.10 -1.68 1.29 0.04 -1.26 -4.21 135.00 133.51 1ao8 s PRO 55 Ca 0.56 -0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.46 1ao8 s PRO 55 Cb -0.23 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1ao8 s PRO 55 CO 0.17 -2.15 0.00 -1.91 0.04 0.00 0.00 177.00 173.16 1ao8 n GLU 56 N -3.64 -1.50 -3.61 4.56 4.07 -1.26 -4.91 120.64 114.35 1ao8 n GLU 56 Ca 0.12 0.96 0.03 0.00 -0.06 0.00 0.00 57.16 58.20 1ao8 n GLU 56 Cb 0.60 -5.49 -0.00 0.00 -0.06 0.00 0.00 31.44 26.49 1ao8 n GLU 56 CO 0.00 0.00 0.00 -0.98 -0.06 0.00 0.00 177.13 176.09 1ao8 s ARG 57 N -4.78 0.19 -0.12 5.31 1.70 -1.26 -4.25 118.95 115.74 1ao8 s ARG 57 Ca 0.00 -0.11 -0.08 0.00 -0.47 0.00 0.00 55.73 55.08 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 -0.09 0.15 0.99 -1.08 0.00 0.00 175.30 175.28 1ao8 s THR 58 N -2.19 5.48 -0.07 4.99 2.01 -1.22 -4.95 115.64 119.69 1ao8 s THR 58 Ca 0.15 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.43 1ao8 s THR 58 Cb 0.06 -3.42 -0.02 0.00 0.01 0.00 0.00 72.50 69.13 1ao8 s THR 58 CO -0.05 0.60 -0.16 0.20 -0.69 0.00 0.00 174.62 174.52 1ao8 s ASN 59 N -0.93 3.86 -0.23 3.53 0.01 -1.26 -1.44 114.94 118.48 1ao8 s ASN 59 Ca 0.15 -0.29 -0.02 0.00 -0.71 0.00 0.00 52.86 52.00 1ao8 s ASN 59 Cb -0.12 -1.05 0.07 0.00 0.41 0.00 0.00 41.25 40.56 1ao8 s ASN 59 CO 0.04 0.28 0.03 -0.69 -1.51 0.00 0.00 177.10 175.25 1ao8 s VAL 60 N -0.34 0.78 -0.30 1.60 1.01 -0.68 -1.78 120.40 120.69 1ao8 s VAL 60 Ca 0.03 -0.87 -0.23 0.00 0.00 0.00 0.00 61.98 60.90 1ao8 s VAL 60 Cb -0.13 -1.32 -0.00 0.00 0.00 0.00 0.00 36.38 34.94 1ao8 s VAL 60 CO 0.02 -0.30 0.78 -0.69 0.00 0.00 0.00 175.10 174.92 1ao8 s VAL 61 N 1.72 4.80 -0.31 2.92 1.01 -0.59 -2.31 120.40 127.64 1ao8 s VAL 61 Ca 0.01 1.19 -0.08 0.00 0.00 0.00 0.00 61.98 63.09 1ao8 s VAL 61 Cb -0.17 -4.14 0.01 0.00 0.00 0.00 0.00 36.38 32.07 1ao8 s VAL 61 CO -0.12 -0.24 0.12 -0.22 0.00 0.00 0.00 175.10 174.65 1ao8 s LEU 62 N 2.94 4.08 0.28 3.92 2.96 -0.98 -2.41 118.68 129.48 1ao8 s LEU 62 Ca 0.32 -0.72 -0.09 0.00 -0.22 0.00 0.00 54.13 53.42 1ao8 s LEU 62 Cb -0.14 -1.94 -0.00 0.00 0.50 0.00 0.00 46.19 44.61 1ao8 s LEU 62 CO 0.12 -0.23 0.47 0.28 -1.32 0.00 0.00 176.35 175.67 1ao8 s THR 63 N 1.54 0.00 -0.54 3.68 -1.32 -1.26 -3.96 115.64 113.78 1ao8 s THR 63 Ca 0.03 -1.49 0.03 0.00 -1.21 0.00 0.00 61.69 59.04 1ao8 s THR 63 Cb -0.18 -2.41 0.42 0.00 -1.51 0.00 0.00 72.50 68.83 1ao8 s THR 63 CO 0.04 0.00 1.50 1.41 -2.21 0.00 0.00 174.62 175.37 1ao8 n HIS 64 N -0.44 3.12 -4.10 9.09 8.25 -1.26 -4.57 115.22 125.30 1ao8 n HIS 64 Ca -0.01 -2.69 -0.16 0.00 -0.26 0.00 0.00 57.72 54.60 1ao8 n HIS 64 Cb 0.62 -0.64 -0.15 0.00 1.12 0.00 0.00 29.99 30.94 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 -3.73 0.43 -0.40 -0.41 0.74 -1.26 -5.02 119.66 110.00 1ao8 s GLN 65 Ca 0.53 -0.12 0.05 0.00 0.05 0.00 0.00 55.36 55.86 1ao8 s GLN 65 Cb 0.43 -0.45 0.64 0.00 1.10 0.00 0.00 33.01 34.74 1ao8 s GLN 65 CO -0.15 0.04 1.85 0.39 -0.55 0.00 0.00 175.29 176.86 1ao8 n GLU 66 N 3.30 2.41 0.00 1.67 1.02 -1.26 -4.26 120.64 123.52 1ao8 n GLU 66 Ca -0.17 -2.85 0.00 0.00 -0.02 0.00 0.00 57.16 54.13 1ao8 n GLU 66 Cb 0.56 -2.12 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 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 -0.90 3.76 -4.71 1.62 9.92 -1.26 -5.02 116.55 119.96 1ao8 n ASP 67 Ca 0.54 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.38 1ao8 n ASP 67 Cb 1.57 0.05 -0.03 0.00 -0.64 0.00 0.00 41.12 42.06 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 -1.92 2.76 0.14 1.24 6.14 -1.26 -4.99 117.35 119.46 1ao8 s TYR 68 Ca 0.00 0.31 0.02 0.00 0.64 0.00 0.00 57.07 58.04 1ao8 s TYR 68 Cb 0.00 -4.11 -0.04 0.00 0.42 0.00 0.00 41.96 38.22 1ao8 s TYR 68 CO 0.00 -4.29 -0.03 -0.65 0.64 0.00 0.00 175.55 171.22 1ao8 s GLN 69 N 1.54 0.99 -0.09 4.97 -0.21 -1.26 -5.06 119.66 120.53 1ao8 s GLN 69 Ca 0.75 -1.44 -0.09 0.00 0.02 0.00 0.00 55.36 54.60 1ao8 s GLN 69 Cb -0.48 -0.24 0.02 0.00 1.00 0.00 0.00 33.01 33.32 1ao8 s GLN 69 CO 0.33 -0.08 0.25 0.00 -2.12 0.00 0.00 175.29 173.66 1ao8 s ALA 70 N -3.64 -0.61 -0.47 6.09 0.00 -1.26 -5.11 121.76 116.76 1ao8 s ALA 70 Ca 0.19 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 52.63 1ao8 s ALA 70 Cb 0.06 -0.40 0.03 0.00 0.00 0.00 0.00 23.12 22.81 1ao8 s ALA 70 CO 0.00 -0.12 0.70 -0.65 0.00 0.00 0.00 175.76 175.70 1ao8 s GLN 71 N 0.13 3.28 0.00 0.00 -1.52 -1.26 -4.02 119.66 116.26 1ao8 s GLN 71 Ca -0.00 -0.40 0.00 0.00 -1.95 0.00 0.00 55.36 53.01 1ao8 s GLN 71 Cb -0.02 -3.99 0.00 0.00 -0.22 0.00 0.00 33.01 28.79 1ao8 s GLN 71 CO 0.00 -1.12 0.00 0.41 -0.25 0.00 0.00 175.29 174.33 1ao8 n GLY 72 N 5.06 2.93 3.83 3.09 0.00 -1.26 -4.62 105.19 114.22 1ao8 n GLY 72 Ca -0.01 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.85 3.35 0.37 4.61 0.00 -1.26 -4.86 121.76 123.12 1ao8 s ALA 73 Ca 0.00 0.14 -0.24 0.00 0.00 0.00 0.00 51.96 51.86 1ao8 s ALA 73 Cb 0.00 -2.83 -0.10 0.00 0.00 0.00 0.00 23.12 20.19 1ao8 s ALA 73 CO 0.00 0.31 0.96 0.08 0.00 0.00 0.00 175.76 177.11 1ao8 s VAL 74 N -1.76 4.24 -0.20 0.00 1.01 -0.73 -4.66 120.40 118.30 1ao8 s VAL 74 Ca 0.49 1.64 0.01 0.00 0.00 0.00 0.00 61.98 64.13 1ao8 s VAL 74 Cb -0.14 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.47 1ao8 s VAL 74 CO 0.19 -0.06 -0.11 -0.69 0.00 0.00 0.00 175.10 174.43 1ao8 s VAL 75 N -1.85 1.73 0.44 2.92 1.01 -1.26 -1.54 120.40 121.84 1ao8 s VAL 75 Ca 0.56 -1.06 0.07 0.00 0.00 0.00 0.00 61.98 61.55 1ao8 s VAL 75 Cb -0.15 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1ao8 s VAL 75 CO 0.20 0.18 0.27 0.68 0.00 0.00 0.00 175.10 176.42 1ao8 s VAL 76 N 1.36 2.28 -0.25 2.92 -7.23 -1.01 -4.98 120.40 113.48 1ao8 s VAL 76 Ca -0.01 -1.57 0.17 0.00 -1.81 0.00 0.00 61.98 58.75 1ao8 s VAL 76 Cb -0.16 -2.85 0.42 0.00 0.56 0.00 0.00 36.38 34.35 1ao8 s VAL 76 CO -0.08 0.00 1.29 1.41 -0.31 0.00 0.00 175.10 177.41 1ao8 n HIS 77 N -1.41 -0.36 -3.64 2.82 8.25 -1.26 -4.09 115.22 115.52 1ao8 n HIS 77 Ca -0.00 -1.69 -0.06 0.00 -0.26 0.00 0.00 57.72 55.71 1ao8 n HIS 77 Cb 0.64 0.60 -0.07 0.00 1.12 0.00 0.00 29.99 32.28 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 -2.29 -0.43 0.27 0.41 -1.08 -1.26 -5.00 116.67 107.28 1ao8 s ASP 78 Ca 0.18 0.77 -0.03 0.00 -0.52 0.00 0.00 52.55 52.95 1ao8 s ASP 78 Cb 0.35 0.94 0.35 0.00 -1.46 0.00 0.00 42.92 43.10 1ao8 s ASP 78 CO -0.09 -0.13 1.84 0.58 0.52 0.00 0.00 175.17 177.90 1ao8 h VAL 79 N 4.10 1.23 -0.27 1.11 2.07 -1.98 -1.98 116.25 120.52 1ao8 h VAL 79 Ca -0.28 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.44 1ao8 h VAL 79 Cb 1.18 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1ao8 h VAL 79 CO 0.15 0.29 -0.15 0.00 0.02 0.00 0.00 177.57 177.88 1ao8 h ALA 80 N 1.33 1.24 -0.42 1.67 0.00 -2.00 -2.55 119.26 118.53 1ao8 h ALA 80 Ca 0.23 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.76 1ao8 h ALA 80 Cb 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ao8 h ALA 80 CO -0.02 0.50 -0.12 0.00 0.00 0.00 0.00 179.25 179.61 1ao8 h ALA 81 N 1.41 1.01 -0.38 0.00 0.00 -1.77 -1.72 119.26 117.81 1ao8 h ALA 81 Ca 0.08 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1ao8 h ALA 81 Cb 0.52 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1ao8 h ALA 81 CO 0.03 0.59 0.12 0.28 0.00 0.00 0.00 179.25 180.27 1ao8 h VAL 82 N 0.68 1.16 0.00 0.00 2.07 -1.03 -1.89 116.25 117.24 1ao8 h VAL 82 Ca 0.11 -0.56 -0.19 0.00 0.82 0.00 0.00 66.70 66.89 1ao8 h VAL 82 Cb 0.59 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1ao8 h VAL 82 CO 0.04 0.21 -0.89 -0.26 0.02 0.00 0.00 177.57 176.69 1ao8 h PHE 83 N 0.54 0.02 -0.82 1.57 -1.00 -1.30 -3.22 116.94 112.74 1ao8 h PHE 83 Ca 0.13 -0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.85 1ao8 h PHE 83 Cb 0.17 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.69 1ao8 h PHE 83 CO 0.01 0.89 0.35 0.00 -1.61 0.00 0.00 178.31 177.95 1ao8 h ALA 84 N 1.10 1.06 -0.75 2.45 0.00 -0.52 0.15 119.26 122.75 1ao8 h ALA 84 Ca -0.01 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 1ao8 h ALA 84 Cb 1.56 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1ao8 h ALA 84 CO 0.12 0.66 0.33 -0.92 0.00 0.00 0.00 179.25 179.44 1ao8 h TYR 85 N 1.18 1.11 -0.15 0.00 3.20 -1.48 0.28 116.97 121.11 1ao8 h TYR 85 Ca 0.28 -0.07 -0.11 0.00 3.14 0.00 0.00 58.73 61.97 1ao8 h TYR 85 Cb 0.18 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.11 1ao8 h TYR 85 CO 0.02 0.84 -0.33 0.00 -1.64 0.00 0.00 178.16 177.05 1ao8 h ALA 86 N 1.16 0.24 -0.22 1.82 0.00 -1.47 -1.42 119.26 119.38 1ao8 h ALA 86 Ca 0.25 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1ao8 h ALA 86 Cb 0.17 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1ao8 h ALA 86 CO -0.03 0.29 0.09 -0.22 0.00 0.00 0.00 179.25 179.38 1ao8 h LYS 87 N 0.11 0.33 0.00 0.00 3.64 -0.52 -2.24 116.57 117.89 1ao8 h LYS 87 Ca 0.00 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 1ao8 h LYS 87 Cb 0.92 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 1ao8 h LYS 87 CO 0.07 0.38 -0.17 1.96 -2.27 0.00 0.00 179.45 179.42 1ao8 h GLN 88 N 0.21 0.00 -3.97 1.90 4.20 -0.48 -3.35 115.11 113.63 1ao8 h GLN 88 Ca 0.08 0.00 -0.68 0.00 0.06 0.00 0.00 58.65 58.10 1ao8 h GLN 88 Cb 0.17 0.00 -0.37 0.00 0.30 0.00 0.00 27.48 27.58 1ao8 h GLN 88 CO -0.01 0.17 -0.52 -1.01 -0.67 0.00 0.00 178.83 176.80 1ao8 s HIS 89 N -4.34 3.47 0.13 2.96 3.76 -0.54 -4.91 115.29 115.82 1ao8 s HIS 89 Ca -0.03 -2.75 0.10 0.00 -0.15 0.00 0.00 55.06 52.22 1ao8 s HIS 89 Cb 0.14 -3.10 0.03 0.00 1.11 0.00 0.00 32.58 30.75 1ao8 s HIS 89 CO 0.64 -0.88 1.42 -1.00 -0.85 0.00 0.00 174.74 174.07 1ao8 h PRO 90 N 7.31 0.00 -0.28 8.40 0.14 -1.70 -3.22 132.00 142.65 1ao8 h PRO 90 Ca -0.07 0.00 -0.05 0.00 0.14 0.00 0.00 66.00 66.02 1ao8 h PRO 90 Cb 0.98 0.00 -0.02 0.00 0.14 0.00 0.00 31.00 32.10 1ao8 h PRO 90 CO 0.68 0.80 -0.06 0.38 0.14 0.00 0.00 178.00 179.94 1ao8 h ASP 91 N 0.00 0.42 -2.18 1.44 2.03 -1.91 -3.43 116.42 112.80 1ao8 h ASP 91 Ca -0.01 -0.09 -0.47 0.00 -0.73 0.00 0.00 57.03 55.73 1ao8 h ASP 91 Cb 1.49 -0.11 -0.02 0.00 -0.83 0.00 0.00 39.33 39.86 1ao8 h ASP 91 CO 0.10 0.54 -0.45 -1.10 -1.03 0.00 0.00 179.24 177.30 1ao8 s GLN 92 N -4.86 3.31 0.39 4.15 -0.21 -1.22 -4.96 119.66 116.26 1ao8 s GLN 92 Ca -0.07 -0.84 0.02 0.00 0.02 0.00 0.00 55.36 54.49 1ao8 s GLN 92 Cb 0.15 -2.81 0.02 0.00 1.00 0.00 0.00 33.01 31.37 1ao8 s GLN 92 CO 0.76 0.41 0.15 0.39 -2.12 0.00 0.00 175.29 174.88 1ao8 n GLU 93 N -1.36 1.00 -3.92 2.91 1.02 -1.26 -4.91 120.64 114.11 1ao8 n GLU 93 Ca -0.08 -2.61 -0.35 0.00 -0.02 0.00 0.00 57.16 54.09 1ao8 n GLU 93 Cb 0.57 0.50 -0.14 0.00 -0.02 0.00 0.00 31.44 32.35 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 2.90 -0.04 -4.62 2.96 -1.26 -1.54 118.68 117.07 1ao8 s LEU 94 Ca 0.11 -0.45 0.06 0.00 -0.22 0.00 0.00 54.13 53.63 1ao8 s LEU 94 Cb -0.01 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.94 1ao8 s LEU 94 CO 0.07 -0.03 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.18 1ao8 s VAL 95 N 1.46 2.56 -0.20 1.68 1.01 -0.87 -1.11 120.40 124.93 1ao8 s VAL 95 Ca 0.05 -0.91 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1ao8 s VAL 95 Cb -0.14 -1.96 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 1ao8 s VAL 95 CO -0.04 0.58 -0.07 -0.63 0.00 0.00 0.00 175.10 174.94 1ao8 s ILE 96 N -0.62 3.19 -0.09 2.22 -1.09 -0.39 -1.64 121.20 122.78 1ao8 s ILE 96 Ca 0.10 -0.56 0.10 0.00 -2.23 0.00 0.00 60.65 58.05 1ao8 s ILE 96 Cb -0.11 -2.43 -0.14 0.00 -1.58 0.00 0.00 42.46 38.21 1ao8 s ILE 96 CO 0.00 0.45 0.08 0.00 -1.23 0.00 0.00 174.94 174.24 1ao8 n ALA 97 N 4.58 1.88 0.00 9.38 0.00 -1.04 -1.81 120.51 133.50 1ao8 n ALA 97 Ca -0.18 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.65 1ao8 n ALA 97 Cb 0.51 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 2.25 -1.50 0.00 0.00 0.00 -1.26 -4.80 105.19 99.88 1ao8 n GLY 98 Ca -0.14 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.07 -0.04 0.26 -0.02 0.00 -1.26 -0.71 105.19 103.34 1ao8 n GLY 99 Ca 0.00 -1.59 -0.04 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.97 1.13 -0.18 4.61 0.00 -1.94 -2.19 119.26 118.72 1ao8 h ALA 100 Ca 0.00 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.53 1ao8 h ALA 100 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ao8 h ALA 100 CO 0.00 0.55 -0.28 1.96 0.00 0.00 0.00 179.25 181.48 1ao8 h GLN 101 N 0.58 0.34 -0.13 0.00 4.20 -2.00 -2.72 115.11 115.38 1ao8 h GLN 101 Ca 0.10 -0.13 -0.17 0.00 0.06 0.00 0.00 58.65 58.51 1ao8 h GLN 101 Cb 0.53 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1ao8 h GLN 101 CO 0.03 0.60 -0.64 0.82 -0.67 0.00 0.00 178.83 178.96 1ao8 h ILE 102 N 0.30 1.34 -0.56 2.54 1.08 -1.71 -3.01 117.51 117.49 1ao8 h ILE 102 Ca 0.04 -1.96 -0.04 0.00 -0.39 0.00 0.00 64.86 62.51 1ao8 h ILE 102 Cb 0.65 1.94 -0.03 0.00 -3.07 0.00 0.00 36.82 36.31 1ao8 h ILE 102 CO 0.05 0.60 0.16 -0.26 -0.69 0.00 0.00 178.15 178.01 1ao8 h PHE 103 N 0.36 0.85 -0.37 1.37 0.04 -1.11 -2.21 116.94 115.88 1ao8 h PHE 103 Ca -0.01 -0.07 -0.08 0.00 2.80 0.00 0.00 57.97 60.61 1ao8 h PHE 103 Cb 1.20 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 39.08 1ao8 h PHE 103 CO 0.05 0.70 -0.12 1.15 -0.60 0.00 0.00 178.31 179.49 1ao8 h THR 104 N 0.81 1.25 -0.63 -1.55 2.02 -1.40 -0.94 112.91 112.47 1ao8 h THR 104 Ca 0.18 -1.10 -0.08 0.00 0.77 0.00 0.00 66.41 66.18 1ao8 h THR 104 Cb 0.25 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 1ao8 h THR 104 CO -0.01 0.37 0.07 0.00 0.37 0.00 0.00 175.52 176.32 1ao8 h ALA 105 N 1.29 0.92 -0.85 6.16 0.00 -1.29 -2.86 119.26 122.64 1ao8 h ALA 105 Ca 0.10 -0.28 -0.55 0.00 0.00 0.00 0.00 54.91 54.19 1ao8 h ALA 105 Cb 0.54 -0.24 -0.29 0.00 0.00 0.00 0.00 17.79 17.80 1ao8 h ALA 105 CO 0.03 0.66 0.35 1.19 0.00 0.00 0.00 179.25 181.48 1ao8 n PHE 106 N -4.20 2.77 0.05 0.00 3.72 -0.99 -4.53 117.46 114.27 1ao8 n PHE 106 Ca 0.04 -2.44 -0.10 0.00 -0.05 0.00 0.00 57.45 54.91 1ao8 n PHE 106 Cb 0.31 -0.99 -0.13 0.00 -0.94 0.00 0.00 39.48 37.73 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 1.69 0.06 -1.02 -1.08 3.64 -0.93 -3.29 116.57 115.64 1ao8 h LYS 107 Ca 0.51 -0.10 -0.54 0.00 -1.27 0.00 0.00 60.65 59.25 1ao8 h LYS 107 Cb 1.47 0.04 -0.28 0.00 -0.41 0.00 0.00 32.23 33.04 1ao8 h LYS 107 CO 1.15 0.93 0.69 -0.25 -2.27 0.00 0.00 179.45 179.70 1ao8 n ASP 108 N -3.31 5.07 -2.77 4.20 8.00 -1.26 -4.56 116.55 121.92 1ao8 n ASP 108 Ca -0.07 -3.57 -0.08 0.00 0.71 0.00 0.00 54.79 51.79 1ao8 n ASP 108 Cb 0.99 -0.88 0.04 0.00 -0.02 0.00 0.00 41.12 41.24 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 -0.94 -2.95 -3.61 -2.24 8.00 -1.24 -5.13 116.55 108.44 1ao8 n ASP 109 Ca 0.57 -3.19 -0.14 0.00 0.71 0.00 0.00 54.79 52.74 1ao8 n ASP 109 Cb 1.26 1.74 -0.07 0.00 -0.02 0.00 0.00 41.12 44.04 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 0.69 0.00 -0.03 2.53 0.11 -1.26 -4.68 120.40 117.75 1ao8 s VAL 110 Ca 0.32 0.00 -0.01 0.00 -2.93 0.00 0.00 61.98 59.35 1ao8 s VAL 110 Cb 0.17 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 34.01 1ao8 s VAL 110 CO -0.20 0.00 -0.04 -0.67 -3.33 0.00 0.00 175.10 170.86 1ao8 n ASP 111 N 2.27 1.29 -4.67 3.54 2.03 -1.26 -4.97 116.55 114.77 1ao8 n ASP 111 Ca -0.14 0.02 -0.39 0.00 0.52 0.00 0.00 54.79 54.80 1ao8 n ASP 111 Cb 0.56 -0.08 -0.06 0.00 -0.72 0.00 0.00 41.12 40.81 1ao8 n ASP 111 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1ao8 s THR 112 N -2.06 5.08 -0.46 5.18 2.01 -1.26 -3.29 115.64 120.83 1ao8 s THR 112 Ca -0.05 1.09 -0.03 0.00 0.31 0.00 0.00 61.69 63.02 1ao8 s THR 112 Cb 0.02 -3.90 0.12 0.00 0.01 0.00 0.00 72.50 68.75 1ao8 s THR 112 CO 0.06 0.18 0.27 -0.76 -0.69 0.00 0.00 174.62 173.68 1ao8 s LEU 113 N 1.53 5.28 -0.23 4.42 1.43 -0.29 -2.17 118.68 128.65 1ao8 s LEU 113 Ca 0.27 -2.23 -0.21 0.00 -1.03 0.00 0.00 54.13 50.94 1ao8 s LEU 113 Cb -0.16 -1.85 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 1ao8 s LEU 113 CO 0.11 -0.51 0.67 -0.76 0.23 0.00 0.00 176.35 176.08 1ao8 s LEU 114 N 0.86 4.10 0.01 1.79 1.43 0.14 -2.35 118.68 124.67 1ao8 s LEU 114 Ca 0.10 0.82 0.01 0.00 -1.03 0.00 0.00 54.13 54.03 1ao8 s LEU 114 Cb -0.22 -2.93 -0.01 0.00 0.03 0.00 0.00 46.19 43.05 1ao8 s LEU 114 CO -0.04 -0.36 -0.05 0.54 0.23 0.00 0.00 176.35 176.67 1ao8 s VAL 115 N 2.35 0.32 -0.38 -1.59 0.11 -1.04 -2.32 120.40 117.86 1ao8 s VAL 115 Ca 0.29 -0.54 -0.11 0.00 -2.93 0.00 0.00 61.98 58.69 1ao8 s VAL 115 Cb -0.16 -0.35 0.03 0.00 -1.53 0.00 0.00 36.38 34.38 1ao8 s VAL 115 CO 0.09 -0.15 0.21 -0.89 -3.33 0.00 0.00 175.10 171.03 1ao8 s THR 116 N -0.69 4.52 -0.51 5.04 2.01 -0.93 -1.87 115.64 123.21 1ao8 s THR 116 Ca -0.05 -0.93 -0.26 0.00 0.31 0.00 0.00 61.69 60.77 1ao8 s THR 116 Cb -0.05 -3.55 0.03 0.00 0.01 0.00 0.00 72.50 68.94 1ao8 s THR 116 CO -0.00 -0.27 0.99 -0.13 -0.69 0.00 0.00 174.62 174.52 1ao8 s ARG 117 N 1.54 3.47 0.07 4.92 0.52 -0.61 -2.40 118.95 126.45 1ao8 s ARG 117 Ca 0.02 0.05 -0.01 0.00 -0.52 0.00 0.00 55.73 55.27 1ao8 s ARG 117 Cb -0.20 -3.98 0.02 0.00 0.52 0.00 0.00 34.95 31.31 1ao8 s ARG 117 CO 0.06 -1.40 0.09 1.28 0.02 0.00 0.00 175.30 175.36 1ao8 n LEU 118 N 7.52 0.00 0.00 2.53 4.32 -0.99 -0.50 117.00 129.88 1ao8 n LEU 118 Ca 0.05 -0.13 0.00 0.00 -0.02 0.00 0.00 56.01 55.91 1ao8 n LEU 118 Cb 0.48 -0.07 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 1ao8 n LEU 118 CO 0.66 -0.56 -0.32 0.00 -1.22 0.00 0.00 177.39 175.95 1ao8 n ALA 119 N -3.04 2.94 -1.75 -1.18 0.00 -0.35 -4.45 120.51 112.67 1ao8 n ALA 119 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.05 1ao8 n ALA 119 Cb 0.04 0.32 0.03 0.00 0.00 0.00 0.00 19.45 19.85 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 -4.91 2.86 0.34 0.00 0.00 -0.66 -4.70 107.32 100.24 1ao8 s GLY 120 Ca 0.00 1.25 -0.13 0.00 0.00 0.00 0.00 44.72 45.84 1ao8 s GLY 120 CO 0.00 1.75 0.73 -0.56 0.00 0.00 0.00 173.10 175.02 1ao8 s SER 121 N -1.07 6.69 -0.18 1.64 0.01 -1.26 -4.55 113.70 114.97 1ao8 s SER 121 Ca 0.71 1.21 -0.05 0.00 1.31 0.00 0.00 55.95 59.13 1ao8 s SER 121 Cb -0.38 -2.35 0.09 0.00 0.21 0.00 0.00 66.02 63.59 1ao8 s SER 121 CO 0.45 -0.26 0.35 -0.36 0.41 0.00 0.00 173.24 173.83 1ao8 s PHE 122 N -2.09 -0.66 0.19 2.43 0.08 -1.26 -5.08 117.98 111.58 1ao8 s PHE 122 Ca 0.53 1.18 -0.15 0.00 0.12 0.00 0.00 56.93 58.60 1ao8 s PHE 122 Cb -0.10 0.12 -0.07 0.00 -0.57 0.00 0.00 43.02 42.39 1ao8 s PHE 122 CO 0.22 -0.49 0.60 -1.83 -0.10 0.00 0.00 175.22 173.63 1ao8 s GLU 123 N 2.53 4.03 0.00 0.44 -1.05 -1.26 -4.70 118.70 118.68 1ao8 s GLU 123 Ca 0.02 0.57 0.00 0.00 -0.15 0.00 0.00 54.97 55.41 1ao8 s GLU 123 Cb -0.13 -2.85 0.00 0.00 -0.44 0.00 0.00 34.13 30.71 1ao8 s GLU 123 CO -0.12 0.42 0.00 0.41 0.95 0.00 0.00 175.26 176.92 1ao8 n GLY 124 N 0.60 2.74 1.28 -3.83 0.00 -1.26 -4.99 105.19 99.73 1ao8 n GLY 124 Ca -0.03 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 -4.62 1.61 8.00 -1.26 -5.05 116.55 115.23 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 0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.18 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 -1.64 3.85 0.30 -3.53 2.01 -1.26 -5.00 115.64 110.38 1ao8 s THR 126 Ca 0.00 0.95 0.09 0.00 0.31 0.00 0.00 61.69 63.04 1ao8 s THR 126 Cb 0.00 -3.92 -0.05 0.00 0.01 0.00 0.00 72.50 68.54 1ao8 s THR 126 CO 0.00 -0.43 0.01 -0.54 -0.69 0.00 0.00 174.62 172.97 1ao8 s LYS 127 N 4.62 2.19 0.43 4.92 1.02 -1.26 -2.16 119.74 129.50 1ao8 s LYS 127 Ca 0.66 -1.58 -0.20 0.00 0.02 0.00 0.00 55.97 54.86 1ao8 s LYS 127 Cb -0.20 -2.06 -0.11 0.00 -0.52 0.00 0.00 37.83 34.94 1ao8 s LYS 127 CO 0.28 0.24 0.94 1.41 -0.92 0.00 0.00 175.35 177.30 1ao8 s MET 128 N -3.71 4.21 0.94 1.68 -2.45 -1.12 -4.82 119.30 114.03 1ao8 s MET 128 Ca 0.34 1.09 -0.11 0.00 -1.25 0.00 0.00 55.69 55.75 1ao8 s MET 128 Cb -0.04 -2.19 0.15 0.00 1.25 0.00 0.00 34.83 34.00 1ao8 s MET 128 CO 0.20 -0.02 1.09 0.96 1.05 0.00 0.00 175.02 178.29 1ao8 s ILE 129 N -2.18 2.48 -0.73 10.11 -4.36 -1.26 -4.93 121.20 120.33 1ao8 s ILE 129 Ca 0.61 0.16 -0.27 0.00 -0.26 0.00 0.00 60.65 60.89 1ao8 s ILE 129 Cb -0.09 -2.46 0.03 0.00 1.25 0.00 0.00 42.46 41.19 1ao8 s ILE 129 CO 0.14 -0.20 1.28 -2.16 0.24 0.00 0.00 174.94 174.23 1ao8 s PRO 130 N -4.78 3.21 0.07 0.37 0.04 -1.26 -5.02 135.00 127.62 1ao8 s PRO 130 Ca 0.65 -0.20 -0.11 0.00 0.04 0.00 0.00 61.00 61.38 1ao8 s PRO 130 Cb -0.20 -4.17 -0.06 0.00 0.04 0.00 0.00 34.50 30.11 1ao8 s PRO 130 CO 0.58 -2.12 0.41 -0.51 0.04 0.00 0.00 177.00 175.40 1ao8 s LEU 131 N 5.72 4.37 -0.28 -3.56 1.43 -1.26 -5.04 118.68 120.06 1ao8 s LEU 131 Ca 0.36 0.85 -0.29 0.00 -1.03 0.00 0.00 54.13 54.02 1ao8 s LEU 131 Cb -0.08 -2.91 0.01 0.00 0.03 0.00 0.00 46.19 43.24 1ao8 s LEU 131 CO 0.16 0.20 1.08 0.21 0.23 0.00 0.00 176.35 178.23 1ao8 s ASN 132 N -1.61 6.97 0.00 2.29 2.47 -1.26 -4.89 114.94 118.92 1ao8 s ASN 132 Ca 0.31 1.19 0.18 0.00 0.42 0.00 0.00 52.86 54.96 1ao8 s ASN 132 Cb -0.15 -2.54 0.51 0.00 -1.45 0.00 0.00 41.25 37.62 1ao8 s ASN 132 CO 0.17 -0.82 1.42 0.79 -3.72 0.00 0.00 177.10 174.94 1ao8 n TRP 133 N 6.72 0.58 0.01 0.43 7.02 -1.26 -4.06 117.44 126.87 1ao8 n TRP 133 Ca 0.12 -0.29 -0.07 0.00 -1.02 0.00 0.00 57.50 56.24 1ao8 n TRP 133 Cb 0.47 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.23 1ao8 n TRP 133 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1ao8 h ASP 134 N 3.11 0.00 -0.86 -0.99 5.19 -2.03 -3.33 116.42 117.51 1ao8 h ASP 134 Ca 0.00 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 55.84 1ao8 h ASP 134 Cb 0.70 0.00 -0.25 0.00 0.18 0.00 0.00 39.33 39.96 1ao8 h ASP 134 CO 0.00 0.96 0.73 0.47 -3.12 0.00 0.00 179.24 178.28 1ao8 n ASP 135 N -3.13 6.90 -3.91 6.45 8.00 -1.26 -4.92 116.55 124.68 1ao8 n ASP 135 Ca -0.11 -3.57 -0.09 0.00 0.71 0.00 0.00 54.79 51.73 1ao8 n ASP 135 Cb 1.00 -0.97 -0.06 0.00 -0.02 0.00 0.00 41.12 41.06 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 -3.23 0.26 0.10 1.24 0.08 -1.25 -3.91 117.98 111.26 1ao8 s PHE 136 Ca 0.55 -0.62 -0.07 0.00 0.12 0.00 0.00 56.93 56.91 1ao8 s PHE 136 Cb 0.44 0.10 -0.01 0.00 -0.57 0.00 0.00 43.02 42.97 1ao8 s PHE 136 CO 0.00 -0.82 0.16 0.99 -0.10 0.00 0.00 175.22 175.45 1ao8 s THR 137 N -3.95 0.14 -0.14 0.64 2.01 0.10 -4.82 115.64 109.62 1ao8 s THR 137 Ca 0.16 -1.38 -0.14 0.00 0.31 0.00 0.00 61.69 60.64 1ao8 s THR 137 Cb 0.01 -1.51 -0.05 0.00 0.01 0.00 0.00 72.50 70.97 1ao8 s THR 137 CO 0.01 -0.64 0.31 -0.75 -0.69 0.00 0.00 174.62 172.86 1ao8 s LYS 138 N -3.90 4.20 0.00 4.92 2.20 -1.26 -1.00 119.74 124.89 1ao8 s LYS 138 Ca 0.09 0.14 0.00 0.00 -0.36 0.00 0.00 55.97 55.83 1ao8 s LYS 138 Cb 0.05 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 1ao8 s LYS 138 CO -0.08 0.29 0.00 1.55 -0.36 0.00 0.00 175.35 176.75 1ao8 n VAL 139 N 3.38 0.00 -4.10 4.02 3.14 -1.24 -4.98 118.33 118.56 1ao8 n VAL 139 Ca -0.12 0.00 -0.14 0.00 -2.96 0.00 0.00 64.34 61.12 1ao8 n VAL 139 Cb 0.52 -0.58 -0.12 0.00 -1.06 0.00 0.00 33.84 32.61 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 1ao8 s SER 140 N -4.04 1.01 -0.28 6.55 0.01 -1.26 -5.08 113.70 110.61 1ao8 s SER 140 Ca 0.00 -0.53 -0.22 0.00 1.31 0.00 0.00 55.95 56.51 1ao8 s SER 140 Cb 0.00 0.01 0.12 0.00 0.21 0.00 0.00 66.02 66.36 1ao8 s SER 140 CO 0.00 -0.16 0.95 -0.55 0.41 0.00 0.00 173.24 173.90 1ao8 s SER 141 N -1.49 -0.54 -0.06 2.44 0.15 -1.26 -2.03 113.70 110.91 1ao8 s SER 141 Ca -0.07 0.98 0.03 0.00 0.70 0.00 0.00 55.95 57.59 1ao8 s SER 141 Cb -0.09 1.07 0.00 0.00 -1.71 0.00 0.00 66.02 65.29 1ao8 s SER 141 CO 0.01 -0.17 -0.16 -0.60 1.20 0.00 0.00 173.24 173.52 1ao8 s ARG 142 N 0.62 1.94 -0.22 5.44 6.06 -0.28 -5.00 118.95 127.51 1ao8 s ARG 142 Ca -0.01 -0.57 -0.10 0.00 -2.50 0.00 0.00 55.73 52.55 1ao8 s ARG 142 Cb -0.05 -1.60 -0.05 0.00 0.06 0.00 0.00 34.95 33.31 1ao8 s ARG 142 CO -0.09 0.15 0.13 0.99 -2.50 0.00 0.00 175.30 173.98 1ao8 s THR 143 N 0.33 5.20 -0.21 4.11 2.01 -1.26 -1.22 115.64 124.59 1ao8 s THR 143 Ca -0.10 0.12 0.02 0.00 0.31 0.00 0.00 61.69 62.03 1ao8 s THR 143 Cb -0.14 -3.40 0.04 0.00 0.01 0.00 0.00 72.50 69.01 1ao8 s THR 143 CO 0.04 0.39 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.50 1ao8 s VAL 144 N 0.80 2.11 -0.20 3.82 1.01 -0.41 -5.01 120.40 122.50 1ao8 s VAL 144 Ca 0.07 -1.23 -0.16 0.00 0.00 0.00 0.00 61.98 60.66 1ao8 s VAL 144 Cb -0.13 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1ao8 s VAL 144 CO 0.02 0.31 0.42 -1.61 0.00 0.00 0.00 175.10 174.24 1ao8 s GLU 145 N 1.21 4.17 0.30 2.72 2.02 -1.26 -2.46 118.70 125.40 1ao8 s GLU 145 Ca -0.01 0.24 -0.01 0.00 0.02 0.00 0.00 54.97 55.22 1ao8 s GLU 145 Cb -0.16 -3.55 0.06 0.00 0.10 0.00 0.00 34.13 30.58 1ao8 s GLU 145 CO -0.10 -0.08 0.41 -3.47 0.02 0.00 0.00 175.26 172.05 1ao8 n ASP 146 N 4.58 0.49 -0.15 -0.19 2.03 -1.26 -4.99 116.55 117.06 1ao8 n ASP 146 Ca -0.07 -1.43 -0.09 0.00 0.52 0.00 0.00 54.79 53.72 1ao8 n ASP 146 Cb 0.51 -0.27 0.00 0.00 -0.72 0.00 0.00 41.12 40.64 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 -0.56 1.19 -2.08 5.18 1.35 -1.98 -3.44 112.91 112.58 1ao8 h THR 147 Ca -0.14 -0.57 -0.44 0.00 -0.55 0.00 0.00 66.41 64.71 1ao8 h THR 147 Cb 0.49 0.75 0.02 0.00 -1.73 0.00 0.00 68.15 67.67 1ao8 h THR 147 CO 0.14 0.21 -0.22 0.20 -0.25 0.00 0.00 175.52 175.60 1ao8 s ASN 148 N -5.86 5.80 0.14 5.36 -0.87 -1.26 -5.02 114.94 113.23 1ao8 s ASN 148 Ca -0.13 -0.08 0.09 0.00 -1.57 0.00 0.00 52.86 51.17 1ao8 s ASN 148 Cb 0.11 -1.17 -0.16 0.00 -0.02 0.00 0.00 41.25 40.01 1ao8 s ASN 148 CO 0.76 -0.65 1.28 1.55 -2.57 0.00 0.00 177.10 177.47 1ao8 h PRO 149 N 0.62 0.00 0.00 -0.60 0.13 -2.00 -3.26 132.00 126.88 1ao8 h PRO 149 Ca -0.44 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 1ao8 h PRO 149 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1ao8 h PRO 149 CO 0.53 0.88 -0.23 0.00 -0.23 0.00 0.00 178.00 178.95 1ao8 h ALA 150 N 1.10 0.86 -0.53 -0.56 0.00 -1.95 -3.20 119.26 114.98 1ao8 h ALA 150 Ca -0.02 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.55 1ao8 h ALA 150 Cb 1.71 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.38 1ao8 h ALA 150 CO 0.12 0.29 0.16 1.28 0.00 0.00 0.00 179.25 181.10 1ao8 n LEU 151 N -3.17 4.92 -4.76 0.00 4.77 -1.23 -1.66 117.00 115.87 1ao8 n LEU 151 Ca 0.03 -2.54 -0.40 0.00 -0.03 0.00 0.00 56.01 53.07 1ao8 n LEU 151 Cb 0.61 -0.68 -0.06 0.00 -2.33 0.00 0.00 43.42 40.97 1ao8 n LEU 151 CO 0.37 0.65 0.47 -0.89 -1.33 0.00 0.00 177.39 176.67 1ao8 s THR 152 N -2.34 4.52 0.04 -5.08 2.01 -1.21 -4.18 115.64 109.41 1ao8 s THR 152 Ca 0.41 1.67 -0.00 0.00 0.31 0.00 0.00 61.69 64.07 1ao8 s THR 152 Cb 0.32 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.67 1ao8 s THR 152 CO 0.10 0.46 -0.04 -1.38 -0.69 0.00 0.00 174.62 173.07 1ao8 s HIS 153 N -0.69 0.48 -0.12 4.92 -3.43 -1.03 -1.21 115.29 114.21 1ao8 s HIS 153 Ca 0.37 -0.82 -0.04 0.00 -0.80 0.00 0.00 55.06 53.77 1ao8 s HIS 153 Cb -0.22 -0.33 0.05 0.00 -1.43 0.00 0.00 32.58 30.65 1ao8 s HIS 153 CO 0.25 -0.27 0.10 0.99 -2.00 0.00 0.00 174.74 173.81 1ao8 s THR 154 N -2.82 -0.13 -0.02 -5.38 2.01 0.35 -1.29 115.64 108.35 1ao8 s THR 154 Ca -0.02 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 61.76 1ao8 s THR 154 Cb -0.00 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 72.04 1ao8 s THR 154 CO -0.05 -0.09 1.26 -0.31 -0.69 0.00 0.00 174.62 174.74 1ao8 s TYR 155 N 2.18 3.12 -0.05 4.92 2.02 -0.36 -1.58 117.35 127.61 1ao8 s TYR 155 Ca 0.03 1.11 0.05 0.00 -0.37 0.00 0.00 57.07 57.89 1ao8 s TYR 155 Cb -0.14 -3.50 -0.01 0.00 -0.40 0.00 0.00 41.96 37.91 1ao8 s TYR 155 CO -0.07 -1.66 -0.20 -1.21 -1.57 0.00 0.00 175.55 170.84 1ao8 s GLU 156 N 2.10 2.06 -0.51 -0.62 2.02 -0.78 -1.13 118.70 121.83 1ao8 s GLU 156 Ca 0.59 -0.72 -0.00 0.00 0.02 0.00 0.00 54.97 54.85 1ao8 s GLU 156 Cb -0.27 -1.78 0.13 0.00 0.10 0.00 0.00 34.13 32.31 1ao8 s GLU 156 CO 0.24 0.30 0.29 0.08 0.02 0.00 0.00 175.26 176.20 1ao8 s VAL 157 N -0.06 3.12 -0.08 2.63 1.01 -0.86 -2.49 120.40 123.68 1ao8 s VAL 157 Ca -0.03 -2.79 -0.26 0.00 0.00 0.00 0.00 61.98 58.91 1ao8 s VAL 157 Cb -0.12 -3.12 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 1ao8 s VAL 157 CO 0.03 -0.78 0.81 0.26 0.00 0.00 0.00 175.10 175.42 1ao8 s TRP 158 N 0.26 3.56 0.23 5.22 0.52 -0.99 -3.68 118.94 124.06 1ao8 s TRP 158 Ca 0.14 1.37 0.09 0.00 0.02 0.00 0.00 56.10 57.72 1ao8 s TRP 158 Cb -0.22 -2.94 -0.04 0.00 -1.15 0.00 0.00 33.47 29.11 1ao8 s TRP 158 CO -0.03 -0.03 -0.03 -0.65 0.02 0.00 0.00 176.95 176.23 1ao8 s GLN 159 N 1.22 2.24 0.40 4.98 -0.21 -0.17 -1.14 119.66 126.98 1ao8 s GLN 159 Ca 0.42 -1.34 -0.23 0.00 0.02 0.00 0.00 55.36 54.22 1ao8 s GLN 159 Cb -0.18 -2.18 -0.10 0.00 1.00 0.00 0.00 33.01 31.55 1ao8 s GLN 159 CO 0.19 0.39 0.98 0.21 -2.12 0.00 0.00 175.29 174.95 1ao8 s LYS 160 N -3.35 4.26 -0.13 2.91 2.20 -1.21 0.00 119.74 124.42 1ao8 s LYS 160 Ca 0.29 1.30 0.16 0.00 -0.36 0.00 0.00 55.97 57.36 1ao8 s LYS 160 Cb -0.07 -2.42 -0.23 0.00 -1.51 0.00 0.00 37.83 33.59 1ao8 s LYS 160 CO 0.18 -0.02 0.15 0.36 -0.36 0.00 0.00 175.35 175.66 1ao8 n LYS 161 N -0.22 1.05 0.00 4.03 2.85 -1.25 -4.82 118.16 119.80 1ao8 n LYS 161 Ca 0.05 -0.05 0.11 0.00 -1.05 0.00 0.00 58.31 57.37 1ao8 n LYS 161 Cb 0.52 -1.44 0.63 0.00 -0.65 0.00 0.00 35.03 34.09 1ao8 n LYS 161 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35