#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 -2.11 0.21 6.98 0.00 0.45 -4.35 121.76 122.94 1ao8 s ALA 2 Ca 0.00 2.32 -0.29 0.00 0.00 0.00 0.00 51.96 53.99 1ao8 s ALA 2 Cb 0.00 -1.73 -0.09 0.00 0.00 0.00 0.00 23.12 21.30 1ao8 s ALA 2 CO 0.00 -0.78 0.91 -0.06 0.00 0.00 0.00 175.76 175.82 1ao8 s PHE 3 N 2.48 3.96 -0.19 0.00 0.40 -0.89 -1.89 117.98 121.85 1ao8 s PHE 3 Ca -0.07 1.85 -0.04 0.00 -0.60 0.00 0.00 56.93 58.07 1ao8 s PHE 3 Cb -0.09 -2.94 0.09 0.00 0.51 0.00 0.00 43.02 40.59 1ao8 s PHE 3 CO -0.19 0.45 0.25 -1.17 0.70 0.00 0.00 175.22 175.26 1ao8 s LEU 4 N -1.08 -0.21 0.12 -0.37 2.96 -0.90 0.08 118.68 119.27 1ao8 s LEU 4 Ca 0.40 0.03 -0.15 0.00 -0.22 0.00 0.00 54.13 54.20 1ao8 s LEU 4 Cb -0.25 0.54 0.03 0.00 0.50 0.00 0.00 46.19 47.00 1ao8 s LEU 4 CO 0.31 -0.30 0.37 -1.66 -1.32 0.00 0.00 176.35 173.75 1ao8 s TRP 5 N 2.37 -0.13 -0.13 5.38 -2.14 -0.99 -4.41 118.94 118.89 1ao8 s TRP 5 Ca 0.06 -0.21 -0.01 0.00 2.66 0.00 0.00 56.10 58.60 1ao8 s TRP 5 Cb -0.15 0.21 -0.02 0.00 -3.10 0.00 0.00 33.47 30.41 1ao8 s TRP 5 CO -0.11 -0.69 -0.10 0.00 -2.66 0.00 0.00 176.95 173.39 1ao8 s ALA 6 N -3.82 2.75 0.29 2.67 0.00 -1.26 -2.22 121.76 120.16 1ao8 s ALA 6 Ca 0.04 -0.87 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1ao8 s ALA 6 Cb 0.02 -1.31 -0.05 0.00 0.00 0.00 0.00 23.12 21.78 1ao8 s ALA 6 CO -0.11 0.26 0.09 1.14 0.00 0.00 0.00 175.76 177.14 1ao8 s GLN 7 N 0.28 1.53 0.12 0.00 -2.07 -0.96 -4.36 119.66 114.19 1ao8 s GLN 7 Ca -0.08 -1.85 0.00 0.00 -1.82 0.00 0.00 55.36 51.62 1ao8 s GLN 7 Cb -0.15 -0.43 -0.00 0.00 -1.09 0.00 0.00 33.01 31.34 1ao8 s GLN 7 CO 0.05 -0.29 0.01 -0.40 -1.32 0.00 0.00 175.29 173.33 1ao8 n ASP 8 N -0.62 2.09 -0.28 12.60 5.75 -1.19 -2.10 116.55 132.79 1ao8 n ASP 8 Ca -0.01 -1.52 -0.04 0.00 -0.01 0.00 0.00 54.79 53.21 1ao8 n ASP 8 Cb 0.66 0.11 0.08 0.00 -1.03 0.00 0.00 41.12 40.94 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 0.96 -0.79 0.11 0.11 -1.78 -2.25 114.38 110.74 1ao8 h ARG 9 Ca -0.09 -0.06 -0.04 0.00 0.10 0.00 0.00 59.98 59.89 1ao8 h ARG 9 Cb 0.30 -0.22 -0.04 0.00 1.11 0.00 0.00 29.97 31.13 1ao8 h ARG 9 CO 0.16 0.64 0.34 -0.44 0.10 0.00 0.00 179.97 180.76 1ao8 h ASP 10 N 0.99 1.07 0.00 0.08 5.19 -1.91 -3.47 116.42 118.38 1ao8 h ASP 10 Ca 0.29 -0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.54 1ao8 h ASP 10 Cb -0.06 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.17 1ao8 h ASP 10 CO -0.08 0.94 0.00 0.61 -3.12 0.00 0.00 179.24 177.58 1ao8 n GLY 11 N -0.91 1.96 3.86 2.75 0.00 -0.85 -5.10 105.19 106.90 1ao8 n GLY 11 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 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 4.39 -0.09 0.99 2.96 -1.26 -3.27 118.68 122.40 1ao8 s LEU 12 Ca 0.00 0.78 0.06 0.00 -0.22 0.00 0.00 54.13 54.76 1ao8 s LEU 12 Cb 0.00 -2.78 -0.10 0.00 0.50 0.00 0.00 46.19 43.81 1ao8 s LEU 12 CO 0.00 0.24 0.01 2.30 -1.32 0.00 0.00 176.35 177.57 1ao8 n ILE 13 N 1.24 0.58 -3.81 6.68 -5.35 -0.87 -3.20 119.36 114.63 1ao8 n ILE 13 Ca -0.11 -0.33 -0.07 0.00 -0.27 0.00 0.00 62.75 61.97 1ao8 n ILE 13 Cb 0.53 -0.80 0.03 0.00 -1.74 0.00 0.00 39.64 37.66 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 2.58 0.90 2.92 3.28 0.00 -1.20 -4.81 105.19 108.86 1ao8 n GLY 14 Ca -0.15 -1.23 -0.14 0.00 0.00 0.00 0.00 46.02 44.50 1ao8 n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ao8 s LYS 15 N -2.08 0.18 -1.79 1.61 2.20 0.99 -2.86 119.74 117.99 1ao8 s LYS 15 Ca 0.17 0.56 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 1ao8 s LYS 15 Cb -0.04 -0.44 0.00 0.00 -1.51 0.00 0.00 37.83 35.84 1ao8 s LYS 15 CO 0.10 -0.44 0.00 -0.25 -0.36 0.00 0.00 175.35 174.41 1ao8 n ASP 16 N 5.34 -5.66 0.00 1.43 9.92 -1.26 -1.84 116.55 124.48 1ao8 n ASP 16 Ca -0.06 0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.29 1ao8 n ASP 16 Cb 0.50 -4.77 0.00 0.00 -0.64 0.00 0.00 41.12 36.21 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 -0.89 2.55 3.89 0.44 0.00 -1.26 -5.00 105.19 104.92 1ao8 n GLY 17 Ca -0.23 -0.61 -0.30 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 -0.44 3.47 0.46 1.61 -3.43 -0.77 -4.85 115.29 111.34 1ao8 s HIS 18 Ca 0.00 0.82 -0.22 0.00 -0.80 0.00 0.00 55.06 54.86 1ao8 s HIS 18 Cb 0.00 -2.25 -0.08 0.00 -1.43 0.00 0.00 32.58 28.83 1ao8 s HIS 18 CO 0.00 0.08 1.11 -0.51 -2.00 0.00 0.00 174.74 173.42 1ao8 s LEU 19 N -3.57 3.97 0.17 5.38 1.43 -1.26 -0.01 118.68 124.80 1ao8 s LEU 19 Ca 0.47 2.16 0.09 0.00 -1.03 0.00 0.00 54.13 55.82 1ao8 s LEU 19 Cb -0.11 -4.33 -0.07 0.00 0.03 0.00 0.00 46.19 41.71 1ao8 s LEU 19 CO 0.29 -0.84 1.36 1.55 0.23 0.00 0.00 176.35 178.94 1ao8 h PRO 20 N 1.94 0.00 0.00 1.29 0.13 -1.87 -3.45 132.00 130.05 1ao8 h PRO 20 Ca -0.49 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.47 1ao8 h PRO 20 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1ao8 h PRO 20 CO 0.60 0.85 -0.10 -2.67 -0.23 0.00 0.00 178.00 176.45 1ao8 n TRP 21 N -3.37 -0.60 -3.59 1.56 2.14 -1.26 -5.04 117.44 107.28 1ao8 n TRP 21 Ca 0.00 -0.65 -0.29 0.00 2.07 0.00 0.00 57.50 58.63 1ao8 n TRP 21 Cb 0.86 -0.11 -0.15 0.00 -0.81 0.00 0.00 31.31 31.10 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 -1.05 0.67 -0.81 -2.67 2.46 -1.26 -5.05 115.29 107.57 1ao8 s HIS 22 Ca 0.05 -1.10 0.02 0.00 0.47 0.00 0.00 55.06 54.49 1ao8 s HIS 22 Cb -0.00 -1.10 0.22 0.00 -0.13 0.00 0.00 32.58 31.57 1ao8 s HIS 22 CO 0.03 -0.84 0.78 -0.11 -2.47 0.00 0.00 174.74 172.13 1ao8 n LEU 23 N 5.13 4.06 -0.32 8.88 7.94 -1.26 -4.90 117.00 136.53 1ao8 n LEU 23 Ca -0.05 -5.24 0.29 0.00 -1.11 0.00 0.00 56.01 49.90 1ao8 n LEU 23 Cb 0.42 -0.93 0.62 0.00 0.53 0.00 0.00 43.42 44.06 1ao8 n LEU 23 CO 0.06 1.74 1.26 -0.65 -1.11 0.00 0.00 177.39 178.69 1ao8 h PRO 24 N 5.34 0.20 -0.55 1.96 0.10 -1.99 0.25 132.00 137.32 1ao8 h PRO 24 Ca 0.17 -0.01 -0.03 0.00 0.10 0.00 0.00 66.00 66.23 1ao8 h PRO 24 Cb 0.74 -0.05 -0.03 0.00 0.10 0.00 0.00 31.00 31.77 1ao8 h PRO 24 CO 0.87 0.13 0.22 0.22 0.10 0.00 0.00 178.00 179.55 1ao8 h ASP 25 N 0.21 0.71 0.30 -2.05 1.82 -1.98 -1.66 116.42 113.76 1ao8 h ASP 25 Ca 0.59 -0.08 -0.06 0.00 -0.39 0.00 0.00 57.03 57.08 1ao8 h ASP 25 Cb 1.86 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 41.68 1ao8 h ASP 25 CO -0.18 0.64 -0.29 -0.78 -1.61 0.00 0.00 179.24 177.02 1ao8 h ASP 26 N 0.78 0.00 0.19 2.28 1.82 -0.92 -2.21 116.42 118.37 1ao8 h ASP 26 Ca 0.19 0.00 -0.05 0.00 -0.39 0.00 0.00 57.03 56.77 1ao8 h ASP 26 Cb 0.15 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.15 1ao8 h ASP 26 CO -0.02 0.29 -0.23 -0.07 -1.61 0.00 0.00 179.24 177.60 1ao8 h LEU 27 N 0.00 0.06 -1.24 2.28 3.38 -1.30 -1.53 115.31 116.98 1ao8 h LEU 27 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1ao8 h LEU 27 Cb 0.52 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1ao8 h LEU 27 CO 0.04 0.30 -0.32 0.45 0.09 0.00 0.00 178.44 179.00 1ao8 h HIS 28 N 0.06 0.12 0.00 1.13 3.86 -1.35 -2.30 115.15 116.67 1ao8 h HIS 28 Ca 0.01 -0.02 -0.24 0.00 -1.16 0.00 0.00 60.37 58.96 1ao8 h HIS 28 Cb 0.44 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.84 1ao8 h HIS 28 CO 0.00 0.42 -1.29 -0.92 0.86 0.00 0.00 177.93 177.00 1ao8 h TYR 29 N 0.10 0.00 -0.32 2.45 3.20 -1.42 -3.27 116.97 117.71 1ao8 h TYR 29 Ca 0.01 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.77 1ao8 h TYR 29 Cb 0.61 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.87 1ao8 h TYR 29 CO 0.00 0.98 -0.27 0.35 -1.64 0.00 0.00 178.16 177.59 1ao8 h PHE 30 N 0.00 0.74 -0.47 -3.82 3.57 -1.01 -2.19 116.94 113.76 1ao8 h PHE 30 Ca -0.13 -0.17 -0.06 0.00 3.53 0.00 0.00 57.97 61.14 1ao8 h PHE 30 Cb 1.86 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 40.41 1ao8 h PHE 30 CO 0.00 0.85 0.07 -0.09 -2.23 0.00 0.00 178.31 176.91 1ao8 h ARG 31 N 0.56 0.78 0.00 1.11 2.43 -1.51 -2.57 114.38 115.17 1ao8 h ARG 31 Ca 0.07 -0.21 -0.07 0.00 -0.81 0.00 0.00 59.98 58.96 1ao8 h ARG 31 Cb 0.75 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1ao8 h ARG 31 CO 0.06 0.79 -0.32 0.00 -1.51 0.00 0.00 179.97 178.99 1ao8 h ALA 32 N 0.95 1.31 -0.88 2.80 0.00 -1.58 -2.41 119.26 119.46 1ao8 h ALA 32 Ca 0.14 -0.29 -0.57 0.00 0.00 0.00 0.00 54.91 54.19 1ao8 h ALA 32 Cb 0.40 -0.05 -0.26 0.00 0.00 0.00 0.00 17.79 17.88 1ao8 h ALA 32 CO 0.01 0.40 0.73 1.04 0.00 0.00 0.00 179.25 181.44 1ao8 n GLN 33 N -3.94 2.41 0.00 0.00 1.13 -0.84 -4.37 117.38 111.77 1ao8 n GLN 33 Ca -0.02 -2.85 0.00 0.00 -1.94 0.00 0.00 57.00 52.19 1ao8 n GLN 33 Cb 0.39 -2.12 0.00 0.00 0.11 0.00 0.00 30.24 28.62 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 -0.71 0.00 -1.81 5.09 -2.24 -1.04 -4.98 114.28 108.60 1ao8 n THR 34 Ca 0.55 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.91 1ao8 n THR 34 Cb 0.84 -0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.80 1ao8 n THR 34 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ao8 s VAL 35 N -1.90 2.76 0.00 2.28 -7.23 -0.93 -2.05 120.40 113.34 1ao8 s VAL 35 Ca 0.00 0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.41 1ao8 s VAL 35 Cb 0.00 -3.15 0.00 0.00 0.56 0.00 0.00 36.38 33.79 1ao8 s VAL 35 CO 0.00 -0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1ao8 n GLY 36 N 4.14 0.80 3.19 2.32 0.00 -1.26 -4.98 105.19 109.40 1ao8 n GLY 36 Ca 0.17 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.13 0.88 -3.60 1.61 5.02 -0.87 -4.73 118.16 115.35 1ao8 n LYS 37 Ca 0.00 -2.10 -0.40 0.00 -2.02 0.00 0.00 58.31 53.78 1ao8 n LYS 37 Cb 0.33 2.42 -0.10 0.00 -0.02 0.00 0.00 35.03 37.65 1ao8 n LYS 37 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ao8 s ILE 38 N -2.38 4.38 0.11 -0.18 1.01 -0.89 -3.10 121.20 120.15 1ao8 s ILE 38 Ca 0.17 -1.18 -0.26 0.00 0.00 0.00 0.00 60.65 59.38 1ao8 s ILE 38 Cb -0.03 -3.58 -0.07 0.00 0.01 0.00 0.00 42.46 38.79 1ao8 s ILE 38 CO 0.13 -0.40 0.81 -0.32 0.00 0.00 0.00 174.94 175.16 1ao8 s MET 39 N 1.48 4.57 -0.04 2.79 1.75 0.88 -1.59 119.30 129.15 1ao8 s MET 39 Ca 0.02 1.18 0.06 0.00 -1.25 0.00 0.00 55.69 55.71 1ao8 s MET 39 Cb -0.22 -3.33 -0.01 0.00 2.84 0.00 0.00 34.83 34.12 1ao8 s MET 39 CO 0.04 0.38 -0.23 0.08 -0.65 0.00 0.00 175.02 174.65 1ao8 s VAL 40 N -0.49 1.86 0.10 10.11 1.01 -0.29 -0.57 120.40 132.13 1ao8 s VAL 40 Ca 0.39 -0.98 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 1ao8 s VAL 40 Cb -0.22 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 1ao8 s VAL 40 CO 0.26 0.52 0.19 0.68 0.00 0.00 0.00 175.10 176.75 1ao8 s VAL 41 N -0.27 0.13 0.00 2.92 -7.23 -1.02 -2.19 120.40 112.74 1ao8 s VAL 41 Ca 0.01 -1.27 0.00 0.00 -1.81 0.00 0.00 61.98 58.91 1ao8 s VAL 41 Cb -0.12 -1.46 0.00 0.00 0.56 0.00 0.00 36.38 35.36 1ao8 s VAL 41 CO 0.02 -0.60 0.00 0.61 -0.31 0.00 0.00 175.10 174.82 1ao8 n GLY 42 N -0.08 0.99 0.14 2.32 0.00 -0.08 -2.35 105.19 106.13 1ao8 n GLY 42 Ca -0.13 -1.83 -0.23 0.00 0.00 0.00 0.00 46.02 43.82 1ao8 n GLY 42 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ao8 h ARG 43 N 0.00 0.38 -0.08 1.61 2.47 -1.91 -2.26 114.38 114.59 1ao8 h ARG 43 Ca 0.00 -0.66 -0.11 0.00 -1.26 0.00 0.00 59.98 57.95 1ao8 h ARG 43 Cb 0.00 0.24 -0.01 0.00 -1.65 0.00 0.00 29.97 28.55 1ao8 h ARG 43 CO 0.00 1.31 -0.46 0.00 0.56 0.00 0.00 179.97 181.39 1ao8 h ARG 44 N 0.03 0.18 0.14 0.04 -0.00 -1.96 -2.04 114.38 110.76 1ao8 h ARG 44 Ca -0.32 -0.10 -0.29 0.00 -0.50 0.00 0.00 59.98 58.77 1ao8 h ARG 44 Cb 2.04 0.00 0.01 0.00 0.00 0.00 0.00 29.97 32.01 1ao8 h ARG 44 CO 0.17 0.61 -1.33 1.15 0.00 0.00 0.00 179.97 180.57 1ao8 h THR 45 N 0.15 1.40 -0.31 2.04 2.02 -1.89 -2.74 112.91 113.58 1ao8 h THR 45 Ca 0.01 -2.97 -0.04 0.00 0.77 0.00 0.00 66.41 64.18 1ao8 h THR 45 Cb 0.87 2.91 -0.01 0.00 -1.74 0.00 0.00 68.15 70.18 1ao8 h THR 45 CO 0.07 0.87 0.05 0.22 0.37 0.00 0.00 175.52 177.10 1ao8 h TYR 46 N 0.08 0.56 0.00 3.16 3.20 -1.29 -2.64 116.97 120.04 1ao8 h TYR 46 Ca -0.17 -0.08 -0.05 0.00 3.14 0.00 0.00 58.73 61.57 1ao8 h TYR 46 Cb 2.00 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 40.11 1ao8 h TYR 46 CO 0.07 0.61 -0.26 0.93 -1.64 0.00 0.00 178.16 177.87 1ao8 h GLU 47 N 0.35 0.00 0.00 1.82 4.39 -1.47 -2.80 114.58 116.86 1ao8 h GLU 47 Ca 0.10 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 1ao8 h GLU 47 Cb 0.35 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1ao8 h GLU 47 CO 0.01 0.26 -0.12 1.03 -1.16 0.00 0.00 179.01 179.03 1ao8 h SER 48 N 0.00 0.00 -4.09 1.42 0.87 -1.14 -3.43 113.55 107.18 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 0.73 0.00 0.10 0.00 -0.44 0.00 0.00 62.40 62.79 1ao8 h SER 48 CO 0.03 0.12 0.46 -0.36 -0.53 0.00 0.00 176.83 176.55 1ao8 s PHE 49 N -4.66 2.50 -0.09 2.24 0.08 -1.06 -4.98 117.98 112.01 1ao8 s PHE 49 Ca -0.04 1.52 -0.05 0.00 0.12 0.00 0.00 56.93 58.48 1ao8 s PHE 49 Cb 0.16 -3.42 -0.04 0.00 -0.57 0.00 0.00 43.02 39.15 1ao8 s PHE 49 CO 0.66 -1.98 0.18 -1.00 -0.10 0.00 0.00 175.22 172.97 1ao8 h PRO 50 N 1.06 -0.07 -4.23 0.24 0.13 -1.89 -3.42 132.00 123.83 1ao8 h PRO 50 Ca -0.50 0.01 -0.74 0.00 -0.87 0.00 0.00 66.00 63.89 1ao8 h PRO 50 Cb 1.28 0.02 -0.25 0.00 0.13 0.00 0.00 31.00 32.18 1ao8 h PRO 50 CO 0.56 0.05 -0.31 0.21 -0.23 0.00 0.00 178.00 178.28 1ao8 s LYS 51 N -1.90 2.84 -0.13 0.86 2.20 -1.26 -5.06 119.74 117.29 1ao8 s LYS 51 Ca -0.03 -1.60 -0.08 0.00 -0.36 0.00 0.00 55.97 53.90 1ao8 s LYS 51 Cb -0.00 -4.12 -0.04 0.00 -1.51 0.00 0.00 37.83 32.15 1ao8 s LYS 51 CO 0.11 -1.18 0.14 1.03 -0.36 0.00 0.00 175.35 175.08 1ao8 s ARG 52 N 1.54 3.57 0.82 4.03 0.52 -1.26 -4.01 118.95 124.16 1ao8 s ARG 52 Ca 0.04 -0.15 -0.09 0.00 -0.52 0.00 0.00 55.73 55.01 1ao8 s ARG 52 Cb -0.27 -3.23 0.18 0.00 0.52 0.00 0.00 34.95 32.15 1ao8 s ARG 52 CO 0.03 0.69 1.12 -0.35 0.02 0.00 0.00 175.30 176.81 1ao8 n PRO 53 N 2.27 -0.73 -3.19 3.54 -0.04 -1.26 -5.06 135.00 130.53 1ao8 n PRO 53 Ca -0.19 -2.21 -0.41 0.00 -0.04 0.00 0.00 63.50 60.66 1ao8 n PRO 53 Cb 0.54 -1.00 -0.07 0.00 -0.04 0.00 0.00 33.50 32.93 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 4.14 0.00 1.53 1.43 -1.26 -5.06 118.68 119.46 1ao8 s LEU 54 Ca 0.67 0.38 -0.17 0.00 -1.03 0.00 0.00 54.13 53.98 1ao8 s LEU 54 Cb -0.03 -2.71 0.24 0.00 0.03 0.00 0.00 46.19 43.72 1ao8 s LEU 54 CO 0.46 -0.40 1.27 -0.81 0.23 0.00 0.00 176.35 177.10 1ao8 n PRO 55 N 5.71 -1.62 -1.75 1.29 -0.04 -1.26 -4.24 135.00 133.09 1ao8 n PRO 55 Ca -0.03 -1.98 -0.19 0.00 -0.04 0.00 0.00 63.50 61.27 1ao8 n PRO 55 Cb 0.49 -1.40 -0.06 0.00 -0.04 0.00 0.00 33.50 32.49 1ao8 n PRO 55 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1ao8 n GLU 56 N -3.97 -1.34 0.00 0.54 2.13 -1.26 -4.89 120.64 111.84 1ao8 n GLU 56 Ca 0.16 1.09 0.00 0.00 0.66 0.00 0.00 57.16 59.07 1ao8 n GLU 56 Cb 0.57 -5.44 0.00 0.00 0.27 0.00 0.00 31.44 26.84 1ao8 n GLU 56 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 1ao8 n ARG 57 N -2.54 0.00 -3.66 5.31 1.85 -1.26 -4.11 116.66 112.25 1ao8 n ARG 57 Ca -0.20 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.28 1ao8 n ARG 57 Cb 0.63 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.98 1ao8 n ARG 57 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1ao8 s THR 58 N -2.00 5.23 -0.03 8.89 2.01 -1.18 -4.93 115.64 123.64 1ao8 s THR 58 Ca 0.00 0.57 0.04 0.00 0.31 0.00 0.00 61.69 62.61 1ao8 s THR 58 Cb 0.00 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 68.90 1ao8 s THR 58 CO 0.00 0.59 -0.13 0.20 -0.69 0.00 0.00 174.62 174.59 1ao8 s ASN 59 N -1.01 4.13 -0.39 3.53 0.01 -1.26 -0.08 114.94 119.88 1ao8 s ASN 59 Ca 0.20 -0.21 0.01 0.00 -0.71 0.00 0.00 52.86 52.15 1ao8 s ASN 59 Cb -0.15 -0.87 0.12 0.00 0.41 0.00 0.00 41.25 40.77 1ao8 s ASN 59 CO 0.09 0.32 0.18 -0.69 -1.51 0.00 0.00 177.10 175.50 1ao8 s VAL 60 N -0.81 1.19 -0.03 1.60 1.01 0.26 -2.01 120.40 121.62 1ao8 s VAL 60 Ca 0.13 -2.13 -0.30 0.00 0.00 0.00 0.00 61.98 59.68 1ao8 s VAL 60 Cb -0.11 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 1ao8 s VAL 60 CO 0.02 -0.82 1.03 -0.69 0.00 0.00 0.00 175.10 174.65 1ao8 s VAL 61 N 0.82 4.69 -0.21 2.92 1.01 -0.84 -2.43 120.40 126.35 1ao8 s VAL 61 Ca 0.15 1.94 -0.04 0.00 0.00 0.00 0.00 61.98 64.03 1ao8 s VAL 61 Cb -0.22 -4.25 -0.02 0.00 0.00 0.00 0.00 36.38 31.90 1ao8 s VAL 61 CO -0.08 0.09 -0.03 -0.22 0.00 0.00 0.00 175.10 174.87 1ao8 s LEU 62 N 1.42 3.04 0.34 3.92 2.96 -0.99 -1.80 118.68 127.57 1ao8 s LEU 62 Ca 0.52 -0.31 -0.10 0.00 -0.22 0.00 0.00 54.13 54.02 1ao8 s LEU 62 Cb -0.22 -1.77 0.02 0.00 0.50 0.00 0.00 46.19 44.72 1ao8 s LEU 62 CO 0.25 0.02 0.60 0.28 -1.32 0.00 0.00 176.35 176.18 1ao8 s THR 63 N 1.24 0.00 -0.47 3.68 -1.32 -1.26 -4.29 115.64 113.23 1ao8 s THR 63 Ca 0.03 -1.33 0.05 0.00 -1.21 0.00 0.00 61.69 59.23 1ao8 s THR 63 Cb -0.14 -2.62 0.41 0.00 -1.51 0.00 0.00 72.50 68.64 1ao8 s THR 63 CO -0.00 0.00 1.13 1.41 -2.21 0.00 0.00 174.62 174.95 1ao8 n HIS 64 N -0.52 3.46 -3.80 9.09 8.25 -1.26 -4.63 115.22 125.81 1ao8 n HIS 64 Ca -0.03 -3.16 -0.13 0.00 -0.26 0.00 0.00 57.72 54.14 1ao8 n HIS 64 Cb 0.61 -0.15 -0.12 0.00 1.12 0.00 0.00 29.99 31.44 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 -3.56 0.22 -0.45 -0.41 0.74 -1.26 -5.03 119.66 109.92 1ao8 s GLN 65 Ca 0.48 0.29 0.04 0.00 0.05 0.00 0.00 55.36 56.23 1ao8 s GLN 65 Cb 0.39 0.09 0.67 0.00 1.10 0.00 0.00 33.01 35.26 1ao8 s GLN 65 CO -0.19 -0.04 1.92 0.39 -0.55 0.00 0.00 175.29 176.81 1ao8 n GLU 66 N 3.09 2.25 -0.04 1.67 -0.58 -1.26 -4.21 120.64 121.55 1ao8 n GLU 66 Ca -0.14 -3.00 -0.04 0.00 -0.42 0.00 0.00 57.16 53.57 1ao8 n GLU 66 Cb 0.58 -2.18 -0.07 0.00 -0.57 0.00 0.00 31.44 29.21 1ao8 n GLU 66 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1ao8 n ASP 67 N -1.14 2.86 -4.73 1.62 9.92 -1.26 -4.99 116.55 118.82 1ao8 n ASP 67 Ca 0.60 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.44 1ao8 n ASP 67 Cb 1.68 0.77 -0.02 0.00 -0.64 0.00 0.00 41.12 42.91 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 -2.25 2.92 -0.40 1.24 5.04 -1.26 -4.97 117.35 117.67 1ao8 s TYR 68 Ca -0.04 0.69 0.01 0.00 -2.44 0.00 0.00 57.07 55.29 1ao8 s TYR 68 Cb 0.03 -4.00 0.13 0.00 0.35 0.00 0.00 41.96 38.47 1ao8 s TYR 68 CO 0.36 -3.53 0.21 -0.65 -1.34 0.00 0.00 175.55 170.60 1ao8 s GLN 69 N 0.31 1.03 -0.20 4.97 -0.21 -1.26 -5.05 119.66 119.24 1ao8 s GLN 69 Ca 0.67 -1.70 -0.25 0.00 0.02 0.00 0.00 55.36 54.10 1ao8 s GLN 69 Cb -0.46 -2.06 -0.01 0.00 1.00 0.00 0.00 33.01 31.48 1ao8 s GLN 69 CO 0.39 -1.14 0.82 0.00 -2.12 0.00 0.00 175.29 173.25 1ao8 s ALA 70 N 0.73 3.57 -0.46 6.09 0.00 -1.26 -5.01 121.76 125.41 1ao8 s ALA 70 Ca 0.16 -0.04 -0.22 0.00 0.00 0.00 0.00 51.96 51.87 1ao8 s ALA 70 Cb -0.23 -3.24 0.03 0.00 0.00 0.00 0.00 23.12 19.68 1ao8 s ALA 70 CO -0.04 -0.76 0.72 -0.65 0.00 0.00 0.00 175.76 175.03 1ao8 s GLN 71 N 2.41 3.30 0.00 0.00 -0.21 -1.26 -3.92 119.66 119.99 1ao8 s GLN 71 Ca 0.37 -0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.40 1ao8 s GLN 71 Cb -0.16 -3.98 0.00 0.00 1.00 0.00 0.00 33.01 29.87 1ao8 s GLN 71 CO 0.10 -1.12 0.00 0.41 -2.12 0.00 0.00 175.29 172.56 1ao8 n GLY 72 N 5.05 2.41 3.97 3.09 0.00 -1.26 -4.74 105.19 113.70 1ao8 n GLY 72 Ca -0.01 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.23 3.44 -0.35 4.61 0.00 -1.25 -4.91 121.76 122.06 1ao8 s ALA 73 Ca 0.00 -1.43 -0.03 0.00 0.00 0.00 0.00 51.96 50.50 1ao8 s ALA 73 Cb 0.00 -2.24 0.07 0.00 0.00 0.00 0.00 23.12 20.96 1ao8 s ALA 73 CO 0.00 -1.42 0.10 0.08 0.00 0.00 0.00 175.76 174.52 1ao8 s VAL 74 N -3.19 3.29 -0.28 0.00 1.01 -0.85 -4.86 120.40 115.52 1ao8 s VAL 74 Ca 0.64 -1.58 -0.18 0.00 0.00 0.00 0.00 61.98 60.86 1ao8 s VAL 74 Cb -0.07 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.26 1ao8 s VAL 74 CO 0.44 -0.35 0.54 -0.69 0.00 0.00 0.00 175.10 175.05 1ao8 s VAL 75 N 1.25 5.03 0.47 2.92 1.01 -1.26 -1.99 120.40 127.82 1ao8 s VAL 75 Ca 0.01 0.84 0.08 0.00 0.00 0.00 0.00 61.98 62.91 1ao8 s VAL 75 Cb -0.21 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.31 1ao8 s VAL 75 CO -0.01 0.01 0.50 0.68 0.00 0.00 0.00 175.10 176.27 1ao8 s VAL 76 N 2.39 2.45 -0.12 2.92 -7.23 -0.74 -4.95 120.40 115.10 1ao8 s VAL 76 Ca 0.22 -1.24 0.16 0.00 -1.81 0.00 0.00 61.98 59.31 1ao8 s VAL 76 Cb -0.15 -2.69 0.33 0.00 0.56 0.00 0.00 36.38 34.43 1ao8 s VAL 76 CO 0.10 0.00 1.18 1.41 -0.31 0.00 0.00 175.10 177.48 1ao8 n HIS 77 N -1.77 -0.11 -3.64 2.82 8.25 -1.26 -3.99 115.22 115.52 1ao8 n HIS 77 Ca 0.06 -1.10 -0.08 0.00 -0.26 0.00 0.00 57.72 56.34 1ao8 n HIS 77 Cb 0.62 0.33 -0.07 0.00 1.12 0.00 0.00 29.99 31.99 1ao8 n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ao8 s ASP 78 N -1.97 -0.68 0.12 0.41 1.01 -1.26 -5.01 116.67 109.29 1ao8 s ASP 78 Ca 0.19 1.17 -0.18 0.00 0.71 0.00 0.00 52.55 54.44 1ao8 s ASP 78 Cb 0.28 1.24 -0.03 0.00 1.01 0.00 0.00 42.92 45.42 1ao8 s ASP 78 CO -0.09 -0.19 1.71 0.58 0.21 0.00 0.00 175.17 177.39 1ao8 h VAL 79 N 4.45 1.15 0.00 -1.27 2.07 -1.99 -1.95 116.25 118.72 1ao8 h VAL 79 Ca -0.29 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 1ao8 h VAL 79 Cb 1.19 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 1ao8 h VAL 79 CO 0.13 0.16 -0.23 0.00 0.02 0.00 0.00 177.57 177.65 1ao8 h ALA 80 N 1.02 1.53 -0.23 1.67 0.00 -1.99 -2.73 119.26 118.52 1ao8 h ALA 80 Ca 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1ao8 h ALA 80 Cb 0.10 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ao8 h ALA 80 CO -0.02 0.29 0.12 0.00 0.00 0.00 0.00 179.25 179.65 1ao8 h ALA 81 N 1.77 0.30 -0.05 0.00 0.00 -1.76 0.74 119.26 120.26 1ao8 h ALA 81 Ca -0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1ao8 h ALA 81 Cb 0.43 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ao8 h ALA 81 CO 0.03 -0.16 -0.10 0.28 0.00 0.00 0.00 179.25 179.29 1ao8 h VAL 82 N 0.26 1.11 0.00 0.00 2.07 -1.18 -1.38 116.25 117.13 1ao8 h VAL 82 Ca 0.08 -0.47 -0.19 0.00 0.82 0.00 0.00 66.70 66.94 1ao8 h VAL 82 Cb 0.08 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1ao8 h VAL 82 CO -0.01 0.14 -0.86 -0.26 0.02 0.00 0.00 177.57 176.60 1ao8 h PHE 83 N 0.07 0.18 -0.15 1.57 -1.00 -1.17 -2.87 116.94 113.57 1ao8 h PHE 83 Ca 0.02 -0.10 -0.17 0.00 2.81 0.00 0.00 57.97 60.52 1ao8 h PHE 83 Cb 0.23 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.76 1ao8 h PHE 83 CO 0.00 0.92 -0.61 0.00 -1.61 0.00 0.00 178.31 177.01 1ao8 h ALA 84 N 1.05 0.66 -0.52 2.45 0.00 0.06 -2.30 119.26 120.65 1ao8 h ALA 84 Ca -0.03 -0.54 -0.07 0.00 0.00 0.00 0.00 54.91 54.27 1ao8 h ALA 84 Cb 1.49 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 1ao8 h ALA 84 CO 0.12 0.71 0.05 -0.92 0.00 0.00 0.00 179.25 179.22 1ao8 h TYR 85 N 0.38 0.94 0.00 0.00 3.20 -1.26 -1.80 116.97 118.43 1ao8 h TYR 85 Ca -0.01 -0.14 -0.07 0.00 3.14 0.00 0.00 58.73 61.65 1ao8 h TYR 85 Cb 1.16 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 39.17 1ao8 h TYR 85 CO 0.05 0.86 -0.35 0.00 -1.64 0.00 0.00 178.16 177.07 1ao8 h ALA 86 N 0.97 1.38 -0.24 1.82 0.00 -1.44 -2.70 119.26 119.05 1ao8 h ALA 86 Ca 0.15 -0.32 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 1ao8 h ALA 86 Cb 0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ao8 h ALA 86 CO 0.02 0.44 -0.56 -0.22 0.00 0.00 0.00 179.25 178.93 1ao8 h LYS 87 N 0.00 0.75 0.00 0.00 1.63 -0.94 -2.97 116.57 115.04 1ao8 h LYS 87 Ca -0.00 -0.48 -0.06 0.00 -0.85 0.00 0.00 60.65 59.26 1ao8 h LYS 87 Cb 0.64 0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.32 1ao8 h LYS 87 CO 0.05 1.11 -0.27 1.96 -3.45 0.00 0.00 179.45 178.84 1ao8 h GLN 88 N 0.57 0.00 -3.90 1.90 1.08 -1.03 -3.35 115.11 110.38 1ao8 h GLN 88 Ca 0.01 0.00 -0.68 0.00 -1.45 0.00 0.00 58.65 56.53 1ao8 h GLN 88 Cb 1.14 0.00 -0.37 0.00 -0.05 0.00 0.00 27.48 28.20 1ao8 h GLN 88 CO 0.12 0.27 -0.52 -1.01 -0.95 0.00 0.00 178.83 176.74 1ao8 s HIS 89 N -4.38 3.45 -0.67 2.96 3.76 -1.08 -4.92 115.29 114.41 1ao8 s HIS 89 Ca -0.03 -2.80 0.24 0.00 -0.15 0.00 0.00 55.06 52.33 1ao8 s HIS 89 Cb 0.15 -3.08 0.91 0.00 1.11 0.00 0.00 32.58 31.66 1ao8 s HIS 89 CO 0.70 -0.86 1.74 -0.35 -0.85 0.00 0.00 174.74 175.11 1ao8 n PRO 90 N 3.76 0.19 -0.88 8.40 -0.05 -1.26 -3.16 135.00 142.01 1ao8 n PRO 90 Ca 0.04 0.29 -0.10 0.00 -0.05 0.00 0.00 63.50 63.68 1ao8 n PRO 90 Cb 0.38 -1.78 0.21 0.00 -0.05 0.00 0.00 33.50 32.26 1ao8 n PRO 90 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 175.50 175.05 1ao8 n ASP 91 N -2.12 4.05 -3.89 3.54 5.75 -1.26 -4.90 116.55 117.73 1ao8 n ASP 91 Ca 0.04 -3.08 -0.10 0.00 -0.01 0.00 0.00 54.79 51.64 1ao8 n ASP 91 Cb 0.31 -0.73 -0.09 0.00 -1.03 0.00 0.00 41.12 39.59 1ao8 n ASP 91 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1ao8 s GLN 92 N -2.54 0.59 0.24 0.11 1.11 -1.19 -4.94 119.66 113.04 1ao8 s GLN 92 Ca 0.45 -0.61 0.11 0.00 0.01 0.00 0.00 55.36 55.32 1ao8 s GLN 92 Cb 0.36 0.24 -0.05 0.00 -1.01 0.00 0.00 33.01 32.56 1ao8 s GLN 92 CO 0.10 -0.15 -0.17 -1.21 0.01 0.00 0.00 175.29 173.87 1ao8 s GLU 93 N -2.22 1.79 -0.26 2.91 2.02 -1.26 -4.94 118.70 116.73 1ao8 s GLU 93 Ca -0.08 -1.58 -0.19 0.00 0.02 0.00 0.00 54.97 53.14 1ao8 s GLU 93 Cb -0.03 -1.91 -0.02 0.00 0.10 0.00 0.00 34.13 32.27 1ao8 s GLU 93 CO -0.02 0.37 0.57 -1.17 0.02 0.00 0.00 175.26 175.03 1ao8 s LEU 94 N -3.21 4.07 -0.30 1.80 2.96 -1.26 -2.10 118.68 120.63 1ao8 s LEU 94 Ca 0.27 0.57 -0.05 0.00 -0.22 0.00 0.00 54.13 54.70 1ao8 s LEU 94 Cb -0.07 -2.75 0.02 0.00 0.50 0.00 0.00 46.19 43.89 1ao8 s LEU 94 CO 0.14 -0.35 0.06 -0.69 -1.32 0.00 0.00 176.35 174.20 1ao8 s VAL 95 N 2.42 3.66 -0.29 1.68 1.01 -0.62 -0.42 120.40 127.84 1ao8 s VAL 95 Ca 0.24 -0.92 -0.20 0.00 0.00 0.00 0.00 61.98 61.09 1ao8 s VAL 95 Cb -0.15 -2.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.26 1ao8 s VAL 95 CO 0.09 0.02 0.62 -0.63 0.00 0.00 0.00 175.10 175.20 1ao8 s ILE 96 N 1.43 4.96 -0.15 2.22 -1.09 -0.79 -1.14 121.20 126.62 1ao8 s ILE 96 Ca 0.00 0.91 0.18 0.00 -2.23 0.00 0.00 60.65 59.52 1ao8 s ILE 96 Cb -0.18 -3.97 -0.26 0.00 -1.58 0.00 0.00 42.46 36.47 1ao8 s ILE 96 CO 0.01 -0.09 0.24 0.00 -1.23 0.00 0.00 174.94 173.87 1ao8 n ALA 97 N 5.82 1.79 0.00 9.38 0.00 -0.93 -2.12 120.51 134.45 1ao8 n ALA 97 Ca -0.01 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.34 1ao8 n ALA 97 Cb 0.49 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 1.62 0.45 0.00 0.00 0.00 -1.26 -4.77 105.19 101.24 1ao8 n GLY 98 Ca -0.25 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.03 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 0.04 0.22 -0.02 0.00 -1.26 -0.90 105.19 103.27 1ao8 n GLY 99 Ca 0.00 -1.50 0.03 0.00 0.00 0.00 0.00 46.02 44.55 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 1.52 -0.06 4.61 0.00 -1.93 -1.94 119.26 119.47 1ao8 h ALA 100 Ca 0.00 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1ao8 h ALA 100 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ao8 h ALA 100 CO 0.00 0.35 -0.12 1.96 0.00 0.00 0.00 179.25 181.44 1ao8 h GLN 101 N 0.12 0.08 0.19 0.00 4.20 -1.98 -1.16 115.11 116.56 1ao8 h GLN 101 Ca 0.02 -0.01 -0.32 0.00 0.06 0.00 0.00 58.65 58.39 1ao8 h GLN 101 Cb 0.43 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.22 1ao8 h GLN 101 CO 0.03 0.21 -1.49 0.82 -0.67 0.00 0.00 178.83 177.73 1ao8 h ILE 102 N 0.08 1.24 -0.70 2.54 1.08 -1.62 -3.16 117.51 116.97 1ao8 h ILE 102 Ca 0.02 -2.76 -0.05 0.00 -0.39 0.00 0.00 64.86 61.68 1ao8 h ILE 102 Cb 0.27 2.92 -0.03 0.00 -3.07 0.00 0.00 36.82 36.91 1ao8 h ILE 102 CO 0.02 0.84 0.25 -0.26 -0.69 0.00 0.00 178.15 178.30 1ao8 h PHE 103 N 0.11 1.09 -0.56 1.37 0.04 -1.04 -2.41 116.94 115.54 1ao8 h PHE 103 Ca -0.25 -0.10 -0.03 0.00 2.80 0.00 0.00 57.97 60.39 1ao8 h PHE 103 Cb 2.09 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 39.89 1ao8 h PHE 103 CO 0.10 0.86 0.21 1.15 -0.60 0.00 0.00 178.31 180.03 1ao8 h THR 104 N 1.01 1.21 -0.56 -1.55 2.02 -1.32 -1.00 112.91 112.72 1ao8 h THR 104 Ca 0.23 -0.66 -0.04 0.00 0.77 0.00 0.00 66.41 66.71 1ao8 h THR 104 Cb 0.26 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 1ao8 h THR 104 CO -0.01 0.26 0.21 0.00 0.37 0.00 0.00 175.52 176.34 1ao8 h ALA 105 N 1.43 0.73 -0.94 6.16 0.00 -1.41 -2.78 119.26 122.45 1ao8 h ALA 105 Ca 0.19 -0.17 -0.63 0.00 0.00 0.00 0.00 54.91 54.30 1ao8 h ALA 105 Cb 0.18 -0.22 -0.31 0.00 0.00 0.00 0.00 17.79 17.44 1ao8 h ALA 105 CO -0.02 0.36 0.56 1.19 0.00 0.00 0.00 179.25 181.34 1ao8 n PHE 106 N -4.48 3.08 0.02 0.00 3.72 -0.96 -4.58 117.46 114.27 1ao8 n PHE 106 Ca 0.03 -2.76 -0.15 0.00 -0.05 0.00 0.00 57.45 54.52 1ao8 n PHE 106 Cb 0.18 -1.21 -0.04 0.00 -0.94 0.00 0.00 39.48 37.47 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 1.91 0.59 -1.04 -1.08 3.64 -0.90 -3.16 116.57 116.54 1ao8 h LYS 107 Ca 0.56 -0.52 -0.54 0.00 -1.27 0.00 0.00 60.65 58.87 1ao8 h LYS 107 Cb 1.13 0.12 -0.28 0.00 -0.41 0.00 0.00 32.23 32.79 1ao8 h LYS 107 CO 1.38 1.15 0.70 -0.25 -2.27 0.00 0.00 179.45 180.16 1ao8 n ASP 108 N -3.86 5.43 -2.92 4.20 9.92 -1.26 -4.52 116.55 123.54 1ao8 n ASP 108 Ca -0.07 -3.57 -0.14 0.00 -0.53 0.00 0.00 54.79 50.49 1ao8 n ASP 108 Cb 0.76 -0.89 0.02 0.00 -0.64 0.00 0.00 41.12 40.37 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 -0.88 -1.48 -3.62 -2.24 8.00 -1.19 -5.12 116.55 110.03 1ao8 n ASP 109 Ca 0.56 -3.22 -0.14 0.00 0.71 0.00 0.00 54.79 52.71 1ao8 n ASP 109 Cb 1.16 0.91 -0.07 0.00 -0.02 0.00 0.00 41.12 43.09 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 -0.33 0.00 -0.05 2.53 0.11 -1.26 -4.82 120.40 116.58 1ao8 s VAL 110 Ca 0.31 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.36 1ao8 s VAL 110 Cb 0.25 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 34.07 1ao8 s VAL 110 CO -0.14 0.00 -0.05 -0.90 -3.33 0.00 0.00 175.10 170.68 1ao8 n ASP 111 N 2.38 2.75 -4.76 3.54 5.75 -1.26 -4.97 116.55 119.97 1ao8 n ASP 111 Ca -0.14 -0.00 -0.36 0.00 -0.01 0.00 0.00 54.79 54.27 1ao8 n ASP 111 Cb 0.55 -0.10 -0.07 0.00 -1.03 0.00 0.00 41.12 40.48 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 -2.10 5.31 -0.34 2.12 2.01 -1.26 -1.82 115.64 119.57 1ao8 s THR 112 Ca -0.07 0.49 0.03 0.00 0.31 0.00 0.00 61.69 62.45 1ao8 s THR 112 Cb 0.02 -3.59 0.09 0.00 0.01 0.00 0.00 72.50 69.04 1ao8 s THR 112 CO 0.11 0.45 0.04 -0.76 -0.69 0.00 0.00 174.62 173.78 1ao8 s LEU 113 N 0.03 4.60 -0.16 4.42 1.43 -0.94 -2.11 118.68 125.95 1ao8 s LEU 113 Ca 0.16 -1.99 -0.16 0.00 -1.03 0.00 0.00 54.13 51.11 1ao8 s LEU 113 Cb -0.13 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1ao8 s LEU 113 CO 0.04 -0.37 0.41 -0.76 0.23 0.00 0.00 176.35 175.90 1ao8 s LEU 114 N 0.98 4.22 -0.03 1.79 1.43 0.11 -2.27 118.68 124.91 1ao8 s LEU 114 Ca 0.07 0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 53.70 1ao8 s LEU 114 Cb -0.20 -2.56 0.02 0.00 0.03 0.00 0.00 46.19 43.48 1ao8 s LEU 114 CO -0.07 -0.01 0.24 0.54 0.23 0.00 0.00 176.35 177.28 1ao8 s VAL 115 N 0.87 0.05 -0.32 -1.59 0.11 -1.02 -2.34 120.40 116.15 1ao8 s VAL 115 Ca 0.21 -0.41 -0.08 0.00 -2.93 0.00 0.00 61.98 58.78 1ao8 s VAL 115 Cb -0.14 -0.49 0.02 0.00 -1.53 0.00 0.00 36.38 34.24 1ao8 s VAL 115 CO 0.08 -0.22 0.12 -0.89 -3.33 0.00 0.00 175.10 170.86 1ao8 s THR 116 N -0.92 4.13 -0.31 5.04 2.01 -0.94 -1.26 115.64 123.39 1ao8 s THR 116 Ca -0.10 -0.80 -0.26 0.00 0.31 0.00 0.00 61.69 60.84 1ao8 s THR 116 Cb -0.05 -3.22 0.01 0.00 0.01 0.00 0.00 72.50 69.25 1ao8 s THR 116 CO 0.02 -0.05 0.90 -0.13 -0.69 0.00 0.00 174.62 174.67 1ao8 s ARG 117 N 1.50 4.01 0.65 4.92 0.52 -1.02 -2.27 118.95 127.26 1ao8 s ARG 117 Ca 0.02 0.79 0.04 0.00 -0.52 0.00 0.00 55.73 56.07 1ao8 s ARG 117 Cb -0.18 -3.73 0.11 0.00 0.52 0.00 0.00 34.95 31.67 1ao8 s ARG 117 CO 0.04 -0.76 0.89 -0.51 0.02 0.00 0.00 175.30 174.98 1ao8 s LEU 118 N 3.22 3.05 -0.00 2.53 1.02 -0.89 -1.22 118.68 126.38 1ao8 s LEU 118 Ca 0.38 -0.61 0.00 0.00 0.02 0.00 0.00 54.13 53.92 1ao8 s LEU 118 Cb -0.13 -1.80 -0.00 0.00 0.02 0.00 0.00 46.19 44.27 1ao8 s LEU 118 CO 0.13 -1.60 -0.00 0.00 0.02 0.00 0.00 176.35 174.90 1ao8 n ALA 119 N -2.54 1.99 -1.77 4.21 0.00 -0.77 -4.00 120.51 117.64 1ao8 n ALA 119 Ca 0.15 -0.01 -0.40 0.00 0.00 0.00 0.00 53.44 53.19 1ao8 n ALA 119 Cb 0.61 0.49 0.01 0.00 0.00 0.00 0.00 19.45 20.55 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 -4.00 2.92 0.29 0.00 0.00 -1.05 -4.66 107.32 100.82 1ao8 s GLY 120 Ca -0.00 1.35 -0.08 0.00 0.00 0.00 0.00 44.72 45.99 1ao8 s GLY 120 CO 0.01 1.95 0.61 -0.45 0.00 0.00 0.00 173.10 175.21 1ao8 s SER 121 N -0.62 6.54 0.16 1.64 0.15 -1.26 -4.47 113.70 115.83 1ao8 s SER 121 Ca 0.59 0.90 -0.12 0.00 0.70 0.00 0.00 55.95 58.03 1ao8 s SER 121 Cb -0.41 -2.22 0.01 0.00 -1.71 0.00 0.00 66.02 61.69 1ao8 s SER 121 CO 0.53 -0.19 0.34 -0.36 1.20 0.00 0.00 173.24 174.75 1ao8 s PHE 122 N -2.04 0.17 0.11 3.44 0.08 -1.26 -5.10 117.98 113.38 1ao8 s PHE 122 Ca 0.47 -0.54 0.09 0.00 0.12 0.00 0.00 56.93 57.07 1ao8 s PHE 122 Cb -0.11 0.08 -0.04 0.00 -0.57 0.00 0.00 43.02 42.39 1ao8 s PHE 122 CO 0.26 -0.74 -0.19 -2.00 -0.10 0.00 0.00 175.22 172.46 1ao8 s GLU 123 N -3.91 1.78 -0.06 0.44 2.12 -1.26 -4.92 118.70 112.89 1ao8 s GLU 123 Ca 0.12 -1.17 -0.22 0.00 0.36 0.00 0.00 54.97 54.06 1ao8 s GLU 123 Cb 0.02 -2.10 0.07 0.00 0.26 0.00 0.00 34.13 32.38 1ao8 s GLU 123 CO -0.04 0.48 0.98 0.41 -0.54 0.00 0.00 175.26 176.56 1ao8 n GLY 124 N 0.88 0.18 0.04 -1.50 0.00 -1.26 -4.88 105.19 98.65 1ao8 n GLY 124 Ca -0.16 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.73 2.91 -4.69 1.61 8.00 -1.26 -4.96 116.55 117.44 1ao8 n ASP 125 Ca 0.05 -0.01 -0.42 0.00 0.71 0.00 0.00 54.79 55.12 1ao8 n ASP 125 Cb 0.42 0.63 -0.03 0.00 -0.02 0.00 0.00 41.12 42.12 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 -2.21 4.19 0.31 -3.53 2.01 -1.13 -5.02 115.64 110.26 1ao8 s THR 126 Ca -0.05 1.52 0.03 0.00 0.31 0.00 0.00 61.69 63.50 1ao8 s THR 126 Cb 0.03 -3.98 -0.06 0.00 0.01 0.00 0.00 72.50 68.50 1ao8 s THR 126 CO 0.34 -0.01 0.06 -0.54 -0.69 0.00 0.00 174.62 173.79 1ao8 s LYS 127 N 2.32 1.59 0.22 4.92 1.02 -1.26 -2.05 119.74 126.50 1ao8 s LYS 127 Ca 0.57 -1.87 -0.13 0.00 0.02 0.00 0.00 55.97 54.56 1ao8 s LYS 127 Cb -0.25 -0.72 -0.08 0.00 -0.52 0.00 0.00 37.83 36.26 1ao8 s LYS 127 CO 0.22 -0.21 0.60 1.41 -0.92 0.00 0.00 175.35 176.45 1ao8 s MET 128 N -3.92 3.93 0.92 1.68 -2.45 -1.20 -4.73 119.30 113.51 1ao8 s MET 128 Ca 0.37 0.46 -0.12 0.00 -1.25 0.00 0.00 55.69 55.15 1ao8 s MET 128 Cb 0.08 -2.71 0.14 0.00 1.25 0.00 0.00 34.83 33.60 1ao8 s MET 128 CO 0.15 0.34 1.09 0.96 1.05 0.00 0.00 175.02 178.61 1ao8 s ILE 129 N -1.72 2.57 -0.72 10.11 -4.36 -1.26 -4.94 121.20 120.88 1ao8 s ILE 129 Ca 0.45 0.18 -0.27 0.00 -0.26 0.00 0.00 60.65 60.76 1ao8 s ILE 129 Cb -0.13 -2.61 0.03 0.00 1.25 0.00 0.00 42.46 41.00 1ao8 s ILE 129 CO 0.20 -0.24 1.28 -2.16 0.24 0.00 0.00 174.94 174.26 1ao8 s PRO 130 N -4.88 3.22 0.07 0.37 0.04 -1.26 -5.02 135.00 127.53 1ao8 s PRO 130 Ca 0.64 -0.16 0.01 0.00 0.04 0.00 0.00 61.00 61.53 1ao8 s PRO 130 Cb -0.19 -4.16 -0.04 0.00 0.04 0.00 0.00 34.50 30.15 1ao8 s PRO 130 CO 0.58 -2.11 0.19 -0.51 0.04 0.00 0.00 177.00 175.19 1ao8 s LEU 131 N 5.72 4.28 -0.16 -3.56 1.43 -1.26 -5.08 118.68 120.05 1ao8 s LEU 131 Ca 0.37 0.22 -0.20 0.00 -1.03 0.00 0.00 54.13 53.49 1ao8 s LEU 131 Cb -0.08 -2.89 -0.03 0.00 0.03 0.00 0.00 46.19 43.22 1ao8 s LEU 131 CO 0.16 0.16 0.60 0.21 0.23 0.00 0.00 176.35 177.72 1ao8 s ASN 132 N -2.53 6.72 0.00 2.29 2.47 -1.26 -4.94 114.94 117.69 1ao8 s ASN 132 Ca 0.34 0.87 0.21 0.00 0.42 0.00 0.00 52.86 54.69 1ao8 s ASN 132 Cb -0.13 -2.34 0.51 0.00 -1.45 0.00 0.00 41.25 37.85 1ao8 s ASN 132 CO 0.27 -0.18 1.43 0.79 -3.72 0.00 0.00 177.10 175.69 1ao8 n TRP 133 N 4.54 0.73 0.07 0.43 7.02 -1.26 -4.34 117.44 124.64 1ao8 n TRP 133 Ca -0.03 -0.41 -0.08 0.00 -1.02 0.00 0.00 57.50 55.96 1ao8 n TRP 133 Cb 0.50 -0.00 -0.11 0.00 -2.42 0.00 0.00 31.31 29.28 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 3.93 0.06 -0.91 -0.99 5.19 -2.04 -3.25 116.42 118.41 1ao8 h ASP 134 Ca 0.00 -0.06 -0.58 0.00 -0.62 0.00 0.00 57.03 55.77 1ao8 h ASP 134 Cb 0.93 -0.02 -0.27 0.00 0.18 0.00 0.00 39.33 40.16 1ao8 h ASP 134 CO 0.00 1.03 0.75 -0.67 -3.12 0.00 0.00 179.24 177.23 1ao8 n ASP 135 N -3.40 6.46 -3.99 6.45 2.03 -1.26 -4.92 116.55 117.91 1ao8 n ASP 135 Ca -0.01 -3.61 -0.09 0.00 0.52 0.00 0.00 54.79 51.60 1ao8 n ASP 135 Cb 0.93 -0.94 -0.08 0.00 -0.72 0.00 0.00 41.12 40.31 1ao8 n ASP 135 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1ao8 s PHE 136 N -3.35 0.45 -0.01 -0.67 0.08 -1.23 -3.77 117.98 109.48 1ao8 s PHE 136 Ca 0.57 -0.86 -0.06 0.00 0.12 0.00 0.00 56.93 56.70 1ao8 s PHE 136 Cb 0.46 -0.20 0.00 0.00 -0.57 0.00 0.00 43.02 42.71 1ao8 s PHE 136 CO 0.02 -0.57 0.13 0.99 -0.10 0.00 0.00 175.22 175.68 1ao8 s THR 137 N -3.95 0.07 -0.12 0.64 2.01 0.09 -4.89 115.64 109.48 1ao8 s THR 137 Ca 0.14 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.32 1ao8 s THR 137 Cb 0.05 -0.37 -0.02 0.00 0.01 0.00 0.00 72.50 72.18 1ao8 s THR 137 CO -0.04 -0.30 0.86 -0.75 -0.69 0.00 0.00 174.62 173.69 1ao8 s LYS 138 N -1.05 4.37 -0.09 4.92 2.20 -1.26 -1.13 119.74 127.70 1ao8 s LYS 138 Ca -0.11 1.10 0.07 0.00 -0.36 0.00 0.00 55.97 56.67 1ao8 s LYS 138 Cb -0.06 -3.54 -0.11 0.00 -1.51 0.00 0.00 37.83 32.62 1ao8 s LYS 138 CO 0.01 -0.23 0.02 1.33 -0.36 0.00 0.00 175.35 176.12 1ao8 n VAL 139 N 4.46 0.60 -3.91 4.02 0.24 -1.20 -4.97 118.33 117.56 1ao8 n VAL 139 Ca 0.04 -0.36 -0.09 0.00 -2.04 0.00 0.00 64.34 61.90 1ao8 n VAL 139 Cb 0.49 -0.78 -0.08 0.00 -1.47 0.00 0.00 33.84 32.01 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 -4.12 0.20 -0.29 -1.34 0.15 -1.22 -5.08 113.70 102.00 1ao8 s SER 140 Ca -0.05 -0.69 -0.23 0.00 0.70 0.00 0.00 55.95 55.68 1ao8 s SER 140 Cb 0.03 0.29 0.14 0.00 -1.71 0.00 0.00 66.02 64.77 1ao8 s SER 140 CO 0.35 -0.66 1.08 -0.55 1.20 0.00 0.00 173.24 174.66 1ao8 s SER 141 N -2.73 -0.40 -0.04 5.45 0.15 -1.26 -2.20 113.70 112.68 1ao8 s SER 141 Ca 0.04 0.73 0.02 0.00 0.70 0.00 0.00 55.95 57.44 1ao8 s SER 141 Cb 0.04 0.84 0.01 0.00 -1.71 0.00 0.00 66.02 65.20 1ao8 s SER 141 CO -0.10 -0.12 -0.08 -0.60 1.20 0.00 0.00 173.24 173.54 1ao8 s ARG 142 N 0.44 0.97 0.05 5.44 3.52 -0.38 -5.01 118.95 123.98 1ao8 s ARG 142 Ca 0.01 -0.24 0.00 0.00 -0.13 0.00 0.00 55.73 55.37 1ao8 s ARG 142 Cb -0.05 -0.91 -0.04 0.00 -1.56 0.00 0.00 34.95 32.40 1ao8 s ARG 142 CO -0.09 0.03 0.19 0.99 -0.81 0.00 0.00 175.30 175.61 1ao8 s THR 143 N 0.48 5.26 -0.14 4.11 2.01 -1.26 0.09 115.64 126.19 1ao8 s THR 143 Ca -0.07 -0.42 -0.04 0.00 0.31 0.00 0.00 61.69 61.46 1ao8 s THR 143 Cb -0.11 -3.55 0.07 0.00 0.01 0.00 0.00 72.50 68.92 1ao8 s THR 143 CO 0.01 0.16 0.23 -0.69 -0.69 0.00 0.00 174.62 173.63 1ao8 s VAL 144 N -1.47 -0.35 -0.20 3.82 1.01 -0.48 -4.93 120.40 117.80 1ao8 s VAL 144 Ca 0.33 0.19 -0.13 0.00 0.00 0.00 0.00 61.98 62.37 1ao8 s VAL 144 Cb -0.13 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 1ao8 s VAL 144 CO 0.26 0.04 0.29 -1.61 0.00 0.00 0.00 175.10 174.07 1ao8 s GLU 145 N 2.36 4.16 0.19 2.72 2.02 -1.26 -2.42 118.70 126.48 1ao8 s GLU 145 Ca 0.03 0.01 -0.01 0.00 0.02 0.00 0.00 54.97 55.03 1ao8 s GLU 145 Cb -0.13 -3.51 0.04 0.00 0.10 0.00 0.00 34.13 30.63 1ao8 s GLU 145 CO -0.09 0.07 0.27 -3.47 0.02 0.00 0.00 175.26 172.06 1ao8 n ASP 146 N 4.18 0.25 -0.20 -0.19 -0.08 -1.25 -4.98 116.55 114.27 1ao8 n ASP 146 Ca -0.11 -1.23 -0.08 0.00 -1.51 0.00 0.00 54.79 51.85 1ao8 n ASP 146 Cb 0.52 -0.18 0.02 0.00 2.34 0.00 0.00 41.12 43.81 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 -0.64 1.23 -1.84 5.18 1.35 -1.98 -3.44 112.91 112.77 1ao8 h THR 147 Ca -0.09 -0.72 -0.44 0.00 -0.55 0.00 0.00 66.41 64.61 1ao8 h THR 147 Cb 0.30 0.66 0.01 0.00 -1.73 0.00 0.00 68.15 67.39 1ao8 h THR 147 CO 0.08 0.28 -0.28 0.20 -0.25 0.00 0.00 175.52 175.55 1ao8 s ASN 148 N -6.08 5.83 0.10 5.36 -0.87 -1.26 -5.02 114.94 112.99 1ao8 s ASN 148 Ca -0.13 -0.19 -0.00 0.00 -1.57 0.00 0.00 52.86 50.96 1ao8 s ASN 148 Cb 0.12 -1.08 -0.23 0.00 -0.02 0.00 0.00 41.25 40.04 1ao8 s ASN 148 CO 0.79 -0.59 1.21 1.55 -2.57 0.00 0.00 177.10 177.49 1ao8 h PRO 149 N 0.72 0.18 0.00 -0.60 0.13 -2.00 -3.24 132.00 127.20 1ao8 h PRO 149 Ca -0.44 -0.30 -0.04 0.00 -0.87 0.00 0.00 66.00 64.35 1ao8 h PRO 149 Cb 1.27 0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.50 1ao8 h PRO 149 CO 0.51 1.13 -0.19 0.00 -0.23 0.00 0.00 178.00 179.21 1ao8 h ALA 150 N 0.75 1.01 -0.57 -0.56 0.00 -1.95 -2.83 119.26 115.11 1ao8 h ALA 150 Ca -0.09 -0.18 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 1ao8 h ALA 150 Cb 1.86 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 19.52 1ao8 h ALA 150 CO 0.17 0.24 0.20 1.28 0.00 0.00 0.00 179.25 181.15 1ao8 n LEU 151 N -3.34 5.10 -4.70 0.00 4.77 -1.22 -2.53 117.00 115.09 1ao8 n LEU 151 Ca 0.00 -2.64 -0.41 0.00 -0.03 0.00 0.00 56.01 52.93 1ao8 n LEU 151 Cb 0.42 -0.69 -0.04 0.00 -2.33 0.00 0.00 43.42 40.78 1ao8 n LEU 151 CO 0.33 0.69 0.58 -0.89 -1.33 0.00 0.00 177.39 176.77 1ao8 s THR 152 N -2.40 4.92 0.07 -5.08 2.01 -1.07 -3.96 115.64 110.14 1ao8 s THR 152 Ca 0.42 1.74 0.02 0.00 0.31 0.00 0.00 61.69 64.18 1ao8 s THR 152 Cb 0.33 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.63 1ao8 s THR 152 CO 0.11 0.14 -0.07 -1.38 -0.69 0.00 0.00 174.62 172.73 1ao8 s HIS 153 N 1.33 0.78 -0.18 4.92 -3.43 -1.02 -1.85 115.29 115.85 1ao8 s HIS 153 Ca 0.43 -0.77 -0.04 0.00 -0.80 0.00 0.00 55.06 53.89 1ao8 s HIS 153 Cb -0.18 -0.46 0.06 0.00 -1.43 0.00 0.00 32.58 30.56 1ao8 s HIS 153 CO 0.20 -0.14 0.06 0.99 -2.00 0.00 0.00 174.74 173.84 1ao8 s THR 154 N -2.81 0.23 0.16 -5.38 2.01 -0.36 -1.38 115.64 108.11 1ao8 s THR 154 Ca 0.03 -0.34 -0.31 0.00 0.31 0.00 0.00 61.69 61.38 1ao8 s THR 154 Cb -0.00 -0.79 -0.10 0.00 0.01 0.00 0.00 72.50 71.61 1ao8 s THR 154 CO -0.03 -0.22 1.67 -0.31 -0.69 0.00 0.00 174.62 175.04 1ao8 s TYR 155 N 1.99 2.77 -0.14 4.92 2.02 0.11 -2.44 117.35 126.59 1ao8 s TYR 155 Ca 0.01 0.39 0.02 0.00 -0.37 0.00 0.00 57.07 57.12 1ao8 s TYR 155 Cb -0.16 -4.03 0.01 0.00 -0.40 0.00 0.00 41.96 37.37 1ao8 s TYR 155 CO -0.08 -3.98 -0.21 -1.21 -1.57 0.00 0.00 175.55 168.50 1ao8 s GLU 156 N 1.64 3.07 -0.63 -0.62 0.41 -0.39 -1.25 118.70 120.93 1ao8 s GLU 156 Ca 0.74 -0.83 -0.04 0.00 -0.41 0.00 0.00 54.97 54.43 1ao8 s GLU 156 Cb -0.45 -2.47 0.16 0.00 -1.78 0.00 0.00 34.13 29.59 1ao8 s GLU 156 CO 0.32 0.01 0.46 0.08 -0.49 0.00 0.00 175.26 175.64 1ao8 s VAL 157 N 0.77 3.86 0.50 2.63 1.01 -0.93 -2.43 120.40 125.81 1ao8 s VAL 157 Ca -0.08 -2.88 -0.09 0.00 0.00 0.00 0.00 61.98 58.93 1ao8 s VAL 157 Cb -0.16 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 1ao8 s VAL 157 CO -0.01 -0.88 0.86 0.26 0.00 0.00 0.00 175.10 175.33 1ao8 s TRP 158 N 0.01 3.54 -0.11 5.22 0.52 -0.96 -3.23 118.94 123.93 1ao8 s TRP 158 Ca 0.17 1.06 -0.08 0.00 0.02 0.00 0.00 56.10 57.26 1ao8 s TRP 158 Cb -0.20 -2.49 0.03 0.00 -1.15 0.00 0.00 33.47 29.66 1ao8 s TRP 158 CO -0.04 -0.34 0.27 -0.65 0.02 0.00 0.00 176.95 176.21 1ao8 s GLN 159 N -4.54 0.29 0.87 4.98 -0.21 -0.28 -2.20 119.66 118.57 1ao8 s GLN 159 Ca 0.51 0.43 -0.11 0.00 0.02 0.00 0.00 55.36 56.22 1ao8 s GLN 159 Cb -0.10 0.08 0.12 0.00 1.00 0.00 0.00 33.01 34.10 1ao8 s GLN 159 CO 0.42 -0.07 1.11 0.21 -2.12 0.00 0.00 175.29 174.83 1ao8 s LYS 160 N 0.48 1.42 -0.62 2.91 2.20 -0.75 -0.73 119.74 124.64 1ao8 s LYS 160 Ca -0.03 1.21 -0.27 0.00 -0.36 0.00 0.00 55.97 56.52 1ao8 s LYS 160 Cb -0.04 -1.80 -0.00 0.00 -1.51 0.00 0.00 37.83 34.48 1ao8 s LYS 160 CO -0.02 -2.24 1.61 0.15 -0.36 0.00 0.00 175.35 174.48 1ao8 s LYS 161 N -4.79 2.95 0.00 4.03 1.02 -1.25 -4.75 119.74 116.96 1ao8 s LYS 161 Ca 0.64 0.39 0.00 0.00 0.02 0.00 0.00 55.97 57.02 1ao8 s LYS 161 Cb -0.20 -4.27 0.00 0.00 -0.52 0.00 0.00 37.83 32.84 1ao8 s LYS 161 CO 0.57 -2.37 0.00 0.00 -0.92 0.00 0.00 175.35 172.64