#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 -2.21 0.66 2.41 0.00 0.32 -4.41 121.76 118.52 1ao8 s ALA 2 Ca 0.00 2.25 -0.13 0.00 0.00 0.00 0.00 51.96 54.08 1ao8 s ALA 2 Cb 0.00 -1.68 -0.01 0.00 0.00 0.00 0.00 23.12 21.43 1ao8 s ALA 2 CO 0.00 -0.44 1.06 -0.06 0.00 0.00 0.00 175.76 176.32 1ao8 s PHE 3 N 1.59 3.08 -0.30 0.00 0.40 -0.41 -2.09 117.98 120.24 1ao8 s PHE 3 Ca -0.09 1.45 -0.01 0.00 -0.60 0.00 0.00 56.93 57.69 1ao8 s PHE 3 Cb -0.05 -2.92 0.19 0.00 0.51 0.00 0.00 43.02 40.75 1ao8 s PHE 3 CO -0.17 -1.17 0.65 -1.17 0.70 0.00 0.00 175.22 174.06 1ao8 s LEU 4 N -5.15 -1.35 0.14 -0.37 2.96 -0.54 -1.77 118.68 112.60 1ao8 s LEU 4 Ca 0.60 0.64 -0.14 0.00 -0.22 0.00 0.00 54.13 55.01 1ao8 s LEU 4 Cb -0.15 2.05 0.02 0.00 0.50 0.00 0.00 46.19 48.62 1ao8 s LEU 4 CO 0.48 -0.25 0.37 -1.66 -1.32 0.00 0.00 176.35 173.97 1ao8 s TRP 5 N 2.86 -0.04 -0.12 5.38 -2.14 -0.99 -4.29 118.94 119.60 1ao8 s TRP 5 Ca 0.17 -0.31 0.00 0.00 2.66 0.00 0.00 56.10 58.62 1ao8 s TRP 5 Cb -0.13 0.18 -0.02 0.00 -3.10 0.00 0.00 33.47 30.40 1ao8 s TRP 5 CO -0.21 -0.71 -0.12 0.00 -2.66 0.00 0.00 176.95 173.25 1ao8 s ALA 6 N -3.85 2.70 0.18 2.67 0.00 -1.26 -2.21 121.76 119.99 1ao8 s ALA 6 Ca 0.06 -0.89 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 1ao8 s ALA 6 Cb 0.02 -1.22 -0.04 0.00 0.00 0.00 0.00 23.12 21.88 1ao8 s ALA 6 CO -0.08 0.32 0.13 1.14 0.00 0.00 0.00 175.76 177.26 1ao8 s GLN 7 N 0.10 1.14 0.24 0.00 -2.07 -1.01 -4.30 119.66 113.74 1ao8 s GLN 7 Ca -0.05 -1.54 0.01 0.00 -1.82 0.00 0.00 55.36 51.96 1ao8 s GLN 7 Cb -0.14 0.28 0.01 0.00 -1.09 0.00 0.00 33.01 32.07 1ao8 s GLN 7 CO 0.04 -0.37 0.12 -0.40 -1.32 0.00 0.00 175.29 173.37 1ao8 n ASP 8 N -0.22 2.04 0.27 12.60 5.68 -1.16 -2.18 116.55 133.57 1ao8 n ASP 8 Ca -0.01 -1.88 0.10 0.00 -0.50 0.00 0.00 54.79 52.50 1ao8 n ASP 8 Cb 0.65 0.04 0.71 0.00 -1.14 0.00 0.00 41.12 41.37 1ao8 n ASP 8 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1ao8 h ARG 9 N 0.00 0.00 0.06 0.11 0.11 -1.77 -2.72 114.38 110.17 1ao8 h ARG 9 Ca -0.16 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.91 1ao8 h ARG 9 Cb 0.56 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.64 1ao8 h ARG 9 CO 0.26 0.03 -0.03 -0.44 0.10 0.00 0.00 179.97 179.90 1ao8 h ASP 10 N 0.00 -0.06 0.00 0.08 5.19 -1.90 -3.48 116.42 116.25 1ao8 h ASP 10 Ca -0.00 -0.50 0.00 0.00 -0.62 0.00 0.00 57.03 55.90 1ao8 h ASP 10 Cb 0.07 0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.59 1ao8 h ASP 10 CO 0.00 0.50 0.00 0.61 -3.12 0.00 0.00 179.24 177.23 1ao8 n GLY 11 N 0.47 1.13 3.74 2.75 0.00 -1.03 -5.11 105.19 107.13 1ao8 n GLY 11 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 4.48 -0.04 0.99 7.94 -1.26 -3.36 117.00 125.76 1ao8 n LEU 12 Ca 0.00 1.15 -0.04 0.00 -1.11 0.00 0.00 56.01 56.01 1ao8 n LEU 12 Cb 0.00 -1.56 -0.06 0.00 0.53 0.00 0.00 43.42 42.34 1ao8 n LEU 12 CO 0.00 -0.30 -0.75 2.30 -1.11 0.00 0.00 177.39 177.53 1ao8 n ILE 13 N -0.01 0.51 -2.95 1.96 -5.35 -0.85 -2.99 119.36 109.67 1ao8 n ILE 13 Ca 0.05 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 62.24 1ao8 n ILE 13 Cb 0.40 -0.81 0.00 0.00 -1.74 0.00 0.00 39.64 37.49 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 2.63 3.14 3.26 3.28 0.00 -1.18 -4.72 105.19 111.60 1ao8 n GLY 14 Ca -0.13 -1.14 0.02 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.80 0.56 -1.64 1.61 2.20 0.91 -3.86 119.74 118.73 1ao8 s LYS 15 Ca 0.00 1.10 0.00 0.00 -0.36 0.00 0.00 55.97 56.71 1ao8 s LYS 15 Cb 0.00 0.60 0.00 0.00 -1.51 0.00 0.00 37.83 36.92 1ao8 s LYS 15 CO 0.00 -0.52 0.00 -0.25 -0.36 0.00 0.00 175.35 174.22 1ao8 n ASP 16 N 5.43 -5.37 0.00 1.43 9.92 -1.26 -1.66 116.55 125.05 1ao8 n ASP 16 Ca -0.04 0.08 0.00 0.00 -0.53 0.00 0.00 54.79 54.30 1ao8 n ASP 16 Cb 0.51 -4.51 0.00 0.00 -0.64 0.00 0.00 41.12 36.47 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 -0.91 2.60 3.91 0.44 0.00 -1.26 -5.00 105.19 104.98 1ao8 n GLY 17 Ca -0.22 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.45 3.50 0.45 1.61 -3.43 -0.66 -4.82 115.29 111.48 1ao8 s HIS 18 Ca 0.00 0.65 -0.22 0.00 -0.80 0.00 0.00 55.06 54.70 1ao8 s HIS 18 Cb 0.00 -2.13 -0.09 0.00 -1.43 0.00 0.00 32.58 28.93 1ao8 s HIS 18 CO 0.00 0.05 1.05 -0.51 -2.00 0.00 0.00 174.74 173.34 1ao8 s LEU 19 N -3.94 3.98 0.05 5.38 1.43 -1.26 -0.06 118.68 124.25 1ao8 s LEU 19 Ca 0.44 2.01 -0.14 0.00 -1.03 0.00 0.00 54.13 55.41 1ao8 s LEU 19 Cb -0.10 -4.38 -0.30 0.00 0.03 0.00 0.00 46.19 41.43 1ao8 s LEU 19 CO 0.34 -0.68 1.09 1.55 0.23 0.00 0.00 176.35 178.88 1ao8 h PRO 20 N 1.98 0.60 0.00 1.29 0.13 -1.86 -3.45 132.00 130.69 1ao8 h PRO 20 Ca -0.49 -0.84 -0.27 0.00 -0.87 0.00 0.00 66.00 63.53 1ao8 h PRO 20 Cb 1.22 0.29 0.02 0.00 0.13 0.00 0.00 31.00 32.66 1ao8 h PRO 20 CO 0.60 1.39 -0.03 -2.67 -0.23 0.00 0.00 178.00 177.06 1ao8 n TRP 21 N -3.77 -2.66 -3.81 1.56 2.14 -1.26 -5.11 117.44 104.54 1ao8 n TRP 21 Ca -0.14 -1.16 -0.29 0.00 2.07 0.00 0.00 57.50 57.98 1ao8 n TRP 21 Cb 1.01 -0.32 -0.16 0.00 -0.81 0.00 0.00 31.31 31.04 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 -1.07 1.66 -0.39 -2.67 2.46 -1.26 -5.08 115.29 108.95 1ao8 s HIS 22 Ca 0.34 -1.34 0.03 0.00 0.47 0.00 0.00 55.06 54.56 1ao8 s HIS 22 Cb -0.03 -1.35 0.11 0.00 -0.13 0.00 0.00 32.58 31.18 1ao8 s HIS 22 CO 0.22 -0.71 0.13 -1.17 -2.47 0.00 0.00 174.74 170.74 1ao8 s LEU 23 N 1.64 4.03 0.33 8.88 2.96 -1.26 -4.95 118.68 130.31 1ao8 s LEU 23 Ca -0.01 -2.35 0.14 0.00 -0.22 0.00 0.00 54.13 51.69 1ao8 s LEU 23 Cb -0.18 -1.45 0.54 0.00 0.50 0.00 0.00 46.19 45.60 1ao8 s LEU 23 CO -0.10 -0.34 1.69 1.55 -1.32 0.00 0.00 176.35 177.84 1ao8 h PRO 24 N 7.31 0.00 -0.05 0.98 0.14 -1.98 -2.98 132.00 135.42 1ao8 h PRO 24 Ca -0.06 0.00 -0.11 0.00 0.14 0.00 0.00 66.00 65.97 1ao8 h PRO 24 Cb 0.98 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.10 1ao8 h PRO 24 CO 0.55 0.49 -0.49 0.22 0.14 0.00 0.00 178.00 178.91 1ao8 h ASP 25 N 0.00 0.13 0.69 1.44 1.82 -1.98 -2.78 116.42 115.74 1ao8 h ASP 25 Ca -0.00 -0.06 -0.14 0.00 -0.39 0.00 0.00 57.03 56.43 1ao8 h ASP 25 Cb 0.96 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 40.91 1ao8 h ASP 25 CO 0.06 0.60 -0.67 -0.78 -1.61 0.00 0.00 179.24 176.85 1ao8 h ASP 26 N 0.10 0.00 -0.22 2.28 1.82 -1.95 -3.03 116.42 115.42 1ao8 h ASP 26 Ca 0.00 0.00 0.01 0.00 -0.39 0.00 0.00 57.03 56.65 1ao8 h ASP 26 Cb 0.90 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.90 1ao8 h ASP 26 CO 0.07 0.67 0.15 -0.07 -1.61 0.00 0.00 179.24 178.45 1ao8 h LEU 27 N 0.00 0.24 -0.85 2.28 3.38 -1.47 -0.41 115.31 118.48 1ao8 h LEU 27 Ca -0.01 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1ao8 h LEU 27 Cb 1.19 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1ao8 h LEU 27 CO 0.09 0.17 -0.55 0.45 0.09 0.00 0.00 178.44 178.69 1ao8 h HIS 28 N 0.28 0.09 0.14 1.13 3.86 -1.58 -3.01 115.15 116.07 1ao8 h HIS 28 Ca 0.08 -0.03 -0.31 0.00 -1.16 0.00 0.00 60.37 58.96 1ao8 h HIS 28 Cb 0.00 -0.02 0.03 0.00 1.06 0.00 0.00 27.41 28.49 1ao8 h HIS 28 CO -0.00 0.60 -1.29 -0.92 0.86 0.00 0.00 177.93 177.18 1ao8 h TYR 29 N 0.06 1.00 -0.07 2.45 3.20 -1.20 -3.20 116.97 119.20 1ao8 h TYR 29 Ca -0.00 -0.65 0.02 0.00 3.14 0.00 0.00 58.73 61.24 1ao8 h TYR 29 Cb 0.99 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 39.18 1ao8 h TYR 29 CO 0.01 1.49 0.06 0.35 -1.64 0.00 0.00 178.16 178.43 1ao8 h PHE 30 N 0.25 0.00 0.00 -3.82 3.57 -1.13 -0.52 116.94 115.30 1ao8 h PHE 30 Ca -0.20 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.15 1ao8 h PHE 30 Cb 1.97 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.68 1ao8 h PHE 30 CO 0.12 0.00 -0.70 -0.09 -2.23 0.00 0.00 178.31 175.40 1ao8 h ARG 31 N 0.00 0.00 -0.32 1.11 2.43 -1.53 -3.25 114.38 112.81 1ao8 h ARG 31 Ca 0.03 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.03 1ao8 h ARG 31 Cb 0.16 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1ao8 h ARG 31 CO -0.00 0.70 -0.48 0.00 -1.51 0.00 0.00 179.97 178.68 1ao8 h ALA 32 N 1.30 0.52 -0.72 2.80 0.00 -1.09 -2.75 119.26 119.33 1ao8 h ALA 32 Ca -0.01 -0.49 -0.53 0.00 0.00 0.00 0.00 54.91 53.88 1ao8 h ALA 32 Cb 1.43 -0.09 -0.21 0.00 0.00 0.00 0.00 17.79 18.91 1ao8 h ALA 32 CO 0.09 0.68 0.64 1.04 0.00 0.00 0.00 179.25 181.70 1ao8 n GLN 33 N -4.02 2.33 0.07 0.00 3.00 -1.05 -4.31 117.38 113.39 1ao8 n GLN 33 Ca -0.03 -2.52 0.00 0.00 -0.01 0.00 0.00 57.00 54.44 1ao8 n GLN 33 Cb 0.60 -2.02 0.00 0.00 0.00 0.00 0.00 30.24 28.81 1ao8 n GLN 33 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1ao8 n THR 34 N -0.03 0.00 -1.74 5.09 -2.24 -1.19 -4.92 114.28 109.25 1ao8 n THR 34 Ca 0.47 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.83 1ao8 n THR 34 Cb 0.55 -0.25 -0.03 0.00 -2.10 0.00 0.00 70.33 68.50 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 -2.00 3.16 0.00 2.28 -7.23 -1.04 -1.24 120.40 114.33 1ao8 s VAL 35 Ca 0.00 0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.35 1ao8 s VAL 35 Cb 0.00 -3.14 0.00 0.00 0.56 0.00 0.00 36.38 33.80 1ao8 s VAL 35 CO 0.00 -0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.35 1ao8 n GLY 36 N 4.86 3.14 3.57 2.32 0.00 -1.25 -4.99 105.19 112.83 1ao8 n GLY 36 Ca 0.22 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.60 0.68 -3.60 1.61 5.02 -0.37 -4.62 118.16 116.28 1ao8 n LYS 37 Ca 0.00 -3.02 -0.36 0.00 -2.02 0.00 0.00 58.31 52.91 1ao8 n LYS 37 Cb 0.00 0.04 -0.08 0.00 -0.02 0.00 0.00 35.03 34.96 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 -2.42 5.33 -0.54 -0.18 1.01 -0.94 -3.40 121.20 120.06 1ao8 s ILE 38 Ca 0.44 0.36 -0.17 0.00 0.00 0.00 0.00 60.65 61.28 1ao8 s ILE 38 Cb -0.03 -3.56 0.11 0.00 0.01 0.00 0.00 42.46 38.98 1ao8 s ILE 38 CO 0.28 0.37 0.56 -0.32 0.00 0.00 0.00 174.94 175.82 1ao8 s MET 39 N 0.76 3.02 -0.18 2.79 1.75 -0.74 -1.56 119.30 125.14 1ao8 s MET 39 Ca 0.12 -1.47 -0.19 0.00 -1.25 0.00 0.00 55.69 52.90 1ao8 s MET 39 Cb -0.13 -4.25 -0.03 0.00 2.84 0.00 0.00 34.83 33.26 1ao8 s MET 39 CO 0.03 -1.34 0.53 0.08 -0.65 0.00 0.00 175.02 173.67 1ao8 s VAL 40 N 2.02 5.11 0.17 10.11 1.01 -0.23 -1.92 120.40 136.67 1ao8 s VAL 40 Ca 0.07 1.00 -0.09 0.00 0.00 0.00 0.00 61.98 62.96 1ao8 s VAL 40 Cb -0.26 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.25 1ao8 s VAL 40 CO 0.05 0.20 0.29 0.68 0.00 0.00 0.00 175.10 176.33 1ao8 s VAL 41 N 1.42 0.06 0.00 2.92 -7.23 -1.02 -2.49 120.40 114.06 1ao8 s VAL 41 Ca 0.26 -1.39 0.00 0.00 -1.81 0.00 0.00 61.98 59.04 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 0.10 -0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.23 1ao8 n GLY 42 N -0.23 0.80 0.14 2.32 0.00 -0.36 -2.41 105.19 105.46 1ao8 n GLY 42 Ca -0.07 -1.92 -0.23 0.00 0.00 0.00 0.00 46.02 43.80 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 0.49 -0.45 1.61 3.08 -1.92 -2.21 114.38 114.98 1ao8 h ARG 43 Ca 0.00 -0.84 -0.04 0.00 0.07 0.00 0.00 59.98 59.17 1ao8 h ARG 43 Cb 0.00 0.31 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 1ao8 h ARG 43 CO 0.00 1.40 0.12 0.00 -1.07 0.00 0.00 179.97 180.42 1ao8 h ARG 44 N 0.13 0.67 0.04 0.04 3.08 -1.97 -2.18 114.38 114.20 1ao8 h ARG 44 Ca -0.24 -0.12 -0.23 0.00 0.07 0.00 0.00 59.98 59.46 1ao8 h ARG 44 Cb 2.14 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 32.06 1ao8 h ARG 44 CO 0.26 0.61 -1.09 1.15 -1.07 0.00 0.00 179.97 179.83 1ao8 h THR 45 N 0.66 1.64 -0.74 2.04 2.02 -1.90 -3.13 112.91 113.50 1ao8 h THR 45 Ca 0.15 -3.30 -0.03 0.00 0.77 0.00 0.00 66.41 64.00 1ao8 h THR 45 Cb 0.24 2.88 -0.03 0.00 -1.74 0.00 0.00 68.15 69.50 1ao8 h THR 45 CO -0.00 0.95 0.33 0.22 0.37 0.00 0.00 175.52 177.39 1ao8 h TYR 46 N 0.03 1.09 0.00 3.16 3.20 -0.91 -1.90 116.97 121.63 1ao8 h TYR 46 Ca -0.05 -0.07 -0.05 0.00 3.14 0.00 0.00 58.73 61.70 1ao8 h TYR 46 Cb 1.84 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 39.77 1ao8 h TYR 46 CO 0.02 0.81 -0.25 0.93 -1.64 0.00 0.00 178.16 178.04 1ao8 h GLU 47 N 1.05 0.00 0.00 1.82 4.39 -1.47 -2.82 114.58 117.55 1ao8 h GLU 47 Ca 0.25 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.92 1ao8 h GLU 47 Cb 0.16 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1ao8 h GLU 47 CO -0.03 0.25 -0.13 0.77 -1.16 0.00 0.00 179.01 178.71 1ao8 h SER 48 N 0.00 0.00 -4.23 1.42 0.02 -1.28 -3.43 113.55 106.05 1ao8 h SER 48 Ca -0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.42 1ao8 h SER 48 Cb 0.74 0.00 0.15 0.00 0.14 0.00 0.00 62.40 63.43 1ao8 h SER 48 CO 0.03 0.13 0.33 -0.36 -1.14 0.00 0.00 176.83 175.83 1ao8 s PHE 49 N -4.70 2.12 -0.10 3.45 0.08 -1.07 -4.99 117.98 112.78 1ao8 s PHE 49 Ca -0.04 1.63 -0.01 0.00 0.12 0.00 0.00 56.93 58.63 1ao8 s PHE 49 Cb 0.16 -3.32 -0.00 0.00 -0.57 0.00 0.00 43.02 39.29 1ao8 s PHE 49 CO 0.68 -2.37 -0.02 -1.00 -0.10 0.00 0.00 175.22 172.40 1ao8 h PRO 50 N -0.78 0.00 -4.79 0.24 0.13 -1.88 -3.44 132.00 121.48 1ao8 h PRO 50 Ca -0.46 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 63.99 1ao8 h PRO 50 Cb 1.27 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.11 1ao8 h PRO 50 CO 0.49 0.00 -0.66 0.21 -0.23 0.00 0.00 178.00 177.81 1ao8 s LYS 51 N -1.63 2.82 -0.06 0.86 2.36 -1.26 -5.09 119.74 117.74 1ao8 s LYS 51 Ca -0.02 -1.02 -0.01 0.00 -2.55 0.00 0.00 55.97 52.37 1ao8 s LYS 51 Cb 0.00 -3.29 -0.03 0.00 -1.05 0.00 0.00 37.83 33.46 1ao8 s LYS 51 CO 0.03 -0.52 -0.00 1.03 1.55 0.00 0.00 175.35 177.44 1ao8 s ARG 52 N 1.40 2.90 0.86 4.03 0.52 -1.26 -4.04 118.95 123.37 1ao8 s ARG 52 Ca -0.00 -0.48 -0.12 0.00 -0.52 0.00 0.00 55.73 54.60 1ao8 s ARG 52 Cb -0.18 -2.74 0.14 0.00 0.52 0.00 0.00 34.95 32.69 1ao8 s ARG 52 CO 0.01 0.67 1.21 -1.25 0.02 0.00 0.00 175.30 175.96 1ao8 s PRO 53 N -1.12 1.35 -0.30 3.54 0.04 -1.26 -5.07 135.00 132.18 1ao8 s PRO 53 Ca 0.15 -0.30 -0.22 0.00 0.04 0.00 0.00 61.00 60.67 1ao8 s PRO 53 Cb -0.11 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.45 1ao8 s PRO 53 CO 0.05 -1.92 0.70 -0.51 0.04 0.00 0.00 177.00 175.37 1ao8 s LEU 54 N -5.64 4.11 0.95 -3.56 1.43 -1.26 -5.05 118.68 109.67 1ao8 s LEU 54 Ca 0.68 0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 54.19 1ao8 s LEU 54 Cb -0.07 -2.94 0.19 0.00 0.03 0.00 0.00 46.19 43.40 1ao8 s LEU 54 CO 0.50 -0.53 1.30 -2.16 0.23 0.00 0.00 176.35 175.68 1ao8 s PRO 55 N 2.76 0.72 -1.81 1.29 0.04 -1.26 -4.23 135.00 132.51 1ao8 s PRO 55 Ca 0.29 -0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.00 1ao8 s PRO 55 Cb -0.15 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1ao8 s PRO 55 CO 0.12 -2.37 0.00 -1.91 0.04 0.00 0.00 177.00 172.87 1ao8 n GLU 56 N -3.76 -1.46 -3.94 4.56 2.13 -1.26 -4.89 120.64 112.02 1ao8 n GLU 56 Ca 0.14 1.03 0.04 0.00 0.66 0.00 0.00 57.16 59.03 1ao8 n GLU 56 Cb 0.60 -5.51 0.01 0.00 0.27 0.00 0.00 31.44 26.81 1ao8 n GLU 56 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 1ao8 s ARG 57 N -4.44 0.11 0.07 5.31 1.70 -1.26 -3.97 118.95 116.47 1ao8 s ARG 57 Ca 0.00 -0.07 0.02 0.00 -0.47 0.00 0.00 55.73 55.21 1ao8 s ARG 57 Cb 0.00 0.03 -0.04 0.00 -0.57 0.00 0.00 34.95 34.37 1ao8 s ARG 57 CO 0.00 -0.05 0.11 0.99 -1.08 0.00 0.00 175.30 175.27 1ao8 s THR 58 N -2.02 4.74 -0.04 4.99 2.01 -1.22 -4.97 115.64 119.13 1ao8 s THR 58 Ca 0.29 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.66 1ao8 s THR 58 Cb 0.01 -3.29 0.00 0.00 0.01 0.00 0.00 72.50 69.24 1ao8 s THR 58 CO -0.03 0.14 -0.14 0.20 -0.69 0.00 0.00 174.62 174.10 1ao8 s ASN 59 N -2.38 1.83 -0.27 3.53 0.01 -1.26 -1.79 114.94 114.62 1ao8 s ASN 59 Ca 0.30 -0.30 -0.01 0.00 -0.71 0.00 0.00 52.86 52.14 1ao8 s ASN 59 Cb -0.12 -0.58 0.08 0.00 0.41 0.00 0.00 41.25 41.04 1ao8 s ASN 59 CO 0.23 0.10 0.06 -0.69 -1.51 0.00 0.00 177.10 175.29 1ao8 s VAL 60 N 0.22 0.83 -0.14 1.60 1.01 -0.81 -0.95 120.40 122.17 1ao8 s VAL 60 Ca -0.06 -1.12 -0.22 0.00 0.00 0.00 0.00 61.98 60.58 1ao8 s VAL 60 Cb -0.12 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 1ao8 s VAL 60 CO 0.02 -0.47 0.67 -0.69 0.00 0.00 0.00 175.10 174.63 1ao8 s VAL 61 N 1.67 5.02 -0.44 2.92 1.01 0.09 -2.42 120.40 128.25 1ao8 s VAL 61 Ca 0.05 1.33 -0.08 0.00 0.00 0.00 0.00 61.98 63.28 1ao8 s VAL 61 Cb -0.17 -4.00 0.11 0.00 0.00 0.00 0.00 36.38 32.31 1ao8 s VAL 61 CO -0.18 0.17 0.29 -0.22 0.00 0.00 0.00 175.10 175.16 1ao8 s LEU 62 N 1.44 5.45 0.19 3.92 2.96 -1.01 -2.28 118.68 129.35 1ao8 s LEU 62 Ca 0.33 -1.83 0.07 0.00 -0.22 0.00 0.00 54.13 52.48 1ao8 s LEU 62 Cb -0.17 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 1ao8 s LEU 62 CO 0.13 -0.62 -0.13 0.28 -1.32 0.00 0.00 176.35 174.69 1ao8 s THR 63 N 1.33 1.57 -0.56 3.68 -1.32 -1.26 -4.55 115.64 114.54 1ao8 s THR 63 Ca 0.05 -2.16 -0.00 0.00 -1.21 0.00 0.00 61.69 58.37 1ao8 s THR 63 Cb -0.25 -1.98 0.46 0.00 -1.51 0.00 0.00 72.50 69.22 1ao8 s THR 63 CO -0.01 -0.63 1.99 1.57 -2.21 0.00 0.00 174.62 175.32 1ao8 n HIS 64 N -0.30 2.89 -4.30 9.09 -0.00 -1.26 -4.69 115.22 116.65 1ao8 n HIS 64 Ca -0.09 -2.57 -0.19 0.00 0.46 0.00 0.00 57.72 55.34 1ao8 n HIS 64 Cb 0.60 -1.25 -0.15 0.00 -0.12 0.00 0.00 29.99 29.07 1ao8 n HIS 64 CO 0.00 0.00 0.00 -1.14 0.46 0.00 0.00 176.34 175.66 1ao8 s GLN 65 N -3.34 0.73 -0.52 1.57 2.00 -1.26 -5.03 119.66 113.81 1ao8 s GLN 65 Ca 0.57 -0.26 0.02 0.00 -2.00 0.00 0.00 55.36 53.69 1ao8 s GLN 65 Cb 0.45 -0.71 0.57 0.00 0.80 0.00 0.00 33.01 34.13 1ao8 s GLN 65 CO 0.02 0.12 1.92 0.39 -0.50 0.00 0.00 175.29 177.24 1ao8 n GLU 66 N 3.14 2.44 -1.92 1.67 1.02 -1.26 -4.29 120.64 121.43 1ao8 n GLU 66 Ca -0.16 -3.16 0.02 0.00 -0.02 0.00 0.00 57.16 53.83 1ao8 n GLU 66 Cb 0.56 -2.21 0.03 0.00 -0.02 0.00 0.00 31.44 29.80 1ao8 n GLU 66 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ao8 n ASP 67 N -1.05 0.97 -4.87 1.62 8.00 -1.26 -5.10 116.55 114.86 1ao8 n ASP 67 Ca 0.59 -2.01 -0.33 0.00 0.71 0.00 0.00 54.79 53.75 1ao8 n ASP 67 Cb 1.22 -0.29 -0.05 0.00 -0.02 0.00 0.00 41.12 41.98 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1ao8 s TYR 68 N -1.17 3.48 -0.33 1.24 5.04 -1.26 -5.06 117.35 119.28 1ao8 s TYR 68 Ca 0.29 0.86 -0.06 0.00 -2.44 0.00 0.00 57.07 55.72 1ao8 s TYR 68 Cb 0.35 -2.24 0.04 0.00 0.35 0.00 0.00 41.96 40.46 1ao8 s TYR 68 CO -0.12 0.34 0.08 -0.65 -1.34 0.00 0.00 175.55 173.87 1ao8 s GLN 69 N -2.55 2.64 -0.35 4.97 -0.21 -1.26 -5.03 119.66 117.87 1ao8 s GLN 69 Ca 0.43 -1.15 0.01 0.00 0.02 0.00 0.00 55.36 54.67 1ao8 s GLN 69 Cb -0.12 -3.39 0.14 0.00 1.00 0.00 0.00 33.01 30.64 1ao8 s GLN 69 CO 0.21 -0.63 0.25 0.00 -2.12 0.00 0.00 175.29 173.00 1ao8 s ALA 70 N 1.39 0.61 -0.11 6.09 0.00 -1.26 -5.11 121.76 123.37 1ao8 s ALA 70 Ca -0.02 -1.66 -0.27 0.00 0.00 0.00 0.00 51.96 50.01 1ao8 s ALA 70 Cb -0.19 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.21 1ao8 s ALA 70 CO 0.02 -2.12 0.90 -0.65 0.00 0.00 0.00 175.76 173.91 1ao8 s GLN 71 N 1.16 4.40 0.00 0.00 -0.21 -1.26 -3.55 119.66 120.20 1ao8 s GLN 71 Ca 0.18 1.19 0.00 0.00 0.02 0.00 0.00 55.36 56.75 1ao8 s GLN 71 Cb -0.21 -3.53 0.00 0.00 1.00 0.00 0.00 33.01 30.27 1ao8 s GLN 71 CO -0.00 -0.23 0.00 0.41 -2.12 0.00 0.00 175.29 173.35 1ao8 n GLY 72 N 3.19 3.00 3.98 3.09 0.00 -1.26 -4.55 105.19 112.65 1ao8 n GLY 72 Ca 0.05 -0.57 -0.25 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 -1.62 3.33 -0.24 4.61 0.00 -1.23 -4.84 121.76 121.76 1ao8 s ALA 73 Ca 0.00 -1.66 -0.03 0.00 0.00 0.00 0.00 51.96 50.27 1ao8 s ALA 73 Cb 0.00 -2.18 0.01 0.00 0.00 0.00 0.00 23.12 20.95 1ao8 s ALA 73 CO 0.00 -1.78 -0.04 0.08 0.00 0.00 0.00 175.76 174.02 1ao8 s VAL 74 N -3.36 3.23 -0.45 0.00 1.01 -0.12 -4.98 120.40 115.73 1ao8 s VAL 74 Ca 0.69 -0.71 -0.18 0.00 0.00 0.00 0.00 61.98 61.78 1ao8 s VAL 74 Cb -0.04 -2.55 0.04 0.00 0.00 0.00 0.00 36.38 33.82 1ao8 s VAL 74 CO 0.47 0.31 0.52 -0.69 0.00 0.00 0.00 175.10 175.71 1ao8 s VAL 75 N 1.42 4.99 0.45 2.92 1.01 -1.26 -0.73 120.40 129.21 1ao8 s VAL 75 Ca 0.04 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 61.73 1ao8 s VAL 75 Cb -0.15 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.09 1ao8 s VAL 75 CO -0.03 -0.57 0.51 0.68 0.00 0.00 0.00 175.10 175.69 1ao8 s VAL 76 N 2.35 2.60 -0.11 2.92 -7.23 -0.97 -4.99 120.40 114.99 1ao8 s VAL 76 Ca 0.14 -1.19 0.16 0.00 -1.81 0.00 0.00 61.98 59.28 1ao8 s VAL 76 Cb -0.18 -2.79 0.32 0.00 0.56 0.00 0.00 36.38 34.29 1ao8 s VAL 76 CO 0.14 0.00 1.17 1.41 -0.31 0.00 0.00 175.10 177.51 1ao8 n HIS 77 N -1.78 -0.09 -3.64 2.82 8.25 -1.26 -4.06 115.22 115.46 1ao8 n HIS 77 Ca 0.06 -1.03 -0.04 0.00 -0.26 0.00 0.00 57.72 56.45 1ao8 n HIS 77 Cb 0.61 0.31 -0.07 0.00 1.12 0.00 0.00 29.99 31.96 1ao8 n HIS 77 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1ao8 s ASP 78 N -1.93 -0.26 0.39 0.41 2.15 -1.26 -5.02 116.67 111.15 1ao8 s ASP 78 Ca 0.19 0.48 0.10 0.00 0.43 0.00 0.00 52.55 53.74 1ao8 s ASP 78 Cb 0.27 0.69 0.81 0.00 -0.30 0.00 0.00 42.92 44.39 1ao8 s ASP 78 CO -0.09 -0.08 1.94 0.58 -0.17 0.00 0.00 175.17 177.35 1ao8 h VAL 79 N 3.87 1.16 -0.44 1.11 2.07 -1.99 -2.01 116.25 120.02 1ao8 h VAL 79 Ca -0.28 -0.69 -0.05 0.00 0.82 0.00 0.00 66.70 66.51 1ao8 h VAL 79 Cb 1.18 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1ao8 h VAL 79 CO 0.17 0.22 0.07 0.00 0.02 0.00 0.00 177.57 178.05 1ao8 h ALA 80 N 1.67 1.31 -0.20 1.67 0.00 -1.99 -2.16 119.26 119.55 1ao8 h ALA 80 Ca 0.05 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.58 1ao8 h ALA 80 Cb 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ao8 h ALA 80 CO 0.02 0.48 -0.63 0.00 0.00 0.00 0.00 179.25 179.12 1ao8 h ALA 81 N 1.43 0.51 -0.06 0.00 0.00 -1.78 -0.46 119.26 118.90 1ao8 h ALA 81 Ca 0.14 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1ao8 h ALA 81 Cb 0.30 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ao8 h ALA 81 CO 0.00 0.69 -0.15 0.28 0.00 0.00 0.00 179.25 180.08 1ao8 h VAL 82 N 0.53 1.15 0.03 0.00 2.07 -1.07 -2.11 116.25 116.84 1ao8 h VAL 82 Ca -0.01 -0.66 -0.27 0.00 0.82 0.00 0.00 66.70 66.58 1ao8 h VAL 82 Cb 1.22 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 32.23 1ao8 h VAL 82 CO 0.13 0.20 -1.47 -0.26 0.02 0.00 0.00 177.57 176.19 1ao8 h PHE 83 N 0.09 0.11 -0.02 1.57 0.04 -1.25 -3.28 116.94 114.21 1ao8 h PHE 83 Ca 0.02 -0.08 -0.06 0.00 2.80 0.00 0.00 57.97 60.64 1ao8 h PHE 83 Cb 0.33 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.46 1ao8 h PHE 83 CO 0.00 1.11 -0.27 0.00 -0.60 0.00 0.00 178.31 178.55 1ao8 h ALA 84 N 0.86 1.50 -0.07 2.45 0.00 -0.63 0.50 119.26 123.87 1ao8 h ALA 84 Ca -0.20 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.27 1ao8 h ALA 84 Cb 1.94 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 1ao8 h ALA 84 CO 0.11 0.37 -0.73 -0.92 0.00 0.00 0.00 179.25 178.09 1ao8 h TYR 85 N 0.04 0.49 0.06 0.00 3.20 -1.48 -2.90 116.97 116.38 1ao8 h TYR 85 Ca 0.00 -0.22 -0.24 0.00 3.14 0.00 0.00 58.73 61.42 1ao8 h TYR 85 Cb 0.51 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1ao8 h TYR 85 CO 0.00 0.97 -1.11 0.00 -1.64 0.00 0.00 178.16 176.38 1ao8 h ALA 86 N 0.97 0.24 0.00 1.82 0.00 -1.50 -3.20 119.26 117.59 1ao8 h ALA 86 Ca -0.03 -0.90 -0.05 0.00 0.00 0.00 0.00 54.91 53.93 1ao8 h ALA 86 Cb 1.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1ao8 h ALA 86 CO 0.12 1.13 -0.26 -0.22 0.00 0.00 0.00 179.25 180.02 1ao8 h LYS 87 N 0.03 0.00 0.01 0.00 3.64 -0.89 -2.50 116.57 116.86 1ao8 h LYS 87 Ca -0.07 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.12 1ao8 h LYS 87 Cb 1.86 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.66 1ao8 h LYS 87 CO 0.16 0.26 -0.87 1.96 -2.27 0.00 0.00 179.45 178.69 1ao8 h GLN 88 N 0.00 0.09 -2.91 1.90 1.08 -1.52 -3.36 115.11 110.38 1ao8 h GLN 88 Ca -0.00 -0.10 -0.65 0.00 -1.45 0.00 0.00 58.65 56.44 1ao8 h GLN 88 Cb 0.51 0.03 -0.39 0.00 -0.05 0.00 0.00 27.48 27.58 1ao8 h GLN 88 CO 0.03 0.90 -0.35 0.72 -0.95 0.00 0.00 178.83 179.19 1ao8 n HIS 89 N -3.58 3.59 -0.35 2.96 8.25 -0.94 -4.92 115.22 120.22 1ao8 n HIS 89 Ca -0.02 -4.11 0.24 0.00 -0.26 0.00 0.00 57.72 53.57 1ao8 n HIS 89 Cb 0.82 -0.80 0.49 0.00 1.12 0.00 0.00 29.99 31.62 1ao8 n HIS 89 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ao8 h PRO 90 N 5.24 0.33 -0.31 -0.41 0.10 -1.72 0.59 132.00 135.83 1ao8 h PRO 90 Ca 0.17 -0.02 -0.05 0.00 0.10 0.00 0.00 66.00 66.20 1ao8 h PRO 90 Cb 0.73 -0.07 -0.02 0.00 0.10 0.00 0.00 31.00 31.74 1ao8 h PRO 90 CO 0.83 0.22 -0.04 0.22 0.10 0.00 0.00 178.00 179.33 1ao8 h ASP 91 N 0.34 0.45 -3.46 -2.05 1.82 -1.91 -3.40 116.42 108.21 1ao8 h ASP 91 Ca 0.71 -0.09 -0.60 0.00 -0.39 0.00 0.00 57.03 56.66 1ao8 h ASP 91 Cb 1.70 -0.12 -0.11 0.00 0.68 0.00 0.00 39.33 41.49 1ao8 h ASP 91 CO -0.52 0.55 0.09 -1.10 -1.61 0.00 0.00 179.24 176.64 1ao8 s GLN 92 N -4.90 4.16 0.36 0.28 -0.21 0.21 -4.94 119.66 114.62 1ao8 s GLN 92 Ca -0.07 0.53 0.04 0.00 0.02 0.00 0.00 55.36 55.87 1ao8 s GLN 92 Cb 0.15 -3.60 0.06 0.00 1.00 0.00 0.00 33.01 30.62 1ao8 s GLN 92 CO 0.76 -0.28 0.50 0.39 -2.12 0.00 0.00 175.29 174.54 1ao8 n GLU 93 N 5.23 0.62 -4.30 2.91 1.02 -1.26 -4.80 120.64 120.07 1ao8 n GLU 93 Ca -0.02 -1.75 -0.34 0.00 -0.02 0.00 0.00 57.16 55.03 1ao8 n GLU 93 Cb 0.50 -0.20 -0.11 0.00 -0.02 0.00 0.00 31.44 31.60 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 3.48 -0.23 -4.62 2.96 -1.26 -2.22 118.68 116.79 1ao8 s LEU 94 Ca 0.36 -0.00 0.02 0.00 -0.22 0.00 0.00 54.13 54.29 1ao8 s LEU 94 Cb -0.03 -1.84 0.05 0.00 0.50 0.00 0.00 46.19 44.87 1ao8 s LEU 94 CO 0.23 0.23 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.66 1ao8 s VAL 95 N 0.04 2.05 -0.26 1.68 1.01 -0.60 -0.52 120.40 123.80 1ao8 s VAL 95 Ca 0.02 -1.35 -0.18 0.00 0.00 0.00 0.00 61.98 60.48 1ao8 s VAL 95 Cb -0.13 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1ao8 s VAL 95 CO 0.02 0.16 0.51 -0.63 0.00 0.00 0.00 175.10 175.16 1ao8 s ILE 96 N 1.20 5.07 -0.13 2.22 -1.09 -0.89 -1.07 121.20 126.52 1ao8 s ILE 96 Ca -0.04 0.88 0.11 0.00 -2.23 0.00 0.00 60.65 59.37 1ao8 s ILE 96 Cb -0.17 -3.83 -0.16 0.00 -1.58 0.00 0.00 42.46 36.72 1ao8 s ILE 96 CO -0.08 0.09 0.04 0.00 -1.23 0.00 0.00 174.94 173.76 1ao8 n ALA 97 N 5.49 1.68 0.00 9.38 0.00 -1.04 -1.47 120.51 134.55 1ao8 n ALA 97 Ca -0.04 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.55 1ao8 n ALA 97 Cb 0.50 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 2.23 -0.75 0.00 0.00 0.00 -1.26 -4.76 105.19 100.64 1ao8 n GLY 98 Ca -0.21 -1.49 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.31 -1.22 0.25 -0.02 0.00 -1.26 -1.22 105.19 101.41 1ao8 n GLY 99 Ca 0.00 -1.55 0.05 0.00 0.00 0.00 0.00 46.02 44.53 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 1.77 -0.31 4.61 0.00 -1.92 -1.40 119.26 120.01 1ao8 h ALA 100 Ca 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1ao8 h ALA 100 Cb 0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ao8 h ALA 100 CO 0.00 0.18 -0.02 0.37 0.00 0.00 0.00 179.25 179.78 1ao8 h GLN 101 N 0.12 0.48 0.05 0.00 5.75 -1.98 -1.63 115.11 117.90 1ao8 h GLN 101 Ca 0.03 -0.10 -0.25 0.00 -0.15 0.00 0.00 58.65 58.18 1ao8 h GLN 101 Cb 0.17 -0.07 0.01 0.00 1.07 0.00 0.00 27.48 28.66 1ao8 h GLN 101 CO 0.01 0.52 -1.07 0.82 -2.65 0.00 0.00 178.83 176.46 1ao8 h ILE 102 N 0.46 1.40 -0.64 2.39 1.08 -1.53 -3.10 117.51 117.57 1ao8 h ILE 102 Ca 0.10 -2.59 -0.05 0.00 -0.39 0.00 0.00 64.86 61.94 1ao8 h ILE 102 Cb 0.33 2.59 -0.03 0.00 -3.07 0.00 0.00 36.82 36.64 1ao8 h ILE 102 CO 0.01 0.77 0.22 -0.26 -0.69 0.00 0.00 178.15 178.20 1ao8 h PHE 103 N 0.21 1.01 -0.07 1.37 0.04 -1.01 -2.16 116.94 116.32 1ao8 h PHE 103 Ca -0.11 -0.09 -0.04 0.00 2.80 0.00 0.00 57.97 60.53 1ao8 h PHE 103 Cb 1.73 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 39.58 1ao8 h PHE 103 CO 0.07 0.81 -0.12 1.15 -0.60 0.00 0.00 178.31 179.63 1ao8 h THR 104 N 0.91 1.13 -0.31 -1.55 2.02 -1.35 -2.33 112.91 111.43 1ao8 h THR 104 Ca 0.21 -0.58 -0.09 0.00 0.77 0.00 0.00 66.41 66.72 1ao8 h THR 104 Cb 0.26 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 1ao8 h THR 104 CO -0.01 0.17 -0.17 0.00 0.37 0.00 0.00 175.52 175.88 1ao8 h ALA 105 N 1.78 0.44 -1.00 6.16 0.00 -1.32 -3.11 119.26 122.21 1ao8 h ALA 105 Ca 0.02 -0.34 -0.69 0.00 0.00 0.00 0.00 54.91 53.90 1ao8 h ALA 105 Cb 0.28 -0.10 -0.29 0.00 0.00 0.00 0.00 17.79 17.68 1ao8 h ALA 105 CO 0.02 0.36 0.86 1.19 0.00 0.00 0.00 179.25 181.68 1ao8 n PHE 106 N -4.36 3.19 -0.04 0.00 3.72 -0.98 -4.43 117.46 114.56 1ao8 n PHE 106 Ca -0.03 -2.90 -0.13 0.00 -0.05 0.00 0.00 57.45 54.34 1ao8 n PHE 106 Cb 0.40 -1.38 -0.14 0.00 -0.94 0.00 0.00 39.48 37.41 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 -0.85 0.68 0.14 -1.08 4.81 -0.92 -4.12 118.16 116.82 1ao8 n LYS 107 Ca 0.61 0.21 -0.01 0.00 -0.87 0.00 0.00 58.31 58.25 1ao8 n LYS 107 Cb 0.60 -1.69 0.20 0.00 0.02 0.00 0.00 35.03 34.16 1ao8 n LYS 107 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1ao8 h ASP 108 N 0.02 0.00 -2.39 3.14 5.19 -1.81 -3.32 116.42 117.25 1ao8 h ASP 108 Ca -0.41 0.00 -0.65 0.00 -0.62 0.00 0.00 57.03 55.35 1ao8 h ASP 108 Cb 2.06 0.00 -0.38 0.00 0.18 0.00 0.00 39.33 41.18 1ao8 h ASP 108 CO 0.05 0.58 -0.24 0.47 -3.12 0.00 0.00 179.24 176.98 1ao8 n ASP 109 N -3.83 4.43 -4.02 6.45 8.00 -1.26 -5.03 116.55 121.30 1ao8 n ASP 109 Ca -0.01 -3.44 -0.19 0.00 0.71 0.00 0.00 54.79 51.87 1ao8 n ASP 109 Cb 0.59 -0.82 -0.15 0.00 -0.02 0.00 0.00 41.12 40.72 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 -2.55 0.71 0.00 2.53 0.11 -1.25 -4.93 120.40 115.02 1ao8 s VAL 110 Ca 0.37 -0.38 0.00 0.00 -2.93 0.00 0.00 61.98 59.04 1ao8 s VAL 110 Cb 0.12 -0.60 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 1ao8 s VAL 110 CO 0.02 0.20 0.00 0.47 -3.33 0.00 0.00 175.10 172.46 1ao8 n ASP 111 N 2.88 0.00 -4.66 3.54 9.92 -1.26 -4.95 116.55 122.02 1ao8 n ASP 111 Ca -0.14 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.70 1ao8 n ASP 111 Cb 0.57 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 41.02 1ao8 n ASP 111 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1ao8 s THR 112 N -0.95 4.01 -0.45 -3.53 2.01 -1.26 -3.32 115.64 112.14 1ao8 s THR 112 Ca 0.00 1.21 -0.04 0.00 0.31 0.00 0.00 61.69 63.17 1ao8 s THR 112 Cb 0.00 -3.81 0.12 0.00 0.01 0.00 0.00 72.50 68.82 1ao8 s THR 112 CO 0.00 -0.14 0.26 -0.76 -0.69 0.00 0.00 174.62 173.29 1ao8 s LEU 113 N 3.83 5.32 -0.20 4.42 1.43 0.26 -1.28 118.68 132.46 1ao8 s LEU 113 Ca 0.62 -2.14 -0.19 0.00 -1.03 0.00 0.00 54.13 51.38 1ao8 s LEU 113 Cb -0.25 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.08 1ao8 s LEU 113 CO 0.21 -0.54 0.57 -0.76 0.23 0.00 0.00 176.35 176.06 1ao8 s LEU 114 N 0.99 4.14 0.00 1.79 1.43 -0.73 -2.03 118.68 124.28 1ao8 s LEU 114 Ca 0.09 0.75 -0.05 0.00 -1.03 0.00 0.00 54.13 53.89 1ao8 s LEU 114 Cb -0.23 -2.79 -0.00 0.00 0.03 0.00 0.00 46.19 43.20 1ao8 s LEU 114 CO -0.04 -0.22 0.09 0.54 0.23 0.00 0.00 176.35 176.95 1ao8 s VAL 115 N 1.77 0.08 -0.40 -1.59 0.11 -1.00 -2.35 120.40 117.02 1ao8 s VAL 115 Ca 0.26 -0.65 -0.09 0.00 -2.93 0.00 0.00 61.98 58.57 1ao8 s VAL 115 Cb -0.16 -0.35 0.07 0.00 -1.53 0.00 0.00 36.38 34.42 1ao8 s VAL 115 CO 0.10 -0.36 0.22 -0.89 -3.33 0.00 0.00 175.10 170.85 1ao8 s THR 116 N -1.20 4.14 -0.31 5.04 2.01 -0.94 -1.57 115.64 122.82 1ao8 s THR 116 Ca -0.13 -1.33 -0.28 0.00 0.31 0.00 0.00 61.69 60.26 1ao8 s THR 116 Cb -0.07 -3.49 0.01 0.00 0.01 0.00 0.00 72.50 68.96 1ao8 s THR 116 CO 0.01 -0.43 1.01 -0.13 -0.69 0.00 0.00 174.62 174.38 1ao8 s ARG 117 N 1.42 4.06 0.67 4.92 0.52 -0.99 -2.42 118.95 127.14 1ao8 s ARG 117 Ca 0.02 0.99 0.00 0.00 -0.52 0.00 0.00 55.73 56.23 1ao8 s ARG 117 Cb -0.22 -3.73 0.10 0.00 0.52 0.00 0.00 34.95 31.63 1ao8 s ARG 117 CO 0.02 -0.83 0.93 -0.51 0.02 0.00 0.00 175.30 174.94 1ao8 s LEU 118 N 3.46 3.05 -0.10 2.53 1.02 -0.93 -0.54 118.68 127.17 1ao8 s LEU 118 Ca 0.42 -0.33 0.03 0.00 0.02 0.00 0.00 54.13 54.27 1ao8 s LEU 118 Cb -0.13 -2.14 -0.08 0.00 0.02 0.00 0.00 46.19 43.86 1ao8 s LEU 118 CO 0.14 -1.67 -0.06 0.00 0.02 0.00 0.00 176.35 174.77 1ao8 n ALA 119 N -2.69 1.77 -1.74 4.21 0.00 -0.46 -4.00 120.51 117.61 1ao8 n ALA 119 Ca 0.14 -0.49 -0.35 0.00 0.00 0.00 0.00 53.44 52.73 1ao8 n ALA 119 Cb 0.60 0.20 0.01 0.00 0.00 0.00 0.00 19.45 20.27 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 -4.81 2.58 0.08 0.00 0.00 -1.02 -4.75 107.32 99.41 1ao8 s GLY 120 Ca -0.12 0.80 -0.05 0.00 0.00 0.00 0.00 44.72 45.35 1ao8 s GLY 120 CO 0.28 1.16 0.32 -1.35 0.00 0.00 0.00 173.10 173.51 1ao8 s SER 121 N -1.86 6.49 0.03 1.64 1.04 -1.26 -4.40 113.70 115.37 1ao8 s SER 121 Ca 0.72 0.56 -0.13 0.00 0.48 0.00 0.00 55.95 57.59 1ao8 s SER 121 Cb -0.24 -2.08 0.02 0.00 0.10 0.00 0.00 66.02 63.81 1ao8 s SER 121 CO 0.29 0.15 0.27 -0.36 0.98 0.00 0.00 173.24 174.57 1ao8 s PHE 122 N -1.49 -0.08 0.25 5.02 0.40 -1.26 -5.10 117.98 115.72 1ao8 s PHE 122 Ca 0.35 -0.03 0.11 0.00 -0.60 0.00 0.00 56.93 56.76 1ao8 s PHE 122 Cb -0.13 0.06 -0.05 0.00 0.51 0.00 0.00 43.02 43.42 1ao8 s PHE 122 CO 0.22 -0.45 -0.14 -1.83 0.70 0.00 0.00 175.22 173.71 1ao8 s GLU 123 N -2.24 1.87 0.00 0.44 1.03 -1.26 -4.74 118.70 113.80 1ao8 s GLU 123 Ca -0.07 -1.59 0.00 0.00 0.03 0.00 0.00 54.97 53.34 1ao8 s GLU 123 Cb -0.02 -1.93 0.00 0.00 -0.80 0.00 0.00 34.13 31.38 1ao8 s GLU 123 CO -0.02 0.36 0.00 0.41 -1.33 0.00 0.00 175.26 174.68 1ao8 n GLY 124 N -0.51 1.35 0.51 -3.83 0.00 -1.26 -4.94 105.19 96.51 1ao8 n GLY 124 Ca -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1ao8 n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ao8 n ASP 125 N 0.00 1.60 -4.66 1.61 8.00 -1.26 -5.01 116.55 116.83 1ao8 n ASP 125 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1ao8 n ASP 125 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.08 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ao8 s THR 126 N -1.78 3.90 0.36 -3.53 2.01 -1.25 -5.00 115.64 110.35 1ao8 s THR 126 Ca 0.00 1.11 0.05 0.00 0.31 0.00 0.00 61.69 63.16 1ao8 s THR 126 Cb 0.00 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 68.72 1ao8 s THR 126 CO 0.00 -0.09 0.04 -0.54 -0.69 0.00 0.00 174.62 173.34 1ao8 s LYS 127 N 3.63 1.78 0.12 4.92 1.02 -1.26 -2.01 119.74 127.94 1ao8 s LYS 127 Ca 0.64 -2.00 -0.17 0.00 0.02 0.00 0.00 55.97 54.47 1ao8 s LYS 127 Cb -0.28 -1.17 -0.07 0.00 -0.52 0.00 0.00 37.83 35.79 1ao8 s LYS 127 CO 0.23 -0.14 0.57 1.41 -0.92 0.00 0.00 175.35 176.50 1ao8 s MET 128 N -3.82 4.10 1.05 1.68 -2.45 -1.21 -4.78 119.30 113.86 1ao8 s MET 128 Ca 0.36 0.64 -0.12 0.00 -1.25 0.00 0.00 55.69 55.32 1ao8 s MET 128 Cb 0.09 -3.07 0.22 0.00 1.25 0.00 0.00 34.83 33.32 1ao8 s MET 128 CO 0.16 0.55 1.07 0.96 1.05 0.00 0.00 175.02 178.81 1ao8 s ILE 129 N -1.30 2.14 -0.82 10.11 -4.36 -1.26 -4.90 121.20 120.79 1ao8 s ILE 129 Ca 0.34 0.04 -0.26 0.00 -0.26 0.00 0.00 60.65 60.52 1ao8 s ILE 129 Cb -0.17 -2.17 0.04 0.00 1.25 0.00 0.00 42.46 41.41 1ao8 s ILE 129 CO 0.19 -0.06 1.33 -2.16 0.24 0.00 0.00 174.94 174.48 1ao8 s PRO 130 N -4.60 3.31 0.28 0.37 0.04 -1.26 -5.02 135.00 128.12 1ao8 s PRO 130 Ca 0.67 -0.51 -0.01 0.00 0.04 0.00 0.00 61.00 61.19 1ao8 s PRO 130 Cb -0.23 -4.54 -0.04 0.00 0.04 0.00 0.00 34.50 29.73 1ao8 s PRO 130 CO 0.61 -2.16 0.49 -0.51 0.04 0.00 0.00 177.00 175.46 1ao8 s LEU 131 N 5.49 4.11 -0.38 -3.56 1.43 -1.26 -5.05 118.68 119.46 1ao8 s LEU 131 Ca 0.38 0.48 -0.22 0.00 -1.03 0.00 0.00 54.13 53.74 1ao8 s LEU 131 Cb -0.06 -3.29 0.01 0.00 0.03 0.00 0.00 46.19 42.88 1ao8 s LEU 131 CO 0.07 -0.17 0.71 0.21 0.23 0.00 0.00 176.35 177.40 1ao8 s ASN 132 N -3.53 6.45 0.06 2.29 2.47 -1.26 -4.90 114.94 116.52 1ao8 s ASN 132 Ca 0.40 0.11 0.17 0.00 0.42 0.00 0.00 52.86 53.96 1ao8 s ASN 132 Cb -0.10 -2.36 -0.14 0.00 -1.45 0.00 0.00 41.25 37.20 1ao8 s ASN 132 CO 0.32 -0.72 0.82 0.79 -3.72 0.00 0.00 177.10 174.59 1ao8 n TRP 133 N 6.31 0.99 0.28 0.43 7.02 -1.26 -3.91 117.44 127.30 1ao8 n TRP 133 Ca 0.01 0.33 0.12 0.00 -1.02 0.00 0.00 57.50 56.94 1ao8 n TRP 133 Cb 0.48 -1.10 0.80 0.00 -2.42 0.00 0.00 31.31 29.08 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 0.00 0.00 -0.89 -0.99 1.82 -2.05 -1.37 116.42 112.94 1ao8 h ASP 134 Ca -0.17 0.00 -0.55 0.00 -0.39 0.00 0.00 57.03 55.92 1ao8 h ASP 134 Cb 1.61 0.00 -0.26 0.00 0.68 0.00 0.00 39.33 41.35 1ao8 h ASP 134 CO 0.05 0.01 0.70 0.47 -1.61 0.00 0.00 179.24 178.86 1ao8 n ASP 135 N -4.09 5.93 -3.85 2.28 8.00 -1.25 -4.92 116.55 118.64 1ao8 n ASP 135 Ca -0.03 -3.55 -0.12 0.00 0.71 0.00 0.00 54.79 51.80 1ao8 n ASP 135 Cb 0.10 -0.92 -0.06 0.00 -0.02 0.00 0.00 41.12 40.21 1ao8 n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1ao8 s PHE 136 N -3.21 0.79 0.06 1.24 0.40 -0.52 -4.37 117.98 112.37 1ao8 s PHE 136 Ca 0.55 -1.07 -0.07 0.00 -0.60 0.00 0.00 56.93 55.74 1ao8 s PHE 136 Cb 0.44 -0.11 -0.01 0.00 0.51 0.00 0.00 43.02 43.86 1ao8 s PHE 136 CO 0.03 -0.93 0.14 0.99 0.70 0.00 0.00 175.22 176.15 1ao8 s THR 137 N -3.80 0.14 -0.02 0.64 2.01 -0.53 -4.80 115.64 109.28 1ao8 s THR 137 Ca 0.29 -1.16 -0.17 0.00 0.31 0.00 0.00 61.69 60.97 1ao8 s THR 137 Cb 0.02 -1.12 -0.05 0.00 0.01 0.00 0.00 72.50 71.35 1ao8 s THR 137 CO 0.13 -0.64 0.47 -0.75 -0.69 0.00 0.00 174.62 173.14 1ao8 s LYS 138 N -3.17 4.12 0.03 4.92 2.20 -1.26 -1.03 119.74 125.56 1ao8 s LYS 138 Ca -0.00 0.51 -0.01 0.00 -0.36 0.00 0.00 55.97 56.11 1ao8 s LYS 138 Cb 0.02 -3.29 -0.00 0.00 -1.51 0.00 0.00 37.83 33.05 1ao8 s LYS 138 CO -0.07 0.51 -0.02 0.28 -0.36 0.00 0.00 175.35 175.70 1ao8 n VAL 139 N 2.37 0.56 -4.27 4.02 0.31 -1.15 -4.92 118.33 115.25 1ao8 n VAL 139 Ca -0.11 0.20 -0.33 0.00 -0.01 0.00 0.00 64.34 64.09 1ao8 n VAL 139 Cb 0.52 -1.32 -0.09 0.00 -0.91 0.00 0.00 33.84 32.04 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1ao8 s SER 140 N -5.39 5.20 -0.23 4.52 0.01 -1.23 -5.04 113.70 111.55 1ao8 s SER 140 Ca -0.01 0.03 -0.03 0.00 1.31 0.00 0.00 55.95 57.25 1ao8 s SER 140 Cb 0.00 -1.39 0.12 0.00 0.21 0.00 0.00 66.02 64.96 1ao8 s SER 140 CO 0.02 0.29 0.30 -0.55 0.41 0.00 0.00 173.24 173.71 1ao8 s SER 141 N -1.49 0.90 -0.26 2.44 0.15 -1.26 -1.79 113.70 112.40 1ao8 s SER 141 Ca 0.19 -0.10 -0.03 0.00 0.70 0.00 0.00 55.95 56.71 1ao8 s SER 141 Cb -0.12 0.73 0.02 0.00 -1.71 0.00 0.00 66.02 64.95 1ao8 s SER 141 CO 0.10 -0.32 -0.03 -0.60 1.20 0.00 0.00 173.24 173.58 1ao8 s ARG 142 N 2.43 2.88 0.33 5.44 3.52 -0.92 -5.01 118.95 127.62 1ao8 s ARG 142 Ca 0.10 -0.96 -0.17 0.00 -0.13 0.00 0.00 55.73 54.57 1ao8 s ARG 142 Cb -0.15 -3.07 -0.09 0.00 -1.56 0.00 0.00 34.95 30.07 1ao8 s ARG 142 CO -0.17 -0.41 0.78 0.99 -0.81 0.00 0.00 175.30 175.68 1ao8 s THR 143 N 1.36 4.59 -0.19 4.11 2.01 -1.26 -0.81 115.64 125.45 1ao8 s THR 143 Ca 0.01 1.13 -0.04 0.00 0.31 0.00 0.00 61.69 63.09 1ao8 s THR 143 Cb -0.17 -3.65 0.06 0.00 0.01 0.00 0.00 72.50 68.75 1ao8 s THR 143 CO -0.03 -0.15 0.08 -0.69 -0.69 0.00 0.00 174.62 173.14 1ao8 s VAL 144 N -1.95 0.10 -0.20 3.82 1.01 -0.31 -4.91 120.40 117.96 1ao8 s VAL 144 Ca 0.54 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.97 1ao8 s VAL 144 Cb -0.11 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 1ao8 s VAL 144 CO 0.17 -0.30 0.64 -0.70 0.00 0.00 0.00 175.10 174.91 1ao8 s GLU 145 N 2.05 4.20 0.35 2.72 -6.30 -1.26 -2.52 118.70 117.94 1ao8 s GLU 145 Ca 0.02 0.62 -0.01 0.00 -2.50 0.00 0.00 54.97 53.10 1ao8 s GLU 145 Cb -0.16 -3.59 0.07 0.00 0.00 0.00 0.00 34.13 30.45 1ao8 s GLU 145 CO -0.11 -0.26 0.47 -3.47 0.02 0.00 0.00 175.26 171.91 1ao8 n ASP 146 N 5.13 0.57 -0.23 -1.70 -0.08 -1.26 -4.99 116.55 113.99 1ao8 n ASP 146 Ca -0.01 -1.50 -0.07 0.00 -1.51 0.00 0.00 54.79 51.70 1ao8 n ASP 146 Cb 0.50 -0.31 0.04 0.00 2.34 0.00 0.00 41.12 43.68 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 -0.56 1.23 -1.72 5.18 1.35 -1.97 -3.44 112.91 112.98 1ao8 h THR 147 Ca -0.16 -0.66 -0.46 0.00 -0.55 0.00 0.00 66.41 64.58 1ao8 h THR 147 Cb 0.56 0.46 -0.01 0.00 -1.73 0.00 0.00 68.15 67.44 1ao8 h THR 147 CO 0.16 0.27 -0.36 0.20 -0.25 0.00 0.00 175.52 175.54 1ao8 s ASN 148 N -6.09 5.62 0.11 5.36 0.01 -1.26 -5.03 114.94 113.66 1ao8 s ASN 148 Ca -0.13 -0.38 0.07 0.00 -0.71 0.00 0.00 52.86 51.71 1ao8 s ASN 148 Cb 0.14 -0.98 -0.21 0.00 0.41 0.00 0.00 41.25 40.60 1ao8 s ASN 148 CO 0.80 -0.49 1.23 1.55 -1.51 0.00 0.00 177.10 178.67 1ao8 h PRO 149 N 0.96 0.01 0.00 -0.60 0.13 -2.00 -3.27 132.00 127.24 1ao8 h PRO 149 Ca -0.44 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 64.59 1ao8 h PRO 149 Cb 1.26 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 1ao8 h PRO 149 CO 0.53 0.97 -0.36 0.00 -0.23 0.00 0.00 178.00 178.91 1ao8 h ALA 150 N 0.98 0.82 -0.68 -0.56 0.00 -1.95 -3.14 119.26 114.73 1ao8 h ALA 150 Ca -0.04 -0.33 -0.27 0.00 0.00 0.00 0.00 54.91 54.27 1ao8 h ALA 150 Cb 1.80 -0.06 -0.16 0.00 0.00 0.00 0.00 17.79 19.37 1ao8 h ALA 150 CO 0.13 0.46 0.34 1.28 0.00 0.00 0.00 179.25 181.46 1ao8 n LEU 151 N -3.27 5.58 -4.78 0.00 4.77 -1.23 -2.42 117.00 115.64 1ao8 n LEU 151 Ca 0.02 -2.92 -0.39 0.00 -0.03 0.00 0.00 56.01 52.68 1ao8 n LEU 151 Cb 0.62 -0.73 -0.06 0.00 -2.33 0.00 0.00 43.42 40.92 1ao8 n LEU 151 CO 0.38 0.80 0.48 -0.89 -1.33 0.00 0.00 177.39 176.83 1ao8 s THR 152 N -2.56 4.38 0.02 -5.08 2.01 -1.19 -4.26 115.64 108.96 1ao8 s THR 152 Ca 0.45 1.67 -0.05 0.00 0.31 0.00 0.00 61.69 64.07 1ao8 s THR 152 Cb 0.37 -4.11 -0.01 0.00 0.01 0.00 0.00 72.50 68.76 1ao8 s THR 152 CO 0.10 0.48 0.09 -1.38 -0.69 0.00 0.00 174.62 173.22 1ao8 s HIS 153 N -1.20 0.14 -0.18 4.92 -3.43 -1.05 -1.35 115.29 113.15 1ao8 s HIS 153 Ca 0.37 -0.35 -0.02 0.00 -0.80 0.00 0.00 55.06 54.26 1ao8 s HIS 153 Cb -0.22 -0.11 0.05 0.00 -1.43 0.00 0.00 32.58 30.87 1ao8 s HIS 153 CO 0.26 -0.30 -0.00 0.99 -2.00 0.00 0.00 174.74 173.68 1ao8 s THR 154 N -1.89 0.77 -0.60 -5.38 2.01 0.30 -1.16 115.64 109.69 1ao8 s THR 154 Ca -0.11 -0.57 -0.26 0.00 0.31 0.00 0.00 61.69 61.06 1ao8 s THR 154 Cb -0.05 -1.12 -0.05 0.00 0.01 0.00 0.00 72.50 71.28 1ao8 s THR 154 CO -0.01 -0.05 2.10 -0.31 -0.69 0.00 0.00 174.62 175.66 1ao8 s TYR 155 N 1.76 1.43 -0.14 4.92 2.02 0.01 -2.34 117.35 125.00 1ao8 s TYR 155 Ca -0.00 1.13 -0.16 0.00 -0.37 0.00 0.00 57.07 57.67 1ao8 s TYR 155 Cb -0.16 -3.86 -0.04 0.00 -0.40 0.00 0.00 41.96 37.49 1ao8 s TYR 155 CO -0.07 -2.30 0.40 -1.21 -1.57 0.00 0.00 175.55 170.80 1ao8 s GLU 156 N 7.60 4.30 -0.60 -0.62 0.41 -0.61 -2.17 118.70 127.01 1ao8 s GLU 156 Ca 0.80 0.29 -0.01 0.00 -0.41 0.00 0.00 54.97 55.63 1ao8 s GLU 156 Cb -0.14 -3.44 0.15 0.00 -1.78 0.00 0.00 34.13 28.93 1ao8 s GLU 156 CO 0.20 0.18 0.40 0.08 -0.49 0.00 0.00 175.26 175.62 1ao8 s VAL 157 N 0.61 3.44 0.19 2.63 1.01 -0.74 -2.36 120.40 125.18 1ao8 s VAL 157 Ca 0.22 -3.05 -0.26 0.00 0.00 0.00 0.00 61.98 58.88 1ao8 s VAL 157 Cb -0.14 -3.27 -0.08 0.00 0.00 0.00 0.00 36.38 32.89 1ao8 s VAL 157 CO 0.07 -0.86 0.82 0.26 0.00 0.00 0.00 175.10 175.39 1ao8 s TRP 158 N -0.12 3.92 0.06 5.22 0.52 -0.86 -2.91 118.94 124.76 1ao8 s TRP 158 Ca 0.17 1.70 0.05 0.00 0.02 0.00 0.00 56.10 58.04 1ao8 s TRP 158 Cb -0.21 -2.82 -0.03 0.00 -1.15 0.00 0.00 33.47 29.26 1ao8 s TRP 158 CO -0.03 0.49 -0.14 -0.65 0.02 0.00 0.00 176.95 176.64 1ao8 s GLN 159 N -1.20 0.88 -0.01 4.98 -0.21 -0.20 -0.58 119.66 123.33 1ao8 s GLN 159 Ca 0.37 -0.86 -0.30 0.00 0.02 0.00 0.00 55.36 54.60 1ao8 s GLN 159 Cb -0.24 -0.90 -0.05 0.00 1.00 0.00 0.00 33.01 32.83 1ao8 s GLN 159 CO 0.27 0.21 1.31 0.21 -2.12 0.00 0.00 175.29 175.18 1ao8 s LYS 160 N -1.44 4.32 0.73 2.91 2.20 -1.21 -1.46 119.74 125.80 1ao8 s LYS 160 Ca -0.00 1.85 -0.13 0.00 -0.36 0.00 0.00 55.97 57.33 1ao8 s LYS 160 Cb -0.09 -3.53 0.04 0.00 -1.51 0.00 0.00 37.83 32.74 1ao8 s LYS 160 CO 0.02 -0.49 1.12 -1.59 -0.36 0.00 0.00 175.35 174.05 1ao8 s LYS 161 N 2.15 2.34 0.00 4.03 -2.85 -1.26 -4.90 119.74 119.24 1ao8 s LYS 161 Ca 0.61 1.40 0.00 0.00 -1.00 0.00 0.00 55.97 56.98 1ao8 s LYS 161 Cb -0.29 -1.89 0.00 0.00 -2.06 0.00 0.00 37.83 33.59 1ao8 s LYS 161 CO 0.25 -1.61 0.00 0.00 0.10 0.00 0.00 175.35 174.09