#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ao8 s ALA 2 N 0.00 -1.68 0.29 6.98 0.00 0.20 -4.48 121.76 123.06 1ao8 s ALA 2 Ca 0.00 1.80 -0.29 0.00 0.00 0.00 0.00 51.96 53.47 1ao8 s ALA 2 Cb 0.00 -1.70 -0.09 0.00 0.00 0.00 0.00 23.12 21.33 1ao8 s ALA 2 CO 0.00 -1.00 1.04 -0.06 0.00 0.00 0.00 175.76 175.74 1ao8 s PHE 3 N 2.76 3.66 -0.23 0.00 0.40 -0.89 -1.27 117.98 122.40 1ao8 s PHE 3 Ca 0.03 1.76 -0.05 0.00 -0.60 0.00 0.00 56.93 58.07 1ao8 s PHE 3 Cb -0.13 -3.17 0.12 0.00 0.51 0.00 0.00 43.02 40.35 1ao8 s PHE 3 CO -0.17 -0.25 0.42 -1.17 0.70 0.00 0.00 175.22 174.75 1ao8 s LEU 4 N -1.56 -0.71 0.16 -0.37 2.96 -0.74 -0.82 118.68 117.60 1ao8 s LEU 4 Ca 0.45 0.65 -0.16 0.00 -0.22 0.00 0.00 54.13 54.85 1ao8 s LEU 4 Cb -0.28 1.33 0.03 0.00 0.50 0.00 0.00 46.19 47.77 1ao8 s LEU 4 CO 0.36 -0.26 0.44 -1.66 -1.32 0.00 0.00 176.35 173.91 1ao8 s TRP 5 N 2.61 -0.12 -0.11 5.38 -2.14 -0.99 -4.31 118.94 119.26 1ao8 s TRP 5 Ca 0.07 -0.21 0.01 0.00 2.66 0.00 0.00 56.10 58.63 1ao8 s TRP 5 Cb -0.14 0.29 -0.02 0.00 -3.10 0.00 0.00 33.47 30.50 1ao8 s TRP 5 CO -0.15 -0.79 -0.13 0.00 -2.66 0.00 0.00 176.95 173.21 1ao8 s ALA 6 N -3.85 2.63 0.26 2.67 0.00 -1.26 -2.31 121.76 119.90 1ao8 s ALA 6 Ca 0.07 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.13 1ao8 s ALA 6 Cb 0.01 -1.14 -0.03 0.00 0.00 0.00 0.00 23.12 21.96 1ao8 s ALA 6 CO -0.07 0.34 0.21 1.14 0.00 0.00 0.00 175.76 177.38 1ao8 s GLN 7 N 0.02 1.45 0.18 0.00 -2.07 -1.00 -4.40 119.66 113.84 1ao8 s GLN 7 Ca -0.04 -1.77 0.01 0.00 -1.82 0.00 0.00 55.36 51.73 1ao8 s GLN 7 Cb -0.14 0.30 0.01 0.00 -1.09 0.00 0.00 33.01 32.09 1ao8 s GLN 7 CO 0.04 -0.51 0.06 -0.40 -1.32 0.00 0.00 175.29 173.16 1ao8 n ASP 8 N -0.81 2.11 0.20 12.60 5.68 -1.14 -1.81 116.55 133.39 1ao8 n ASP 8 Ca 0.04 -1.71 0.04 0.00 -0.50 0.00 0.00 54.79 52.66 1ao8 n ASP 8 Cb 0.64 0.07 0.43 0.00 -1.14 0.00 0.00 41.12 41.12 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 -0.21 0.11 0.11 -1.79 -2.62 114.38 109.97 1ao8 h ARG 9 Ca -0.13 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.80 1ao8 h ARG 9 Cb 0.43 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.51 1ao8 h ARG 9 CO 0.22 0.30 -0.47 -0.44 0.10 0.00 0.00 179.97 179.67 1ao8 h ASP 10 N 0.00 0.61 0.00 0.08 3.32 -1.89 -3.47 116.42 115.06 1ao8 h ASP 10 Ca -0.00 -0.30 0.00 0.00 0.02 0.00 0.00 57.03 56.75 1ao8 h ASP 10 Cb 0.56 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1ao8 h ASP 10 CO 0.04 0.99 0.00 0.61 -1.72 0.00 0.00 179.24 179.16 1ao8 n GLY 11 N 0.12 1.91 3.80 2.75 0.00 -0.99 -5.11 105.19 107.66 1ao8 n GLY 11 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.14 0.99 2.96 -1.26 -3.79 118.68 121.73 1ao8 s LEU 12 Ca 0.00 0.39 0.14 0.00 -0.22 0.00 0.00 54.13 54.44 1ao8 s LEU 12 Cb 0.00 -2.13 -0.20 0.00 0.50 0.00 0.00 46.19 44.36 1ao8 s LEU 12 CO 0.00 0.27 0.09 2.30 -1.32 0.00 0.00 176.35 177.69 1ao8 n ILE 13 N 2.82 0.96 -3.19 6.68 -5.35 -0.75 -2.87 119.36 117.66 1ao8 n ILE 13 Ca -0.17 -0.64 -0.01 0.00 -0.27 0.00 0.00 62.75 61.67 1ao8 n ILE 13 Cb 0.53 -0.51 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 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 1.98 1.69 3.32 3.28 0.00 -1.11 -4.81 105.19 109.54 1ao8 n GLY 14 Ca -0.23 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.01 0.53 -1.83 1.61 2.20 0.84 -3.61 119.74 117.48 1ao8 s LYS 15 Ca 0.01 1.13 0.00 0.00 -0.36 0.00 0.00 55.97 56.76 1ao8 s LYS 15 Cb -0.00 0.56 0.00 0.00 -1.51 0.00 0.00 37.83 36.88 1ao8 s LYS 15 CO 0.01 -0.44 0.00 -0.25 -0.36 0.00 0.00 175.35 174.31 1ao8 n ASP 16 N 5.43 -5.60 0.00 1.43 8.00 -1.26 -1.83 116.55 122.71 1ao8 n ASP 16 Ca -0.06 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.58 1ao8 n ASP 16 Cb 0.50 -4.75 0.00 0.00 -0.02 0.00 0.00 41.12 36.85 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 -0.82 2.56 3.93 0.44 0.00 -1.26 -5.00 105.19 105.03 1ao8 n GLY 17 Ca -0.23 -0.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.43 3.42 0.36 1.61 -3.43 -0.76 -4.88 115.29 111.18 1ao8 s HIS 18 Ca 0.00 0.56 -0.15 0.00 -0.80 0.00 0.00 55.06 54.68 1ao8 s HIS 18 Cb 0.00 -2.30 -0.09 0.00 -1.43 0.00 0.00 32.58 28.77 1ao8 s HIS 18 CO 0.00 -0.31 0.78 -0.51 -2.00 0.00 0.00 174.74 172.70 1ao8 s LEU 19 N -4.66 3.97 0.20 5.38 1.43 -1.26 -0.11 118.68 123.63 1ao8 s LEU 19 Ca 0.47 1.31 0.11 0.00 -1.03 0.00 0.00 54.13 54.99 1ao8 s LEU 19 Cb -0.10 -4.14 -0.06 0.00 0.03 0.00 0.00 46.19 41.92 1ao8 s LEU 19 CO 0.42 -0.29 1.37 1.55 0.23 0.00 0.00 176.35 179.63 1ao8 h PRO 20 N 1.92 0.00 0.00 1.29 0.13 -1.87 -3.46 132.00 130.01 1ao8 h PRO 20 Ca -0.48 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.36 1ao8 h PRO 20 Cb 1.18 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 1ao8 h PRO 20 CO 0.64 0.77 -0.16 -2.67 -0.23 0.00 0.00 178.00 176.35 1ao8 n TRP 21 N -3.31 -0.65 -3.57 1.56 2.14 -1.26 -5.09 117.44 107.26 1ao8 n TRP 21 Ca 0.01 -1.15 -0.28 0.00 2.07 0.00 0.00 57.50 58.14 1ao8 n TRP 21 Cb 0.84 -0.20 -0.15 0.00 -0.81 0.00 0.00 31.31 30.98 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 -1.46 0.39 -0.36 -2.67 2.46 -1.26 -5.09 115.29 107.30 1ao8 s HIS 22 Ca 0.11 -0.81 0.01 0.00 0.47 0.00 0.00 55.06 54.84 1ao8 s HIS 22 Cb -0.01 -0.91 0.10 0.00 -0.13 0.00 0.00 32.58 31.63 1ao8 s HIS 22 CO 0.07 -0.76 0.09 -1.17 -2.47 0.00 0.00 174.74 170.50 1ao8 s LEU 23 N 2.07 4.81 0.23 8.88 2.96 -1.26 -4.94 118.68 131.44 1ao8 s LEU 23 Ca 0.07 -2.03 0.11 0.00 -0.22 0.00 0.00 54.13 52.06 1ao8 s LEU 23 Cb -0.16 -1.70 0.16 0.00 0.50 0.00 0.00 46.19 45.00 1ao8 s LEU 23 CO -0.30 -0.42 1.49 1.55 -1.32 0.00 0.00 176.35 177.35 1ao8 h PRO 24 N 7.79 0.00 -0.31 0.98 0.14 -1.98 -3.21 132.00 135.41 1ao8 h PRO 24 Ca -0.09 0.00 -0.11 0.00 0.14 0.00 0.00 66.00 65.94 1ao8 h PRO 24 Cb 1.03 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.16 1ao8 h PRO 24 CO 0.58 0.71 -0.27 0.22 0.14 0.00 0.00 178.00 179.37 1ao8 h ASP 25 N 0.00 0.64 0.39 1.44 1.82 -1.99 -2.62 116.42 116.11 1ao8 h ASP 25 Ca -0.01 -0.24 -0.08 0.00 -0.39 0.00 0.00 57.03 56.32 1ao8 h ASP 25 Cb 1.34 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 41.17 1ao8 h ASP 25 CO 0.09 0.89 -0.37 -0.78 -1.61 0.00 0.00 179.24 177.46 1ao8 h ASP 26 N 0.54 0.00 -0.46 2.28 1.82 -1.98 -2.65 116.42 115.97 1ao8 h ASP 26 Ca 0.07 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.70 1ao8 h ASP 26 Cb 0.75 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.73 1ao8 h ASP 26 CO 0.06 0.37 0.27 -0.07 -1.61 0.00 0.00 179.24 178.25 1ao8 h LEU 27 N 0.00 0.58 -0.96 2.28 3.38 -1.51 -1.33 115.31 117.74 1ao8 h LEU 27 Ca -0.00 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1ao8 h LEU 27 Cb 0.66 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1ao8 h LEU 27 CO 0.05 0.46 0.06 0.45 0.09 0.00 0.00 178.44 179.55 1ao8 h HIS 28 N 0.66 0.86 -0.06 1.13 3.86 -1.49 -1.19 115.15 118.92 1ao8 h HIS 28 Ca 0.17 -0.10 -0.17 0.00 -1.16 0.00 0.00 60.37 59.11 1ao8 h HIS 28 Cb 0.01 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.23 1ao8 h HIS 28 CO 0.00 0.76 -0.70 -0.92 0.86 0.00 0.00 177.93 177.93 1ao8 h TYR 29 N 0.78 0.40 -0.44 2.45 5.03 -1.36 -2.81 116.97 121.02 1ao8 h TYR 29 Ca 0.16 -0.18 -0.14 0.00 2.58 0.00 0.00 58.73 61.15 1ao8 h TYR 29 Cb 0.38 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.59 1ao8 h TYR 29 CO 0.02 0.90 -0.27 0.35 -1.32 0.00 0.00 178.16 177.84 1ao8 h PHE 30 N 0.21 1.13 -0.00 -3.82 3.57 -0.84 -2.39 116.94 114.79 1ao8 h PHE 30 Ca -0.02 -0.30 -0.06 0.00 3.53 0.00 0.00 57.97 61.12 1ao8 h PHE 30 Cb 1.26 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 1ao8 h PHE 30 CO 0.03 1.12 -0.29 -0.09 -2.23 0.00 0.00 178.31 176.85 1ao8 h ARG 31 N 0.81 0.00 -0.01 1.11 2.43 -1.20 -2.33 114.38 115.20 1ao8 h ARG 31 Ca 0.09 -0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.10 1ao8 h ARG 31 Cb 0.86 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.39 1ao8 h ARG 31 CO 0.08 0.30 -0.73 0.00 -1.51 0.00 0.00 179.97 178.10 1ao8 h ALA 32 N 1.70 0.77 -0.99 2.80 0.00 -1.22 -2.61 119.26 119.72 1ao8 h ALA 32 Ca -0.00 -0.65 -0.65 0.00 0.00 0.00 0.00 54.91 53.61 1ao8 h ALA 32 Cb 0.52 -0.10 -0.29 0.00 0.00 0.00 0.00 17.79 17.92 1ao8 h ALA 32 CO 0.04 0.87 0.84 1.04 0.00 0.00 0.00 179.25 182.04 1ao8 n GLN 33 N -3.72 2.62 0.00 0.00 1.13 -0.89 -4.37 117.38 112.15 1ao8 n GLN 33 Ca -0.02 -3.22 0.00 0.00 -1.94 0.00 0.00 57.00 51.82 1ao8 n GLN 33 Cb 0.70 -2.26 0.00 0.00 0.11 0.00 0.00 30.24 28.79 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 -0.92 0.00 -1.75 5.09 -2.24 -1.15 -5.00 114.28 108.31 1ao8 n THR 34 Ca 0.62 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.98 1ao8 n THR 34 Cb 0.79 -0.15 -0.02 0.00 -2.10 0.00 0.00 70.33 68.84 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 -1.54 2.06 -0.28 2.28 -7.23 -0.99 -1.83 120.40 112.87 1ao8 s VAL 35 Ca 0.00 0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.21 1ao8 s VAL 35 Cb 0.00 -3.03 0.00 0.00 0.56 0.00 0.00 36.38 33.91 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 3.28 0.30 3.23 2.32 0.00 -1.25 -5.00 105.19 108.06 1ao8 n GLY 36 Ca 0.13 -0.79 -0.11 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.57 0.83 -3.71 1.61 5.02 -0.76 -4.63 118.16 114.95 1ao8 n LYS 37 Ca -0.04 -2.29 -0.38 0.00 -2.02 0.00 0.00 58.31 53.58 1ao8 n LYS 37 Cb 0.46 2.48 -0.12 0.00 -0.02 0.00 0.00 35.03 37.83 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 -2.50 4.37 -0.18 -0.18 1.01 -0.98 -3.09 121.20 119.65 1ao8 s ILE 38 Ca 0.21 -0.42 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 1ao8 s ILE 38 Cb -0.03 -3.18 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 1ao8 s ILE 38 CO 0.15 0.14 0.65 -0.32 0.00 0.00 0.00 174.94 175.57 1ao8 s MET 39 N 1.59 4.24 -0.19 2.79 1.75 -1.01 -2.47 119.30 126.00 1ao8 s MET 39 Ca 0.05 0.68 -0.05 0.00 -1.25 0.00 0.00 55.69 55.11 1ao8 s MET 39 Cb -0.17 -3.56 -0.03 0.00 2.84 0.00 0.00 34.83 33.91 1ao8 s MET 39 CO 0.05 -0.22 -0.01 0.08 -0.65 0.00 0.00 175.02 174.27 1ao8 s VAL 40 N 1.82 4.01 0.11 10.11 1.01 -0.31 -1.48 120.40 135.68 1ao8 s VAL 40 Ca 0.30 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 1ao8 s VAL 40 Cb -0.16 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.40 1ao8 s VAL 40 CO 0.11 0.45 0.14 0.68 0.00 0.00 0.00 175.10 176.48 1ao8 s VAL 41 N 0.75 0.13 0.00 2.92 -7.23 -0.78 -2.05 120.40 114.13 1ao8 s VAL 41 Ca -0.00 -1.55 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 1ao8 s VAL 41 Cb -0.14 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 35.10 1ao8 s VAL 41 CO 0.02 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 174.85 1ao8 n GLY 42 N -0.08 0.30 0.11 2.32 0.00 0.06 -2.41 105.19 105.49 1ao8 n GLY 42 Ca -0.10 -1.87 -0.12 0.00 0.00 0.00 0.00 46.02 43.93 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 0.21 -0.23 1.61 1.12 -1.92 -2.03 114.38 113.14 1ao8 h ARG 43 Ca 0.00 -0.31 -0.16 0.00 -1.11 0.00 0.00 59.98 58.40 1ao8 h ARG 43 Cb 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 29.97 30.07 1ao8 h ARG 43 CO 0.00 1.10 -0.48 -0.09 -3.11 0.00 0.00 179.97 177.38 1ao8 h ARG 44 N 0.08 0.74 -0.02 0.20 2.43 -1.97 -2.76 114.38 113.08 1ao8 h ARG 44 Ca -0.08 -0.48 -0.14 0.00 -0.81 0.00 0.00 59.98 58.47 1ao8 h ARG 44 Cb 1.77 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 31.37 1ao8 h ARG 44 CO 0.17 1.11 -0.64 1.15 -1.51 0.00 0.00 179.97 180.25 1ao8 h THR 45 N 0.46 1.44 0.67 0.20 2.02 -1.90 -2.52 112.91 113.28 1ao8 h THR 45 Ca 0.01 -2.14 -0.03 0.00 0.77 0.00 0.00 66.41 65.01 1ao8 h THR 45 Cb 1.09 2.14 0.01 0.00 -1.74 0.00 0.00 68.15 69.65 1ao8 h THR 45 CO 0.11 0.62 -0.32 0.22 0.37 0.00 0.00 175.52 176.51 1ao8 h TYR 46 N 0.04 -0.83 0.00 3.16 3.20 -1.29 -2.57 116.97 118.68 1ao8 h TYR 46 Ca -0.01 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 1ao8 h TYR 46 Cb 1.13 0.28 -0.00 0.00 1.54 0.00 0.00 36.73 39.68 1ao8 h TYR 46 CO 0.01 -0.48 -0.02 0.93 -1.64 0.00 0.00 178.16 176.95 1ao8 h GLU 47 N -1.04 0.00 -0.13 1.82 4.39 -1.54 -2.06 114.58 116.02 1ao8 h GLU 47 Ca -0.09 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 1ao8 h GLU 47 Cb 0.72 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 1ao8 h GLU 47 CO 0.15 0.02 -0.06 1.03 -1.16 0.00 0.00 179.01 179.00 1ao8 h SER 48 N 0.00 0.17 -4.07 1.42 0.87 -1.02 -3.43 113.55 107.49 1ao8 h SER 48 Ca -0.00 -0.02 -0.52 0.00 -1.23 0.00 0.00 61.79 60.02 1ao8 h SER 48 Cb 0.19 -0.04 0.09 0.00 -0.44 0.00 0.00 62.40 62.19 1ao8 h SER 48 CO 0.00 0.26 0.47 -0.36 -0.53 0.00 0.00 176.83 176.67 1ao8 s PHE 49 N -4.89 2.58 -0.10 2.24 0.08 -0.78 -4.98 117.98 112.13 1ao8 s PHE 49 Ca -0.05 1.52 -0.09 0.00 0.12 0.00 0.00 56.93 58.42 1ao8 s PHE 49 Cb 0.16 -3.41 -0.08 0.00 -0.57 0.00 0.00 43.02 39.12 1ao8 s PHE 49 CO 0.71 -1.88 0.29 -1.00 -0.10 0.00 0.00 175.22 173.24 1ao8 h PRO 50 N 1.26 -0.05 -4.37 0.24 0.13 -1.88 -3.43 132.00 123.90 1ao8 h PRO 50 Ca -0.50 0.00 -0.73 0.00 -0.87 0.00 0.00 66.00 63.90 1ao8 h PRO 50 Cb 1.28 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 32.20 1ao8 h PRO 50 CO 0.57 0.22 -0.33 0.21 -0.23 0.00 0.00 178.00 178.44 1ao8 s LYS 51 N -1.98 2.98 -0.02 0.86 2.47 -1.26 -5.06 119.74 117.74 1ao8 s LYS 51 Ca -0.06 -1.27 0.05 0.00 -1.56 0.00 0.00 55.97 53.14 1ao8 s LYS 51 Cb -0.01 -4.10 -0.03 0.00 -1.46 0.00 0.00 37.83 32.24 1ao8 s LYS 51 CO 0.21 -0.98 -0.17 1.03 0.16 0.00 0.00 175.35 175.60 1ao8 s ARG 52 N 1.69 2.31 0.87 4.03 0.52 -1.26 -4.09 118.95 123.01 1ao8 s ARG 52 Ca 0.05 -0.82 -0.13 0.00 -0.52 0.00 0.00 55.73 54.31 1ao8 s ARG 52 Cb -0.23 -2.27 0.14 0.00 0.52 0.00 0.00 34.95 33.12 1ao8 s ARG 52 CO 0.08 0.59 1.22 -1.25 0.02 0.00 0.00 175.30 175.95 1ao8 s PRO 53 N -0.91 1.31 -0.21 3.54 0.04 -1.26 -5.10 135.00 132.41 1ao8 s PRO 53 Ca 0.12 -0.28 -0.25 0.00 0.04 0.00 0.00 61.00 60.64 1ao8 s PRO 53 Cb -0.10 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 1ao8 s PRO 53 CO 0.02 -1.95 0.82 -0.51 0.04 0.00 0.00 177.00 175.42 1ao8 s LEU 54 N -5.66 4.12 0.82 -3.56 1.43 -1.26 -5.05 118.68 109.52 1ao8 s LEU 54 Ca 0.68 1.09 -0.12 0.00 -1.03 0.00 0.00 54.13 54.75 1ao8 s LEU 54 Cb -0.07 -3.20 0.08 0.00 0.03 0.00 0.00 46.19 43.04 1ao8 s LEU 54 CO 0.50 -0.46 1.17 -2.16 0.23 0.00 0.00 176.35 175.64 1ao8 s PRO 55 N 2.52 1.89 -1.83 1.29 0.04 -1.26 -4.10 135.00 133.55 1ao8 s PRO 55 Ca 0.36 0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.53 1ao8 s PRO 55 Cb -0.16 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1ao8 s PRO 55 CO 0.09 -1.65 0.00 0.39 0.04 0.00 0.00 177.00 175.87 1ao8 n GLU 56 N -3.36 -1.49 -3.64 4.56 -0.58 -1.26 -4.92 120.64 109.95 1ao8 n GLU 56 Ca 0.08 1.04 -0.02 0.00 -0.42 0.00 0.00 57.16 57.84 1ao8 n GLU 56 Cb 0.61 -5.53 -0.04 0.00 -0.57 0.00 0.00 31.44 25.91 1ao8 n GLU 56 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1ao8 s ARG 57 N -4.49 0.07 0.53 3.49 1.70 -1.26 -3.92 118.95 115.07 1ao8 s ARG 57 Ca 0.00 0.01 -0.15 0.00 -0.47 0.00 0.00 55.73 55.12 1ao8 s ARG 57 Cb 0.00 0.03 -0.07 0.00 -0.57 0.00 0.00 34.95 34.34 1ao8 s ARG 57 CO 0.00 -0.02 0.98 0.99 -1.08 0.00 0.00 175.30 176.16 1ao8 s THR 58 N -1.19 4.59 -0.02 4.99 2.01 -1.18 -4.83 115.64 120.02 1ao8 s THR 58 Ca 0.09 1.09 0.05 0.00 0.31 0.00 0.00 61.69 63.23 1ao8 s THR 58 Cb -0.01 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.74 1ao8 s THR 58 CO -0.07 -0.77 -0.16 0.20 -0.69 0.00 0.00 174.62 173.13 1ao8 s ASN 59 N -3.31 1.90 -0.07 3.53 0.01 -1.26 -2.40 114.94 113.34 1ao8 s ASN 59 Ca 0.57 -0.30 -0.01 0.00 -0.71 0.00 0.00 52.86 52.42 1ao8 s ASN 59 Cb -0.10 -0.28 0.03 0.00 0.41 0.00 0.00 41.25 41.31 1ao8 s ASN 59 CO 0.36 0.19 -0.01 -0.69 -1.51 0.00 0.00 177.10 175.44 1ao8 s VAL 60 N -0.29 0.44 -0.24 1.60 1.01 -0.55 -1.69 120.40 120.68 1ao8 s VAL 60 Ca 0.04 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 62.01 1ao8 s VAL 60 Cb -0.07 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 1ao8 s VAL 60 CO -0.00 0.26 0.09 -0.69 0.00 0.00 0.00 175.10 174.77 1ao8 s VAL 61 N 1.85 4.64 -0.65 2.92 1.01 -0.85 -1.87 120.40 127.45 1ao8 s VAL 61 Ca 0.03 -0.06 0.01 0.00 0.00 0.00 0.00 61.98 61.96 1ao8 s VAL 61 Cb -0.12 -3.16 0.16 0.00 0.00 0.00 0.00 36.38 33.26 1ao8 s VAL 61 CO -0.05 0.35 0.45 -0.22 0.00 0.00 0.00 175.10 175.63 1ao8 s LEU 62 N 1.36 4.91 -0.00 3.92 2.96 -1.01 -2.19 118.68 128.63 1ao8 s LEU 62 Ca 0.06 -3.26 0.03 0.00 -0.22 0.00 0.00 54.13 50.74 1ao8 s LEU 62 Cb -0.15 -1.75 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 1ao8 s LEU 62 CO 0.05 -0.24 0.11 1.07 -1.32 0.00 0.00 176.35 176.02 1ao8 n THR 63 N 2.86 0.00 -3.42 3.68 5.66 -1.26 -4.58 114.28 117.23 1ao8 n THR 63 Ca 0.12 -0.30 -0.20 0.00 -3.05 0.00 0.00 64.05 60.62 1ao8 n THR 63 Cb 0.35 0.79 0.07 0.00 -1.55 0.00 0.00 70.33 70.00 1ao8 n THR 63 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 1ao8 n HIS 64 N -1.26 -2.39 -3.86 1.09 -0.00 -1.26 -4.99 115.22 102.54 1ao8 n HIS 64 Ca 0.00 0.88 -0.30 0.00 0.46 0.00 0.00 57.72 58.77 1ao8 n HIS 64 Cb 0.06 -4.62 -0.15 0.00 -0.12 0.00 0.00 29.99 25.15 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 -5.90 1.19 -1.04 1.57 0.74 -1.26 -5.03 119.66 109.92 1ao8 s GLN 65 Ca 0.38 -1.09 -0.20 0.00 0.05 0.00 0.00 55.36 54.51 1ao8 s GLN 65 Cb -0.17 -2.44 -0.08 0.00 1.10 0.00 0.00 33.01 31.42 1ao8 s GLN 65 CO 0.65 -0.78 1.99 0.39 -0.55 0.00 0.00 175.29 176.98 1ao8 n GLU 66 N 4.71 1.99 0.00 1.67 1.02 -1.26 -3.43 120.64 125.34 1ao8 n GLU 66 Ca -0.06 -2.24 0.00 0.00 -0.02 0.00 0.00 57.16 54.84 1ao8 n GLU 66 Cb 0.43 -3.17 0.00 0.00 -0.02 0.00 0.00 31.44 28.68 1ao8 n GLU 66 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1ao8 n ASP 67 N 8.16 0.00 -4.61 1.62 2.03 -1.26 -5.08 116.55 117.41 1ao8 n ASP 67 Ca 0.50 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 55.38 1ao8 n ASP 67 Cb 0.41 0.30 -0.03 0.00 -0.72 0.00 0.00 41.12 41.09 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1ao8 s TYR 68 N -1.80 1.88 -0.23 -0.67 5.04 -1.22 -4.96 117.35 115.37 1ao8 s TYR 68 Ca 0.00 0.54 0.02 0.00 -2.44 0.00 0.00 57.07 55.19 1ao8 s TYR 68 Cb 0.00 -4.07 0.05 0.00 0.35 0.00 0.00 41.96 38.29 1ao8 s TYR 68 CO 0.00 -3.10 -0.11 -0.65 -1.34 0.00 0.00 175.55 170.36 1ao8 s GLN 69 N 5.26 2.15 -0.10 4.97 -0.21 -1.26 -5.04 119.66 125.42 1ao8 s GLN 69 Ca 0.78 -1.12 -0.02 0.00 0.02 0.00 0.00 55.36 55.02 1ao8 s GLN 69 Cb -0.25 -2.70 -0.03 0.00 1.00 0.00 0.00 33.01 31.03 1ao8 s GLN 69 CO 0.32 -0.51 -0.03 0.00 -2.12 0.00 0.00 175.29 172.95 1ao8 s ALA 70 N 1.24 3.10 -0.08 6.09 0.00 -1.26 -5.10 121.76 125.74 1ao8 s ALA 70 Ca -0.05 -0.84 -0.15 0.00 0.00 0.00 0.00 51.96 50.92 1ao8 s ALA 70 Cb -0.18 -1.43 -0.05 0.00 0.00 0.00 0.00 23.12 21.46 1ao8 s ALA 70 CO -0.07 0.46 0.40 -0.65 0.00 0.00 0.00 175.76 175.89 1ao8 s GLN 71 N -0.43 4.13 0.00 0.00 -0.21 -1.26 -4.06 119.66 117.83 1ao8 s GLN 71 Ca 0.07 0.33 0.00 0.00 0.02 0.00 0.00 55.36 55.78 1ao8 s GLN 71 Cb -0.12 -3.34 0.00 0.00 1.00 0.00 0.00 33.01 30.54 1ao8 s GLN 71 CO 0.02 0.40 0.00 0.41 -2.12 0.00 0.00 175.29 174.00 1ao8 n GLY 72 N 2.71 2.14 3.59 3.09 0.00 -1.26 -4.85 105.19 110.60 1ao8 n GLY 72 Ca -0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.32 3.02 0.12 4.61 0.00 -1.26 -4.88 121.76 121.05 1ao8 s ALA 73 Ca 0.00 -1.73 -0.17 0.00 0.00 0.00 0.00 51.96 50.06 1ao8 s ALA 73 Cb 0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 23.12 22.45 1ao8 s ALA 73 CO 0.00 0.27 0.57 0.08 0.00 0.00 0.00 175.76 176.68 1ao8 s VAL 74 N -2.39 4.79 -0.13 0.00 1.01 -0.68 -4.82 120.40 118.17 1ao8 s VAL 74 Ca 0.31 1.02 -0.01 0.00 0.00 0.00 0.00 61.98 63.30 1ao8 s VAL 74 Cb -0.06 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.55 1ao8 s VAL 74 CO 0.18 0.37 -0.03 -0.69 0.00 0.00 0.00 175.10 174.93 1ao8 s VAL 75 N -1.32 0.79 0.51 2.92 1.01 -1.26 -2.00 120.40 121.04 1ao8 s VAL 75 Ca 0.34 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.06 1ao8 s VAL 75 Cb -0.17 -0.97 0.05 0.00 0.00 0.00 0.00 36.38 35.29 1ao8 s VAL 75 CO 0.19 0.17 0.45 1.33 0.00 0.00 0.00 175.10 177.24 1ao8 n VAL 76 N 5.00 0.00 -2.56 2.92 0.24 -0.93 -4.95 118.33 118.05 1ao8 n VAL 76 Ca -0.10 -1.95 -0.01 0.00 -2.04 0.00 0.00 64.34 60.24 1ao8 n VAL 76 Cb 0.49 -0.17 0.04 0.00 -1.47 0.00 0.00 33.84 32.73 1ao8 n VAL 76 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1ao8 n HIS 77 N -1.78 -0.18 -3.64 6.34 8.25 -1.26 -4.33 115.22 118.61 1ao8 n HIS 77 Ca 0.02 -1.37 -0.07 0.00 -0.26 0.00 0.00 57.72 56.04 1ao8 n HIS 77 Cb 0.57 0.43 -0.07 0.00 1.12 0.00 0.00 29.99 32.04 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 -2.15 -0.36 0.29 0.41 2.15 -1.26 -4.74 116.67 111.00 1ao8 s ASP 78 Ca 0.18 0.68 -0.01 0.00 0.43 0.00 0.00 52.55 53.83 1ao8 s ASP 78 Cb 0.31 0.76 0.42 0.00 -0.30 0.00 0.00 42.92 44.11 1ao8 s ASP 78 CO -0.09 -0.12 1.86 0.58 -0.17 0.00 0.00 175.17 177.24 1ao8 h VAL 79 N 3.70 1.22 -0.63 1.11 2.07 -2.00 -2.15 116.25 119.56 1ao8 h VAL 79 Ca -0.28 -0.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 1ao8 h VAL 79 Cb 1.18 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 1ao8 h VAL 79 CO 0.14 0.28 0.22 0.00 0.02 0.00 0.00 177.57 178.23 1ao8 h ALA 80 N 1.38 1.20 -0.26 1.67 0.00 -2.00 -2.20 119.26 119.05 1ao8 h ALA 80 Ca 0.20 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1ao8 h ALA 80 Cb 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1ao8 h ALA 80 CO -0.01 0.57 -0.23 0.00 0.00 0.00 0.00 179.25 179.57 1ao8 h ALA 81 N 1.32 1.11 -0.42 0.00 0.00 -1.80 -2.24 119.26 117.23 1ao8 h ALA 81 Ca 0.21 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1ao8 h ALA 81 Cb 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1ao8 h ALA 81 CO -0.01 0.55 0.09 0.28 0.00 0.00 0.00 179.25 180.16 1ao8 h VAL 82 N 0.44 1.19 -0.03 0.00 2.07 -0.94 -1.89 116.25 117.09 1ao8 h VAL 82 Ca 0.07 -0.70 -0.20 0.00 0.82 0.00 0.00 66.70 66.69 1ao8 h VAL 82 Cb 0.65 0.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1ao8 h VAL 82 CO 0.05 0.25 -0.84 -0.26 0.02 0.00 0.00 177.57 176.79 1ao8 h PHE 83 N 0.61 0.54 -0.34 1.57 0.04 -1.20 -3.08 116.94 115.08 1ao8 h PHE 83 Ca 0.14 -0.27 -0.07 0.00 2.80 0.00 0.00 57.97 60.57 1ao8 h PHE 83 Cb 0.25 -0.07 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1ao8 h PHE 83 CO 0.01 1.06 -0.09 0.00 -0.60 0.00 0.00 178.31 178.70 1ao8 h ALA 84 N 0.85 1.21 -0.41 2.45 0.00 -0.90 -1.47 119.26 121.00 1ao8 h ALA 84 Ca -0.05 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 1ao8 h ALA 84 Cb 1.45 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1ao8 h ALA 84 CO 0.14 0.51 -0.12 -0.92 0.00 0.00 0.00 179.25 178.86 1ao8 h TYR 85 N 0.54 0.81 -0.02 0.00 3.20 -1.31 -2.60 116.97 117.58 1ao8 h TYR 85 Ca 0.10 -0.15 -0.15 0.00 3.14 0.00 0.00 58.73 61.67 1ao8 h TYR 85 Cb 0.47 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 1ao8 h TYR 85 CO 0.02 0.82 -0.70 0.00 -1.64 0.00 0.00 178.16 176.66 1ao8 h ALA 86 N 1.20 0.81 -0.69 1.82 0.00 -1.37 -3.13 119.26 117.90 1ao8 h ALA 86 Ca 0.11 -0.62 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1ao8 h ALA 86 Cb 0.59 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1ao8 h ALA 86 CO 0.04 0.83 0.30 -0.22 0.00 0.00 0.00 179.25 180.20 1ao8 h LYS 87 N 0.06 1.01 -0.07 0.00 3.64 -0.91 -2.01 116.57 118.29 1ao8 h LYS 87 Ca -0.01 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 1ao8 h LYS 87 Cb 1.23 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1ao8 h LYS 87 CO 0.10 0.82 -0.10 0.37 -2.27 0.00 0.00 179.45 178.37 1ao8 h GLN 88 N 0.97 0.10 -3.73 1.90 4.15 -1.44 -3.33 115.11 113.73 1ao8 h GLN 88 Ca 0.23 -0.02 -0.67 0.00 0.77 0.00 0.00 58.65 58.97 1ao8 h GLN 88 Cb 0.17 -0.02 -0.38 0.00 0.21 0.00 0.00 27.48 27.46 1ao8 h GLN 88 CO -0.02 0.21 -0.54 -1.01 -1.93 0.00 0.00 178.83 175.54 1ao8 s HIS 89 N -4.81 3.38 0.12 3.99 3.76 -0.75 -4.91 115.29 116.06 1ao8 s HIS 89 Ca -0.05 -2.91 0.10 0.00 -0.15 0.00 0.00 55.06 52.05 1ao8 s HIS 89 Cb 0.16 -3.01 0.03 0.00 1.11 0.00 0.00 32.58 30.87 1ao8 s HIS 89 CO 0.70 -0.83 1.42 -1.00 -0.85 0.00 0.00 174.74 174.18 1ao8 h PRO 90 N 6.98 0.00 -0.04 8.40 0.13 -1.68 -3.21 132.00 142.57 1ao8 h PRO 90 Ca -0.06 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.98 1ao8 h PRO 90 Cb 0.94 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 1ao8 h PRO 90 CO 0.68 0.79 -0.43 0.22 -0.23 0.00 0.00 178.00 179.04 1ao8 h ASP 91 N 0.00 0.10 -3.11 1.44 3.58 -1.91 -3.43 116.42 113.09 1ao8 h ASP 91 Ca -0.01 -0.04 -0.48 0.00 0.42 0.00 0.00 57.03 56.92 1ao8 h ASP 91 Cb 1.49 -0.03 0.02 0.00 1.72 0.00 0.00 39.33 42.54 1ao8 h ASP 91 CO 0.10 0.52 -0.05 -1.10 -2.88 0.00 0.00 179.24 175.83 1ao8 s GLN 92 N -4.08 3.39 0.29 0.28 1.11 -1.21 -4.99 119.66 114.44 1ao8 s GLN 92 Ca -0.03 -0.16 0.11 0.00 0.01 0.00 0.00 55.36 55.29 1ao8 s GLN 92 Cb 0.14 -2.52 -0.05 0.00 -1.01 0.00 0.00 33.01 29.57 1ao8 s GLN 92 CO 0.75 -0.10 -0.15 -1.21 0.01 0.00 0.00 175.29 174.59 1ao8 s GLU 93 N -4.55 1.81 -0.39 2.91 0.41 -1.26 -4.91 118.70 112.72 1ao8 s GLU 93 Ca 0.45 -1.74 -0.19 0.00 -0.41 0.00 0.00 54.97 53.08 1ao8 s GLU 93 Cb -0.10 -1.83 0.01 0.00 -1.78 0.00 0.00 34.13 30.43 1ao8 s GLU 93 CO 0.40 0.30 0.54 -1.17 -0.49 0.00 0.00 175.26 174.83 1ao8 s LEU 94 N -3.56 4.49 -0.16 1.80 2.96 -1.26 -2.31 118.68 120.63 1ao8 s LEU 94 Ca 0.31 -0.23 -0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1ao8 s LEU 94 Cb -0.04 -2.59 -0.02 0.00 0.50 0.00 0.00 46.19 44.04 1ao8 s LEU 94 CO 0.16 -0.58 -0.05 -0.69 -1.32 0.00 0.00 176.35 173.87 1ao8 s VAL 95 N 2.46 3.68 -0.21 1.68 1.01 -1.03 -0.62 120.40 127.36 1ao8 s VAL 95 Ca 0.19 -0.43 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 1ao8 s VAL 95 Cb -0.15 -2.61 -0.05 0.00 0.00 0.00 0.00 36.38 33.57 1ao8 s VAL 95 CO 0.15 0.49 0.11 -0.63 0.00 0.00 0.00 175.10 175.22 1ao8 s ILE 96 N 0.50 5.11 -0.08 2.22 -1.09 -0.40 -1.16 121.20 126.30 1ao8 s ILE 96 Ca -0.04 0.09 0.09 0.00 -2.23 0.00 0.00 60.65 58.55 1ao8 s ILE 96 Cb -0.15 -3.34 -0.13 0.00 -1.58 0.00 0.00 42.46 37.26 1ao8 s ILE 96 CO 0.03 0.41 0.08 0.00 -1.23 0.00 0.00 174.94 174.23 1ao8 n ALA 97 N 3.85 1.89 0.00 9.38 0.00 -0.87 -1.79 120.51 132.98 1ao8 n ALA 97 Ca -0.16 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.72 1ao8 n ALA 97 Cb 0.52 -0.04 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 2.29 -1.11 0.00 0.00 0.00 -1.25 -4.76 105.19 100.36 1ao8 n GLY 98 Ca -0.13 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 0.14 0.29 -0.02 0.00 -1.26 -0.76 105.19 103.51 1ao8 n GLY 99 Ca 0.00 -1.61 -0.04 0.00 0.00 0.00 0.00 46.02 44.37 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 -1.90 1.15 -0.08 4.61 0.00 -1.92 -2.03 119.26 119.08 1ao8 h ALA 100 Ca 0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1ao8 h ALA 100 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1ao8 h ALA 100 CO 0.00 0.56 -0.15 1.96 0.00 0.00 0.00 179.25 181.62 1ao8 h GLN 101 N 0.76 0.13 0.01 0.00 4.20 -1.98 -2.24 115.11 115.99 1ao8 h GLN 101 Ca 0.16 -0.03 -0.25 0.00 0.06 0.00 0.00 58.65 58.59 1ao8 h GLN 101 Cb 0.38 -0.02 0.01 0.00 0.30 0.00 0.00 27.48 28.16 1ao8 h GLN 101 CO 0.01 0.28 -1.03 0.82 -0.67 0.00 0.00 178.83 178.24 1ao8 h ILE 102 N 0.12 1.33 -0.85 2.54 1.08 -1.66 -3.14 117.51 116.94 1ao8 h ILE 102 Ca 0.03 -2.37 -0.03 0.00 -0.39 0.00 0.00 64.86 62.09 1ao8 h ILE 102 Cb 0.34 2.44 -0.04 0.00 -3.07 0.00 0.00 36.82 36.49 1ao8 h ILE 102 CO 0.02 0.72 0.39 -0.26 -0.69 0.00 0.00 178.15 178.33 1ao8 h PHE 103 N 0.31 1.23 -0.40 1.37 0.04 -0.94 -2.08 116.94 116.48 1ao8 h PHE 103 Ca -0.12 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.56 1ao8 h PHE 103 Cb 1.68 -0.38 -0.02 0.00 2.20 0.00 0.00 35.95 39.43 1ao8 h PHE 103 CO 0.09 0.90 0.14 1.15 -0.60 0.00 0.00 178.31 179.99 1ao8 h THR 104 N 1.21 1.16 -0.42 -1.55 2.02 -1.44 -1.47 112.91 112.42 1ao8 h THR 104 Ca 0.29 -0.52 -0.07 0.00 0.77 0.00 0.00 66.41 66.88 1ao8 h THR 104 Cb 0.14 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1ao8 h THR 104 CO -0.03 0.20 -0.02 0.00 0.37 0.00 0.00 175.52 176.03 1ao8 h ALA 105 N 1.60 0.57 -0.98 6.16 0.00 -1.34 -2.99 119.26 122.28 1ao8 h ALA 105 Ca 0.14 -0.28 -0.67 0.00 0.00 0.00 0.00 54.91 54.10 1ao8 h ALA 105 Cb 0.14 -0.15 -0.30 0.00 0.00 0.00 0.00 17.79 17.47 1ao8 h ALA 105 CO -0.01 0.38 0.71 1.19 0.00 0.00 0.00 179.25 181.52 1ao8 n PHE 106 N -4.39 3.19 0.06 0.00 3.72 -0.93 -4.51 117.46 114.60 1ao8 n PHE 106 Ca -0.01 -2.95 -0.08 0.00 -0.05 0.00 0.00 57.45 54.36 1ao8 n PHE 106 Cb 0.31 -1.34 -0.12 0.00 -0.94 0.00 0.00 39.48 37.38 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 2.03 0.04 -1.02 -1.08 3.64 -1.13 -3.26 116.57 115.80 1ao8 h LYS 107 Ca 0.59 -0.06 -0.54 0.00 -1.27 0.00 0.00 60.65 59.36 1ao8 h LYS 107 Cb 0.87 0.02 -0.29 0.00 -0.41 0.00 0.00 32.23 32.43 1ao8 h LYS 107 CO 1.51 1.00 0.69 -0.25 -2.27 0.00 0.00 179.45 180.13 1ao8 n ASP 108 N -3.35 5.00 -2.81 4.20 8.00 -1.26 -4.57 116.55 121.76 1ao8 n ASP 108 Ca -0.02 -3.58 -0.09 0.00 0.71 0.00 0.00 54.79 51.81 1ao8 n ASP 108 Cb 0.96 -0.88 0.03 0.00 -0.02 0.00 0.00 41.12 41.21 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 -0.96 -2.76 -3.64 -2.24 8.00 -1.23 -5.13 116.55 108.60 1ao8 n ASP 109 Ca 0.57 -3.13 -0.10 0.00 0.71 0.00 0.00 54.79 52.85 1ao8 n ASP 109 Cb 1.29 1.56 -0.07 0.00 -0.02 0.00 0.00 41.12 43.88 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 0.59 0.00 -0.02 2.53 0.11 -1.26 -4.81 120.40 117.54 1ao8 s VAL 110 Ca 0.32 0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.37 1ao8 s VAL 110 Cb 0.16 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 34.00 1ao8 s VAL 110 CO -0.18 0.00 -0.02 -0.90 -3.33 0.00 0.00 175.10 170.67 1ao8 n ASP 111 N 3.16 3.28 -4.61 3.54 5.75 -1.26 -4.98 116.55 121.42 1ao8 n ASP 111 Ca -0.16 -0.00 -0.38 0.00 -0.01 0.00 0.00 54.79 54.24 1ao8 n ASP 111 Cb 0.57 -0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 40.52 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 -2.03 5.28 -0.43 2.12 2.01 -1.26 -2.72 115.64 118.60 1ao8 s THR 112 Ca -0.02 0.32 -0.05 0.00 0.31 0.00 0.00 61.69 62.25 1ao8 s THR 112 Cb 0.01 -3.58 0.11 0.00 0.01 0.00 0.00 72.50 69.04 1ao8 s THR 112 CO 0.04 0.24 0.24 -0.76 -0.69 0.00 0.00 174.62 173.70 1ao8 s LEU 113 N 1.67 5.36 -0.18 4.42 1.43 -0.76 -2.08 118.68 128.53 1ao8 s LEU 113 Ca 0.10 -1.97 -0.18 0.00 -1.03 0.00 0.00 54.13 51.05 1ao8 s LEU 113 Cb -0.15 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.15 1ao8 s LEU 113 CO 0.09 -0.58 0.49 -0.76 0.23 0.00 0.00 176.35 175.82 1ao8 s LEU 114 N 1.22 4.17 -0.05 1.79 1.43 -0.00 -2.41 118.68 124.83 1ao8 s LEU 114 Ca 0.07 0.68 -0.04 0.00 -1.03 0.00 0.00 54.13 53.81 1ao8 s LEU 114 Cb -0.24 -2.68 0.01 0.00 0.03 0.00 0.00 46.19 43.32 1ao8 s LEU 114 CO -0.03 -0.13 0.12 0.54 0.23 0.00 0.00 176.35 177.09 1ao8 s VAL 115 N 1.38 -0.00 -0.47 -1.59 0.11 -1.04 -2.36 120.40 116.44 1ao8 s VAL 115 Ca 0.24 0.01 -0.12 0.00 -2.93 0.00 0.00 61.98 59.18 1ao8 s VAL 115 Cb -0.15 -0.18 0.10 0.00 -1.53 0.00 0.00 36.38 34.61 1ao8 s VAL 115 CO 0.09 0.01 0.36 -0.89 -3.33 0.00 0.00 175.10 171.34 1ao8 s THR 116 N 0.14 4.63 0.01 5.04 2.01 -0.98 -1.64 115.64 124.86 1ao8 s THR 116 Ca -0.01 -1.44 -0.30 0.00 0.31 0.00 0.00 61.69 60.25 1ao8 s THR 116 Cb -0.02 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 1ao8 s THR 116 CO -0.00 -0.66 1.02 -0.13 -0.69 0.00 0.00 174.62 174.16 1ao8 s ARG 117 N 1.49 4.53 0.48 4.92 0.52 -0.86 -2.38 118.95 127.65 1ao8 s ARG 117 Ca 0.04 1.49 0.06 0.00 -0.52 0.00 0.00 55.73 56.80 1ao8 s ARG 117 Cb -0.25 -3.44 0.08 0.00 0.52 0.00 0.00 34.95 31.86 1ao8 s ARG 117 CO 0.03 -0.10 0.66 1.28 0.02 0.00 0.00 175.30 177.18 1ao8 n LEU 118 N 3.93 0.00 -0.03 2.53 4.32 -0.75 -0.36 117.00 126.65 1ao8 n LEU 118 Ca 0.07 -1.88 -0.05 0.00 -0.02 0.00 0.00 56.01 54.13 1ao8 n LEU 118 Cb 0.50 -0.37 -0.03 0.00 -1.62 0.00 0.00 43.42 41.91 1ao8 n LEU 118 CO 0.53 -0.71 -0.71 0.00 -1.22 0.00 0.00 177.39 175.28 1ao8 n ALA 119 N -2.58 2.05 -1.77 -1.18 0.00 -0.88 -3.98 120.51 112.18 1ao8 n ALA 119 Ca -0.11 -0.26 -0.40 0.00 0.00 0.00 0.00 53.44 52.67 1ao8 n ALA 119 Cb 0.46 0.37 -0.01 0.00 0.00 0.00 0.00 19.45 20.28 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 -4.73 2.94 0.41 0.00 0.00 -1.10 -4.72 107.32 100.11 1ao8 s GLY 120 Ca -0.08 1.22 -0.11 0.00 0.00 0.00 0.00 44.72 45.75 1ao8 s GLY 120 CO 0.13 1.81 0.77 -1.35 0.00 0.00 0.00 173.10 174.47 1ao8 s SER 121 N -0.71 6.52 0.09 1.64 1.04 -1.26 -4.51 113.70 116.51 1ao8 s SER 121 Ca 0.55 1.14 -0.12 0.00 0.48 0.00 0.00 55.95 57.99 1ao8 s SER 121 Cb -0.38 -2.33 0.02 0.00 0.10 0.00 0.00 66.02 63.43 1ao8 s SER 121 CO 0.49 -0.40 0.29 -0.36 0.98 0.00 0.00 173.24 174.24 1ao8 s PHE 122 N -2.38 -0.04 0.15 5.02 0.08 -1.26 -5.08 117.98 114.48 1ao8 s PHE 122 Ca 0.51 -0.27 0.09 0.00 0.12 0.00 0.00 56.93 57.38 1ao8 s PHE 122 Cb -0.10 0.09 -0.04 0.00 -0.57 0.00 0.00 43.02 42.39 1ao8 s PHE 122 CO 0.31 -0.58 -0.12 -1.83 -0.10 0.00 0.00 175.22 172.90 1ao8 s GLU 123 N -3.47 1.98 0.00 0.44 -1.05 -1.26 -4.84 118.70 110.49 1ao8 s GLU 123 Ca 0.01 -1.22 0.00 0.00 -0.15 0.00 0.00 54.97 53.62 1ao8 s GLU 123 Cb 0.02 -2.16 0.00 0.00 -0.44 0.00 0.00 34.13 31.55 1ao8 s GLU 123 CO -0.09 0.46 0.00 0.41 0.95 0.00 0.00 175.26 176.98 1ao8 n GLY 124 N 0.35 -1.32 0.04 -3.83 0.00 -1.26 -4.92 105.19 94.25 1ao8 n GLY 124 Ca -0.12 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 44.89 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 0.48 3.33 -4.63 1.61 9.92 -1.26 -4.95 116.55 121.05 1ao8 n ASP 125 Ca 0.00 -0.02 -0.43 0.00 -0.53 0.00 0.00 54.79 53.81 1ao8 n ASP 125 Cb 0.00 0.28 -0.02 0.00 -0.64 0.00 0.00 41.12 40.73 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1ao8 s THR 126 N -2.17 3.79 0.25 -3.53 2.01 -1.24 -4.99 115.64 109.77 1ao8 s THR 126 Ca -0.07 0.89 0.05 0.00 0.31 0.00 0.00 61.69 62.87 1ao8 s THR 126 Cb 0.02 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.68 1ao8 s THR 126 CO 0.24 -0.32 -0.03 -0.54 -0.69 0.00 0.00 174.62 173.27 1ao8 s LYS 127 N 4.54 1.43 0.28 4.92 1.02 -1.26 -1.81 119.74 128.86 1ao8 s LYS 127 Ca 0.68 -1.72 -0.18 0.00 0.02 0.00 0.00 55.97 54.76 1ao8 s LYS 127 Cb -0.23 -0.87 -0.09 0.00 -0.52 0.00 0.00 37.83 36.12 1ao8 s LYS 127 CO 0.28 -0.03 0.76 1.41 -0.92 0.00 0.00 175.35 176.85 1ao8 s MET 128 N -3.80 4.18 0.94 1.68 -2.45 -1.25 -4.81 119.30 113.79 1ao8 s MET 128 Ca 0.29 0.85 -0.11 0.00 -1.25 0.00 0.00 55.69 55.46 1ao8 s MET 128 Cb 0.05 -2.66 0.16 0.00 1.25 0.00 0.00 34.83 33.63 1ao8 s MET 128 CO 0.10 0.27 1.09 0.96 1.05 0.00 0.00 175.02 178.49 1ao8 s ILE 129 N -1.75 2.44 -0.75 10.11 -4.36 -1.26 -4.93 121.20 120.70 1ao8 s ILE 129 Ca 0.49 0.14 -0.26 0.00 -0.26 0.00 0.00 60.65 60.76 1ao8 s ILE 129 Cb -0.14 -2.40 0.04 0.00 1.25 0.00 0.00 42.46 41.21 1ao8 s ILE 129 CO 0.19 -0.19 1.26 -2.16 0.24 0.00 0.00 174.94 174.28 1ao8 s PRO 130 N -4.75 3.22 0.61 0.37 0.04 -1.26 -5.03 135.00 128.21 1ao8 s PRO 130 Ca 0.65 -0.38 -0.00 0.00 0.04 0.00 0.00 61.00 61.31 1ao8 s PRO 130 Cb -0.21 -4.28 0.06 0.00 0.04 0.00 0.00 34.50 30.11 1ao8 s PRO 130 CO 0.59 -2.12 0.86 -0.51 0.04 0.00 0.00 177.00 175.86 1ao8 s LEU 131 N 5.48 3.14 -0.35 -3.56 1.02 -1.26 -5.06 118.68 118.09 1ao8 s LEU 131 Ca 0.34 -0.05 -0.15 0.00 0.02 0.00 0.00 54.13 54.30 1ao8 s LEU 131 Cb -0.08 -2.67 -0.01 0.00 0.02 0.00 0.00 46.19 43.45 1ao8 s LEU 131 CO 0.12 -1.38 0.33 0.21 0.02 0.00 0.00 176.35 175.66 1ao8 s ASN 132 N -4.52 6.15 0.00 2.29 2.47 -1.26 -4.93 114.94 115.14 1ao8 s ASN 132 Ca 0.60 -0.35 0.21 0.00 0.42 0.00 0.00 52.86 53.74 1ao8 s ASN 132 Cb -0.09 -2.18 0.54 0.00 -1.45 0.00 0.00 41.25 38.07 1ao8 s ASN 132 CO 0.41 -0.34 1.46 0.79 -3.72 0.00 0.00 177.10 175.70 1ao8 n TRP 133 N 5.32 0.71 0.04 0.43 7.02 -1.26 -4.18 117.44 125.51 1ao8 n TRP 133 Ca -0.10 -0.36 -0.08 0.00 -1.02 0.00 0.00 57.50 55.95 1ao8 n TRP 133 Cb 0.49 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.26 1ao8 n TRP 133 CO 0.00 0.00 0.00 0.22 -2.02 0.00 0.00 177.69 175.89 1ao8 h ASP 134 N 3.80 0.00 -0.90 -0.99 1.82 -2.03 -3.29 116.42 114.84 1ao8 h ASP 134 Ca 0.00 -0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 56.13 1ao8 h ASP 134 Cb 0.86 -0.00 -0.28 0.00 0.68 0.00 0.00 39.33 40.59 1ao8 h ASP 134 CO 0.00 1.00 0.55 -0.67 -1.61 0.00 0.00 179.24 178.51 1ao8 n ASP 135 N -3.26 4.51 -3.83 2.28 2.03 -1.26 -4.92 116.55 112.11 1ao8 n ASP 135 Ca -0.05 -3.69 -0.12 0.00 0.52 0.00 0.00 54.79 51.45 1ao8 n ASP 135 Cb 0.97 -0.83 -0.13 0.00 -0.72 0.00 0.00 41.12 40.42 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 -3.43 -0.14 -0.01 -0.67 0.40 -1.24 -4.07 117.98 108.82 1ao8 s PHE 136 Ca 0.57 0.35 0.03 0.00 -0.60 0.00 0.00 56.93 57.28 1ao8 s PHE 136 Cb 0.47 0.05 -0.01 0.00 0.51 0.00 0.00 43.02 44.05 1ao8 s PHE 136 CO 0.06 -0.07 -0.11 0.99 0.70 0.00 0.00 175.22 176.79 1ao8 s THR 137 N 0.05 0.89 0.29 0.64 2.01 -0.84 -4.93 115.64 113.75 1ao8 s THR 137 Ca -0.00 -0.47 -0.29 0.00 0.31 0.00 0.00 61.69 61.24 1ao8 s THR 137 Cb -0.01 -0.75 -0.10 0.00 0.01 0.00 0.00 72.50 71.65 1ao8 s THR 137 CO 0.00 0.26 1.32 -0.75 -0.69 0.00 0.00 174.62 174.76 1ao8 s LYS 138 N -0.16 4.36 -0.08 4.92 2.20 -1.26 -2.05 119.74 127.68 1ao8 s LYS 138 Ca 0.02 2.18 0.03 0.00 -0.36 0.00 0.00 55.97 57.85 1ao8 s LYS 138 Cb -0.05 -3.11 -0.07 0.00 -1.51 0.00 0.00 37.83 33.09 1ao8 s LYS 138 CO -0.00 -0.22 -0.03 1.55 -0.36 0.00 0.00 175.35 176.29 1ao8 n VAL 139 N 1.43 0.48 -3.78 4.02 3.14 -0.70 -4.92 118.33 118.00 1ao8 n VAL 139 Ca 0.02 -0.24 -0.13 0.00 -2.96 0.00 0.00 64.34 61.04 1ao8 n VAL 139 Cb 0.42 -0.81 -0.12 0.00 -1.06 0.00 0.00 33.84 32.27 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1ao8 s SER 140 N -4.35 -0.25 0.15 6.55 0.15 -1.23 -5.06 113.70 109.66 1ao8 s SER 140 Ca -0.08 0.48 -0.08 0.00 0.70 0.00 0.00 55.95 56.98 1ao8 s SER 140 Cb 0.03 0.47 -0.01 0.00 -1.71 0.00 0.00 66.02 64.80 1ao8 s SER 140 CO 0.24 -0.09 0.24 -0.55 1.20 0.00 0.00 173.24 174.27 1ao8 s SER 141 N 0.28 0.09 -0.26 5.45 0.15 -1.26 -1.19 113.70 116.97 1ao8 s SER 141 Ca -0.01 -0.89 -0.08 0.00 0.70 0.00 0.00 55.95 55.67 1ao8 s SER 141 Cb -0.03 0.40 0.12 0.00 -1.71 0.00 0.00 66.02 64.80 1ao8 s SER 141 CO -0.01 -0.84 0.54 -0.60 1.20 0.00 0.00 173.24 173.53 1ao8 s ARG 142 N -3.96 0.46 -0.20 5.44 3.52 -0.56 -5.00 118.95 118.66 1ao8 s ARG 142 Ca 0.16 1.23 -0.23 0.00 -0.13 0.00 0.00 55.73 56.76 1ao8 s ARG 142 Cb 0.04 0.59 -0.02 0.00 -1.56 0.00 0.00 34.95 34.00 1ao8 s ARG 142 CO -0.01 -0.26 0.76 0.99 -0.81 0.00 0.00 175.30 175.96 1ao8 s THR 143 N 2.77 4.92 -0.17 4.11 2.01 -1.26 -1.37 115.64 126.65 1ao8 s THR 143 Ca -0.02 1.45 0.00 0.00 0.31 0.00 0.00 61.69 63.43 1ao8 s THR 143 Cb -0.12 -4.06 0.01 0.00 0.01 0.00 0.00 72.50 68.33 1ao8 s THR 143 CO -0.16 0.03 -0.16 -0.69 -0.69 0.00 0.00 174.62 172.95 1ao8 s VAL 144 N 2.24 2.47 0.22 3.82 1.01 -0.47 -5.00 120.40 124.69 1ao8 s VAL 144 Ca 0.34 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 1ao8 s VAL 144 Cb -0.16 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 1ao8 s VAL 144 CO 0.10 0.51 0.47 -1.61 0.00 0.00 0.00 175.10 174.58 1ao8 s GLU 145 N 1.07 3.63 0.18 2.72 0.41 -1.26 -2.45 118.70 123.00 1ao8 s GLU 145 Ca -0.00 -0.05 0.00 0.00 -0.41 0.00 0.00 54.97 54.51 1ao8 s GLU 145 Cb -0.14 -2.74 0.00 0.00 -1.78 0.00 0.00 34.13 29.47 1ao8 s GLU 145 CO -0.05 0.34 0.04 -3.47 -0.49 0.00 0.00 175.26 171.62 1ao8 n ASP 146 N -0.49 2.25 -0.25 -0.19 -0.08 -1.26 -4.96 116.55 111.58 1ao8 n ASP 146 Ca -0.02 -1.76 -0.07 0.00 -1.51 0.00 0.00 54.79 51.44 1ao8 n ASP 146 Cb 0.53 0.09 0.04 0.00 2.34 0.00 0.00 41.12 44.12 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 0.94 1.24 -1.84 5.18 1.35 -1.99 -3.44 112.91 114.35 1ao8 h THR 147 Ca -0.14 -0.77 -0.45 0.00 -0.55 0.00 0.00 66.41 64.50 1ao8 h THR 147 Cb 0.45 0.47 -0.01 0.00 -1.73 0.00 0.00 68.15 67.33 1ao8 h THR 147 CO 0.23 0.31 -0.37 0.20 -0.25 0.00 0.00 175.52 175.63 1ao8 s ASN 148 N -6.21 5.84 0.13 5.36 -0.87 -1.26 -5.02 114.94 112.91 1ao8 s ASN 148 Ca -0.13 -0.24 0.08 0.00 -1.57 0.00 0.00 52.86 51.00 1ao8 s ASN 148 Cb 0.14 -1.22 -0.19 0.00 -0.02 0.00 0.00 41.25 39.96 1ao8 s ASN 148 CO 0.82 -0.38 1.29 1.55 -2.57 0.00 0.00 177.10 177.80 1ao8 h PRO 149 N 1.00 0.00 0.00 -0.60 0.13 -2.01 -3.25 132.00 127.27 1ao8 h PRO 149 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ao8 h PRO 149 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1ao8 h PRO 149 CO 0.55 0.96 -0.08 0.00 -0.23 0.00 0.00 178.00 179.20 1ao8 h ALA 150 N 1.03 0.96 -0.71 -0.56 0.00 -1.95 -3.23 119.26 114.80 1ao8 h ALA 150 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.59 1ao8 h ALA 150 Cb 1.75 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 19.35 1ao8 h ALA 150 CO 0.13 0.00 0.39 1.28 0.00 0.00 0.00 179.25 181.04 1ao8 n LEU 151 N -2.99 5.68 -4.81 0.00 4.77 -1.23 -2.73 117.00 115.70 1ao8 n LEU 151 Ca 0.04 -2.98 -0.35 0.00 -0.03 0.00 0.00 56.01 52.68 1ao8 n LEU 151 Cb 0.52 -0.74 -0.07 0.00 -2.33 0.00 0.00 43.42 40.81 1ao8 n LEU 151 CO 0.34 0.84 0.59 -0.89 -1.33 0.00 0.00 177.39 176.94 1ao8 s THR 152 N -2.57 4.37 0.05 -5.08 2.01 -1.22 -4.28 115.64 108.91 1ao8 s THR 152 Ca 0.45 1.54 -0.11 0.00 0.31 0.00 0.00 61.69 63.88 1ao8 s THR 152 Cb 0.37 -3.81 0.01 0.00 0.01 0.00 0.00 72.50 69.08 1ao8 s THR 152 CO 0.10 -0.04 0.24 -1.38 -0.69 0.00 0.00 174.62 172.84 1ao8 s HIS 153 N -1.84 -0.00 -0.07 4.92 -3.43 -1.03 -2.07 115.29 111.78 1ao8 s HIS 153 Ca 0.54 -0.21 -0.02 0.00 -0.80 0.00 0.00 55.06 54.56 1ao8 s HIS 153 Cb -0.14 0.02 0.03 0.00 -1.43 0.00 0.00 32.58 31.06 1ao8 s HIS 153 CO 0.19 -0.48 0.03 0.99 -2.00 0.00 0.00 174.74 173.48 1ao8 s THR 154 N -2.74 0.14 -0.17 -5.38 2.01 0.52 -1.37 115.64 108.65 1ao8 s THR 154 Ca -0.04 0.21 -0.29 0.00 0.31 0.00 0.00 61.69 61.88 1ao8 s THR 154 Cb -0.00 -0.39 -0.02 0.00 0.01 0.00 0.00 72.50 72.10 1ao8 s THR 154 CO -0.05 0.17 1.32 -0.31 -0.69 0.00 0.00 174.62 175.07 1ao8 s TYR 155 N 2.07 2.71 -0.11 4.92 2.02 -0.47 -2.02 117.35 126.46 1ao8 s TYR 155 Ca 0.05 0.89 0.01 0.00 -0.37 0.00 0.00 57.07 57.64 1ao8 s TYR 155 Cb -0.13 -3.61 -0.02 0.00 -0.40 0.00 0.00 41.96 37.81 1ao8 s TYR 155 CO -0.05 -1.98 -0.14 -1.21 -1.57 0.00 0.00 175.55 170.61 1ao8 s GLU 156 N 3.67 3.22 -0.38 -0.62 2.02 -0.65 -1.49 118.70 124.47 1ao8 s GLU 156 Ca 0.57 -0.69 -0.00 0.00 0.02 0.00 0.00 54.97 54.86 1ao8 s GLU 156 Cb -0.22 -2.57 0.10 0.00 0.10 0.00 0.00 34.13 31.54 1ao8 s GLU 156 CO 0.18 0.29 0.14 0.08 0.02 0.00 0.00 175.26 175.97 1ao8 s VAL 157 N 0.16 2.93 0.19 2.63 1.01 -0.33 -2.49 120.40 124.50 1ao8 s VAL 157 Ca -0.07 -2.13 -0.08 0.00 0.00 0.00 0.00 61.98 59.69 1ao8 s VAL 157 Cb -0.15 -3.04 -0.07 0.00 0.00 0.00 0.00 36.38 33.12 1ao8 s VAL 157 CO 0.05 -0.64 0.49 0.26 0.00 0.00 0.00 175.10 175.26 1ao8 s TRP 158 N 1.06 3.46 0.08 5.22 0.52 -1.01 -1.73 118.94 126.55 1ao8 s TRP 158 Ca 0.09 0.78 0.02 0.00 0.02 0.00 0.00 56.10 57.01 1ao8 s TRP 158 Cb -0.21 -2.18 -0.04 0.00 -1.15 0.00 0.00 33.47 29.89 1ao8 s TRP 158 CO -0.05 0.35 -0.07 -0.65 0.02 0.00 0.00 176.95 176.54 1ao8 s GLN 159 N -2.65 0.76 -0.57 4.98 -0.21 -0.87 -1.84 119.66 119.27 1ao8 s GLN 159 Ca 0.44 -1.17 -0.22 0.00 0.02 0.00 0.00 55.36 54.43 1ao8 s GLN 159 Cb -0.12 -0.27 0.06 0.00 1.00 0.00 0.00 33.01 33.68 1ao8 s GLN 159 CO 0.22 0.01 0.83 0.21 -2.12 0.00 0.00 175.29 174.44 1ao8 s LYS 160 N -3.16 3.19 0.41 2.91 2.20 -1.10 -1.99 119.74 122.20 1ao8 s LYS 160 Ca 0.06 -0.67 -0.26 0.00 -0.36 0.00 0.00 55.97 54.74 1ao8 s LYS 160 Cb 0.01 -4.12 -0.09 0.00 -1.51 0.00 0.00 37.83 32.11 1ao8 s LYS 160 CO -0.03 -1.49 1.33 -1.59 -0.36 0.00 0.00 175.35 173.21 1ao8 s LYS 161 N 3.48 3.94 0.00 4.03 -2.85 -1.26 -5.02 119.74 122.07 1ao8 s LYS 161 Ca 0.22 2.22 0.00 0.00 -1.00 0.00 0.00 55.97 57.41 1ao8 s LYS 161 Cb -0.16 -2.76 0.00 0.00 -2.06 0.00 0.00 37.83 32.85 1ao8 s LYS 161 CO 0.14 -0.54 0.00 0.00 0.10 0.00 0.00 175.35 175.05