#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 -1.97 0.74 2.41 0.00 -0.51 -3.90 121.76 118.53 1ao8 s ALA 2 Ca 0.00 2.38 -0.12 0.00 0.00 0.00 0.00 51.96 54.22 1ao8 s ALA 2 Cb 0.00 -1.52 0.04 0.00 0.00 0.00 0.00 23.12 21.64 1ao8 s ALA 2 CO 0.00 -0.44 1.09 -0.06 0.00 0.00 0.00 175.76 176.36 1ao8 s PHE 3 N 1.72 2.65 -0.30 0.00 0.40 -0.70 -2.23 117.98 119.52 1ao8 s PHE 3 Ca -0.09 1.54 -0.02 0.00 -0.60 0.00 0.00 56.93 57.76 1ao8 s PHE 3 Cb -0.05 -3.06 0.19 0.00 0.51 0.00 0.00 43.02 40.61 1ao8 s PHE 3 CO -0.19 -1.70 0.64 -1.17 0.70 0.00 0.00 175.22 173.50 1ao8 s LEU 4 N -5.62 -1.30 0.25 -0.37 2.96 -0.59 -1.53 118.68 112.48 1ao8 s LEU 4 Ca 0.62 0.81 -0.15 0.00 -0.22 0.00 0.00 54.13 55.18 1ao8 s LEU 4 Cb -0.18 2.09 0.00 0.00 0.50 0.00 0.00 46.19 48.61 1ao8 s LEU 4 CO 0.52 -0.24 0.55 -1.66 -1.32 0.00 0.00 176.35 174.19 1ao8 s TRP 5 N 2.87 0.18 -0.13 5.38 -2.14 -0.99 -4.26 118.94 119.85 1ao8 s TRP 5 Ca 0.19 -0.56 0.02 0.00 2.66 0.00 0.00 56.10 58.41 1ao8 s TRP 5 Cb -0.14 0.35 0.01 0.00 -3.10 0.00 0.00 33.47 30.58 1ao8 s TRP 5 CO -0.20 -1.05 -0.20 0.00 -2.66 0.00 0.00 176.95 172.83 1ao8 s ALA 6 N -3.98 2.07 0.35 2.67 0.00 -1.26 -2.14 121.76 119.47 1ao8 s ALA 6 Ca 0.18 -0.97 0.06 0.00 0.00 0.00 0.00 51.96 51.23 1ao8 s ALA 6 Cb -0.02 -0.93 -0.03 0.00 0.00 0.00 0.00 23.12 22.15 1ao8 s ALA 6 CO 0.08 -0.01 0.21 1.14 0.00 0.00 0.00 175.76 177.18 1ao8 s GLN 7 N 0.82 1.79 0.08 0.00 -2.07 -0.91 -4.41 119.66 114.96 1ao8 s GLN 7 Ca -0.08 -2.06 0.00 0.00 -1.82 0.00 0.00 55.36 51.40 1ao8 s GLN 7 Cb -0.16 -0.03 -0.00 0.00 -1.09 0.00 0.00 33.01 31.74 1ao8 s GLN 7 CO -0.01 -0.57 0.01 -0.40 -1.32 0.00 0.00 175.29 173.00 1ao8 n ASP 8 N -1.39 1.85 -0.24 12.60 5.68 -1.24 -1.97 116.55 131.83 1ao8 n ASP 8 Ca 0.02 -1.38 0.03 0.00 -0.50 0.00 0.00 54.79 52.96 1ao8 n ASP 8 Cb 0.63 0.10 0.26 0.00 -1.14 0.00 0.00 41.12 40.98 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 0.94 -0.10 0.11 0.11 -1.82 -2.58 114.38 111.04 1ao8 h ARG 9 Ca -0.07 -0.06 -0.04 0.00 0.10 0.00 0.00 59.98 59.92 1ao8 h ARG 9 Cb 0.22 -0.21 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 1ao8 h ARG 9 CO 0.11 0.62 -0.09 -0.44 0.10 0.00 0.00 179.97 180.28 1ao8 h ASP 10 N 0.97 0.24 0.00 0.08 3.32 -1.92 -3.48 116.42 115.64 1ao8 h ASP 10 Ca 0.32 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1ao8 h ASP 10 Cb 0.05 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1ao8 h ASP 10 CO -0.09 0.66 0.00 0.61 -1.72 0.00 0.00 179.24 178.70 1ao8 n GLY 11 N 0.18 1.10 3.81 2.75 0.00 -0.97 -5.09 105.19 106.96 1ao8 n GLY 11 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1ao8 n GLY 11 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ao8 s LEU 12 N 0.00 4.32 -0.13 0.99 2.96 -1.26 -3.47 118.68 122.09 1ao8 s LEU 12 Ca 0.00 0.45 0.18 0.00 -0.22 0.00 0.00 54.13 54.54 1ao8 s LEU 12 Cb 0.00 -2.17 0.44 0.00 0.50 0.00 0.00 46.19 44.96 1ao8 s LEU 12 CO 0.00 0.29 1.19 2.30 -1.32 0.00 0.00 176.35 178.80 1ao8 n ILE 13 N 2.66 1.22 0.00 6.68 -5.35 -0.97 -3.68 119.36 119.92 1ao8 n ILE 13 Ca -0.17 -2.36 0.00 0.00 -0.27 0.00 0.00 62.75 59.95 1ao8 n ILE 13 Cb 0.53 0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.79 1ao8 n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ao8 n GLY 14 N -0.35 3.32 3.04 3.28 0.00 -1.25 -4.86 105.19 108.36 1ao8 n GLY 14 Ca 0.15 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 45.16 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 -2.10 0.35 -1.81 1.61 2.20 0.13 -3.17 119.74 116.94 1ao8 s LYS 15 Ca 0.00 0.72 0.00 0.00 -0.36 0.00 0.00 55.97 56.33 1ao8 s LYS 15 Cb 0.00 -0.17 0.00 0.00 -1.51 0.00 0.00 37.83 36.15 1ao8 s LYS 15 CO 0.00 -0.51 0.00 -0.25 -0.36 0.00 0.00 175.35 174.23 1ao8 n ASP 16 N 5.38 -5.69 0.00 1.43 9.92 -1.26 -1.82 116.55 124.51 1ao8 n ASP 16 Ca -0.05 0.09 0.00 0.00 -0.53 0.00 0.00 54.79 54.30 1ao8 n ASP 16 Cb 0.50 -4.79 0.00 0.00 -0.64 0.00 0.00 41.12 36.19 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 -0.88 2.60 3.98 0.44 0.00 -1.26 -5.00 105.19 105.06 1ao8 n GLY 17 Ca -0.23 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 44.95 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 2.96 0.43 1.61 -3.43 -0.76 -4.87 115.29 110.79 1ao8 s HIS 18 Ca 0.00 -0.03 -0.21 0.00 -0.80 0.00 0.00 55.06 54.01 1ao8 s HIS 18 Cb 0.00 -2.53 -0.10 0.00 -1.43 0.00 0.00 32.58 28.52 1ao8 s HIS 18 CO 0.00 -0.61 0.98 -0.51 -2.00 0.00 0.00 174.74 172.61 1ao8 s LEU 19 N -4.60 3.96 0.04 5.38 1.43 -1.26 0.19 118.68 123.83 1ao8 s LEU 19 Ca 0.54 1.80 -0.16 0.00 -1.03 0.00 0.00 54.13 55.28 1ao8 s LEU 19 Cb -0.10 -4.47 -0.31 0.00 0.03 0.00 0.00 46.19 41.34 1ao8 s LEU 19 CO 0.37 -0.46 1.07 1.55 0.23 0.00 0.00 176.35 179.10 1ao8 h PRO 20 N 1.97 0.60 0.00 1.29 0.13 -1.87 -3.45 132.00 130.66 1ao8 h PRO 20 Ca -0.49 -0.85 -0.25 0.00 -0.87 0.00 0.00 66.00 63.54 1ao8 h PRO 20 Cb 1.20 0.29 0.01 0.00 0.13 0.00 0.00 31.00 32.62 1ao8 h PRO 20 CO 0.61 1.39 -0.05 -2.67 -0.23 0.00 0.00 178.00 177.05 1ao8 n TRP 21 N -3.80 -2.37 -3.47 1.56 2.14 -1.26 -5.11 117.44 105.14 1ao8 n TRP 21 Ca -0.15 -1.09 -0.26 0.00 2.07 0.00 0.00 57.50 58.07 1ao8 n TRP 21 Cb 1.00 -0.27 -0.12 0.00 -0.81 0.00 0.00 31.31 31.11 1ao8 n TRP 21 CO 0.00 0.00 0.00 -1.58 2.07 0.00 0.00 177.69 178.18 1ao8 s HIS 22 N -0.92 0.28 -0.20 -2.67 2.46 -1.26 -5.11 115.29 107.86 1ao8 s HIS 22 Ca 0.28 -1.06 0.00 0.00 0.47 0.00 0.00 55.06 54.76 1ao8 s HIS 22 Cb -0.02 -0.77 0.02 0.00 -0.13 0.00 0.00 32.58 31.68 1ao8 s HIS 22 CO 0.18 -0.86 -0.15 -1.17 -2.47 0.00 0.00 174.74 170.27 1ao8 s LEU 23 N 1.65 2.54 0.13 8.88 2.96 -1.26 -4.98 118.68 128.60 1ao8 s LEU 23 Ca 0.14 -0.74 0.06 0.00 -0.22 0.00 0.00 54.13 53.37 1ao8 s LEU 23 Cb -0.18 -1.55 -0.15 0.00 0.50 0.00 0.00 46.19 44.81 1ao8 s LEU 23 CO -0.17 -0.04 1.31 1.55 -1.32 0.00 0.00 176.35 177.67 1ao8 h PRO 24 N 7.95 0.03 -0.72 0.98 0.13 -1.99 -3.22 132.00 135.15 1ao8 h PRO 24 Ca -0.40 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 64.62 1ao8 h PRO 24 Cb 1.13 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 1ao8 h PRO 24 CO 0.60 0.98 0.19 0.22 -0.23 0.00 0.00 178.00 179.76 1ao8 h ASP 25 N 0.01 1.08 0.50 1.44 1.82 -1.98 -1.80 116.42 117.49 1ao8 h ASP 25 Ca -0.02 -0.23 -0.10 0.00 -0.39 0.00 0.00 57.03 56.29 1ao8 h ASP 25 Cb 1.71 -0.29 -0.01 0.00 0.68 0.00 0.00 39.33 41.42 1ao8 h ASP 25 CO 0.13 1.03 -0.47 -0.78 -1.61 0.00 0.00 179.24 177.54 1ao8 h ASP 26 N 1.09 0.00 0.12 2.28 3.58 -2.00 -2.85 116.42 118.64 1ao8 h ASP 26 Ca 0.23 0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.51 1ao8 h ASP 26 Cb 0.36 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 1ao8 h ASP 26 CO 0.00 0.47 -0.60 -0.07 -2.88 0.00 0.00 179.24 176.16 1ao8 h LEU 27 N 0.00 0.54 -0.86 2.28 3.38 -1.43 -2.69 115.31 116.53 1ao8 h LEU 27 Ca -0.00 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 1ao8 h LEU 27 Cb 0.84 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1ao8 h LEU 27 CO 0.06 1.01 0.38 0.45 0.09 0.00 0.00 178.44 180.43 1ao8 h HIS 28 N 0.36 1.21 -0.25 1.13 3.86 -1.11 -2.10 115.15 118.25 1ao8 h HIS 28 Ca -0.00 -0.07 -0.12 0.00 -1.16 0.00 0.00 60.37 59.02 1ao8 h HIS 28 Cb 1.14 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 29.23 1ao8 h HIS 28 CO 0.04 0.89 -0.33 -0.92 0.86 0.00 0.00 177.93 178.47 1ao8 h TYR 29 N 1.19 0.62 -0.43 2.45 3.20 -1.44 -2.27 116.97 120.28 1ao8 h TYR 29 Ca 0.28 -0.16 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 1ao8 h TYR 29 Cb 0.15 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 1ao8 h TYR 29 CO 0.02 0.80 0.19 0.35 -1.64 0.00 0.00 178.16 177.88 1ao8 h PHE 30 N 0.45 0.64 -0.22 -3.82 3.57 -1.08 0.74 116.94 117.23 1ao8 h PHE 30 Ca 0.05 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.44 1ao8 h PHE 30 Cb 0.80 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1ao8 h PHE 30 CO 0.03 0.54 -0.19 -0.09 -2.23 0.00 0.00 178.31 176.37 1ao8 h ARG 31 N 0.56 0.38 -0.00 1.11 2.43 -1.27 -2.41 114.38 115.18 1ao8 h ARG 31 Ca 0.15 -0.12 -0.15 0.00 -0.81 0.00 0.00 59.98 59.05 1ao8 h ARG 31 Cb 0.16 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1ao8 h ARG 31 CO -0.02 0.56 -0.71 0.00 -1.51 0.00 0.00 179.97 178.30 1ao8 h ALA 32 N 1.46 0.83 -0.92 2.80 0.00 -0.90 -2.75 119.26 119.78 1ao8 h ALA 32 Ca 0.06 -0.64 -0.56 0.00 0.00 0.00 0.00 54.91 53.77 1ao8 h ALA 32 Cb 0.54 -0.11 -0.27 0.00 0.00 0.00 0.00 17.79 17.94 1ao8 h ALA 32 CO 0.04 0.88 0.72 1.04 0.00 0.00 0.00 179.25 181.93 1ao8 n GLN 33 N -3.70 2.38 0.00 0.00 1.13 0.21 -4.34 117.38 113.06 1ao8 n GLN 33 Ca -0.01 -2.91 0.00 0.00 -1.94 0.00 0.00 57.00 52.14 1ao8 n GLN 33 Cb 0.69 -2.14 0.00 0.00 0.11 0.00 0.00 30.24 28.90 1ao8 n GLN 33 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1ao8 n THR 34 N -0.85 0.00 -1.75 5.09 -2.24 -1.10 -4.98 114.28 108.45 1ao8 n THR 34 Ca 0.57 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.93 1ao8 n THR 34 Cb 1.05 -0.21 -0.02 0.00 -2.10 0.00 0.00 70.33 69.04 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 -1.53 2.05 -0.58 2.28 -7.23 -1.04 -1.82 120.40 112.53 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 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 33.92 1ao8 s VAL 35 CO 0.00 0.00 0.02 0.61 -0.31 0.00 0.00 175.10 175.42 1ao8 n GLY 36 N 3.05 0.11 2.35 2.32 0.00 -1.26 -5.01 105.19 106.74 1ao8 n GLY 36 Ca 0.12 -0.59 -0.09 0.00 0.00 0.00 0.00 46.02 45.46 1ao8 n GLY 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ao8 n LYS 37 N -1.67 0.55 -3.60 1.61 5.02 -0.75 -4.65 118.16 114.67 1ao8 n LYS 37 Ca -0.08 -1.81 -0.40 0.00 -2.02 0.00 0.00 58.31 54.01 1ao8 n LYS 37 Cb 0.56 1.84 -0.09 0.00 -0.02 0.00 0.00 35.03 37.32 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 -2.62 4.11 -0.53 -0.18 1.01 -0.79 -3.41 121.20 118.78 1ao8 s ILE 38 Ca 0.18 -1.64 -0.28 0.00 0.00 0.00 0.00 60.65 58.90 1ao8 s ILE 38 Cb -0.01 -3.63 0.03 0.00 0.01 0.00 0.00 42.46 38.86 1ao8 s ILE 38 CO 0.13 -0.64 1.15 -0.32 0.00 0.00 0.00 174.94 175.25 1ao8 s MET 39 N 1.36 3.61 -0.27 2.79 1.75 -0.84 -1.80 119.30 125.90 1ao8 s MET 39 Ca 0.05 0.38 -0.16 0.00 -1.25 0.00 0.00 55.69 54.71 1ao8 s MET 39 Cb -0.24 -3.96 -0.03 0.00 2.84 0.00 0.00 34.83 33.43 1ao8 s MET 39 CO 0.00 -1.52 0.42 0.08 -0.65 0.00 0.00 175.02 173.35 1ao8 s VAL 40 N 4.65 5.14 0.04 10.11 1.01 -0.13 -1.65 120.40 139.56 1ao8 s VAL 40 Ca 0.45 0.65 -0.00 0.00 0.00 0.00 0.00 61.98 63.07 1ao8 s VAL 40 Cb -0.07 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1ao8 s VAL 40 CO 0.28 0.11 -0.04 0.68 0.00 0.00 0.00 175.10 176.14 1ao8 s VAL 41 N 2.16 0.23 0.00 2.92 -7.23 -0.83 -2.45 120.40 115.20 1ao8 s VAL 41 Ca 0.17 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 1ao8 s VAL 41 Cb -0.16 -0.84 0.00 0.00 0.56 0.00 0.00 36.38 35.94 1ao8 s VAL 41 CO 0.10 -0.69 0.00 0.61 -0.31 0.00 0.00 175.10 174.81 1ao8 n GLY 42 N 0.95 0.45 0.09 2.32 0.00 -0.21 -2.18 105.19 106.61 1ao8 n GLY 42 Ca -0.20 -1.82 -0.12 0.00 0.00 0.00 0.00 46.02 43.88 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 0.12 -0.00 1.61 2.43 -1.91 -1.86 114.38 114.77 1ao8 h ARG 43 Ca 0.00 -0.21 -0.10 0.00 -0.81 0.00 0.00 59.98 58.85 1ao8 h ARG 43 Cb 0.00 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1ao8 h ARG 43 CO 0.00 0.96 -0.49 -0.09 -1.51 0.00 0.00 179.97 178.84 1ao8 h ARG 44 N 0.03 0.00 0.04 0.20 2.43 -1.95 -2.48 114.38 112.66 1ao8 h ARG 44 Ca -0.17 -0.00 -0.31 0.00 -0.81 0.00 0.00 59.98 58.68 1ao8 h ARG 44 Cb 1.94 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 31.45 1ao8 h ARG 44 CO 0.14 0.50 -1.77 1.15 -1.51 0.00 0.00 179.97 178.47 1ao8 h THR 45 N 0.00 0.80 -0.39 0.20 2.02 -1.90 -3.20 112.91 110.44 1ao8 h THR 45 Ca -0.00 -2.61 -0.05 0.00 0.77 0.00 0.00 66.41 64.51 1ao8 h THR 45 Cb 0.88 2.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.73 1ao8 h THR 45 CO 0.06 0.62 0.02 0.22 0.37 0.00 0.00 175.52 176.81 1ao8 h TYR 46 N 0.02 0.64 0.00 3.16 3.20 -1.27 -2.27 116.97 120.45 1ao8 h TYR 46 Ca -0.32 -0.07 -0.10 0.00 3.14 0.00 0.00 58.73 61.38 1ao8 h TYR 46 Cb 2.02 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 40.09 1ao8 h TYR 46 CO 0.02 0.61 -0.46 0.93 -1.64 0.00 0.00 178.16 177.62 1ao8 h GLU 47 N 0.59 0.00 -0.13 1.82 5.08 -1.58 -3.20 114.58 117.16 1ao8 h GLU 47 Ca 0.12 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 1ao8 h GLU 47 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1ao8 h GLU 47 CO 0.01 0.46 -0.06 0.77 -1.00 0.00 0.00 179.01 179.19 1ao8 h SER 48 N 0.00 0.18 -4.20 1.42 0.02 -1.40 -3.43 113.55 106.14 1ao8 h SER 48 Ca -0.00 -0.02 -0.52 0.00 -0.84 0.00 0.00 61.79 60.40 1ao8 h SER 48 Cb 1.31 -0.05 0.13 0.00 0.14 0.00 0.00 62.40 63.94 1ao8 h SER 48 CO 0.06 0.27 0.37 -0.36 -1.14 0.00 0.00 176.83 176.03 1ao8 s PHE 49 N -4.87 2.30 -0.10 3.45 0.08 -1.19 -4.99 117.98 112.65 1ao8 s PHE 49 Ca -0.05 1.59 -0.02 0.00 0.12 0.00 0.00 56.93 58.57 1ao8 s PHE 49 Cb 0.16 -3.31 -0.01 0.00 -0.57 0.00 0.00 43.02 39.28 1ao8 s PHE 49 CO 0.71 -2.18 0.01 -1.00 -0.10 0.00 0.00 175.22 172.67 1ao8 h PRO 50 N -0.27 0.00 -4.69 0.24 0.13 -1.89 -3.44 132.00 122.07 1ao8 h PRO 50 Ca -0.47 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.98 1ao8 h PRO 50 Cb 1.27 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.21 1ao8 h PRO 50 CO 0.51 0.04 -0.44 0.21 -0.23 0.00 0.00 178.00 178.08 1ao8 s LYS 51 N -1.62 3.38 -0.09 0.86 2.47 -1.26 -5.06 119.74 118.41 1ao8 s LYS 51 Ca -0.02 -0.71 0.03 0.00 -1.56 0.00 0.00 55.97 53.71 1ao8 s LYS 51 Cb 0.00 -3.85 -0.01 0.00 -1.46 0.00 0.00 37.83 32.51 1ao8 s LYS 51 CO 0.04 -0.53 -0.18 1.03 0.16 0.00 0.00 175.35 175.87 1ao8 s ARG 52 N 1.75 2.93 0.61 4.03 0.52 -1.26 -3.60 118.95 123.93 1ao8 s ARG 52 Ca 0.06 -0.77 -0.08 0.00 -0.52 0.00 0.00 55.73 54.43 1ao8 s ARG 52 Cb -0.18 -2.41 -0.00 0.00 0.52 0.00 0.00 34.95 32.88 1ao8 s ARG 52 CO 0.11 0.34 0.95 -1.25 0.02 0.00 0.00 175.30 175.47 1ao8 s PRO 53 N -0.02 3.09 -0.14 3.54 0.04 -1.26 -5.07 135.00 135.17 1ao8 s PRO 53 Ca -0.05 0.24 -0.29 0.00 0.04 0.00 0.00 61.00 60.93 1ao8 s PRO 53 Cb -0.14 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 1ao8 s PRO 53 CO 0.05 -0.69 1.16 -0.51 0.04 0.00 0.00 177.00 177.04 1ao8 s LEU 54 N -5.07 4.20 0.92 -3.56 1.43 -1.24 -5.03 118.68 110.33 1ao8 s LEU 54 Ca 0.54 1.63 -0.14 0.00 -1.03 0.00 0.00 54.13 55.12 1ao8 s LEU 54 Cb -0.11 -3.55 0.16 0.00 0.03 0.00 0.00 46.19 42.72 1ao8 s LEU 54 CO 0.48 -0.65 1.24 -2.16 0.23 0.00 0.00 176.35 175.49 1ao8 s PRO 55 N 2.87 1.06 -1.75 1.29 0.04 -1.26 -4.19 135.00 133.05 1ao8 s PRO 55 Ca 0.52 -0.14 0.00 0.00 0.04 0.00 0.00 61.00 61.42 1ao8 s PRO 55 Cb -0.20 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1ao8 s PRO 55 CO 0.15 -2.17 0.00 0.39 0.04 0.00 0.00 177.00 175.41 1ao8 n GLU 56 N -3.66 -1.56 -3.63 4.56 -0.58 -1.26 -4.92 120.64 109.58 1ao8 n GLU 56 Ca 0.12 0.99 -0.03 0.00 -0.42 0.00 0.00 57.16 57.82 1ao8 n GLU 56 Cb 0.60 -5.57 -0.03 0.00 -0.57 0.00 0.00 31.44 25.87 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 -4.84 0.10 0.08 3.49 1.70 -1.26 -4.34 118.95 113.87 1ao8 s ARG 57 Ca 0.00 -0.02 -0.21 0.00 -0.47 0.00 0.00 55.73 55.03 1ao8 s ARG 57 Cb 0.00 0.04 -0.07 0.00 -0.57 0.00 0.00 34.95 34.36 1ao8 s ARG 57 CO 0.00 -0.04 0.63 0.99 -1.08 0.00 0.00 175.30 175.80 1ao8 s THR 58 N -1.78 4.69 0.07 4.99 2.01 -1.22 -4.91 115.64 119.50 1ao8 s THR 58 Ca 0.10 1.35 0.09 0.00 0.31 0.00 0.00 61.69 63.54 1ao8 s THR 58 Cb -0.01 -3.97 -0.03 0.00 0.01 0.00 0.00 72.50 68.50 1ao8 s THR 58 CO -0.04 0.51 -0.21 0.20 -0.69 0.00 0.00 174.62 174.38 1ao8 s ASN 59 N -0.86 3.62 -0.26 3.53 0.01 -1.26 -1.98 114.94 117.74 1ao8 s ASN 59 Ca 0.31 -0.54 -0.04 0.00 -0.71 0.00 0.00 52.86 51.89 1ao8 s ASN 59 Cb -0.20 -0.47 0.09 0.00 0.41 0.00 0.00 41.25 41.08 1ao8 s ASN 59 CO 0.20 0.23 0.14 -0.69 -1.51 0.00 0.00 177.10 175.47 1ao8 s VAL 60 N -0.97 -0.12 -0.06 1.60 1.01 -0.66 -1.79 120.40 119.42 1ao8 s VAL 60 Ca 0.15 -0.56 -0.22 0.00 0.00 0.00 0.00 61.98 61.34 1ao8 s VAL 60 Cb -0.10 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 1ao8 s VAL 60 CO 0.06 -0.58 0.66 -0.69 0.00 0.00 0.00 175.10 174.55 1ao8 s VAL 61 N 2.14 5.03 -0.37 2.92 1.01 -0.63 -1.96 120.40 128.54 1ao8 s VAL 61 Ca 0.07 1.36 -0.03 0.00 0.00 0.00 0.00 61.98 63.38 1ao8 s VAL 61 Cb -0.16 -4.00 0.09 0.00 0.00 0.00 0.00 36.38 32.31 1ao8 s VAL 61 CO -0.29 0.30 0.14 -0.22 0.00 0.00 0.00 175.10 175.03 1ao8 s LEU 62 N 0.57 4.82 0.41 3.92 2.96 -0.93 -1.91 118.68 128.52 1ao8 s LEU 62 Ca 0.35 -1.75 0.06 0.00 -0.22 0.00 0.00 54.13 52.57 1ao8 s LEU 62 Cb -0.18 -1.80 -0.07 0.00 0.50 0.00 0.00 46.19 44.64 1ao8 s LEU 62 CO 0.17 -0.45 0.01 0.28 -1.32 0.00 0.00 176.35 175.05 1ao8 s THR 63 N 1.19 1.86 -0.48 3.68 -1.32 -1.24 -4.29 115.64 115.05 1ao8 s THR 63 Ca 0.04 -2.00 0.03 0.00 -1.21 0.00 0.00 61.69 58.55 1ao8 s THR 63 Cb -0.22 -2.92 0.48 0.00 -1.51 0.00 0.00 72.50 68.33 1ao8 s THR 63 CO -0.03 0.00 1.69 0.00 -2.21 0.00 0.00 174.62 174.08 1ao8 n HIS 64 N -0.96 2.77 -3.81 9.09 1.44 -1.26 -4.65 115.22 117.85 1ao8 n HIS 64 Ca -0.06 -2.48 -0.12 0.00 -2.01 0.00 0.00 57.72 53.05 1ao8 n HIS 64 Cb 0.67 -0.94 -0.11 0.00 0.12 0.00 0.00 29.99 29.72 1ao8 n HIS 64 CO 0.00 0.00 0.00 -1.14 -2.81 0.00 0.00 176.34 172.39 1ao8 s GLN 65 N -3.63 0.30 -0.40 -1.40 0.74 -1.26 -5.03 119.66 108.97 1ao8 s GLN 65 Ca 0.57 0.17 0.06 0.00 0.05 0.00 0.00 55.36 56.21 1ao8 s GLN 65 Cb 0.46 0.14 0.68 0.00 1.10 0.00 0.00 33.01 35.39 1ao8 s GLN 65 CO 0.02 -0.05 1.87 0.39 -0.55 0.00 0.00 175.29 176.97 1ao8 n GLU 66 N 2.67 2.67 -0.04 1.67 1.02 -1.26 -4.20 120.64 123.18 1ao8 n GLU 66 Ca -0.14 -2.97 -0.03 0.00 -0.02 0.00 0.00 57.16 53.99 1ao8 n GLU 66 Cb 0.58 -2.17 -0.06 0.00 -0.02 0.00 0.00 31.44 29.77 1ao8 n GLU 66 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1ao8 n ASP 67 N -0.82 3.12 -4.76 1.62 9.92 -1.26 -5.00 116.55 119.37 1ao8 n ASP 67 Ca 0.53 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 54.38 1ao8 n ASP 67 Cb 1.57 0.73 -0.01 0.00 -0.64 0.00 0.00 41.12 42.77 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 -2.21 2.77 0.05 1.24 5.04 -1.26 -5.01 117.35 117.98 1ao8 s TYR 68 Ca -0.04 1.00 0.06 0.00 -2.44 0.00 0.00 57.07 55.65 1ao8 s TYR 68 Cb 0.02 -3.98 -0.03 0.00 0.35 0.00 0.00 41.96 38.33 1ao8 s TYR 68 CO 0.31 -3.09 -0.17 -0.65 -1.34 0.00 0.00 175.55 170.62 1ao8 s GLN 69 N -1.09 1.06 -0.10 4.97 -1.52 -1.26 -5.08 119.66 116.64 1ao8 s GLN 69 Ca 0.58 -0.90 -0.05 0.00 -1.95 0.00 0.00 55.36 53.05 1ao8 s GLN 69 Cb -0.46 -1.13 0.05 0.00 -0.22 0.00 0.00 33.01 31.25 1ao8 s GLN 69 CO 0.52 0.28 0.22 0.00 -0.25 0.00 0.00 175.29 176.06 1ao8 s ALA 70 N -0.95 -0.47 -0.48 6.09 0.00 -1.26 -5.11 121.76 119.57 1ao8 s ALA 70 Ca 0.03 0.90 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 1ao8 s ALA 70 Cb -0.09 -0.62 0.10 0.00 0.00 0.00 0.00 23.12 22.51 1ao8 s ALA 70 CO 0.02 -0.23 0.39 -0.65 0.00 0.00 0.00 175.76 175.30 1ao8 s GLN 71 N 1.34 2.82 0.00 0.00 -0.21 -1.26 -4.30 119.66 118.06 1ao8 s GLN 71 Ca -0.08 -1.56 0.00 0.00 0.02 0.00 0.00 55.36 53.74 1ao8 s GLN 71 Cb -0.11 -4.08 0.00 0.00 1.00 0.00 0.00 33.01 29.82 1ao8 s GLN 71 CO -0.08 -1.14 0.00 0.41 -2.12 0.00 0.00 175.29 172.36 1ao8 n GLY 72 N 5.11 2.38 3.59 3.09 0.00 -1.26 -4.76 105.19 113.35 1ao8 n GLY 72 Ca -0.12 -0.38 -0.28 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 -0.21 3.00 -0.07 4.61 0.00 -1.26 -4.80 121.76 123.03 1ao8 s ALA 73 Ca 0.00 -1.37 -0.26 0.00 0.00 0.00 0.00 51.96 50.33 1ao8 s ALA 73 Cb 0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 1ao8 s ALA 73 CO 0.00 0.54 0.82 0.08 0.00 0.00 0.00 175.76 177.20 1ao8 s VAL 74 N -1.52 4.95 -0.29 0.00 1.01 -0.74 -4.79 120.40 119.01 1ao8 s VAL 74 Ca 0.24 1.69 -0.08 0.00 0.00 0.00 0.00 61.98 63.82 1ao8 s VAL 74 Cb -0.10 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 1ao8 s VAL 74 CO 0.15 0.16 0.11 -0.69 0.00 0.00 0.00 175.10 174.84 1ao8 s VAL 75 N 1.23 4.39 0.20 2.92 1.01 -1.26 -1.60 120.40 127.29 1ao8 s VAL 75 Ca 0.42 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 62.06 1ao8 s VAL 75 Cb -0.18 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1ao8 s VAL 75 CO 0.19 0.14 0.08 0.68 0.00 0.00 0.00 175.10 176.20 1ao8 s VAL 76 N 1.59 4.07 -0.12 2.92 -7.23 -0.80 -4.97 120.40 115.85 1ao8 s VAL 76 Ca 0.05 -1.39 0.22 0.00 -1.81 0.00 0.00 61.98 59.05 1ao8 s VAL 76 Cb -0.17 -3.11 0.45 0.00 0.56 0.00 0.00 36.38 34.12 1ao8 s VAL 76 CO 0.05 -0.20 1.16 1.41 -0.31 0.00 0.00 175.10 177.21 1ao8 n HIS 77 N -0.52 0.55 -3.68 2.82 8.25 -1.26 -3.60 115.22 117.78 1ao8 n HIS 77 Ca -0.08 -1.21 -0.09 0.00 -0.26 0.00 0.00 57.72 56.07 1ao8 n HIS 77 Cb 0.56 -0.20 -0.10 0.00 1.12 0.00 0.00 29.99 31.37 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 -2.78 -0.61 0.23 0.41 2.15 -1.26 -5.02 116.67 109.79 1ao8 s ASP 78 Ca 0.34 1.04 -0.06 0.00 0.43 0.00 0.00 52.55 54.30 1ao8 s ASP 78 Cb 0.37 0.96 0.21 0.00 -0.30 0.00 0.00 42.92 44.16 1ao8 s ASP 78 CO -0.11 -0.21 1.79 0.58 -0.17 0.00 0.00 175.17 177.06 1ao8 h VAL 79 N 5.47 1.25 -0.13 1.11 2.07 -1.99 -2.06 116.25 121.98 1ao8 h VAL 79 Ca -0.34 -0.83 -0.07 0.00 0.82 0.00 0.00 66.70 66.28 1ao8 h VAL 79 Cb 1.19 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1ao8 h VAL 79 CO 0.25 0.33 -0.23 0.00 0.02 0.00 0.00 177.57 177.95 1ao8 h ALA 80 N 1.21 1.37 -0.24 1.67 0.00 -2.00 -2.51 119.26 118.76 1ao8 h ALA 80 Ca 0.25 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1ao8 h ALA 80 Cb 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ao8 h ALA 80 CO -0.02 0.44 -0.38 0.00 0.00 0.00 0.00 179.25 179.29 1ao8 h ALA 81 N 1.55 0.89 -0.27 0.00 0.00 -1.80 -0.74 119.26 118.90 1ao8 h ALA 81 Ca 0.04 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1ao8 h ALA 81 Cb 0.53 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1ao8 h ALA 81 CO 0.04 0.63 0.10 0.28 0.00 0.00 0.00 179.25 180.30 1ao8 h VAL 82 N 0.45 1.18 -0.23 0.00 2.07 -1.00 0.14 116.25 118.87 1ao8 h VAL 82 Ca 0.04 -0.57 -0.14 0.00 0.82 0.00 0.00 66.70 66.85 1ao8 h VAL 82 Cb 0.87 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1ao8 h VAL 82 CO 0.07 0.19 -0.45 -0.26 0.02 0.00 0.00 177.57 177.14 1ao8 h PHE 83 N 0.28 0.70 -0.18 1.57 0.04 -1.43 -2.94 116.94 114.98 1ao8 h PHE 83 Ca 0.09 -0.22 -0.11 0.00 2.80 0.00 0.00 57.97 60.53 1ao8 h PHE 83 Cb 0.20 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1ao8 h PHE 83 CO -0.00 0.92 -0.37 0.00 -0.60 0.00 0.00 178.31 178.26 1ao8 h ALA 84 N 1.04 1.04 -0.33 2.45 0.00 -0.89 -2.72 119.26 119.85 1ao8 h ALA 84 Ca 0.03 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1ao8 h ALA 84 Cb 0.97 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1ao8 h ALA 84 CO 0.09 0.59 0.07 -0.92 0.00 0.00 0.00 179.25 179.08 1ao8 h TYR 85 N 0.32 0.49 -0.01 0.00 3.20 -0.54 -1.69 116.97 118.74 1ao8 h TYR 85 Ca 0.03 -0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.75 1ao8 h TYR 85 Cb 0.80 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 1ao8 h TYR 85 CO 0.02 0.43 -0.59 0.00 -1.64 0.00 0.00 178.16 176.39 1ao8 h ALA 86 N 1.61 1.01 -0.46 1.82 0.00 -1.41 -3.06 119.26 118.77 1ao8 h ALA 86 Ca 0.11 -0.54 -0.09 0.00 0.00 0.00 0.00 54.91 54.40 1ao8 h ALA 86 Cb 0.20 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ao8 h ALA 86 CO -0.00 0.74 -0.06 0.87 0.00 0.00 0.00 179.25 180.79 1ao8 h LYS 87 N 0.02 0.85 -0.02 0.00 1.57 -1.17 -2.64 116.57 115.17 1ao8 h LYS 87 Ca -0.01 -0.30 -0.03 0.00 -1.87 0.00 0.00 60.65 58.44 1ao8 h LYS 87 Cb 1.05 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 1ao8 h LYS 87 CO 0.08 0.93 -0.13 1.96 -0.57 0.00 0.00 179.45 181.71 1ao8 h GLN 88 N 0.69 0.03 -3.71 3.15 7.50 -1.40 -3.33 115.11 118.04 1ao8 h GLN 88 Ca 0.12 -0.00 -0.67 0.00 0.50 0.00 0.00 58.65 58.60 1ao8 h GLN 88 Cb 0.59 -0.00 -0.38 0.00 0.05 0.00 0.00 27.48 27.73 1ao8 h GLN 88 CO 0.04 0.16 -0.53 -1.01 -1.50 0.00 0.00 178.83 175.99 1ao8 s HIS 89 N -4.75 3.37 0.18 2.96 3.76 -1.00 -4.91 115.29 114.90 1ao8 s HIS 89 Ca -0.04 -2.91 0.08 0.00 -0.15 0.00 0.00 55.06 52.03 1ao8 s HIS 89 Cb 0.16 -3.02 -0.00 0.00 1.11 0.00 0.00 32.58 30.83 1ao8 s HIS 89 CO 0.70 -0.82 1.40 -1.00 -0.85 0.00 0.00 174.74 174.16 1ao8 h PRO 90 N 6.96 0.01 -0.04 8.40 0.14 -1.68 -3.20 132.00 142.59 1ao8 h PRO 90 Ca -0.06 -0.01 -0.09 0.00 0.14 0.00 0.00 66.00 65.98 1ao8 h PRO 90 Cb 0.94 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.07 1ao8 h PRO 90 CO 0.68 0.86 -0.42 0.38 0.14 0.00 0.00 178.00 179.65 1ao8 h ASP 91 N 0.00 0.08 -2.67 1.44 3.04 -1.91 -3.43 116.42 112.97 1ao8 h ASP 91 Ca -0.01 -0.03 -0.47 0.00 -3.24 0.00 0.00 57.03 53.28 1ao8 h ASP 91 Cb 1.52 -0.02 0.01 0.00 -1.04 0.00 0.00 39.33 39.80 1ao8 h ASP 91 CO 0.11 0.49 -0.21 -1.10 -2.04 0.00 0.00 179.24 176.49 1ao8 s GLN 92 N -4.10 3.40 0.14 4.15 -0.21 -1.21 -5.01 119.66 116.83 1ao8 s GLN 92 Ca -0.03 -0.44 0.10 0.00 0.02 0.00 0.00 55.36 55.01 1ao8 s GLN 92 Cb 0.14 -2.68 -0.04 0.00 1.00 0.00 0.00 33.01 31.43 1ao8 s GLN 92 CO 0.75 0.11 -0.23 -1.21 -2.12 0.00 0.00 175.29 172.59 1ao8 s GLU 93 N -4.31 1.32 -0.05 2.91 0.41 -1.26 -4.93 118.70 112.79 1ao8 s GLU 93 Ca 0.41 -1.34 -0.26 0.00 -0.41 0.00 0.00 54.97 53.37 1ao8 s GLU 93 Cb -0.10 -1.62 -0.03 0.00 -1.78 0.00 0.00 34.13 30.60 1ao8 s GLU 93 CO 0.35 0.37 0.81 -1.17 -0.49 0.00 0.00 175.26 175.12 1ao8 s LEU 94 N -2.26 4.33 -0.08 1.80 2.96 -1.26 -1.89 118.68 122.27 1ao8 s LEU 94 Ca 0.13 1.35 0.05 0.00 -0.22 0.00 0.00 54.13 55.44 1ao8 s LEU 94 Cb -0.09 -3.26 -0.00 0.00 0.50 0.00 0.00 46.19 43.34 1ao8 s LEU 94 CO 0.06 -0.18 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.00 1ao8 s VAL 95 N 0.95 1.90 -0.30 1.68 1.01 -0.75 -1.42 120.40 123.46 1ao8 s VAL 95 Ca 0.43 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 1ao8 s VAL 95 Cb -0.19 -1.63 -0.00 0.00 0.00 0.00 0.00 36.38 34.56 1ao8 s VAL 95 CO 0.21 0.53 0.12 -0.63 0.00 0.00 0.00 175.10 175.33 1ao8 s ILE 96 N 0.17 4.38 -0.12 2.22 -1.09 -0.95 -0.95 121.20 124.86 1ao8 s ILE 96 Ca -0.12 -0.48 0.14 0.00 -2.23 0.00 0.00 60.65 57.95 1ao8 s ILE 96 Cb -0.16 -3.23 -0.19 0.00 -1.58 0.00 0.00 42.46 37.31 1ao8 s ILE 96 CO 0.06 0.09 0.10 0.00 -1.23 0.00 0.00 174.94 173.97 1ao8 n ALA 97 N 4.94 1.81 0.00 9.38 0.00 -1.03 -1.54 120.51 134.07 1ao8 n ALA 97 Ca -0.14 -0.87 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1ao8 n ALA 97 Cb 0.49 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.79 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 2.00 -1.32 0.00 0.00 0.00 -1.26 -4.83 105.19 99.79 1ao8 n GLY 98 Ca -0.20 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.57 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 -0.64 0.30 -0.02 0.00 -1.26 -1.04 105.19 102.52 1ao8 n GLY 99 Ca 0.00 -1.58 -0.05 0.00 0.00 0.00 0.00 46.02 44.39 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 1.08 -0.27 4.61 0.00 -1.92 -2.11 119.26 118.64 1ao8 h ALA 100 Ca 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1ao8 h ALA 100 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1ao8 h ALA 100 CO 0.00 0.59 -0.06 1.96 0.00 0.00 0.00 179.25 181.75 1ao8 h GLN 101 N 0.84 0.43 -0.16 0.00 4.20 -1.99 -2.39 115.11 116.04 1ao8 h GLN 101 Ca 0.17 -0.10 -0.18 0.00 0.06 0.00 0.00 58.65 58.61 1ao8 h GLN 101 Cb 0.41 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.13 1ao8 h GLN 101 CO 0.01 0.50 -0.63 0.82 -0.67 0.00 0.00 178.83 178.86 1ao8 h ILE 102 N 0.41 1.33 -0.70 2.54 1.08 -1.69 -3.04 117.51 117.42 1ao8 h ILE 102 Ca 0.09 -1.92 -0.04 0.00 -0.39 0.00 0.00 64.86 62.60 1ao8 h ILE 102 Cb 0.36 1.89 -0.03 0.00 -3.07 0.00 0.00 36.82 35.97 1ao8 h ILE 102 CO 0.02 0.59 0.30 -0.26 -0.69 0.00 0.00 178.15 178.11 1ao8 h PHE 103 N 0.42 1.05 -0.00 1.37 0.04 -0.92 -1.88 116.94 117.01 1ao8 h PHE 103 Ca -0.01 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1ao8 h PHE 103 Cb 1.20 -0.32 -0.00 0.00 2.20 0.00 0.00 35.95 39.03 1ao8 h PHE 103 CO 0.05 0.80 -0.11 1.15 -0.60 0.00 0.00 178.31 179.60 1ao8 h THR 104 N 1.00 1.09 -0.31 -1.55 2.02 -1.40 0.08 112.91 113.84 1ao8 h THR 104 Ca 0.24 -0.40 -0.16 0.00 0.77 0.00 0.00 66.41 66.85 1ao8 h THR 104 Cb 0.18 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1ao8 h THR 104 CO -0.02 0.12 -0.44 0.00 0.37 0.00 0.00 175.52 175.54 1ao8 h ALA 105 N 1.88 0.47 -0.81 6.16 0.00 -1.24 -3.17 119.26 122.54 1ao8 h ALA 105 Ca 0.00 -0.47 -0.52 0.00 0.00 0.00 0.00 54.91 53.92 1ao8 h ALA 105 Cb 0.21 -0.09 -0.29 0.00 0.00 0.00 0.00 17.79 17.62 1ao8 h ALA 105 CO 0.01 0.60 0.29 1.19 0.00 0.00 0.00 179.25 181.35 1ao8 n PHE 106 N -4.10 2.66 0.08 0.00 3.72 -0.86 -4.56 117.46 114.40 1ao8 n PHE 106 Ca -0.04 -2.36 -0.11 0.00 -0.05 0.00 0.00 57.45 54.90 1ao8 n PHE 106 Cb 0.57 -0.93 -0.11 0.00 -0.94 0.00 0.00 39.48 38.07 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 1.65 0.13 -0.89 -1.08 3.64 -0.97 -3.27 116.57 115.78 1ao8 h LYS 107 Ca 0.49 -0.21 -0.58 0.00 -1.27 0.00 0.00 60.65 59.07 1ao8 h LYS 107 Cb 1.52 0.08 -0.30 0.00 -0.41 0.00 0.00 32.23 33.12 1ao8 h LYS 107 CO 1.09 1.07 0.46 -0.25 -2.27 0.00 0.00 179.45 179.55 1ao8 n ASP 108 N -3.47 6.05 -2.81 4.20 8.00 -1.26 -4.61 116.55 122.65 1ao8 n ASP 108 Ca -0.04 -3.75 -0.10 0.00 0.71 0.00 0.00 54.79 51.61 1ao8 n ASP 108 Cb 0.95 -0.81 0.05 0.00 -0.02 0.00 0.00 41.12 41.29 1ao8 n ASP 108 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ao8 n ASP 109 N -0.94 -2.16 -3.64 -2.24 8.00 -1.23 -5.13 116.55 109.19 1ao8 n ASP 109 Ca 0.56 -3.42 -0.15 0.00 0.71 0.00 0.00 54.79 52.49 1ao8 n ASP 109 Cb 0.93 1.53 -0.08 0.00 -0.02 0.00 0.00 41.12 43.48 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 0.14 0.02 0.01 2.53 0.11 -1.26 -4.86 120.40 117.09 1ao8 s VAL 110 Ca 0.28 -0.17 -0.02 0.00 -2.93 0.00 0.00 61.98 59.14 1ao8 s VAL 110 Cb 0.26 -0.81 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 1ao8 s VAL 110 CO -0.14 -0.10 -0.05 0.47 -3.33 0.00 0.00 175.10 171.96 1ao8 n ASP 111 N 1.44 0.70 -4.76 3.54 8.00 -1.25 -5.00 116.55 119.21 1ao8 n ASP 111 Ca -0.19 0.10 -0.39 0.00 0.71 0.00 0.00 54.79 55.03 1ao8 n ASP 111 Cb 0.56 -0.24 -0.06 0.00 -0.02 0.00 0.00 41.12 41.37 1ao8 n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ao8 s THR 112 N -2.09 4.98 -0.29 -3.53 2.01 -1.26 -3.04 115.64 112.42 1ao8 s THR 112 Ca -0.04 1.16 0.03 0.00 0.31 0.00 0.00 61.69 63.14 1ao8 s THR 112 Cb 0.01 -3.89 0.08 0.00 0.01 0.00 0.00 72.50 68.71 1ao8 s THR 112 CO 0.06 0.41 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.61 1ao8 s LEU 113 N -0.09 3.77 -0.22 4.42 1.43 0.52 -1.73 118.68 126.78 1ao8 s LEU 113 Ca 0.30 -1.67 -0.15 0.00 -1.03 0.00 0.00 54.13 51.58 1ao8 s LEU 113 Cb -0.17 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1ao8 s LEU 113 CO 0.15 -0.28 0.36 -0.76 0.23 0.00 0.00 176.35 176.06 1ao8 s LEU 114 N 1.09 4.12 0.00 1.79 1.43 -0.58 -2.11 118.68 124.42 1ao8 s LEU 114 Ca -0.00 0.41 -0.02 0.00 -1.03 0.00 0.00 54.13 53.49 1ao8 s LEU 114 Cb -0.19 -2.44 -0.01 0.00 0.03 0.00 0.00 46.19 43.58 1ao8 s LEU 114 CO -0.07 -0.08 0.04 0.54 0.23 0.00 0.00 176.35 177.00 1ao8 s VAL 115 N 1.45 0.06 -0.38 -1.59 0.11 -1.04 -2.34 120.40 116.67 1ao8 s VAL 115 Ca 0.17 -0.51 -0.06 0.00 -2.93 0.00 0.00 61.98 58.65 1ao8 s VAL 115 Cb -0.15 -0.23 0.07 0.00 -1.53 0.00 0.00 36.38 34.55 1ao8 s VAL 115 CO 0.08 -0.28 0.17 -0.89 -3.33 0.00 0.00 175.10 170.85 1ao8 s THR 116 N -0.87 3.74 -0.15 5.04 2.01 -0.91 -1.54 115.64 122.97 1ao8 s THR 116 Ca -0.10 -1.48 -0.27 0.00 0.31 0.00 0.00 61.69 60.15 1ao8 s THR 116 Cb -0.06 -3.29 -0.01 0.00 0.01 0.00 0.00 72.50 69.15 1ao8 s THR 116 CO -0.00 -0.42 0.92 -0.13 -0.69 0.00 0.00 174.62 174.31 1ao8 s ARG 117 N 1.33 4.35 0.28 4.92 0.52 -0.79 -2.15 118.95 127.42 1ao8 s ARG 117 Ca 0.02 1.21 -0.01 0.00 -0.52 0.00 0.00 55.73 56.43 1ao8 s ARG 117 Cb -0.22 -3.57 0.06 0.00 0.52 0.00 0.00 34.95 31.74 1ao8 s ARG 117 CO 0.00 -0.35 0.38 1.28 0.02 0.00 0.00 175.30 176.64 1ao8 n LEU 118 N 5.23 0.00 0.00 2.53 4.32 -0.83 -0.86 117.00 127.38 1ao8 n LEU 118 Ca 0.07 -0.75 0.00 0.00 -0.02 0.00 0.00 56.01 55.30 1ao8 n LEU 118 Cb 0.48 -0.25 0.00 0.00 -1.62 0.00 0.00 43.42 42.03 1ao8 n LEU 118 CO 0.50 -0.70 -0.48 0.00 -1.22 0.00 0.00 177.39 175.49 1ao8 n ALA 119 N -3.00 2.57 -1.76 -1.18 0.00 -0.42 -4.38 120.51 112.34 1ao8 n ALA 119 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.02 1ao8 n ALA 119 Cb 0.22 0.48 0.02 0.00 0.00 0.00 0.00 19.45 20.17 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 -4.55 2.74 0.28 0.00 0.00 -1.07 -4.81 107.32 99.91 1ao8 s GLY 120 Ca 0.00 1.00 -0.16 0.00 0.00 0.00 0.00 44.72 45.55 1ao8 s GLY 120 CO 0.00 1.40 0.72 -0.56 0.00 0.00 0.00 173.10 174.67 1ao8 s SER 121 N -1.53 6.87 -0.04 1.64 0.01 -1.26 -4.64 113.70 114.74 1ao8 s SER 121 Ca 0.74 1.32 -0.10 0.00 1.31 0.00 0.00 55.95 59.22 1ao8 s SER 121 Cb -0.30 -2.38 0.02 0.00 0.21 0.00 0.00 66.02 63.56 1ao8 s SER 121 CO 0.33 -0.11 0.23 -0.36 0.41 0.00 0.00 173.24 173.74 1ao8 s PHE 122 N -1.81 -0.15 0.21 2.43 0.08 -1.26 -5.12 117.98 112.36 1ao8 s PHE 122 Ca 0.50 0.32 0.10 0.00 0.12 0.00 0.00 56.93 57.97 1ao8 s PHE 122 Cb -0.13 0.05 -0.04 0.00 -0.57 0.00 0.00 43.02 42.33 1ao8 s PHE 122 CO 0.19 -0.24 -0.16 -1.83 -0.10 0.00 0.00 175.22 173.07 1ao8 s GLU 123 N -0.69 1.81 0.00 0.44 -1.05 -1.26 -4.76 118.70 113.18 1ao8 s GLU 123 Ca -0.08 -1.46 0.00 0.00 -0.15 0.00 0.00 54.97 53.28 1ao8 s GLU 123 Cb -0.04 -1.98 0.00 0.00 -0.44 0.00 0.00 34.13 31.67 1ao8 s GLU 123 CO 0.02 0.40 0.00 0.41 0.95 0.00 0.00 175.26 177.04 1ao8 n GLY 124 N -0.06 0.60 0.05 -3.83 0.00 -1.26 -4.94 105.19 95.74 1ao8 n GLY 124 Ca -0.10 -0.69 -0.06 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.01 2.57 -4.69 1.61 9.92 -1.26 -4.96 116.55 119.73 1ao8 n ASP 125 Ca 0.00 -0.01 -0.42 0.00 -0.53 0.00 0.00 54.79 53.83 1ao8 n ASP 125 Cb 0.00 0.62 -0.03 0.00 -0.64 0.00 0.00 41.12 41.08 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 -2.25 4.03 0.03 -3.53 2.01 -1.19 -5.02 115.64 109.72 1ao8 s THR 126 Ca -0.07 1.40 0.00 0.00 0.31 0.00 0.00 61.69 63.33 1ao8 s THR 126 Cb 0.03 -3.90 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 1ao8 s THR 126 CO 0.40 0.02 -0.04 -0.54 -0.69 0.00 0.00 174.62 173.78 1ao8 s LYS 127 N 2.00 0.41 0.36 4.92 1.02 -1.26 -2.29 119.74 124.90 1ao8 s LYS 127 Ca 0.59 -0.79 -0.21 0.00 0.02 0.00 0.00 55.97 55.59 1ao8 s LYS 127 Cb -0.28 0.09 -0.10 0.00 -0.52 0.00 0.00 37.83 37.02 1ao8 s LYS 127 CO 0.25 -0.05 0.88 1.41 -0.92 0.00 0.00 175.35 176.91 1ao8 s MET 128 N -2.11 4.26 0.56 1.68 -2.45 -1.23 -4.85 119.30 115.17 1ao8 s MET 128 Ca -0.09 1.04 -0.17 0.00 -1.25 0.00 0.00 55.69 55.21 1ao8 s MET 128 Cb -0.05 -2.45 -0.05 0.00 1.25 0.00 0.00 34.83 33.53 1ao8 s MET 128 CO -0.03 0.13 1.07 0.96 1.05 0.00 0.00 175.02 178.20 1ao8 s ILE 129 N -1.94 3.63 0.08 10.11 -4.36 -1.26 -4.93 121.20 122.53 1ao8 s ILE 129 Ca 0.56 0.87 -0.36 0.00 -0.26 0.00 0.00 60.65 61.45 1ao8 s ILE 129 Cb -0.12 -3.35 -0.18 0.00 1.25 0.00 0.00 42.46 40.06 1ao8 s ILE 129 CO 0.17 -0.36 1.14 -2.65 0.24 0.00 0.00 174.94 173.48 1ao8 n PRO 130 N -1.68 0.65 -5.12 0.37 -0.01 -1.26 -4.99 135.00 122.97 1ao8 n PRO 130 Ca 0.10 0.23 -0.30 0.00 -0.01 0.00 0.00 63.50 63.52 1ao8 n PRO 130 Cb 0.52 -1.74 -0.15 0.00 -0.01 0.00 0.00 33.50 32.12 1ao8 n PRO 130 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 1ao8 s LEU 131 N 0.56 2.09 -0.43 2.45 1.43 -1.26 -5.10 118.68 118.41 1ao8 s LEU 131 Ca 0.83 -0.49 -0.20 0.00 -1.03 0.00 0.00 54.13 53.24 1ao8 s LEU 131 Cb -1.04 -1.26 0.02 0.00 0.03 0.00 0.00 46.19 43.94 1ao8 s LEU 131 CO 0.52 0.28 0.58 0.21 0.23 0.00 0.00 176.35 178.18 1ao8 s ASN 132 N -0.79 6.28 0.00 2.29 3.84 -1.26 -4.90 114.94 120.40 1ao8 s ASN 132 Ca 0.10 -0.45 0.18 0.00 0.21 0.00 0.00 52.86 52.90 1ao8 s ASN 132 Cb -0.10 -2.29 0.51 0.00 -0.55 0.00 0.00 41.25 38.82 1ao8 s ASN 132 CO 0.00 -0.73 1.42 0.79 -2.79 0.00 0.00 177.10 175.79 1ao8 n TRP 133 N 6.07 0.59 0.06 0.43 7.02 -1.26 -4.10 117.44 126.25 1ao8 n TRP 133 Ca -0.03 -0.29 -0.08 0.00 -1.02 0.00 0.00 57.50 56.07 1ao8 n TRP 133 Cb 0.48 0.00 -0.12 0.00 -2.42 0.00 0.00 31.31 29.24 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 3.15 0.06 -0.99 -0.99 5.19 -2.04 -3.26 116.42 117.54 1ao8 h ASP 134 Ca 0.00 -0.07 -0.62 0.00 -0.62 0.00 0.00 57.03 55.73 1ao8 h ASP 134 Cb 0.71 -0.02 -0.30 0.00 0.18 0.00 0.00 39.33 39.90 1ao8 h ASP 134 CO 0.00 1.05 0.78 0.47 -3.12 0.00 0.00 179.24 178.42 1ao8 n ASP 135 N -3.37 6.19 -3.69 6.45 9.92 -1.26 -4.92 116.55 125.87 1ao8 n ASP 135 Ca -0.02 -3.72 -0.12 0.00 -0.53 0.00 0.00 54.79 50.40 1ao8 n ASP 135 Cb 0.95 -0.92 -0.07 0.00 -0.64 0.00 0.00 41.12 40.45 1ao8 n ASP 135 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1ao8 s PHE 136 N -3.63 -0.22 0.01 1.24 0.08 -1.23 -4.45 117.98 109.79 1ao8 s PHE 136 Ca 0.62 0.14 0.00 0.00 0.12 0.00 0.00 56.93 57.81 1ao8 s PHE 136 Cb 0.50 0.18 -0.01 0.00 -0.57 0.00 0.00 43.02 43.12 1ao8 s PHE 136 CO 0.03 -0.56 -0.03 0.99 -0.10 0.00 0.00 175.22 175.56 1ao8 s THR 137 N -2.54 0.16 -0.36 0.64 2.01 -1.03 -4.97 115.64 109.56 1ao8 s THR 137 Ca -0.05 -0.54 -0.18 0.00 0.31 0.00 0.00 61.69 61.23 1ao8 s THR 137 Cb -0.01 -0.23 0.00 0.00 0.01 0.00 0.00 72.50 72.27 1ao8 s THR 137 CO -0.03 -0.24 0.50 -0.75 -0.69 0.00 0.00 174.62 173.41 1ao8 s LYS 138 N -0.83 3.53 -0.09 4.92 2.20 -1.26 -2.01 119.74 126.21 1ao8 s LYS 138 Ca -0.08 -0.26 0.07 0.00 -0.36 0.00 0.00 55.97 55.34 1ao8 s LYS 138 Cb -0.06 -3.84 -0.11 0.00 -1.51 0.00 0.00 37.83 32.32 1ao8 s LYS 138 CO -0.00 -0.68 0.02 1.33 -0.36 0.00 0.00 175.35 175.65 1ao8 n VAL 139 N 5.45 0.60 -5.20 4.02 0.24 -1.25 -4.98 118.33 117.21 1ao8 n VAL 139 Ca -0.05 -0.36 -0.32 0.00 -2.04 0.00 0.00 64.34 61.57 1ao8 n VAL 139 Cb 0.49 -0.78 -0.17 0.00 -1.47 0.00 0.00 33.84 31.91 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1ao8 s SER 140 N -4.12 3.04 -0.27 -1.34 0.01 -1.26 -5.06 113.70 104.69 1ao8 s SER 140 Ca -0.05 -0.55 -0.24 0.00 1.31 0.00 0.00 55.95 56.43 1ao8 s SER 140 Cb 0.03 -1.32 0.08 0.00 0.21 0.00 0.00 66.02 65.02 1ao8 s SER 140 CO 0.35 0.17 0.79 -0.55 0.41 0.00 0.00 173.24 174.41 1ao8 s SER 141 N 0.29 -0.70 -0.10 2.44 0.15 -1.26 -1.14 113.70 113.38 1ao8 s SER 141 Ca -0.17 1.32 0.02 0.00 0.70 0.00 0.00 55.95 57.82 1ao8 s SER 141 Cb -0.17 1.33 0.01 0.00 -1.71 0.00 0.00 66.02 65.48 1ao8 s SER 141 CO 0.08 -0.23 -0.15 -0.60 1.20 0.00 0.00 173.24 173.55 1ao8 s ARG 142 N 0.48 2.16 -0.04 5.44 3.52 -0.86 -4.99 118.95 124.66 1ao8 s ARG 142 Ca -0.00 -0.55 -0.22 0.00 -0.13 0.00 0.00 55.73 54.83 1ao8 s ARG 142 Cb -0.05 -1.82 -0.05 0.00 -1.56 0.00 0.00 34.95 31.48 1ao8 s ARG 142 CO -0.03 -0.04 0.64 0.99 -0.81 0.00 0.00 175.30 176.05 1ao8 s THR 143 N 0.91 4.98 -0.15 4.11 2.01 -1.26 -1.75 115.64 124.49 1ao8 s THR 143 Ca -0.08 1.33 -0.01 0.00 0.31 0.00 0.00 61.69 63.23 1ao8 s THR 143 Cb -0.15 -3.98 0.04 0.00 0.01 0.00 0.00 72.50 68.42 1ao8 s THR 143 CO -0.00 0.34 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.56 1ao8 s VAL 144 N 0.31 0.78 0.15 3.82 1.01 -0.92 -5.00 120.40 120.55 1ao8 s VAL 144 Ca 0.34 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 1ao8 s VAL 144 Cb -0.18 -1.04 -0.06 0.00 0.00 0.00 0.00 36.38 35.10 1ao8 s VAL 144 CO 0.17 0.07 0.40 -1.61 0.00 0.00 0.00 175.10 174.13 1ao8 s GLU 145 N 1.77 3.65 0.08 2.72 8.01 -1.26 -2.47 118.70 131.20 1ao8 s GLU 145 Ca 0.01 -0.03 0.01 0.00 0.01 0.00 0.00 54.97 54.97 1ao8 s GLU 145 Cb -0.15 -2.83 0.01 0.00 -4.31 0.00 0.00 34.13 26.84 1ao8 s GLU 145 CO -0.07 0.45 0.05 -3.47 0.01 0.00 0.00 175.26 172.23 1ao8 n ASP 146 N 0.10 1.45 -0.27 -0.19 2.03 -1.26 -4.97 116.55 113.45 1ao8 n ASP 146 Ca -0.02 -1.30 -0.06 0.00 0.52 0.00 0.00 54.79 53.93 1ao8 n ASP 146 Cb 0.52 0.01 0.05 0.00 -0.72 0.00 0.00 41.12 40.98 1ao8 n ASP 146 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1ao8 h THR 147 N 0.63 1.25 -1.76 5.18 1.35 -1.99 -3.44 112.91 114.12 1ao8 h THR 147 Ca -0.06 -0.74 -0.49 0.00 -0.55 0.00 0.00 66.41 64.58 1ao8 h THR 147 Cb 0.19 0.36 -0.03 0.00 -1.73 0.00 0.00 68.15 66.94 1ao8 h THR 147 CO 0.09 0.30 -0.41 0.20 -0.25 0.00 0.00 175.52 175.45 1ao8 s ASN 148 N -6.22 5.33 0.14 5.36 0.01 -1.26 -5.03 114.94 113.27 1ao8 s ASN 148 Ca -0.13 -0.51 0.07 0.00 -0.71 0.00 0.00 52.86 51.58 1ao8 s ASN 148 Cb 0.15 -0.91 -0.13 0.00 0.41 0.00 0.00 41.25 40.77 1ao8 s ASN 148 CO 0.82 -0.44 1.32 1.55 -1.51 0.00 0.00 177.10 178.85 1ao8 h PRO 149 N 1.14 0.02 0.00 -0.60 0.13 -2.00 -3.23 132.00 127.45 1ao8 h PRO 149 Ca -0.44 -0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 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 0.57 0.95 -0.30 0.00 -0.23 0.00 0.00 178.00 178.99 1ao8 h ALA 150 N 1.04 0.87 -0.62 -0.56 0.00 -1.96 -3.10 119.26 114.93 1ao8 h ALA 150 Ca -0.01 -0.28 -0.22 0.00 0.00 0.00 0.00 54.91 54.40 1ao8 h ALA 150 Cb 1.68 -0.05 -0.13 0.00 0.00 0.00 0.00 17.79 19.29 1ao8 h ALA 150 CO 0.13 0.38 0.27 1.28 0.00 0.00 0.00 179.25 181.31 1ao8 n LEU 151 N -3.27 5.35 -4.79 0.00 4.77 -1.22 -2.60 117.00 115.24 1ao8 n LEU 151 Ca 0.01 -2.79 -0.39 0.00 -0.03 0.00 0.00 56.01 52.82 1ao8 n LEU 151 Cb 0.57 -0.71 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 1ao8 n LEU 151 CO 0.36 0.75 0.41 -0.89 -1.33 0.00 0.00 177.39 176.69 1ao8 s THR 152 N -2.47 4.51 0.11 -5.08 2.01 -1.17 -4.18 115.64 109.36 1ao8 s THR 152 Ca 0.43 1.49 -0.04 0.00 0.31 0.00 0.00 61.69 63.88 1ao8 s THR 152 Cb 0.35 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.82 1ao8 s THR 152 CO 0.10 0.47 0.11 -1.38 -0.69 0.00 0.00 174.62 173.23 1ao8 s HIS 153 N -1.21 0.57 -0.11 4.92 -3.43 -1.03 -1.31 115.29 113.69 1ao8 s HIS 153 Ca 0.35 -1.00 -0.05 0.00 -0.80 0.00 0.00 55.06 53.57 1ao8 s HIS 153 Cb -0.21 -0.30 0.05 0.00 -1.43 0.00 0.00 32.58 30.69 1ao8 s HIS 153 CO 0.23 -0.54 0.24 0.99 -2.00 0.00 0.00 174.74 173.67 1ao8 s THR 154 N -3.97 -0.23 0.00 -5.38 2.01 -0.04 -2.16 115.64 105.87 1ao8 s THR 154 Ca 0.16 0.23 -0.30 0.00 0.31 0.00 0.00 61.69 62.09 1ao8 s THR 154 Cb 0.06 -0.40 -0.03 0.00 0.01 0.00 0.00 72.50 72.14 1ao8 s THR 154 CO -0.03 0.09 1.04 -0.31 -0.69 0.00 0.00 174.62 174.72 1ao8 s TYR 155 N 1.87 3.58 -0.10 4.92 2.02 -0.72 -1.88 117.35 127.06 1ao8 s TYR 155 Ca -0.03 1.58 0.04 0.00 -0.37 0.00 0.00 57.07 58.28 1ao8 s TYR 155 Cb -0.11 -3.20 0.00 0.00 -0.40 0.00 0.00 41.96 38.24 1ao8 s TYR 155 CO -0.08 -0.36 -0.22 -1.21 -1.57 0.00 0.00 175.55 172.11 1ao8 s GLU 156 N 1.14 2.81 -0.73 -0.62 8.01 -0.59 -2.03 118.70 126.69 1ao8 s GLU 156 Ca 0.53 -0.79 -0.00 0.00 0.01 0.00 0.00 54.97 54.72 1ao8 s GLU 156 Cb -0.23 -2.15 0.18 0.00 -4.31 0.00 0.00 34.13 27.62 1ao8 s GLU 156 CO 0.27 0.14 0.55 0.08 0.01 0.00 0.00 175.26 176.32 1ao8 s VAL 157 N 0.43 3.64 -0.22 2.63 1.01 -0.29 -2.48 120.40 125.11 1ao8 s VAL 157 Ca -0.17 -3.61 -0.29 0.00 0.00 0.00 0.00 61.98 57.91 1ao8 s VAL 157 Cb -0.17 -3.34 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1ao8 s VAL 157 CO 0.07 -0.97 1.02 0.26 0.00 0.00 0.00 175.10 175.48 1ao8 s TRP 158 N -0.85 3.35 0.30 5.22 0.52 -0.90 -3.84 118.94 122.75 1ao8 s TRP 158 Ca 0.22 1.45 0.08 0.00 0.02 0.00 0.00 56.10 57.87 1ao8 s TRP 158 Cb -0.13 -3.24 -0.04 0.00 -1.15 0.00 0.00 33.47 28.91 1ao8 s TRP 158 CO -0.09 -0.45 0.13 -0.65 0.02 0.00 0.00 176.95 175.92 1ao8 s GLN 159 N 3.06 2.51 -0.05 4.98 -0.21 -0.85 -0.36 119.66 128.75 1ao8 s GLN 159 Ca 0.43 -1.38 -0.26 0.00 0.02 0.00 0.00 55.36 54.18 1ao8 s GLN 159 Cb -0.15 -2.29 -0.03 0.00 1.00 0.00 0.00 33.01 31.53 1ao8 s GLN 159 CO 0.07 0.24 0.80 0.21 -2.12 0.00 0.00 175.29 174.49 1ao8 s LYS 160 N -3.82 4.47 -0.39 2.91 2.20 -1.17 -2.45 119.74 121.49 1ao8 s LYS 160 Ca 0.35 1.07 0.06 0.00 -0.36 0.00 0.00 55.97 57.09 1ao8 s LYS 160 Cb -0.05 -3.46 0.54 0.00 -1.51 0.00 0.00 37.83 33.35 1ao8 s LYS 160 CO 0.23 0.01 1.64 0.36 -0.36 0.00 0.00 175.35 177.23 1ao8 n LYS 161 N 3.88 2.23 0.00 4.03 -0.00 -1.26 -4.99 118.16 122.04 1ao8 n LYS 161 Ca 0.01 -3.25 0.15 0.00 -0.00 0.00 0.00 58.31 55.22 1ao8 n LYS 161 Cb 0.51 -2.03 0.68 0.00 -0.00 0.00 0.00 35.03 34.20 1ao8 n LYS 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40