#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 -2.24 0.44 2.41 0.00 -0.24 -4.11 121.76 118.02 1ao8 s ALA 2 Ca 0.00 2.26 -0.23 0.00 0.00 0.00 0.00 51.96 54.00 1ao8 s ALA 2 Cb 0.00 -1.84 -0.08 0.00 0.00 0.00 0.00 23.12 21.19 1ao8 s ALA 2 CO 0.00 -0.90 1.07 -0.06 0.00 0.00 0.00 175.76 175.87 1ao8 s PHE 3 N 2.67 3.11 -0.24 0.00 0.40 -0.49 -2.51 117.98 120.92 1ao8 s PHE 3 Ca -0.05 1.60 -0.03 0.00 -0.60 0.00 0.00 56.93 57.85 1ao8 s PHE 3 Cb -0.10 -3.16 0.13 0.00 0.51 0.00 0.00 43.02 40.41 1ao8 s PHE 3 CO -0.19 -0.86 0.42 -1.17 0.70 0.00 0.00 175.22 174.12 1ao8 s LEU 4 N -2.97 -0.74 0.11 -0.37 2.96 -0.85 -0.42 118.68 116.40 1ao8 s LEU 4 Ca 0.62 0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 54.83 1ao8 s LEU 4 Cb -0.22 1.30 0.02 0.00 0.50 0.00 0.00 46.19 47.80 1ao8 s LEU 4 CO 0.27 -0.28 0.33 -1.66 -1.32 0.00 0.00 176.35 173.68 1ao8 s TRP 5 N 2.60 -0.09 -0.17 5.38 -2.14 -1.00 -4.33 118.94 119.19 1ao8 s TRP 5 Ca 0.12 -0.25 -0.03 0.00 2.66 0.00 0.00 56.10 58.59 1ao8 s TRP 5 Cb -0.15 0.15 -0.02 0.00 -3.10 0.00 0.00 33.47 30.35 1ao8 s TRP 5 CO -0.16 -0.64 -0.04 0.00 -2.66 0.00 0.00 176.95 173.45 1ao8 s ALA 6 N -3.72 2.92 0.29 2.67 0.00 -1.26 -2.14 121.76 120.52 1ao8 s ALA 6 Ca 0.03 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.09 1ao8 s ALA 6 Cb 0.03 -1.57 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 1ao8 s ALA 6 CO -0.11 0.04 0.15 1.14 0.00 0.00 0.00 175.76 176.98 1ao8 s GLN 7 N 0.68 1.54 0.12 0.00 -2.07 -0.95 -4.28 119.66 114.70 1ao8 s GLN 7 Ca -0.02 -1.87 0.00 0.00 -1.82 0.00 0.00 55.36 51.65 1ao8 s GLN 7 Cb -0.15 -0.06 -0.00 0.00 -1.09 0.00 0.00 33.01 31.71 1ao8 s GLN 7 CO 0.02 -0.43 0.02 -0.40 -1.32 0.00 0.00 175.29 173.17 1ao8 n ASP 8 N -0.84 1.84 -0.32 12.60 5.75 -1.21 -2.02 116.55 132.35 1ao8 n ASP 8 Ca 0.01 -1.59 -0.03 0.00 -0.01 0.00 0.00 54.79 53.18 1ao8 n ASP 8 Cb 0.65 0.17 0.13 0.00 -1.03 0.00 0.00 41.12 41.03 1ao8 n ASP 8 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 1ao8 h ARG 9 N 0.00 1.22 -0.72 0.11 0.11 -1.83 -2.37 114.38 110.90 1ao8 h ARG 9 Ca -0.10 -0.12 -0.05 0.00 0.10 0.00 0.00 59.98 59.82 1ao8 h ARG 9 Cb 0.33 -0.25 -0.03 0.00 1.11 0.00 0.00 29.97 31.13 1ao8 h ARG 9 CO 0.17 0.86 0.26 -0.44 0.10 0.00 0.00 179.97 180.92 1ao8 h ASP 10 N 1.23 1.01 0.00 0.08 3.32 -1.92 -3.47 116.42 116.68 1ao8 h ASP 10 Ca 0.32 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1ao8 h ASP 10 Cb -0.04 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.25 1ao8 h ASP 10 CO -0.06 0.93 0.00 0.61 -1.72 0.00 0.00 179.24 179.00 1ao8 n GLY 11 N -0.81 1.98 3.71 2.75 0.00 -0.89 -5.09 105.19 106.84 1ao8 n GLY 11 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 4.21 -0.16 0.99 2.96 -1.26 -3.22 118.68 122.20 1ao8 s LEU 12 Ca 0.00 0.44 0.16 0.00 -0.22 0.00 0.00 54.13 54.52 1ao8 s LEU 12 Cb 0.00 -2.34 -0.23 0.00 0.50 0.00 0.00 46.19 44.12 1ao8 s LEU 12 CO 0.00 0.08 0.10 2.30 -1.32 0.00 0.00 176.35 177.51 1ao8 n ILE 13 N 3.75 1.11 -3.84 6.68 -5.35 -0.99 -3.35 119.36 117.36 1ao8 n ILE 13 Ca -0.12 -0.73 -0.05 0.00 -0.27 0.00 0.00 62.75 61.58 1ao8 n ILE 13 Cb 0.52 -0.46 0.01 0.00 -1.74 0.00 0.00 39.64 37.97 1ao8 n ILE 13 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ao8 s GLY 14 N -5.12 0.15 -0.15 3.28 0.00 -1.22 -4.73 107.32 99.52 1ao8 s GLY 14 Ca -0.09 -0.41 -0.04 0.00 0.00 0.00 0.00 44.72 44.18 1ao8 s GLY 14 CO 0.75 1.11 0.21 1.25 0.00 0.00 0.00 173.10 176.42 1ao8 s LYS 15 N -2.43 0.13 -1.77 2.90 2.20 0.43 -2.69 119.74 118.52 1ao8 s LYS 15 Ca 0.18 0.43 0.00 0.00 -0.36 0.00 0.00 55.97 56.22 1ao8 s LYS 15 Cb -0.03 -0.67 0.00 0.00 -1.51 0.00 0.00 37.83 35.61 1ao8 s LYS 15 CO 0.07 -0.47 0.00 -0.25 -0.36 0.00 0.00 175.35 174.34 1ao8 n ASP 16 N 5.33 -5.41 0.00 1.43 9.92 -1.26 -1.80 116.55 124.75 1ao8 n ASP 16 Ca -0.05 0.16 0.00 0.00 -0.53 0.00 0.00 54.79 54.36 1ao8 n ASP 16 Cb 0.50 -4.60 0.00 0.00 -0.64 0.00 0.00 41.12 36.38 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 -0.80 2.55 3.92 0.44 0.00 -1.26 -5.00 105.19 105.04 1ao8 n GLY 17 Ca -0.22 -0.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.94 1ao8 n GLY 17 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ao8 s HIS 18 N -0.44 3.47 0.32 1.61 -3.43 -0.75 -4.84 115.29 111.24 1ao8 s HIS 18 Ca 0.00 0.60 -0.19 0.00 -0.80 0.00 0.00 55.06 54.66 1ao8 s HIS 18 Cb 0.00 -2.24 -0.09 0.00 -1.43 0.00 0.00 32.58 28.82 1ao8 s HIS 18 CO 0.00 -0.23 0.81 -0.51 -2.00 0.00 0.00 174.74 172.81 1ao8 s LEU 19 N -4.63 4.16 0.02 5.38 1.43 -1.26 -0.43 118.68 123.35 1ao8 s LEU 19 Ca 0.46 1.50 -0.17 0.00 -1.03 0.00 0.00 54.13 54.89 1ao8 s LEU 19 Cb -0.10 -4.03 -0.34 0.00 0.03 0.00 0.00 46.19 41.75 1ao8 s LEU 19 CO 0.42 -0.15 1.00 1.55 0.23 0.00 0.00 176.35 179.39 1ao8 h PRO 20 N 2.66 0.52 -6.92 1.29 0.13 -1.88 -3.46 132.00 124.33 1ao8 h PRO 20 Ca -0.48 -0.85 -0.46 0.00 -0.87 0.00 0.00 66.00 63.35 1ao8 h PRO 20 Cb 1.18 0.31 0.06 0.00 0.13 0.00 0.00 31.00 32.68 1ao8 h PRO 20 CO 0.64 1.40 0.01 1.67 -0.23 0.00 0.00 178.00 181.50 1ao8 s TRP 21 N -2.63 2.13 -0.35 1.56 -2.14 -1.26 -5.08 118.94 111.17 1ao8 s TRP 21 Ca -0.10 -0.22 0.02 0.00 2.66 0.00 0.00 56.10 58.46 1ao8 s TRP 21 Cb 0.04 -2.79 0.11 0.00 -3.10 0.00 0.00 33.47 27.73 1ao8 s TRP 21 CO 0.93 -1.26 0.10 -1.58 -2.66 0.00 0.00 176.95 172.47 1ao8 s HIS 22 N -2.91 2.86 -0.35 1.66 2.46 -1.26 -5.06 115.29 112.69 1ao8 s HIS 22 Ca 0.62 -2.53 0.04 0.00 0.47 0.00 0.00 55.06 53.66 1ao8 s HIS 22 Cb -0.08 -2.41 0.10 0.00 -0.13 0.00 0.00 32.58 30.06 1ao8 s HIS 22 CO 0.41 -0.90 0.06 -1.17 -2.47 0.00 0.00 174.74 170.67 1ao8 s LEU 23 N 1.02 4.78 0.25 8.88 2.96 -1.26 -4.95 118.68 130.37 1ao8 s LEU 23 Ca 0.12 -2.18 0.11 0.00 -0.22 0.00 0.00 54.13 51.97 1ao8 s LEU 23 Cb -0.19 -1.64 0.23 0.00 0.50 0.00 0.00 46.19 45.09 1ao8 s LEU 23 CO -0.13 -0.38 1.53 1.55 -1.32 0.00 0.00 176.35 177.60 1ao8 h PRO 24 N 7.60 0.00 -0.67 0.98 0.14 -1.99 -3.20 132.00 134.86 1ao8 h PRO 24 Ca -0.04 0.00 -0.05 0.00 0.14 0.00 0.00 66.00 66.05 1ao8 h PRO 24 Cb 1.02 0.00 -0.03 0.00 0.14 0.00 0.00 31.00 32.13 1ao8 h PRO 24 CO 0.53 0.67 0.23 0.22 0.14 0.00 0.00 178.00 179.78 1ao8 h ASP 25 N 0.00 0.94 0.17 1.44 1.82 -2.00 -2.11 116.42 116.69 1ao8 h ASP 25 Ca -0.01 -0.16 -0.09 0.00 -0.39 0.00 0.00 57.03 56.39 1ao8 h ASP 25 Cb 1.27 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 41.02 1ao8 h ASP 25 CO 0.09 0.87 -0.32 -0.78 -1.61 0.00 0.00 179.24 177.48 1ao8 h ASP 26 N 0.99 0.23 -0.62 2.28 1.82 -1.98 -2.72 116.42 116.42 1ao8 h ASP 26 Ca 0.22 -0.08 -0.04 0.00 -0.39 0.00 0.00 57.03 56.74 1ao8 h ASP 26 Cb 0.25 -0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.17 1ao8 h ASP 26 CO -0.01 0.55 0.24 -0.07 -1.61 0.00 0.00 179.24 178.34 1ao8 h LEU 27 N 0.20 0.89 -0.96 2.28 3.38 -1.44 0.14 115.31 119.81 1ao8 h LEU 27 Ca 0.03 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1ao8 h LEU 27 Cb 0.68 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 1ao8 h LEU 27 CO 0.05 0.81 0.22 0.45 0.09 0.00 0.00 178.44 180.07 1ao8 h HIS 28 N 0.95 1.00 0.00 1.13 3.86 -1.26 -2.32 115.15 118.50 1ao8 h HIS 28 Ca 0.22 -0.08 -0.17 0.00 -1.16 0.00 0.00 60.37 59.18 1ao8 h HIS 28 Cb 0.21 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.36 1ao8 h HIS 28 CO 0.02 0.79 -0.83 -0.92 0.86 0.00 0.00 177.93 177.84 1ao8 h TYR 29 N 0.95 0.03 -0.59 2.45 3.20 -1.35 -3.17 116.97 118.49 1ao8 h TYR 29 Ca 0.22 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 1ao8 h TYR 29 Cb 0.24 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1ao8 h TYR 29 CO 0.02 0.84 0.24 0.35 -1.64 0.00 0.00 178.16 177.96 1ao8 h PHE 30 N 0.01 0.85 -0.15 -3.82 3.57 -0.45 -1.79 116.94 115.15 1ao8 h PHE 30 Ca -0.01 -0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.36 1ao8 h PHE 30 Cb 1.46 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1ao8 h PHE 30 CO 0.00 0.65 -0.28 -0.09 -2.23 0.00 0.00 178.31 176.36 1ao8 h ARG 31 N 0.84 0.29 -0.02 1.11 2.43 -1.44 -2.43 114.38 115.15 1ao8 h ARG 31 Ca 0.20 -0.11 -0.10 0.00 -0.81 0.00 0.00 59.98 59.16 1ao8 h ARG 31 Cb 0.16 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1ao8 h ARG 31 CO -0.02 0.55 -0.46 0.00 -1.51 0.00 0.00 179.97 178.53 1ao8 h ALA 32 N 1.45 1.20 -0.90 2.80 0.00 -1.37 -1.67 119.26 120.78 1ao8 h ALA 32 Ca 0.04 -0.42 -0.56 0.00 0.00 0.00 0.00 54.91 53.96 1ao8 h ALA 32 Cb 0.64 -0.08 -0.27 0.00 0.00 0.00 0.00 17.79 18.08 1ao8 h ALA 32 CO 0.05 0.59 0.72 1.04 0.00 0.00 0.00 179.25 181.64 1ao8 n GLN 33 N -3.99 2.38 0.00 0.00 6.02 -0.92 -4.35 117.38 116.51 1ao8 n GLN 33 Ca -0.02 -2.87 0.00 0.00 -0.01 0.00 0.00 57.00 54.10 1ao8 n GLN 33 Cb 0.49 -2.13 0.00 0.00 1.02 0.00 0.00 30.24 29.62 1ao8 n GLN 33 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1ao8 n THR 34 N -0.79 0.00 -1.79 5.09 -2.24 -1.07 -4.96 114.28 108.53 1ao8 n THR 34 Ca 0.56 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.92 1ao8 n THR 34 Cb 0.98 -0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.01 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 -1.62 2.85 0.00 2.28 -7.23 -0.65 -1.81 120.40 114.22 1ao8 s VAL 35 Ca 0.00 0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.38 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 -0.01 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1ao8 n GLY 36 N 4.23 0.52 2.91 2.32 0.00 -1.26 -4.98 105.19 108.93 1ao8 n GLY 36 Ca 0.18 -0.81 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 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 -0.94 0.81 -3.76 1.61 5.02 -0.75 -4.49 118.16 115.66 1ao8 n LYS 37 Ca 0.00 -1.89 -0.35 0.00 -2.02 0.00 0.00 58.31 54.04 1ao8 n LYS 37 Cb 0.47 2.19 -0.08 0.00 -0.02 0.00 0.00 35.03 37.60 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 -2.41 5.43 -0.45 -0.18 1.01 0.61 -3.39 121.20 121.82 1ao8 s ILE 38 Ca 0.15 0.20 -0.11 0.00 0.00 0.00 0.00 60.65 60.89 1ao8 s ILE 38 Cb -0.03 -3.46 0.09 0.00 0.01 0.00 0.00 42.46 39.07 1ao8 s ILE 38 CO 0.11 0.47 0.33 -0.32 0.00 0.00 0.00 174.94 175.54 1ao8 s MET 39 N 0.10 2.69 -0.35 2.79 1.75 -0.81 -1.32 119.30 124.15 1ao8 s MET 39 Ca 0.09 -1.54 -0.17 0.00 -1.25 0.00 0.00 55.69 52.83 1ao8 s MET 39 Cb -0.11 -3.94 -0.01 0.00 2.84 0.00 0.00 34.83 33.61 1ao8 s MET 39 CO -0.01 -1.07 0.46 0.08 -0.65 0.00 0.00 175.02 173.84 1ao8 s VAL 40 N 1.47 5.07 0.09 10.11 1.01 0.05 -1.79 120.40 136.41 1ao8 s VAL 40 Ca 0.04 0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1ao8 s VAL 40 Cb -0.25 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 1ao8 s VAL 40 CO 0.02 -0.17 -0.02 0.68 0.00 0.00 0.00 175.10 175.61 1ao8 s VAL 41 N 2.26 0.38 0.00 2.92 -7.23 -0.63 -2.49 120.40 115.62 1ao8 s VAL 41 Ca 0.16 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.45 1ao8 s VAL 41 Cb -0.16 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 35.07 1ao8 s VAL 41 CO 0.13 -0.83 0.00 0.61 -0.31 0.00 0.00 175.10 174.70 1ao8 n GLY 42 N -0.00 0.88 0.08 2.32 0.00 -0.19 -1.67 105.19 106.60 1ao8 n GLY 42 Ca -0.11 -1.93 -0.11 0.00 0.00 0.00 0.00 46.02 43.87 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 0.10 -0.05 1.61 1.12 -1.92 -1.71 114.38 113.54 1ao8 h ARG 43 Ca 0.00 -0.17 -0.10 0.00 -1.11 0.00 0.00 59.98 58.60 1ao8 h ARG 43 Cb 0.00 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.01 1ao8 h ARG 43 CO 0.00 0.97 -0.42 -0.09 -3.11 0.00 0.00 179.97 177.32 1ao8 h ARG 44 N 0.03 0.10 0.02 0.20 9.65 -1.95 -2.54 114.38 119.90 1ao8 h ARG 44 Ca -0.13 -0.05 -0.30 0.00 -1.10 0.00 0.00 59.98 58.40 1ao8 h ARG 44 Cb 1.90 -0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 30.44 1ao8 h ARG 44 CO 0.14 0.51 -1.71 1.15 2.80 0.00 0.00 179.97 182.86 1ao8 h THR 45 N 0.09 0.87 -0.39 0.20 2.02 -1.90 -3.27 112.91 110.52 1ao8 h THR 45 Ca 0.01 -2.69 -0.04 0.00 0.77 0.00 0.00 66.41 64.45 1ao8 h THR 45 Cb 0.78 2.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.63 1ao8 h THR 45 CO 0.06 0.57 0.07 0.22 0.37 0.00 0.00 175.52 176.81 1ao8 h TYR 46 N 0.01 0.61 0.00 3.16 3.20 -1.19 -1.99 116.97 120.76 1ao8 h TYR 46 Ca -0.29 -0.05 -0.08 0.00 3.14 0.00 0.00 58.73 61.45 1ao8 h TYR 46 Cb 2.01 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 40.08 1ao8 h TYR 46 CO 0.01 0.54 -0.38 0.93 -1.64 0.00 0.00 178.16 177.63 1ao8 h GLU 47 N 0.58 0.00 0.00 1.82 5.08 -1.58 -3.14 114.58 117.34 1ao8 h GLU 47 Ca 0.13 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1ao8 h GLU 47 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1ao8 h GLU 47 CO 0.00 0.38 -0.12 0.66 -1.00 0.00 0.00 179.01 178.93 1ao8 h SER 48 N 0.00 0.00 -4.21 1.42 4.64 -1.41 -3.43 113.55 110.57 1ao8 h SER 48 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.79 1ao8 h SER 48 Cb 1.14 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 63.38 1ao8 h SER 48 CO 0.05 0.12 0.36 -0.36 -0.87 0.00 0.00 176.83 176.13 1ao8 s PHE 49 N -4.72 2.20 -0.10 4.77 0.08 -1.19 -4.99 117.98 114.04 1ao8 s PHE 49 Ca -0.04 1.61 -0.02 0.00 0.12 0.00 0.00 56.93 58.60 1ao8 s PHE 49 Cb 0.16 -3.34 -0.01 0.00 -0.57 0.00 0.00 43.02 39.27 1ao8 s PHE 49 CO 0.67 -2.31 -0.03 -1.00 -0.10 0.00 0.00 175.22 172.45 1ao8 h PRO 50 N -0.46 0.00 -4.54 0.24 0.13 -1.89 -3.44 132.00 122.04 1ao8 h PRO 50 Ca -0.46 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.96 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 0.50 0.00 -0.53 0.21 -0.23 0.00 0.00 178.00 177.95 1ao8 s LYS 51 N -1.62 2.55 -0.05 0.86 2.20 -1.26 -5.08 119.74 117.34 1ao8 s LYS 51 Ca -0.03 -1.39 -0.02 0.00 -0.36 0.00 0.00 55.97 54.17 1ao8 s LYS 51 Cb 0.00 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 1ao8 s LYS 51 CO 0.04 -0.86 0.07 1.03 -0.36 0.00 0.00 175.35 175.27 1ao8 s ARG 52 N 1.39 3.12 0.64 4.03 0.52 -1.26 -3.94 118.95 123.44 1ao8 s ARG 52 Ca 0.02 -0.39 -0.08 0.00 -0.52 0.00 0.00 55.73 54.76 1ao8 s ARG 52 Cb -0.22 -2.91 0.02 0.00 0.52 0.00 0.00 34.95 32.37 1ao8 s ARG 52 CO 0.02 0.69 0.98 -1.25 0.02 0.00 0.00 175.30 175.75 1ao8 s PRO 53 N -1.36 2.79 -0.11 3.54 0.04 -1.26 -5.10 135.00 133.55 1ao8 s PRO 53 Ca 0.19 0.10 -0.30 0.00 0.04 0.00 0.00 61.00 61.03 1ao8 s PRO 53 Cb -0.12 -2.18 -0.01 0.00 0.04 0.00 0.00 34.50 32.23 1ao8 s PRO 53 CO 0.09 -0.88 1.07 -0.51 0.04 0.00 0.00 177.00 176.81 1ao8 s LEU 54 N -5.14 4.24 0.89 -3.56 1.43 -1.25 -5.03 118.68 110.25 1ao8 s LEU 54 Ca 0.56 1.59 -0.14 0.00 -1.03 0.00 0.00 54.13 55.12 1ao8 s LEU 54 Cb -0.11 -3.55 0.14 0.00 0.03 0.00 0.00 46.19 42.70 1ao8 s LEU 54 CO 0.47 -0.52 1.22 -2.16 0.23 0.00 0.00 176.35 175.59 1ao8 s PRO 55 N 2.25 1.25 -1.70 1.29 0.04 -1.26 -4.18 135.00 132.70 1ao8 s PRO 55 Ca 0.50 -0.05 0.00 0.00 0.04 0.00 0.00 61.00 61.49 1ao8 s PRO 55 Cb -0.20 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1ao8 s PRO 55 CO 0.17 -2.06 0.00 0.39 0.04 0.00 0.00 177.00 175.55 1ao8 n GLU 56 N -3.60 -1.56 -3.60 4.56 -0.58 -1.26 -4.92 120.64 109.68 1ao8 n GLU 56 Ca 0.10 0.96 0.00 0.00 -0.42 0.00 0.00 57.16 57.81 1ao8 n GLU 56 Cb 0.60 -5.54 -0.01 0.00 -0.57 0.00 0.00 31.44 25.92 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 -4.94 0.19 -0.06 3.49 1.70 -1.26 -4.03 118.95 114.05 1ao8 s ARG 57 Ca 0.00 -0.09 -0.16 0.00 -0.47 0.00 0.00 55.73 55.01 1ao8 s ARG 57 Cb 0.00 0.07 -0.05 0.00 -0.57 0.00 0.00 34.95 34.40 1ao8 s ARG 57 CO 0.00 -0.09 0.43 0.99 -1.08 0.00 0.00 175.30 175.55 1ao8 s THR 58 N -2.22 5.11 -0.17 4.99 2.01 -1.22 -4.93 115.64 119.21 1ao8 s THR 58 Ca 0.13 0.86 -0.06 0.00 0.31 0.00 0.00 61.69 62.93 1ao8 s THR 58 Cb 0.03 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1ao8 s THR 58 CO -0.05 0.46 0.02 0.20 -0.69 0.00 0.00 174.62 174.57 1ao8 s ASN 59 N -0.27 5.26 -0.25 3.53 0.01 -1.26 -1.93 114.94 120.03 1ao8 s ASN 59 Ca 0.24 -0.02 -0.02 0.00 -0.71 0.00 0.00 52.86 52.35 1ao8 s ASN 59 Cb -0.16 -1.89 0.08 0.00 0.41 0.00 0.00 41.25 39.69 1ao8 s ASN 59 CO 0.11 0.17 0.06 -0.69 -1.51 0.00 0.00 177.10 175.24 1ao8 s VAL 60 N 0.40 0.68 -0.05 1.60 1.01 -0.74 -0.50 120.40 122.80 1ao8 s VAL 60 Ca 0.00 -0.93 -0.16 0.00 0.00 0.00 0.00 61.98 60.89 1ao8 s VAL 60 Cb -0.13 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.88 1ao8 s VAL 60 CO 0.01 -0.42 0.42 -0.69 0.00 0.00 0.00 175.10 174.43 1ao8 s VAL 61 N 1.76 5.09 -0.27 2.92 1.01 -0.88 -1.60 120.40 128.43 1ao8 s VAL 61 Ca 0.03 0.86 0.02 0.00 0.00 0.00 0.00 61.98 62.89 1ao8 s VAL 61 Cb -0.17 -3.74 0.07 0.00 0.00 0.00 0.00 36.38 32.54 1ao8 s VAL 61 CO -0.17 0.48 -0.04 -0.22 0.00 0.00 0.00 175.10 175.16 1ao8 s LEU 62 N -0.41 3.16 0.31 3.92 2.96 -0.67 -2.46 118.68 125.49 1ao8 s LEU 62 Ca 0.24 -1.44 0.05 0.00 -0.22 0.00 0.00 54.13 52.76 1ao8 s LEU 62 Cb -0.16 -1.33 -0.03 0.00 0.50 0.00 0.00 46.19 45.17 1ao8 s LEU 62 CO 0.12 -0.26 0.23 0.28 -1.32 0.00 0.00 176.35 175.40 1ao8 s THR 63 N 1.25 0.06 -0.32 3.68 -1.32 -1.26 -4.06 115.64 113.68 1ao8 s THR 63 Ca -0.03 -2.00 0.08 0.00 -1.21 0.00 0.00 61.69 58.53 1ao8 s THR 63 Cb -0.19 -2.49 0.53 0.00 -1.51 0.00 0.00 72.50 68.84 1ao8 s THR 63 CO -0.08 0.00 1.54 0.00 -2.21 0.00 0.00 174.62 173.87 1ao8 n HIS 64 N -0.58 1.40 -4.97 9.09 1.44 -1.26 -4.75 115.22 115.59 1ao8 n HIS 64 Ca 0.05 -1.64 -0.32 0.00 -2.01 0.00 0.00 57.72 53.79 1ao8 n HIS 64 Cb 0.63 -0.56 -0.14 0.00 0.12 0.00 0.00 29.99 30.03 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 -3.26 2.79 -0.43 -1.40 2.00 -1.26 -5.01 119.66 113.10 1ao8 s GLN 65 Ca 0.47 -0.75 0.05 0.00 -2.00 0.00 0.00 55.36 53.12 1ao8 s GLN 65 Cb 0.42 -2.39 0.63 0.00 0.80 0.00 0.00 33.01 32.47 1ao8 s GLN 65 CO 0.01 0.43 1.84 0.39 -0.50 0.00 0.00 175.29 177.46 1ao8 n GLU 66 N 2.87 2.19 -0.91 1.67 1.02 -1.26 -4.31 120.64 121.91 1ao8 n GLU 66 Ca -0.18 -3.06 0.05 0.00 -0.02 0.00 0.00 57.16 53.95 1ao8 n GLU 66 Cb 0.52 -2.12 0.10 0.00 -0.02 0.00 0.00 31.44 29.93 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 -1.14 1.29 -4.72 1.62 9.92 -1.26 -5.05 116.55 117.21 1ao8 n ASP 67 Ca 0.55 -2.83 -0.37 0.00 -0.53 0.00 0.00 54.79 51.61 1ao8 n ASP 67 Cb 1.52 -0.39 -0.06 0.00 -0.64 0.00 0.00 41.12 41.55 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 1ao8 s TYR 68 N -1.51 3.49 -0.59 1.24 5.04 -1.26 -5.02 117.35 118.74 1ao8 s TYR 68 Ca 0.32 0.79 0.06 0.00 -2.44 0.00 0.00 57.07 55.79 1ao8 s TYR 68 Cb 0.33 -2.49 0.21 0.00 0.35 0.00 0.00 41.96 40.37 1ao8 s TYR 68 CO -0.09 0.18 0.58 1.04 -1.34 0.00 0.00 175.55 175.92 1ao8 n GLN 69 N 3.67 1.73 -3.72 4.97 6.02 -1.26 -5.02 117.38 123.77 1ao8 n GLN 69 Ca -0.09 -4.20 -0.36 0.00 -0.01 0.00 0.00 57.00 52.34 1ao8 n GLN 69 Cb 0.52 -2.03 -0.10 0.00 1.02 0.00 0.00 30.24 29.65 1ao8 n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ao8 s ALA 70 N -1.64 3.55 0.81 -1.58 0.00 -1.26 -5.08 121.76 116.57 1ao8 s ALA 70 Ca 0.33 -3.22 -0.11 0.00 0.00 0.00 0.00 51.96 48.97 1ao8 s ALA 70 Cb 0.08 -2.64 0.08 0.00 0.00 0.00 0.00 23.12 20.64 1ao8 s ALA 70 CO -0.10 -2.08 1.11 -0.65 0.00 0.00 0.00 175.76 174.04 1ao8 s GLN 71 N 0.00 1.89 0.00 0.00 -0.21 -1.26 -3.50 119.66 116.59 1ao8 s GLN 71 Ca 0.16 1.31 0.00 0.00 0.02 0.00 0.00 55.36 56.85 1ao8 s GLN 71 Cb -0.20 -1.85 0.00 0.00 1.00 0.00 0.00 33.01 31.96 1ao8 s GLN 71 CO -0.03 -1.94 0.00 0.41 -2.12 0.00 0.00 175.29 171.61 1ao8 n GLY 72 N -0.71 0.56 3.37 3.09 0.00 -1.26 -4.70 105.19 105.55 1ao8 n GLY 72 Ca 0.10 -0.13 -0.18 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 1.46 -0.52 4.61 0.00 -1.23 -4.68 121.76 119.40 1ao8 s ALA 73 Ca 0.00 -1.88 -0.02 0.00 0.00 0.00 0.00 51.96 50.06 1ao8 s ALA 73 Cb 0.00 1.35 0.14 0.00 0.00 0.00 0.00 23.12 24.60 1ao8 s ALA 73 CO 0.00 -0.72 0.32 0.08 0.00 0.00 0.00 175.76 175.44 1ao8 s VAL 74 N -3.19 3.40 -0.34 0.00 1.01 0.34 -5.00 120.40 116.62 1ao8 s VAL 74 Ca 0.37 -2.61 -0.26 0.00 0.00 0.00 0.00 61.98 59.48 1ao8 s VAL 74 Cb 0.01 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 33.12 1ao8 s VAL 74 CO 0.26 -0.79 0.94 -0.69 0.00 0.00 0.00 175.10 174.82 1ao8 s VAL 75 N 0.43 4.61 0.42 2.92 1.01 -1.26 -2.07 120.40 126.46 1ao8 s VAL 75 Ca 0.13 1.37 0.07 0.00 0.00 0.00 0.00 61.98 63.55 1ao8 s VAL 75 Cb -0.22 -4.32 -0.06 0.00 0.00 0.00 0.00 36.38 31.78 1ao8 s VAL 75 CO -0.04 -0.45 0.08 0.68 0.00 0.00 0.00 175.10 175.37 1ao8 s VAL 76 N 3.41 2.06 -0.13 2.92 -7.23 -1.03 -4.98 120.40 115.41 1ao8 s VAL 76 Ca 0.39 -1.88 0.21 0.00 -1.81 0.00 0.00 61.98 58.89 1ao8 s VAL 76 Cb -0.13 -2.94 0.42 0.00 0.56 0.00 0.00 36.38 34.29 1ao8 s VAL 76 CO 0.16 0.00 1.16 1.41 -0.31 0.00 0.00 175.10 177.52 1ao8 n HIS 77 N -1.09 0.31 -3.65 2.82 8.25 -1.26 -4.14 115.22 116.45 1ao8 n HIS 77 Ca -0.04 -1.24 -0.05 0.00 -0.26 0.00 0.00 57.72 56.13 1ao8 n HIS 77 Cb 0.66 0.02 -0.07 0.00 1.12 0.00 0.00 29.99 31.73 1ao8 n HIS 77 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1ao8 s ASP 78 N -2.54 -0.80 0.35 0.41 1.01 -1.26 -5.03 116.67 108.81 1ao8 s ASP 78 Ca 0.26 1.34 0.04 0.00 0.71 0.00 0.00 52.55 54.90 1ao8 s ASP 78 Cb 0.33 1.79 0.63 0.00 1.01 0.00 0.00 42.92 46.69 1ao8 s ASP 78 CO -0.10 -0.22 1.92 0.58 0.21 0.00 0.00 175.17 177.55 1ao8 h VAL 79 N 5.90 1.18 -0.18 -1.27 2.07 -1.99 -2.05 116.25 119.91 1ao8 h VAL 79 Ca -0.20 -0.63 -0.13 0.00 0.82 0.00 0.00 66.70 66.56 1ao8 h VAL 79 Cb 1.12 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1ao8 h VAL 79 CO 0.13 0.23 -0.45 0.00 0.02 0.00 0.00 177.57 177.50 1ao8 h ALA 80 N 1.54 0.88 -0.50 1.67 0.00 -1.99 -2.94 119.26 117.92 1ao8 h ALA 80 Ca 0.14 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 1ao8 h ALA 80 Cb 0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1ao8 h ALA 80 CO -0.00 0.65 -0.00 0.00 0.00 0.00 0.00 179.25 179.89 1ao8 h ALA 81 N 1.15 1.06 -0.26 0.00 0.00 -1.79 -2.31 119.26 117.11 1ao8 h ALA 81 Ca 0.03 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1ao8 h ALA 81 Cb 0.94 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1ao8 h ALA 81 CO 0.08 0.59 -0.01 0.28 0.00 0.00 0.00 179.25 180.19 1ao8 h VAL 82 N 0.78 1.17 -0.08 0.00 2.07 -1.28 -2.00 116.25 116.91 1ao8 h VAL 82 Ca 0.15 -0.65 -0.16 0.00 0.82 0.00 0.00 66.70 66.86 1ao8 h VAL 82 Cb 0.47 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1ao8 h VAL 82 CO 0.02 0.22 -0.64 -0.26 0.02 0.00 0.00 177.57 176.93 1ao8 h PHE 83 N 0.37 0.38 -0.12 1.57 0.04 -1.33 -3.01 116.94 114.85 1ao8 h PHE 83 Ca 0.08 -0.15 -0.11 0.00 2.80 0.00 0.00 57.97 60.59 1ao8 h PHE 83 Cb 0.27 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 1ao8 h PHE 83 CO 0.01 0.85 -0.41 0.00 -0.60 0.00 0.00 178.31 178.15 1ao8 h ALA 84 N 1.11 1.09 -0.65 2.45 0.00 -0.93 -2.25 119.26 120.07 1ao8 h ALA 84 Ca -0.01 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1ao8 h ALA 84 Cb 1.17 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1ao8 h ALA 84 CO 0.10 0.60 0.19 -0.92 0.00 0.00 0.00 179.25 179.22 1ao8 h TYR 85 N 0.22 1.04 -0.02 0.00 3.20 -1.28 -2.15 116.97 117.97 1ao8 h TYR 85 Ca 0.02 -0.10 -0.17 0.00 3.14 0.00 0.00 58.73 61.62 1ao8 h TYR 85 Cb 0.83 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 1ao8 h TYR 85 CO 0.02 0.84 -0.74 0.00 -1.64 0.00 0.00 178.16 176.63 1ao8 h ALA 86 N 1.23 0.71 -0.62 1.82 0.00 -1.47 -2.92 119.26 118.02 1ao8 h ALA 86 Ca 0.21 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 1ao8 h ALA 86 Cb 0.30 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1ao8 h ALA 86 CO -0.01 0.84 0.11 0.87 0.00 0.00 0.00 179.25 181.07 1ao8 h LYS 87 N 0.10 1.00 -0.01 0.00 1.57 -0.93 -2.40 116.57 115.90 1ao8 h LYS 87 Ca -0.02 -0.24 -0.11 0.00 -1.87 0.00 0.00 60.65 58.40 1ao8 h LYS 87 Cb 1.30 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 1ao8 h LYS 87 CO 0.11 0.91 -0.52 1.96 -0.57 0.00 0.00 179.45 181.34 1ao8 h GLN 88 N 0.95 0.03 -3.69 3.15 4.20 -1.35 -3.37 115.11 115.02 1ao8 h GLN 88 Ca 0.19 -0.02 -0.66 0.00 0.06 0.00 0.00 58.65 58.23 1ao8 h GLN 88 Cb 0.39 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 27.78 1ao8 h GLN 88 CO 0.01 0.54 -0.57 -1.01 -0.67 0.00 0.00 178.83 177.13 1ao8 s HIS 89 N -3.85 3.35 0.10 2.96 3.76 -0.90 -4.91 115.29 115.80 1ao8 s HIS 89 Ca -0.02 -2.99 0.11 0.00 -0.15 0.00 0.00 55.06 52.01 1ao8 s HIS 89 Cb 0.13 -2.96 0.08 0.00 1.11 0.00 0.00 32.58 30.94 1ao8 s HIS 89 CO 0.75 -0.81 1.44 -1.00 -0.85 0.00 0.00 174.74 174.28 1ao8 h PRO 90 N 6.89 0.00 -0.04 8.40 0.14 -1.73 -3.20 132.00 142.47 1ao8 h PRO 90 Ca -0.06 0.00 -0.03 0.00 0.14 0.00 0.00 66.00 66.05 1ao8 h PRO 90 Cb 0.93 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.07 1ao8 h PRO 90 CO 0.67 0.74 -0.12 -0.44 0.14 0.00 0.00 178.00 178.99 1ao8 h ASP 91 N 0.00 0.05 -2.62 1.44 5.19 -1.91 -3.42 116.42 115.15 1ao8 h ASP 91 Ca -0.01 -0.01 -0.47 0.00 -0.62 0.00 0.00 57.03 55.93 1ao8 h ASP 91 Cb 1.43 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.94 1ao8 h ASP 91 CO 0.10 0.18 -0.26 -1.10 -3.12 0.00 0.00 179.24 175.04 1ao8 s GLN 92 N -4.77 3.46 0.16 3.56 -0.21 -1.21 -4.98 119.66 115.67 1ao8 s GLN 92 Ca -0.04 -0.47 0.11 0.00 0.02 0.00 0.00 55.36 54.98 1ao8 s GLN 92 Cb 0.16 -2.73 -0.04 0.00 1.00 0.00 0.00 33.01 31.40 1ao8 s GLN 92 CO 0.70 0.22 -0.25 -1.21 -2.12 0.00 0.00 175.29 172.62 1ao8 s GLU 93 N -4.22 1.44 -0.05 2.91 0.41 -1.26 -4.90 118.70 113.02 1ao8 s GLU 93 Ca 0.38 -1.42 -0.25 0.00 -0.41 0.00 0.00 54.97 53.27 1ao8 s GLU 93 Cb -0.09 -1.85 -0.03 0.00 -1.78 0.00 0.00 34.13 30.37 1ao8 s GLU 93 CO 0.34 0.42 0.77 -1.17 -0.49 0.00 0.00 175.26 175.13 1ao8 s LEU 94 N -2.33 4.33 -0.13 1.80 2.96 -1.26 -0.28 118.68 123.77 1ao8 s LEU 94 Ca 0.17 1.30 0.03 0.00 -0.22 0.00 0.00 54.13 55.41 1ao8 s LEU 94 Cb -0.09 -3.20 0.01 0.00 0.50 0.00 0.00 46.19 43.40 1ao8 s LEU 94 CO 0.08 -0.15 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.05 1ao8 s VAL 95 N 0.87 1.95 -0.30 1.68 1.01 -0.43 -1.08 120.40 124.10 1ao8 s VAL 95 Ca 0.41 -0.92 -0.10 0.00 0.00 0.00 0.00 61.98 61.37 1ao8 s VAL 95 Cb -0.19 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.45 1ao8 s VAL 95 CO 0.20 0.53 0.17 -0.63 0.00 0.00 0.00 175.10 175.37 1ao8 s ILE 96 N 0.76 4.93 -0.12 2.22 -1.09 -1.04 -0.77 121.20 126.09 1ao8 s ILE 96 Ca -0.09 -0.14 0.14 0.00 -2.23 0.00 0.00 60.65 58.32 1ao8 s ILE 96 Cb -0.16 -3.43 -0.19 0.00 -1.58 0.00 0.00 42.46 37.10 1ao8 s ILE 96 CO 0.00 0.16 0.12 0.00 -1.23 0.00 0.00 174.94 173.98 1ao8 n ALA 97 N 5.02 1.85 0.00 9.38 0.00 -1.04 -2.01 120.51 133.72 1ao8 n ALA 97 Ca -0.14 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.47 1ao8 n ALA 97 Cb 0.51 -0.17 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 1.99 -0.44 0.00 0.00 0.00 -1.26 -4.83 105.19 100.65 1ao8 n GLY 98 Ca -0.19 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.35 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 -0.41 0.31 -0.02 0.00 -1.26 -1.03 105.19 102.78 1ao8 n GLY 99 Ca 0.00 -1.52 -0.03 0.00 0.00 0.00 0.00 46.02 44.47 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 1.21 -0.53 4.61 0.00 -1.92 -1.77 119.26 118.86 1ao8 h ALA 100 Ca 0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1ao8 h ALA 100 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1ao8 h ALA 100 CO 0.00 0.55 0.15 1.96 0.00 0.00 0.00 179.25 181.91 1ao8 h GLN 101 N 0.83 0.79 -0.21 0.00 4.20 -1.99 -2.14 115.11 116.59 1ao8 h GLN 101 Ca 0.18 -0.15 -0.18 0.00 0.06 0.00 0.00 58.65 58.57 1ao8 h GLN 101 Cb 0.27 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 1ao8 h GLN 101 CO -0.00 0.70 -0.59 0.82 -0.67 0.00 0.00 178.83 179.09 1ao8 h ILE 102 N 0.77 1.30 -0.66 2.54 1.08 -1.67 -2.66 117.51 118.23 1ao8 h ILE 102 Ca 0.18 -1.82 -0.03 0.00 -0.39 0.00 0.00 64.86 62.80 1ao8 h ILE 102 Cb 0.25 1.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.74 1ao8 h ILE 102 CO -0.01 0.57 0.30 -0.26 -0.69 0.00 0.00 178.15 178.06 1ao8 h PHE 103 N 0.51 0.94 -0.02 1.37 0.04 -0.89 -1.88 116.94 117.01 1ao8 h PHE 103 Ca 0.00 -0.04 -0.12 0.00 2.80 0.00 0.00 57.97 60.61 1ao8 h PHE 103 Cb 1.16 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 39.01 1ao8 h PHE 103 CO 0.06 0.70 -0.55 1.15 -0.60 0.00 0.00 178.31 179.07 1ao8 h THR 104 N 0.93 1.39 -0.61 -1.55 2.02 -1.30 -2.99 112.91 110.81 1ao8 h THR 104 Ca 0.23 -1.88 -0.08 0.00 0.77 0.00 0.00 66.41 65.44 1ao8 h THR 104 Cb 0.13 1.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 1ao8 h THR 104 CO -0.03 0.54 0.06 0.00 0.37 0.00 0.00 175.52 176.47 1ao8 h ALA 105 N 1.40 0.81 -0.91 6.16 0.00 -0.99 -2.74 119.26 122.99 1ao8 h ALA 105 Ca -0.00 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 54.05 1ao8 h ALA 105 Cb 0.99 -0.23 -0.27 0.00 0.00 0.00 0.00 17.79 18.28 1ao8 h ALA 105 CO 0.07 0.60 0.75 1.19 0.00 0.00 0.00 179.25 181.86 1ao8 n PHE 106 N -4.25 2.91 0.07 0.00 3.01 -0.99 -4.44 117.46 113.77 1ao8 n PHE 106 Ca 0.03 -2.55 -0.07 0.00 1.01 0.00 0.00 57.45 55.87 1ao8 n PHE 106 Cb 0.31 -1.24 -0.10 0.00 -0.01 0.00 0.00 39.48 38.44 1ao8 n PHE 106 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1ao8 h LYS 107 N 1.64 0.02 -1.01 -1.08 3.64 -1.34 -3.23 116.57 115.20 1ao8 h LYS 107 Ca 0.56 -0.04 -0.55 0.00 -1.27 0.00 0.00 60.65 59.36 1ao8 h LYS 107 Cb 1.34 0.01 -0.29 0.00 -0.41 0.00 0.00 32.23 32.89 1ao8 h LYS 107 CO 1.33 0.98 0.70 -0.25 -2.27 0.00 0.00 179.45 179.95 1ao8 n ASP 108 N -3.41 4.91 -2.74 4.20 8.00 -1.26 -4.60 116.55 121.66 1ao8 n ASP 108 Ca -0.01 -3.60 -0.05 0.00 0.71 0.00 0.00 54.79 51.84 1ao8 n ASP 108 Cb 0.92 -0.88 0.03 0.00 -0.02 0.00 0.00 41.12 41.17 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 -1.00 -2.94 -3.59 -2.24 8.00 -1.22 -5.15 116.55 108.41 1ao8 n ASP 109 Ca 0.58 -2.67 -0.16 0.00 0.71 0.00 0.00 54.79 53.25 1ao8 n ASP 109 Cb 1.33 1.58 -0.07 0.00 -0.02 0.00 0.00 41.12 43.94 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 0.80 0.01 0.15 2.53 0.11 -1.26 -4.88 120.40 117.86 1ao8 s VAL 110 Ca 0.29 -0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 1ao8 s VAL 110 Cb 0.08 -0.92 0.00 0.00 -1.53 0.00 0.00 36.38 34.01 1ao8 s VAL 110 CO -0.11 -0.03 0.00 0.47 -3.33 0.00 0.00 175.10 172.10 1ao8 n ASP 111 N 1.48 0.55 -4.77 3.54 9.92 -1.26 -5.03 116.55 120.98 1ao8 n ASP 111 Ca -0.18 0.24 -0.39 0.00 -0.53 0.00 0.00 54.79 53.94 1ao8 n ASP 111 Cb 0.56 -0.04 -0.06 0.00 -0.64 0.00 0.00 41.12 40.94 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 -2.00 4.83 -0.37 -3.53 2.01 -1.26 -3.34 115.64 111.99 1ao8 s THR 112 Ca 0.00 1.29 0.04 0.00 0.31 0.00 0.00 61.69 63.33 1ao8 s THR 112 Cb 0.00 -3.95 0.10 0.00 0.01 0.00 0.00 72.50 68.66 1ao8 s THR 112 CO 0.00 0.45 0.08 -0.76 -0.69 0.00 0.00 174.62 173.70 1ao8 s LEU 113 N -0.42 4.56 -0.19 4.42 1.43 -0.87 -1.39 118.68 126.21 1ao8 s LEU 113 Ca 0.31 -2.26 -0.20 0.00 -1.03 0.00 0.00 54.13 50.95 1ao8 s LEU 113 Cb -0.19 -1.59 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1ao8 s LEU 113 CO 0.18 -0.36 0.58 -0.76 0.23 0.00 0.00 176.35 176.23 1ao8 s LEU 114 N 0.76 4.16 0.03 1.79 1.43 0.44 -2.43 118.68 124.86 1ao8 s LEU 114 Ca 0.12 0.79 0.01 0.00 -1.03 0.00 0.00 54.13 54.02 1ao8 s LEU 114 Cb -0.20 -2.82 -0.02 0.00 0.03 0.00 0.00 46.19 43.18 1ao8 s LEU 114 CO -0.08 -0.21 -0.05 0.54 0.23 0.00 0.00 176.35 176.78 1ao8 s VAL 115 N 1.66 0.30 -0.44 -1.59 0.11 -1.04 -2.36 120.40 117.04 1ao8 s VAL 115 Ca 0.27 -0.87 -0.04 0.00 -2.93 0.00 0.00 61.98 58.41 1ao8 s VAL 115 Cb -0.16 -0.39 0.12 0.00 -1.53 0.00 0.00 36.38 34.42 1ao8 s VAL 115 CO 0.10 -0.37 0.25 -0.89 -3.33 0.00 0.00 175.10 170.86 1ao8 s THR 116 N -1.24 3.49 -0.18 5.04 2.01 -0.91 -1.63 115.64 122.22 1ao8 s THR 116 Ca -0.11 -2.07 -0.29 0.00 0.31 0.00 0.00 61.69 59.53 1ao8 s THR 116 Cb -0.09 -3.37 -0.00 0.00 0.01 0.00 0.00 72.50 69.05 1ao8 s THR 116 CO -0.00 -0.72 1.13 -0.13 -0.69 0.00 0.00 174.62 174.20 1ao8 s ARG 117 N 1.10 4.27 0.28 4.92 0.52 -0.80 -2.24 118.95 127.01 1ao8 s ARG 117 Ca 0.08 1.49 -0.02 0.00 -0.52 0.00 0.00 55.73 56.77 1ao8 s ARG 117 Cb -0.23 -3.67 0.06 0.00 0.52 0.00 0.00 34.95 31.63 1ao8 s ARG 117 CO -0.04 -0.62 0.39 1.28 0.02 0.00 0.00 175.30 176.34 1ao8 n LEU 118 N 6.23 0.00 0.00 2.53 4.32 -0.85 -0.49 117.00 128.74 1ao8 n LEU 118 Ca 0.12 -0.68 -0.00 0.00 -0.02 0.00 0.00 56.01 55.43 1ao8 n LEU 118 Cb 0.46 -0.27 -0.00 0.00 -1.62 0.00 0.00 43.42 41.99 1ao8 n LEU 118 CO 0.54 -0.72 -0.46 0.00 -1.22 0.00 0.00 177.39 175.53 1ao8 n ALA 119 N -3.06 2.97 -1.78 -1.18 0.00 -1.04 -4.43 120.51 111.99 1ao8 n ALA 119 Ca -0.06 -0.02 -0.35 0.00 0.00 0.00 0.00 53.44 53.01 1ao8 n ALA 119 Cb 0.21 0.47 -0.01 0.00 0.00 0.00 0.00 19.45 20.12 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 -4.90 2.64 0.56 0.00 0.00 -0.97 -4.77 107.32 99.88 1ao8 s GLY 120 Ca -0.01 0.80 -0.08 0.00 0.00 0.00 0.00 44.72 45.43 1ao8 s GLY 120 CO 0.01 1.17 0.92 -1.35 0.00 0.00 0.00 173.10 173.85 1ao8 s SER 121 N -1.74 6.16 0.09 1.64 1.04 -1.26 -4.65 113.70 114.98 1ao8 s SER 121 Ca 0.70 1.15 -0.11 0.00 0.48 0.00 0.00 55.95 58.16 1ao8 s SER 121 Cb -0.23 -2.30 0.01 0.00 0.10 0.00 0.00 66.02 63.60 1ao8 s SER 121 CO 0.27 -0.79 0.26 -0.36 0.98 0.00 0.00 173.24 173.61 1ao8 s PHE 122 N -2.99 0.02 0.13 5.02 0.08 -1.26 -5.10 117.98 113.86 1ao8 s PHE 122 Ca 0.52 -0.37 0.05 0.00 0.12 0.00 0.00 56.93 57.25 1ao8 s PHE 122 Cb -0.11 0.05 -0.04 0.00 -0.57 0.00 0.00 43.02 42.35 1ao8 s PHE 122 CO 0.49 -0.58 0.07 -2.00 -0.10 0.00 0.00 175.22 173.10 1ao8 s GLU 123 N -3.63 2.73 0.00 0.44 2.12 -1.26 -4.90 118.70 114.20 1ao8 s GLU 123 Ca 0.03 -0.85 0.00 0.00 0.36 0.00 0.00 54.97 54.51 1ao8 s GLU 123 Cb 0.03 -2.60 0.00 0.00 0.26 0.00 0.00 34.13 31.82 1ao8 s GLU 123 CO -0.10 0.52 0.00 0.41 -0.54 0.00 0.00 175.26 175.54 1ao8 n GLY 124 N 0.13 -1.24 0.01 -1.50 0.00 -1.26 -4.84 105.19 96.48 1ao8 n GLY 124 Ca -0.09 -0.94 -0.01 0.00 0.00 0.00 0.00 46.02 44.98 1ao8 n GLY 124 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ao8 n ASP 125 N 0.25 3.97 -4.71 1.61 2.03 -1.25 -5.00 116.55 113.45 1ao8 n ASP 125 Ca 0.00 -0.01 -0.42 0.00 0.52 0.00 0.00 54.79 54.88 1ao8 n ASP 125 Cb 0.00 0.05 -0.03 0.00 -0.72 0.00 0.00 41.12 40.42 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1ao8 s THR 126 N -2.04 3.57 0.22 5.18 2.01 -1.09 -5.02 115.64 118.48 1ao8 s THR 126 Ca -0.02 1.12 0.05 0.00 0.31 0.00 0.00 61.69 63.15 1ao8 s THR 126 Cb 0.01 -3.72 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 1ao8 s THR 126 CO 0.05 0.08 -0.05 -0.54 -0.69 0.00 0.00 174.62 173.47 1ao8 s LYS 127 N 1.16 1.34 0.28 4.92 3.01 -1.26 -2.36 119.74 126.83 1ao8 s LYS 127 Ca 0.63 -1.65 -0.26 0.00 -1.01 0.00 0.00 55.97 53.67 1ao8 s LYS 127 Cb -0.34 -0.81 -0.09 0.00 -1.01 0.00 0.00 37.83 35.58 1ao8 s LYS 127 CO 0.30 -0.00 0.90 1.41 0.51 0.00 0.00 175.35 178.47 1ao8 s MET 128 N -3.78 4.59 0.88 1.68 1.75 -1.20 -4.78 119.30 118.44 1ao8 s MET 128 Ca 0.26 1.29 -0.12 0.00 -1.25 0.00 0.00 55.69 55.87 1ao8 s MET 128 Cb 0.04 -2.94 0.12 0.00 2.84 0.00 0.00 34.83 34.89 1ao8 s MET 128 CO 0.08 0.36 1.10 0.96 -0.65 0.00 0.00 175.02 176.87 1ao8 s ILE 129 N -1.48 2.68 -0.74 10.11 -4.36 -1.26 -4.95 121.20 121.19 1ao8 s ILE 129 Ca 0.46 0.22 -0.27 0.00 -0.26 0.00 0.00 60.65 60.81 1ao8 s ILE 129 Cb -0.20 -2.81 0.03 0.00 1.25 0.00 0.00 42.46 40.73 1ao8 s ILE 129 CO 0.25 -0.29 1.28 -2.16 0.24 0.00 0.00 174.94 174.26 1ao8 s PRO 130 N -5.04 3.19 0.62 0.37 0.04 -1.26 -5.02 135.00 127.91 1ao8 s PRO 130 Ca 0.63 -0.26 0.02 0.00 0.04 0.00 0.00 61.00 61.43 1ao8 s PRO 130 Cb -0.17 -4.19 0.08 0.00 0.04 0.00 0.00 34.50 30.26 1ao8 s PRO 130 CO 0.56 -2.14 0.86 -0.51 0.04 0.00 0.00 177.00 175.81 1ao8 s LEU 131 N 5.70 3.14 -0.21 -3.56 1.43 -1.26 -5.06 118.68 118.85 1ao8 s LEU 131 Ca 0.35 -0.31 -0.17 0.00 -1.03 0.00 0.00 54.13 52.97 1ao8 s LEU 131 Cb -0.08 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.82 1ao8 s LEU 131 CO 0.15 -1.47 0.43 0.21 0.23 0.00 0.00 176.35 175.90 1ao8 s ASN 132 N -4.59 6.45 -0.07 2.29 3.84 -1.26 -4.93 114.94 116.66 1ao8 s ASN 132 Ca 0.62 0.53 0.13 0.00 0.21 0.00 0.00 52.86 54.35 1ao8 s ASN 132 Cb -0.07 -2.25 -0.19 0.00 -0.55 0.00 0.00 41.25 38.19 1ao8 s ASN 132 CO 0.41 -0.13 0.18 0.79 -2.79 0.00 0.00 177.10 175.56 1ao8 n TRP 133 N 4.72 0.00 0.24 0.43 7.02 -1.26 -4.43 117.44 124.16 1ao8 n TRP 133 Ca -0.07 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.53 1ao8 n TRP 133 Cb 0.51 -0.48 0.74 0.00 -2.42 0.00 0.00 31.31 29.65 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 -0.94 -0.99 3.58 -2.04 -0.23 116.42 115.80 1ao8 h ASP 134 Ca -0.18 0.00 -0.48 0.00 0.42 0.00 0.00 57.03 56.79 1ao8 h ASP 134 Cb 1.22 0.00 -0.29 0.00 1.72 0.00 0.00 39.33 41.99 1ao8 h ASP 134 CO 0.01 0.00 0.61 0.47 -2.88 0.00 0.00 179.24 177.45 1ao8 n ASP 135 N -4.27 3.76 -3.94 2.28 8.00 -1.26 -4.93 116.55 116.19 1ao8 n ASP 135 Ca -0.01 -3.51 -0.09 0.00 0.71 0.00 0.00 54.79 51.88 1ao8 n ASP 135 Cb 0.16 -0.82 -0.07 0.00 -0.02 0.00 0.00 41.12 40.37 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 -3.11 0.36 0.07 1.24 0.40 -0.10 -3.92 117.98 112.91 1ao8 s PHE 136 Ca 0.54 -0.73 -0.13 0.00 -0.60 0.00 0.00 56.93 56.01 1ao8 s PHE 136 Cb 0.45 -0.04 0.02 0.00 0.51 0.00 0.00 43.02 43.96 1ao8 s PHE 136 CO 0.11 -0.71 0.30 0.99 0.70 0.00 0.00 175.22 176.60 1ao8 s THR 137 N -3.96 0.09 0.45 0.64 2.01 -0.82 -4.91 115.64 109.14 1ao8 s THR 137 Ca 0.16 -0.76 -0.20 0.00 0.31 0.00 0.00 61.69 61.20 1ao8 s THR 137 Cb 0.03 -1.05 -0.10 0.00 0.01 0.00 0.00 72.50 71.39 1ao8 s THR 137 CO -0.01 -0.42 0.96 -0.75 -0.69 0.00 0.00 174.62 173.72 1ao8 s LYS 138 N -3.00 4.15 0.09 4.92 2.20 -1.26 -1.59 119.74 125.26 1ao8 s LYS 138 Ca -0.02 1.13 0.00 0.00 -0.36 0.00 0.00 55.97 56.72 1ao8 s LYS 138 Cb 0.01 -2.17 0.00 0.00 -1.51 0.00 0.00 37.83 34.16 1ao8 s LYS 138 CO -0.06 -0.10 0.00 0.28 -0.36 0.00 0.00 175.35 175.11 1ao8 n VAL 139 N -0.78 0.38 -4.38 4.02 0.31 -1.01 -4.87 118.33 112.01 1ao8 n VAL 139 Ca 0.07 0.13 -0.29 0.00 -0.01 0.00 0.00 64.34 64.24 1ao8 n VAL 139 Cb 0.54 -0.88 -0.12 0.00 -0.91 0.00 0.00 33.84 32.46 1ao8 n VAL 139 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ao8 s SER 140 N -5.11 3.45 -0.09 4.52 0.15 -1.22 -5.03 113.70 110.38 1ao8 s SER 140 Ca 0.00 -0.74 -0.10 0.00 0.70 0.00 0.00 55.95 55.81 1ao8 s SER 140 Cb 0.00 -0.29 0.02 0.00 -1.71 0.00 0.00 66.02 64.05 1ao8 s SER 140 CO 0.00 0.17 0.26 -0.55 1.20 0.00 0.00 173.24 174.32 1ao8 s SER 141 N -2.22 -0.25 -0.18 5.45 0.15 -1.26 -1.63 113.70 113.76 1ao8 s SER 141 Ca 0.16 0.44 -0.03 0.00 0.70 0.00 0.00 55.95 57.23 1ao8 s SER 141 Cb -0.10 0.50 0.06 0.00 -1.71 0.00 0.00 66.02 64.77 1ao8 s SER 141 CO 0.08 -0.15 0.04 -0.60 1.20 0.00 0.00 173.24 173.81 1ao8 s ARG 142 N -0.11 0.56 0.11 5.44 3.52 -0.33 -5.00 118.95 123.15 1ao8 s ARG 142 Ca -0.02 -0.33 -0.26 0.00 -0.13 0.00 0.00 55.73 54.99 1ao8 s ARG 142 Cb -0.03 -1.98 -0.07 0.00 -1.56 0.00 0.00 34.95 31.32 1ao8 s ARG 142 CO 0.01 -0.62 0.79 0.99 -0.81 0.00 0.00 175.30 175.66 1ao8 s THR 143 N 1.91 4.54 -0.15 4.11 2.01 -1.26 -1.01 115.64 125.79 1ao8 s THR 143 Ca -0.00 1.72 -0.01 0.00 0.31 0.00 0.00 61.69 63.71 1ao8 s THR 143 Cb -0.17 -4.15 0.04 0.00 0.01 0.00 0.00 72.50 68.23 1ao8 s THR 143 CO -0.08 0.43 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.55 1ao8 s VAL 144 N -0.53 0.94 -0.31 3.82 1.01 -0.38 -4.97 120.40 119.98 1ao8 s VAL 144 Ca 0.38 -0.49 -0.19 0.00 0.00 0.00 0.00 61.98 61.69 1ao8 s VAL 144 Cb -0.22 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.02 1ao8 s VAL 144 CO 0.25 0.13 0.56 -0.70 0.00 0.00 0.00 175.10 175.34 1ao8 s GLU 145 N 1.71 3.86 0.19 2.72 -6.30 -1.26 -2.51 118.70 117.11 1ao8 s GLU 145 Ca 0.02 0.16 -0.03 0.00 -2.50 0.00 0.00 54.97 52.61 1ao8 s GLU 145 Cb -0.15 -3.73 0.04 0.00 0.00 0.00 0.00 34.13 30.29 1ao8 s GLU 145 CO -0.07 -0.53 0.26 -3.47 0.02 0.00 0.00 175.26 171.47 1ao8 n ASP 146 N 5.75 0.06 -0.09 -1.70 2.03 -1.26 -4.94 116.55 116.40 1ao8 n ASP 146 Ca -0.03 -1.12 -0.01 0.00 0.52 0.00 0.00 54.79 54.15 1ao8 n ASP 146 Cb 0.49 -0.20 0.26 0.00 -0.72 0.00 0.00 41.12 40.95 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 -1.05 1.20 -1.96 5.18 1.35 -1.97 -3.43 112.91 112.22 1ao8 h THR 147 Ca -0.09 -0.66 -0.53 0.00 -0.55 0.00 0.00 66.41 64.59 1ao8 h THR 147 Cb 0.25 0.65 -0.06 0.00 -1.73 0.00 0.00 68.15 67.26 1ao8 h THR 147 CO 0.06 0.25 -0.52 0.20 -0.25 0.00 0.00 175.52 175.26 1ao8 s ASN 148 N -6.61 4.97 0.11 5.36 -0.87 -1.26 -5.03 114.94 111.61 1ao8 s ASN 148 Ca -0.09 -0.59 0.07 0.00 -1.57 0.00 0.00 52.86 50.67 1ao8 s ASN 148 Cb 0.16 -0.92 -0.21 0.00 -0.02 0.00 0.00 41.25 40.26 1ao8 s ASN 148 CO 0.78 -0.24 1.26 1.55 -2.57 0.00 0.00 177.10 177.88 1ao8 h PRO 149 N 1.49 0.01 0.00 -0.60 0.13 -2.00 -3.27 132.00 127.76 1ao8 h PRO 149 Ca -0.45 -0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 64.57 1ao8 h PRO 149 Cb 1.25 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1ao8 h PRO 149 CO 0.61 0.99 -0.45 0.00 -0.23 0.00 0.00 178.00 178.92 1ao8 h ALA 150 N 0.99 0.71 -0.86 -0.56 0.00 -1.95 -3.22 119.26 114.37 1ao8 h ALA 150 Ca -0.02 -0.41 -0.45 0.00 0.00 0.00 0.00 54.91 54.04 1ao8 h ALA 150 Cb 1.78 -0.07 -0.27 0.00 0.00 0.00 0.00 17.79 19.24 1ao8 h ALA 150 CO 0.13 0.56 0.57 1.28 0.00 0.00 0.00 179.25 181.79 1ao8 n LEU 151 N -3.22 6.21 -4.85 0.00 4.77 -1.23 -2.30 117.00 116.37 1ao8 n LEU 151 Ca 0.02 -3.31 -0.32 0.00 -0.03 0.00 0.00 56.01 52.38 1ao8 n LEU 151 Cb 0.71 -0.79 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1ao8 n LEU 151 CO 0.40 0.97 0.56 -0.89 -1.33 0.00 0.00 177.39 177.10 1ao8 s THR 152 N -2.83 4.63 -0.03 -5.08 2.01 -1.22 -4.33 115.64 108.80 1ao8 s THR 152 Ca 0.49 0.99 -0.12 0.00 0.31 0.00 0.00 61.69 63.36 1ao8 s THR 152 Cb 0.41 -3.70 0.02 0.00 0.01 0.00 0.00 72.50 69.24 1ao8 s THR 152 CO 0.09 -0.53 0.26 -1.38 -0.69 0.00 0.00 174.62 172.37 1ao8 s HIS 153 N -2.41 -0.15 -0.11 4.92 -3.43 -1.05 -2.51 115.29 110.55 1ao8 s HIS 153 Ca 0.56 0.25 -0.01 0.00 -0.80 0.00 0.00 55.06 55.06 1ao8 s HIS 153 Cb -0.10 0.06 0.04 0.00 -1.43 0.00 0.00 32.58 31.14 1ao8 s HIS 153 CO 0.28 -0.32 -0.01 0.99 -2.00 0.00 0.00 174.74 173.68 1ao8 s THR 154 N -1.06 0.58 0.06 -5.38 2.01 0.36 -1.25 115.64 110.98 1ao8 s THR 154 Ca -0.11 -0.16 -0.31 0.00 0.31 0.00 0.00 61.69 61.42 1ao8 s THR 154 Cb -0.05 -0.80 -0.06 0.00 0.01 0.00 0.00 72.50 71.60 1ao8 s THR 154 CO 0.03 0.17 1.21 -0.31 -0.69 0.00 0.00 174.62 175.03 1ao8 s TYR 155 N 1.87 3.41 -0.11 4.92 2.02 -0.18 -1.90 117.35 127.38 1ao8 s TYR 155 Ca 0.03 1.27 0.01 0.00 -0.37 0.00 0.00 57.07 58.02 1ao8 s TYR 155 Cb -0.14 -3.44 0.02 0.00 -0.40 0.00 0.00 41.96 38.00 1ao8 s TYR 155 CO -0.07 -1.37 -0.14 -1.21 -1.57 0.00 0.00 175.55 171.19 1ao8 s GLU 156 N 1.09 2.15 -0.43 -0.62 2.02 -0.65 -1.18 118.70 121.08 1ao8 s GLU 156 Ca 0.59 -0.53 -0.08 0.00 0.02 0.00 0.00 54.97 54.97 1ao8 s GLU 156 Cb -0.30 -1.85 0.10 0.00 0.10 0.00 0.00 34.13 32.17 1ao8 s GLU 156 CO 0.29 -0.08 0.28 0.08 0.02 0.00 0.00 175.26 175.85 1ao8 s VAL 157 N 1.05 4.10 0.20 2.63 1.01 -0.64 -2.51 120.40 126.24 1ao8 s VAL 157 Ca -0.05 -1.61 -0.07 0.00 0.00 0.00 0.00 61.98 60.25 1ao8 s VAL 157 Cb -0.15 -3.61 -0.06 0.00 0.00 0.00 0.00 36.38 32.56 1ao8 s VAL 157 CO -0.02 -0.62 0.47 0.26 0.00 0.00 0.00 175.10 175.18 1ao8 s TRP 158 N 1.37 3.45 0.03 5.22 0.52 -1.02 -2.39 118.94 126.13 1ao8 s TRP 158 Ca 0.04 0.69 0.01 0.00 0.02 0.00 0.00 56.10 56.86 1ao8 s TRP 158 Cb -0.24 -2.11 -0.02 0.00 -1.15 0.00 0.00 33.47 29.94 1ao8 s TRP 158 CO 0.00 0.34 -0.06 -0.65 0.02 0.00 0.00 176.95 176.60 1ao8 s GLN 159 N -2.84 0.45 0.34 4.98 -0.21 -0.62 -2.06 119.66 119.70 1ao8 s GLN 159 Ca 0.44 -0.72 -0.26 0.00 0.02 0.00 0.00 55.36 54.84 1ao8 s GLN 159 Cb -0.12 -0.12 -0.10 0.00 1.00 0.00 0.00 33.01 33.68 1ao8 s GLN 159 CO 0.24 0.00 0.98 0.21 -2.12 0.00 0.00 175.29 174.60 1ao8 s LYS 160 N -1.63 4.49 0.04 2.91 2.20 -1.21 -1.94 119.74 124.59 1ao8 s LYS 160 Ca -0.12 1.39 -0.18 0.00 -0.36 0.00 0.00 55.97 56.71 1ao8 s LYS 160 Cb -0.09 -2.75 -0.20 0.00 -1.51 0.00 0.00 37.83 33.28 1ao8 s LYS 160 CO -0.01 0.17 1.18 0.87 -0.36 0.00 0.00 175.35 177.21 1ao8 h LYS 161 N 3.02 0.53 0.00 4.03 1.57 -1.92 -3.47 116.57 120.33 1ao8 h LYS 161 Ca -0.47 -0.49 0.00 0.00 -1.87 0.00 0.00 60.65 57.82 1ao8 h LYS 161 Cb 1.20 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1ao8 h LYS 161 CO 0.64 1.12 0.00 0.00 -0.57 0.00 0.00 179.45 180.64