#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 -0.96 0.15 2.41 0.00 -0.07 -4.16 121.76 119.13 1ao8 s ALA 2 Ca 0.00 1.27 -0.13 0.00 0.00 0.00 0.00 51.96 53.10 1ao8 s ALA 2 Cb 0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 23.12 22.29 1ao8 s ALA 2 CO 0.00 -0.22 0.53 -0.06 0.00 0.00 0.00 175.76 176.01 1ao8 s PHE 3 N 0.80 3.58 -0.27 0.00 0.40 0.11 -0.91 117.98 121.69 1ao8 s PHE 3 Ca -0.05 1.00 -0.04 0.00 -0.60 0.00 0.00 56.93 57.24 1ao8 s PHE 3 Cb -0.06 -2.33 0.15 0.00 0.51 0.00 0.00 43.02 41.30 1ao8 s PHE 3 CO -0.06 0.42 0.52 -1.17 0.70 0.00 0.00 175.22 175.63 1ao8 s LEU 4 N -2.08 -1.04 0.23 -0.37 2.96 -0.76 -0.99 118.68 116.64 1ao8 s LEU 4 Ca 0.39 0.84 -0.14 0.00 -0.22 0.00 0.00 54.13 55.00 1ao8 s LEU 4 Cb -0.14 1.79 0.00 0.00 0.50 0.00 0.00 46.19 48.34 1ao8 s LEU 4 CO 0.19 -0.26 0.48 -1.66 -1.32 0.00 0.00 176.35 173.78 1ao8 s TRP 5 N 2.75 0.25 -0.10 5.38 -2.14 -1.00 -4.25 118.94 119.82 1ao8 s TRP 5 Ca 0.11 -0.61 0.02 0.00 2.66 0.00 0.00 56.10 58.28 1ao8 s TRP 5 Cb -0.14 0.23 -0.02 0.00 -3.10 0.00 0.00 33.47 30.45 1ao8 s TRP 5 CO -0.18 -0.97 -0.17 0.00 -2.66 0.00 0.00 176.95 172.98 1ao8 s ALA 6 N -3.98 2.50 0.15 2.67 0.00 -1.26 -2.23 121.76 119.61 1ao8 s ALA 6 Ca 0.19 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 51.15 1ao8 s ALA 6 Cb -0.01 -1.02 -0.02 0.00 0.00 0.00 0.00 23.12 22.07 1ao8 s ALA 6 CO 0.06 0.35 0.17 1.14 0.00 0.00 0.00 175.76 177.48 1ao8 s GLN 7 N 0.01 1.03 0.28 0.00 -2.07 -1.00 -4.41 119.66 113.50 1ao8 s GLN 7 Ca -0.05 -1.29 0.04 0.00 -1.82 0.00 0.00 55.36 52.23 1ao8 s GLN 7 Cb -0.15 0.31 0.04 0.00 -1.09 0.00 0.00 33.01 32.12 1ao8 s GLN 7 CO 0.05 -0.34 0.29 -0.40 -1.32 0.00 0.00 175.29 173.57 1ao8 n ASP 8 N -0.15 1.47 0.24 12.60 5.68 -1.14 -2.01 116.55 133.24 1ao8 n ASP 8 Ca -0.07 -1.85 0.08 0.00 -0.50 0.00 0.00 54.79 52.45 1ao8 n ASP 8 Cb 0.63 -0.11 0.60 0.00 -1.14 0.00 0.00 41.12 41.11 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 0.02 0.11 0.11 -1.80 -2.78 114.38 110.04 1ao8 h ARG 9 Ca -0.15 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.93 1ao8 h ARG 9 Cb 0.62 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.70 1ao8 h ARG 9 CO 0.23 0.11 -0.01 -0.44 0.10 0.00 0.00 179.97 179.96 1ao8 h ASP 10 N 0.00 -0.03 0.00 0.08 3.32 -1.92 -3.48 116.42 114.39 1ao8 h ASP 10 Ca -0.00 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1ao8 h ASP 10 Cb 0.21 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1ao8 h ASP 10 CO 0.01 0.47 0.00 0.61 -1.72 0.00 0.00 179.24 178.61 1ao8 n GLY 11 N 0.25 1.26 3.75 2.75 0.00 -1.05 -5.08 105.19 107.06 1ao8 n GLY 11 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 1ao8 n GLY 11 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ao8 n LEU 12 N 0.00 4.53 -0.04 0.99 7.94 -1.26 -2.75 117.00 126.41 1ao8 n LEU 12 Ca 0.00 1.18 -0.04 0.00 -1.11 0.00 0.00 56.01 56.03 1ao8 n LEU 12 Cb 0.00 -1.57 -0.07 0.00 0.53 0.00 0.00 43.42 42.31 1ao8 n LEU 12 CO 0.00 -0.17 -0.79 2.30 -1.11 0.00 0.00 177.39 177.62 1ao8 n ILE 13 N 0.14 0.62 -2.62 1.96 -5.35 -0.20 -2.90 119.36 111.00 1ao8 n ILE 13 Ca 0.04 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 62.13 1ao8 n ILE 13 Cb 0.39 -0.75 0.00 0.00 -1.74 0.00 0.00 39.64 37.54 1ao8 n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ao8 n GLY 14 N 2.44 2.55 3.58 3.28 0.00 -1.13 -4.79 105.19 111.12 1ao8 n GLY 14 Ca -0.15 -0.94 -0.04 0.00 0.00 0.00 0.00 46.02 44.90 1ao8 n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ao8 s LYS 15 N -0.70 0.57 -1.75 1.61 2.20 0.19 -3.45 119.74 118.41 1ao8 s LYS 15 Ca 0.00 1.31 0.00 0.00 -0.36 0.00 0.00 55.97 56.92 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 0.00 -0.19 0.00 -0.25 -0.36 0.00 0.00 175.35 174.55 1ao8 n ASP 16 N 5.06 -5.32 0.00 1.43 8.00 -1.26 -1.76 116.55 122.70 1ao8 n ASP 16 Ca -0.14 0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.53 1ao8 n ASP 16 Cb 0.52 -4.54 0.00 0.00 -0.02 0.00 0.00 41.12 37.08 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 -0.77 2.55 3.94 0.44 0.00 -1.26 -5.00 105.19 105.09 1ao8 n GLY 17 Ca -0.21 -0.61 -0.24 0.00 0.00 0.00 0.00 46.02 44.96 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 3.13 0.28 1.61 -3.43 -0.72 -4.84 115.29 110.89 1ao8 s HIS 18 Ca 0.00 0.35 -0.17 0.00 -0.80 0.00 0.00 55.06 54.45 1ao8 s HIS 18 Cb 0.00 -2.64 -0.09 0.00 -1.43 0.00 0.00 32.58 28.42 1ao8 s HIS 18 CO 0.00 -0.73 0.73 -0.51 -2.00 0.00 0.00 174.74 172.22 1ao8 s LEU 19 N -4.82 4.17 0.15 5.38 1.43 -1.26 0.55 118.68 124.28 1ao8 s LEU 19 Ca 0.53 1.32 0.08 0.00 -1.03 0.00 0.00 54.13 55.03 1ao8 s LEU 19 Cb -0.10 -3.88 -0.13 0.00 0.03 0.00 0.00 46.19 42.10 1ao8 s LEU 19 CO 0.41 -0.11 1.32 1.55 0.23 0.00 0.00 176.35 179.75 1ao8 h PRO 20 N 2.70 0.00 0.00 1.29 0.13 -1.87 -3.46 132.00 130.80 1ao8 h PRO 20 Ca -0.48 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.42 1ao8 h PRO 20 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1ao8 h PRO 20 CO 0.65 0.93 -0.12 -2.67 -0.23 0.00 0.00 178.00 176.56 1ao8 n TRP 21 N -3.39 -0.90 -3.45 1.56 2.14 -1.26 -5.12 117.44 107.02 1ao8 n TRP 21 Ca 0.00 -0.91 -0.20 0.00 2.07 0.00 0.00 57.50 58.46 1ao8 n TRP 21 Cb 0.89 -0.17 -0.11 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 -1.15 -0.24 -0.79 -2.67 2.46 -1.26 -5.07 115.29 106.57 1ao8 s HIS 22 Ca 0.10 -0.31 0.00 0.00 0.47 0.00 0.00 55.06 55.32 1ao8 s HIS 22 Cb -0.01 -0.56 0.19 0.00 -0.13 0.00 0.00 32.58 32.07 1ao8 s HIS 22 CO 0.06 -0.86 0.63 -1.17 -2.47 0.00 0.00 174.74 170.93 1ao8 s LEU 23 N 2.29 5.25 0.49 8.88 2.96 -1.26 -4.92 118.68 132.37 1ao8 s LEU 23 Ca 0.09 -3.61 0.30 0.00 -0.22 0.00 0.00 54.13 50.70 1ao8 s LEU 23 Cb -0.15 -1.81 1.40 0.00 0.50 0.00 0.00 46.19 46.13 1ao8 s LEU 23 CO -0.32 -0.18 1.79 -0.65 -1.32 0.00 0.00 176.35 175.67 1ao8 h PRO 24 N 6.01 0.13 -0.72 0.98 0.10 -2.00 0.16 132.00 136.65 1ao8 h PRO 24 Ca 0.12 -0.01 -0.03 0.00 0.10 0.00 0.00 66.00 66.18 1ao8 h PRO 24 Cb 0.82 -0.03 -0.03 0.00 0.10 0.00 0.00 31.00 31.86 1ao8 h PRO 24 CO 0.79 0.09 0.31 0.22 0.10 0.00 0.00 178.00 179.51 1ao8 h ASP 25 N 0.13 0.97 0.10 -2.05 1.82 -2.00 -1.93 116.42 113.47 1ao8 h ASP 25 Ca 0.58 -0.16 -0.02 0.00 -0.39 0.00 0.00 57.03 57.04 1ao8 h ASP 25 Cb 2.00 -0.25 -0.00 0.00 0.68 0.00 0.00 39.33 41.76 1ao8 h ASP 25 CO -0.12 0.86 -0.09 -0.78 -1.61 0.00 0.00 179.24 177.50 1ao8 h ASP 26 N 1.02 0.00 0.16 2.28 1.82 -1.09 -1.36 116.42 119.25 1ao8 h ASP 26 Ca 0.24 0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.80 1ao8 h ASP 26 Cb 0.17 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.17 1ao8 h ASP 26 CO -0.02 0.09 -0.29 -0.07 -1.61 0.00 0.00 179.24 177.33 1ao8 h LEU 27 N 0.00 0.22 -0.32 2.28 3.38 -1.33 -1.45 115.31 118.09 1ao8 h LEU 27 Ca -0.00 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1ao8 h LEU 27 Cb 0.16 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1ao8 h LEU 27 CO 0.01 0.52 0.10 0.45 0.09 0.00 0.00 178.44 179.61 1ao8 h HIS 28 N 0.20 0.52 -0.01 1.13 3.86 -1.15 -1.56 115.15 118.14 1ao8 h HIS 28 Ca 0.03 -0.05 -0.12 0.00 -1.16 0.00 0.00 60.37 59.07 1ao8 h HIS 28 Cb 0.63 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 1ao8 h HIS 28 CO 0.01 0.53 -0.55 -0.92 0.86 0.00 0.00 177.93 177.85 1ao8 h TYR 29 N 0.36 0.05 -0.60 2.45 3.20 -1.48 -2.93 116.97 118.02 1ao8 h TYR 29 Ca 0.10 -0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.86 1ao8 h TYR 29 Cb 0.25 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 1ao8 h TYR 29 CO 0.01 0.58 -0.00 0.35 -1.64 0.00 0.00 178.16 177.46 1ao8 h PHE 30 N 0.03 1.16 -0.33 -3.82 3.57 -0.93 -1.63 116.94 114.99 1ao8 h PHE 30 Ca -0.00 -0.20 -0.08 0.00 3.53 0.00 0.00 57.97 61.21 1ao8 h PHE 30 Cb 0.99 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.41 1ao8 h PHE 30 CO 0.00 1.02 -0.14 -0.09 -2.23 0.00 0.00 178.31 176.88 1ao8 h ARG 31 N 0.96 0.57 0.00 1.11 2.43 -1.16 -2.49 114.38 115.80 1ao8 h ARG 31 Ca 0.17 -0.18 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 1ao8 h ARG 31 Cb 0.56 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1ao8 h ARG 31 CO 0.03 0.70 -0.61 0.00 -1.51 0.00 0.00 179.97 178.58 1ao8 h ALA 32 N 1.33 0.97 -0.94 2.80 0.00 -1.31 -2.67 119.26 119.45 1ao8 h ALA 32 Ca 0.09 -0.55 -0.60 0.00 0.00 0.00 0.00 54.91 53.85 1ao8 h ALA 32 Cb 0.54 -0.10 -0.28 0.00 0.00 0.00 0.00 17.79 17.96 1ao8 h ALA 32 CO 0.03 0.76 0.77 1.04 0.00 0.00 0.00 179.25 181.86 1ao8 n GLN 33 N -3.77 2.47 0.00 0.00 1.13 -0.64 -4.35 117.38 112.22 1ao8 n GLN 33 Ca -0.01 -3.02 0.00 0.00 -1.94 0.00 0.00 57.00 52.03 1ao8 n GLN 33 Cb 0.62 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.78 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 -1.66 5.09 -2.24 -1.13 -4.98 114.28 108.51 1ao8 n THR 34 Ca 0.58 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.94 1ao8 n THR 34 Cb 0.91 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.93 1ao8 n THR 34 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1ao8 n VAL 35 N -2.03 0.76 -1.11 2.28 0.24 -1.02 -1.55 118.33 115.90 1ao8 n VAL 35 Ca 0.00 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.15 1ao8 n VAL 35 Cb 0.00 -2.34 0.00 0.00 -1.47 0.00 0.00 33.84 30.03 1ao8 n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ao8 n GLY 36 N 4.62 0.95 1.67 7.63 0.00 -1.26 -5.01 105.19 113.77 1ao8 n GLY 36 Ca 0.21 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.27 0.31 -3.60 1.61 4.76 -0.60 -4.65 118.16 114.73 1ao8 n LYS 37 Ca 0.00 -1.48 -0.40 0.00 -2.87 0.00 0.00 58.31 53.56 1ao8 n LYS 37 Cb 0.25 1.36 -0.09 0.00 -1.84 0.00 0.00 35.03 34.71 1ao8 n LYS 37 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1ao8 s ILE 38 N -2.64 4.13 -0.37 -0.18 1.01 -0.57 -2.97 121.20 119.60 1ao8 s ILE 38 Ca 0.16 -1.62 -0.29 0.00 0.00 0.00 0.00 60.65 58.91 1ao8 s ILE 38 Cb -0.00 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 38.85 1ao8 s ILE 38 CO 0.12 -0.63 1.24 -0.32 0.00 0.00 0.00 174.94 175.35 1ao8 s MET 39 N 1.37 3.82 -0.21 2.79 1.75 -0.30 -1.75 119.30 126.77 1ao8 s MET 39 Ca 0.04 0.97 -0.04 0.00 -1.25 0.00 0.00 55.69 55.41 1ao8 s MET 39 Cb -0.24 -3.89 -0.01 0.00 2.84 0.00 0.00 34.83 33.52 1ao8 s MET 39 CO 0.00 -1.25 -0.03 0.08 -0.65 0.00 0.00 175.02 173.17 1ao8 s VAL 40 N 4.51 3.53 0.12 10.11 1.01 -0.56 -0.71 120.40 138.41 1ao8 s VAL 40 Ca 0.53 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 61.99 1ao8 s VAL 40 Cb -0.13 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 1ao8 s VAL 40 CO 0.26 0.42 0.21 0.68 0.00 0.00 0.00 175.10 176.67 1ao8 s VAL 41 N 1.34 0.11 0.00 2.92 -7.23 -0.75 -2.50 120.40 114.29 1ao8 s VAL 41 Ca 0.04 -1.37 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 1ao8 s VAL 41 Cb -0.14 -1.64 0.00 0.00 0.56 0.00 0.00 36.38 35.16 1ao8 s VAL 41 CO -0.01 -0.50 0.00 0.61 -0.31 0.00 0.00 175.10 174.89 1ao8 n GLY 42 N -0.12 -0.02 0.07 2.32 0.00 -0.64 -1.97 105.19 104.83 1ao8 n GLY 42 Ca -0.11 -1.79 -0.07 0.00 0.00 0.00 0.00 46.02 44.05 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 0.00 -0.47 1.61 2.43 -1.93 -2.31 114.38 113.72 1ao8 h ARG 43 Ca 0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1ao8 h ARG 43 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1ao8 h ARG 43 CO 0.00 0.84 -0.13 0.00 -1.51 0.00 0.00 179.97 179.17 1ao8 h ARG 44 N 0.00 0.92 0.06 0.20 3.08 -1.94 -2.31 114.38 114.39 1ao8 h ARG 44 Ca -0.08 -0.36 -0.24 0.00 0.07 0.00 0.00 59.98 59.37 1ao8 h ARG 44 Cb 1.81 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.80 1ao8 h ARG 44 CO 0.11 1.01 -1.11 1.15 -1.07 0.00 0.00 179.97 180.06 1ao8 h THR 45 N 0.76 1.61 -0.59 2.04 2.02 -1.89 -3.09 112.91 113.77 1ao8 h THR 45 Ca 0.12 -3.25 -0.03 0.00 0.77 0.00 0.00 66.41 64.02 1ao8 h THR 45 Cb 0.69 2.89 -0.03 0.00 -1.74 0.00 0.00 68.15 69.96 1ao8 h THR 45 CO 0.05 0.94 0.24 0.22 0.37 0.00 0.00 175.52 177.34 1ao8 h TYR 46 N 0.04 0.86 0.00 3.16 3.20 -1.33 -1.75 116.97 121.15 1ao8 h TYR 46 Ca -0.07 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.72 1ao8 h TYR 46 Cb 1.86 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.86 1ao8 h TYR 46 CO 0.03 0.66 -0.19 0.93 -1.64 0.00 0.00 178.16 177.96 1ao8 h GLU 47 N 0.85 0.00 0.00 1.82 4.39 -1.46 -3.12 114.58 117.06 1ao8 h GLU 47 Ca 0.20 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.88 1ao8 h GLU 47 Cb 0.16 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1ao8 h GLU 47 CO -0.02 0.19 -0.10 0.77 -1.16 0.00 0.00 179.01 178.69 1ao8 h SER 48 N 0.00 0.00 -3.97 1.42 0.02 -1.23 -3.42 113.55 106.38 1ao8 h SER 48 Ca -0.00 0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.46 1ao8 h SER 48 Cb 0.98 0.00 0.03 0.00 0.14 0.00 0.00 62.40 63.55 1ao8 h SER 48 CO 0.02 0.10 0.44 -0.36 -1.14 0.00 0.00 176.83 175.90 1ao8 s PHE 49 N -4.58 3.15 -0.12 3.45 0.08 -1.18 -4.98 117.98 113.80 1ao8 s PHE 49 Ca -0.04 1.61 -0.13 0.00 0.12 0.00 0.00 56.93 58.48 1ao8 s PHE 49 Cb 0.15 -3.23 -0.12 0.00 -0.57 0.00 0.00 43.02 39.25 1ao8 s PHE 49 CO 0.63 -0.93 0.34 -1.00 -0.10 0.00 0.00 175.22 174.16 1ao8 h PRO 50 N 2.44 0.00 -4.28 0.24 0.13 -1.90 -3.41 132.00 125.22 1ao8 h PRO 50 Ca -0.49 0.00 -0.75 0.00 -0.87 0.00 0.00 66.00 63.90 1ao8 h PRO 50 Cb 1.23 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.13 1ao8 h PRO 50 CO 0.62 0.45 0.21 0.21 -0.23 0.00 0.00 178.00 179.26 1ao8 s LYS 51 N -1.86 3.41 -0.11 0.86 2.20 -1.26 -5.03 119.74 117.94 1ao8 s LYS 51 Ca -0.09 -1.99 -0.06 0.00 -0.36 0.00 0.00 55.97 53.47 1ao8 s LYS 51 Cb -0.01 -4.48 -0.04 0.00 -1.51 0.00 0.00 37.83 31.79 1ao8 s LYS 51 CO 0.31 -1.44 0.10 1.03 -0.36 0.00 0.00 175.35 175.00 1ao8 s ARG 52 N 1.36 3.33 0.62 4.03 0.52 -1.26 -4.09 118.95 123.47 1ao8 s ARG 52 Ca 0.18 -0.20 -0.08 0.00 -0.52 0.00 0.00 55.73 55.10 1ao8 s ARG 52 Cb -0.15 -3.09 0.14 0.00 0.52 0.00 0.00 34.95 32.37 1ao8 s ARG 52 CO -0.04 0.75 0.85 -0.35 0.02 0.00 0.00 175.30 176.53 1ao8 n PRO 53 N 2.04 -0.62 -3.34 3.54 -0.04 -1.26 -5.10 135.00 130.22 1ao8 n PRO 53 Ca -0.20 -1.53 -0.42 0.00 -0.04 0.00 0.00 63.50 61.32 1ao8 n PRO 53 Cb 0.55 -0.81 -0.09 0.00 -0.04 0.00 0.00 33.50 33.11 1ao8 n PRO 53 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ao8 s LEU 54 N 0.00 4.57 0.99 1.53 1.43 -1.26 -5.07 118.68 120.87 1ao8 s LEU 54 Ca 0.50 -0.36 -0.15 0.00 -1.03 0.00 0.00 54.13 53.09 1ao8 s LEU 54 Cb -0.02 -2.40 0.19 0.00 0.03 0.00 0.00 46.19 43.99 1ao8 s LEU 54 CO 0.35 -0.45 1.21 -2.16 0.23 0.00 0.00 176.35 175.52 1ao8 s PRO 55 N 2.13 0.48 -1.52 1.29 0.05 -1.26 -4.22 135.00 131.96 1ao8 s PRO 55 Ca 0.13 -0.09 -0.01 0.00 0.05 0.00 0.00 61.00 61.08 1ao8 s PRO 55 Cb -0.16 -1.80 0.00 0.00 0.05 0.00 0.00 34.50 32.59 1ao8 s PRO 55 CO 0.13 -2.57 0.18 -1.91 0.05 0.00 0.00 177.00 172.88 1ao8 n GLU 56 N -3.95 -2.45 -3.61 4.56 4.07 -1.26 -4.93 120.64 113.06 1ao8 n GLU 56 Ca 0.12 0.87 -0.01 0.00 -0.06 0.00 0.00 57.16 58.08 1ao8 n GLU 56 Cb 0.60 -5.44 -0.01 0.00 -0.06 0.00 0.00 31.44 26.52 1ao8 n GLU 56 CO 0.00 0.00 0.00 -0.98 -0.06 0.00 0.00 177.13 176.09 1ao8 s ARG 57 N -5.14 0.11 -0.19 5.31 1.70 -1.26 -4.16 118.95 115.32 1ao8 s ARG 57 Ca 0.09 -0.05 -0.23 0.00 -0.47 0.00 0.00 55.73 55.08 1ao8 s ARG 57 Cb -0.04 0.04 -0.02 0.00 -0.57 0.00 0.00 34.95 34.36 1ao8 s ARG 57 CO 0.11 -0.05 0.71 0.99 -1.08 0.00 0.00 175.30 175.98 1ao8 s THR 58 N -2.13 4.96 -0.01 4.99 2.01 -1.16 -4.97 115.64 119.33 1ao8 s THR 58 Ca 0.12 1.36 -0.13 0.00 0.31 0.00 0.00 61.69 63.35 1ao8 s THR 58 Cb 0.01 -4.02 -0.05 0.00 0.01 0.00 0.00 72.50 68.45 1ao8 s THR 58 CO -0.04 0.07 0.36 0.20 -0.69 0.00 0.00 174.62 174.52 1ao8 s ASN 59 N 1.21 6.72 -0.27 3.53 0.02 -1.26 -1.15 114.94 123.73 1ao8 s ASN 59 Ca 0.32 0.86 -0.03 0.00 -1.02 0.00 0.00 52.86 52.99 1ao8 s ASN 59 Cb -0.16 -2.21 0.10 0.00 0.02 0.00 0.00 41.25 39.00 1ao8 s ASN 59 CO 0.11 0.33 0.18 -0.69 0.02 0.00 0.00 177.10 177.04 1ao8 s VAL 60 N -1.10 -0.18 0.01 1.60 1.01 0.11 -2.31 120.40 119.53 1ao8 s VAL 60 Ca 0.23 -0.56 -0.08 0.00 0.00 0.00 0.00 61.98 61.57 1ao8 s VAL 60 Cb -0.16 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.26 1ao8 s VAL 60 CO 0.12 -0.56 0.29 -0.69 0.00 0.00 0.00 175.10 174.25 1ao8 s VAL 61 N 2.20 5.27 -0.26 2.92 1.01 -0.80 -1.81 120.40 128.94 1ao8 s VAL 61 Ca 0.08 0.25 -0.01 0.00 0.00 0.00 0.00 61.98 62.31 1ao8 s VAL 61 Cb -0.15 -3.58 0.08 0.00 0.00 0.00 0.00 36.38 32.73 1ao8 s VAL 61 CO -0.31 0.38 0.03 -0.22 0.00 0.00 0.00 175.10 174.99 1ao8 s LEU 62 N -1.70 2.20 0.00 3.92 2.96 -0.83 -2.44 118.68 122.79 1ao8 s LEU 62 Ca 0.27 -1.30 0.04 0.00 -0.22 0.00 0.00 54.13 52.93 1ao8 s LEU 62 Cb -0.13 -0.93 -0.02 0.00 0.50 0.00 0.00 46.19 45.61 1ao8 s LEU 62 CO 0.15 -0.33 0.16 1.07 -1.32 0.00 0.00 176.35 176.09 1ao8 n THR 63 N 4.81 0.00 -1.45 3.68 5.66 -1.25 -4.02 114.28 121.71 1ao8 n THR 63 Ca -0.07 -2.18 -0.06 0.00 -3.05 0.00 0.00 64.05 58.70 1ao8 n THR 63 Cb 0.44 0.85 0.20 0.00 -1.55 0.00 0.00 70.33 70.27 1ao8 n THR 63 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ao8 n HIS 64 N -0.78 1.22 -3.94 1.09 1.44 -1.26 -4.62 115.22 108.36 1ao8 n HIS 64 Ca -0.03 -1.63 -0.35 0.00 -2.01 0.00 0.00 57.72 53.70 1ao8 n HIS 64 Cb 0.56 -0.53 -0.14 0.00 0.12 0.00 0.00 29.99 30.00 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 2.72 0.00 -1.40 0.74 -1.26 -4.96 119.66 112.23 1ao8 s GLN 65 Ca 0.45 -1.06 0.23 0.00 0.05 0.00 0.00 55.36 55.03 1ao8 s GLN 65 Cb 0.41 -3.05 1.16 0.00 1.10 0.00 0.00 33.01 32.63 1ao8 s GLN 65 CO 0.00 -0.47 1.74 0.39 -0.55 0.00 0.00 175.29 176.41 1ao8 n GLU 66 N 4.66 0.35 -0.61 1.67 1.02 -1.26 -2.83 120.64 123.63 1ao8 n GLU 66 Ca -0.15 0.07 0.07 0.00 -0.02 0.00 0.00 57.16 57.12 1ao8 n GLU 66 Cb 0.46 -1.50 0.30 0.00 -0.02 0.00 0.00 31.44 30.68 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 -1.27 4.41 -4.41 1.62 9.92 -1.26 -4.85 116.55 120.71 1ao8 n ASP 67 Ca 0.11 -3.03 -0.45 0.00 -0.53 0.00 0.00 54.79 50.89 1ao8 n ASP 67 Cb 0.17 -0.60 -0.01 0.00 -0.64 0.00 0.00 41.12 40.04 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 -2.84 3.55 -0.51 1.24 5.04 -1.13 -4.99 117.35 117.71 1ao8 s TYR 68 Ca 0.46 -1.94 -0.24 0.00 -2.44 0.00 0.00 57.07 52.92 1ao8 s TYR 68 Cb 0.37 -4.13 0.04 0.00 0.35 0.00 0.00 41.96 38.59 1ao8 s TYR 68 CO 0.11 -1.28 0.89 -0.65 -1.34 0.00 0.00 175.55 173.28 1ao8 s GLN 69 N 1.22 3.38 -0.37 4.97 -0.21 -1.26 -4.91 119.66 122.48 1ao8 s GLN 69 Ca 0.32 -0.17 0.00 0.00 0.02 0.00 0.00 55.36 55.54 1ao8 s GLN 69 Cb -0.06 -4.00 0.10 0.00 1.00 0.00 0.00 33.01 30.05 1ao8 s GLN 69 CO -0.06 -1.33 0.12 0.00 -2.12 0.00 0.00 175.29 171.90 1ao8 s ALA 70 N 3.69 3.02 0.14 6.09 0.00 -1.26 -5.08 121.76 128.35 1ao8 s ALA 70 Ca 0.31 -2.51 -0.31 0.00 0.00 0.00 0.00 51.96 49.45 1ao8 s ALA 70 Cb -0.12 -2.18 -0.09 0.00 0.00 0.00 0.00 23.12 20.73 1ao8 s ALA 70 CO 0.21 -1.73 1.49 -0.65 0.00 0.00 0.00 175.76 175.09 1ao8 s GLN 71 N 1.03 4.26 0.00 0.00 -1.52 -1.26 -2.11 119.66 120.06 1ao8 s GLN 71 Ca 0.09 2.24 0.00 0.00 -1.95 0.00 0.00 55.36 55.74 1ao8 s GLN 71 Cb -0.21 -3.20 0.00 0.00 -0.22 0.00 0.00 33.01 29.38 1ao8 s GLN 71 CO -0.06 -0.54 0.00 0.41 -0.25 0.00 0.00 175.29 174.85 1ao8 n GLY 72 N 3.65 3.03 3.75 3.09 0.00 -1.26 -4.90 105.19 112.54 1ao8 n GLY 72 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.71 3.48 -0.97 4.61 0.00 -0.90 -4.65 121.76 120.61 1ao8 s ALA 73 Ca 0.00 -0.78 -0.20 0.00 0.00 0.00 0.00 51.96 50.98 1ao8 s ALA 73 Cb 0.00 -1.61 0.11 0.00 0.00 0.00 0.00 23.12 21.62 1ao8 s ALA 73 CO 0.00 0.61 1.24 0.08 0.00 0.00 0.00 175.76 177.70 1ao8 s VAL 74 N -0.98 4.50 -0.17 0.00 1.01 -0.98 -4.71 120.40 119.08 1ao8 s VAL 74 Ca 0.15 -1.40 -0.23 0.00 0.00 0.00 0.00 61.98 60.50 1ao8 s VAL 74 Cb -0.12 -4.87 -0.02 0.00 0.00 0.00 0.00 36.38 31.37 1ao8 s VAL 74 CO 0.05 -1.64 0.75 -0.69 0.00 0.00 0.00 175.10 173.56 1ao8 s VAL 75 N 3.32 4.94 0.15 2.92 1.01 -1.26 -1.90 120.40 129.58 1ao8 s VAL 75 Ca 0.37 1.45 0.01 0.00 0.00 0.00 0.00 61.98 63.81 1ao8 s VAL 75 Cb -0.03 -4.06 -0.00 0.00 0.00 0.00 0.00 36.38 32.29 1ao8 s VAL 75 CO -0.09 0.07 0.03 1.33 0.00 0.00 0.00 175.10 176.44 1ao8 n VAL 76 N 4.66 0.00 -2.56 2.92 0.24 -1.02 -4.99 118.33 117.58 1ao8 n VAL 76 Ca 0.02 -0.79 -0.01 0.00 -2.04 0.00 0.00 64.34 61.51 1ao8 n VAL 76 Cb 0.49 0.23 0.05 0.00 -1.47 0.00 0.00 33.84 33.14 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 -0.35 -0.28 -3.64 6.34 8.25 -1.26 -3.84 115.22 120.43 1ao8 n HIS 77 Ca -0.04 -1.38 -0.06 0.00 -0.26 0.00 0.00 57.72 55.98 1ao8 n HIS 77 Cb 0.21 0.50 -0.07 0.00 1.12 0.00 0.00 29.99 31.75 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 -2.07 -0.81 0.32 0.41 -1.08 -1.26 -5.03 116.67 107.15 1ao8 s ASP 78 Ca 0.17 1.32 0.02 0.00 -0.52 0.00 0.00 52.55 53.54 1ao8 s ASP 78 Cb 0.31 1.33 0.55 0.00 -1.46 0.00 0.00 42.92 43.65 1ao8 s ASP 78 CO -0.08 -0.21 1.89 0.58 0.52 0.00 0.00 175.17 177.86 1ao8 h VAL 79 N 4.88 1.20 -0.46 1.11 2.07 -2.00 -1.98 116.25 121.07 1ao8 h VAL 79 Ca -0.29 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.49 1ao8 h VAL 79 Cb 1.21 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1ao8 h VAL 79 CO 0.16 0.26 0.10 0.00 0.02 0.00 0.00 177.57 178.10 1ao8 h ALA 80 N 1.47 1.31 -0.54 1.67 0.00 -1.99 -2.33 119.26 118.86 1ao8 h ALA 80 Ca 0.15 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1ao8 h ALA 80 Cb 0.23 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ao8 h ALA 80 CO -0.01 0.48 -0.11 0.00 0.00 0.00 0.00 179.25 179.62 1ao8 h ALA 81 N 1.44 0.78 -0.40 0.00 0.00 -1.78 -0.86 119.26 118.44 1ao8 h ALA 81 Ca 0.15 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1ao8 h ALA 81 Cb 0.27 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1ao8 h ALA 81 CO -0.00 0.67 0.10 0.28 0.00 0.00 0.00 179.25 180.30 1ao8 h VAL 82 N 0.90 1.18 0.02 0.00 2.07 -1.07 -2.19 116.25 117.17 1ao8 h VAL 82 Ca 0.14 -0.63 -0.21 0.00 0.82 0.00 0.00 66.70 66.82 1ao8 h VAL 82 Cb 0.68 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1ao8 h VAL 82 CO 0.05 0.23 -0.96 -0.26 0.02 0.00 0.00 177.57 176.65 1ao8 h PHE 83 N 0.58 0.34 -0.58 1.57 0.04 -1.11 -3.20 116.94 114.57 1ao8 h PHE 83 Ca 0.13 -0.20 -0.05 0.00 2.80 0.00 0.00 57.97 60.66 1ao8 h PHE 83 Cb 0.21 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 1ao8 h PHE 83 CO 0.01 1.05 0.17 0.00 -0.60 0.00 0.00 178.31 178.94 1ao8 h ALA 84 N 0.88 1.22 -0.27 2.45 0.00 -0.58 -1.61 119.26 121.35 1ao8 h ALA 84 Ca -0.06 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 1ao8 h ALA 84 Cb 1.62 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.16 1ao8 h ALA 84 CO 0.15 0.55 -0.08 -0.92 0.00 0.00 0.00 179.25 178.95 1ao8 h TYR 85 N 0.85 0.45 -0.00 0.00 3.20 -1.42 -2.27 116.97 117.78 1ao8 h TYR 85 Ca 0.19 -0.05 -0.17 0.00 3.14 0.00 0.00 58.73 61.84 1ao8 h TYR 85 Cb 0.26 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1ao8 h TYR 85 CO 0.02 0.51 -0.78 0.00 -1.64 0.00 0.00 178.16 176.27 1ao8 h ALA 86 N 1.51 0.69 -0.66 1.82 0.00 -1.39 -2.97 119.26 118.27 1ao8 h ALA 86 Ca 0.08 -0.69 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 1ao8 h ALA 86 Cb 0.40 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1ao8 h ALA 86 CO 0.02 0.93 0.27 0.87 0.00 0.00 0.00 179.25 181.34 1ao8 h LYS 87 N 0.04 0.98 -0.03 0.00 1.57 -0.73 -2.29 116.57 116.11 1ao8 h LYS 87 Ca -0.02 -0.17 -0.10 0.00 -1.87 0.00 0.00 60.65 58.49 1ao8 h LYS 87 Cb 1.37 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1ao8 h LYS 87 CO 0.11 0.81 -0.45 1.96 -0.57 0.00 0.00 179.45 181.31 1ao8 h GLN 88 N 0.92 0.07 -3.60 3.15 4.20 -1.49 -3.36 115.11 115.01 1ao8 h GLN 88 Ca 0.22 -0.04 -0.66 0.00 0.06 0.00 0.00 58.65 58.24 1ao8 h GLN 88 Cb 0.20 -0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.58 1ao8 h GLN 88 CO -0.02 0.51 -0.59 -1.01 -0.67 0.00 0.00 178.83 177.06 1ao8 s HIS 89 N -4.03 3.31 0.13 2.96 3.76 -0.86 -4.91 115.29 115.64 1ao8 s HIS 89 Ca -0.03 -3.05 0.09 0.00 -0.15 0.00 0.00 55.06 51.92 1ao8 s HIS 89 Cb 0.14 -2.92 -0.02 0.00 1.11 0.00 0.00 32.58 30.89 1ao8 s HIS 89 CO 0.75 -0.79 1.39 -1.00 -0.85 0.00 0.00 174.74 174.24 1ao8 h PRO 90 N 6.77 0.00 -0.02 8.40 0.14 -1.71 -3.21 132.00 142.36 1ao8 h PRO 90 Ca -0.06 0.00 -0.03 0.00 0.14 0.00 0.00 66.00 66.04 1ao8 h PRO 90 Cb 0.92 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.06 1ao8 h PRO 90 CO 0.68 0.83 -0.14 0.22 0.14 0.00 0.00 178.00 179.73 1ao8 h ASP 91 N 0.00 0.03 -2.74 1.44 3.58 -1.91 -3.41 116.42 113.41 1ao8 h ASP 91 Ca -0.01 -0.00 -0.66 0.00 0.42 0.00 0.00 57.03 56.78 1ao8 h ASP 91 Cb 1.54 -0.01 -0.08 0.00 1.72 0.00 0.00 39.33 42.51 1ao8 h ASP 91 CO 0.11 0.17 -0.48 -1.10 -2.88 0.00 0.00 179.24 175.06 1ao8 s GLN 92 N -4.72 3.53 0.40 0.28 -0.21 -1.21 -5.00 119.66 112.72 1ao8 s GLN 92 Ca -0.04 -0.15 0.08 0.00 0.02 0.00 0.00 55.36 55.27 1ao8 s GLN 92 Cb 0.16 -3.21 -0.00 0.00 1.00 0.00 0.00 33.01 30.95 1ao8 s GLN 92 CO 0.70 0.71 0.49 -1.21 -2.12 0.00 0.00 175.29 173.86 1ao8 s GLU 93 N -0.84 2.82 -0.07 2.91 0.41 -1.26 -4.86 118.70 117.81 1ao8 s GLU 93 Ca 0.14 -1.26 -0.15 0.00 -0.41 0.00 0.00 54.97 53.29 1ao8 s GLU 93 Cb -0.12 -2.67 -0.05 0.00 -1.78 0.00 0.00 34.13 29.51 1ao8 s GLU 93 CO 0.03 -0.16 0.39 -1.17 -0.49 0.00 0.00 175.26 173.86 1ao8 s LEU 94 N -4.24 4.37 -0.11 1.80 2.96 -1.26 -1.52 118.68 120.68 1ao8 s LEU 94 Ca 0.51 0.82 0.01 0.00 -0.22 0.00 0.00 54.13 55.24 1ao8 s LEU 94 Cb -0.08 -2.55 0.02 0.00 0.50 0.00 0.00 46.19 44.08 1ao8 s LEU 94 CO 0.31 0.20 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.72 1ao8 s VAL 95 N -0.33 1.34 -0.25 1.68 1.01 -0.72 -0.90 120.40 122.24 1ao8 s VAL 95 Ca 0.22 -0.53 -0.12 0.00 0.00 0.00 0.00 61.98 61.56 1ao8 s VAL 95 Cb -0.15 -1.26 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 1ao8 s VAL 95 CO 0.10 0.41 0.24 -0.63 0.00 0.00 0.00 175.10 175.22 1ao8 s ILE 96 N 1.21 5.29 -0.11 2.22 -1.09 -0.09 -1.49 121.20 127.14 1ao8 s ILE 96 Ca -0.03 0.32 0.12 0.00 -2.23 0.00 0.00 60.65 58.83 1ao8 s ILE 96 Cb -0.14 -3.57 -0.18 0.00 -1.58 0.00 0.00 42.46 36.99 1ao8 s ILE 96 CO -0.04 0.28 0.10 0.00 -1.23 0.00 0.00 174.94 174.05 1ao8 n ALA 97 N 4.66 1.85 0.00 9.38 0.00 -1.04 -1.82 120.51 133.54 1ao8 n ALA 97 Ca -0.13 -0.77 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1ao8 n ALA 97 Cb 0.52 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 2.07 -1.07 0.00 0.00 0.00 -1.26 -4.73 105.19 100.20 1ao8 n GLY 98 Ca -0.18 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.12 -1.09 0.33 -0.02 0.00 -1.26 -1.61 105.19 101.41 1ao8 n GLY 99 Ca 0.00 -1.54 -0.03 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.45 4.61 0.00 -1.91 -1.96 119.26 118.77 1ao8 h ALA 100 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1ao8 h ALA 100 Cb 0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1ao8 h ALA 100 CO 0.00 0.58 0.10 0.37 0.00 0.00 0.00 179.25 180.31 1ao8 h GLN 101 N 1.00 0.67 -0.18 0.00 4.15 -1.97 -2.23 115.11 116.55 1ao8 h GLN 101 Ca 0.24 -0.12 -0.15 0.00 0.77 0.00 0.00 58.65 59.38 1ao8 h GLN 101 Cb 0.16 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.73 1ao8 h GLN 101 CO -0.02 0.61 -0.52 0.82 -1.93 0.00 0.00 178.83 177.78 1ao8 h ILE 102 N 0.65 1.32 -0.40 2.39 1.08 -1.65 -2.62 117.51 118.29 1ao8 h ILE 102 Ca 0.15 -1.77 -0.05 0.00 -0.39 0.00 0.00 64.86 62.80 1ao8 h ILE 102 Cb 0.25 1.75 -0.02 0.00 -3.07 0.00 0.00 36.82 35.74 1ao8 h ILE 102 CO -0.00 0.55 0.04 -0.26 -0.69 0.00 0.00 178.15 177.79 1ao8 h PHE 103 N 0.40 0.63 -0.02 1.37 0.04 -0.80 -2.19 116.94 116.37 1ao8 h PHE 103 Ca 0.01 -0.06 -0.15 0.00 2.80 0.00 0.00 57.97 60.57 1ao8 h PHE 103 Cb 1.05 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 39.00 1ao8 h PHE 103 CO 0.04 0.58 -0.68 1.15 -0.60 0.00 0.00 178.31 178.80 1ao8 h THR 104 N 0.59 1.45 -0.48 -1.55 2.02 -1.28 -3.17 112.91 110.50 1ao8 h THR 104 Ca 0.13 -2.24 -0.06 0.00 0.77 0.00 0.00 66.41 65.01 1ao8 h THR 104 Cb 0.31 2.19 -0.02 0.00 -1.74 0.00 0.00 68.15 68.90 1ao8 h THR 104 CO 0.01 0.65 0.05 0.00 0.37 0.00 0.00 175.52 176.60 1ao8 h ALA 105 N 1.22 0.64 -0.78 6.16 0.00 -1.03 -3.05 119.26 122.41 1ao8 h ALA 105 Ca -0.01 -0.25 -0.65 0.00 0.00 0.00 0.00 54.91 54.00 1ao8 h ALA 105 Cb 1.21 -0.18 -0.21 0.00 0.00 0.00 0.00 17.79 18.61 1ao8 h ALA 105 CO 0.10 0.39 0.92 1.19 0.00 0.00 0.00 179.25 181.85 1ao8 n PHE 106 N -4.41 2.32 -0.03 0.00 3.72 -0.99 -4.46 117.46 113.61 1ao8 n PHE 106 Ca 0.01 -2.24 -0.09 0.00 -0.05 0.00 0.00 57.45 55.09 1ao8 n PHE 106 Cb 0.27 -1.35 -0.14 0.00 -0.94 0.00 0.00 39.48 37.32 1ao8 n PHE 106 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1ao8 n LYS 107 N 0.37 0.64 0.11 -1.08 3.00 -1.16 -4.04 118.16 116.00 1ao8 n LYS 107 Ca 0.52 0.28 -0.04 0.00 -0.00 0.00 0.00 58.31 59.07 1ao8 n LYS 107 Cb 0.37 -1.77 0.06 0.00 0.00 0.00 0.00 35.03 33.69 1ao8 n LYS 107 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1ao8 h ASP 108 N 0.00 0.02 -2.49 3.14 3.32 -1.86 -3.33 116.42 115.23 1ao8 h ASP 108 Ca -0.31 -0.02 -0.70 0.00 0.02 0.00 0.00 57.03 56.02 1ao8 h ASP 108 Cb 2.03 -0.01 -0.35 0.00 0.22 0.00 0.00 39.33 41.23 1ao8 h ASP 108 CO 0.08 0.77 0.13 0.47 -1.72 0.00 0.00 179.24 178.97 1ao8 n ASP 109 N -3.65 5.31 -3.93 6.45 9.92 -1.26 -5.00 116.55 124.41 1ao8 n ASP 109 Ca -0.01 -3.49 -0.21 0.00 -0.53 0.00 0.00 54.79 50.54 1ao8 n ASP 109 Cb 0.73 -0.95 -0.16 0.00 -0.64 0.00 0.00 41.12 40.10 1ao8 n ASP 109 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1ao8 s VAL 110 N -3.06 0.69 0.14 2.53 0.11 -1.25 -4.65 120.40 114.91 1ao8 s VAL 110 Ca 0.37 -0.21 0.00 0.00 -2.93 0.00 0.00 61.98 59.21 1ao8 s VAL 110 Cb 0.13 -0.69 0.00 0.00 -1.53 0.00 0.00 36.38 34.29 1ao8 s VAL 110 CO 0.01 0.26 0.00 0.47 -3.33 0.00 0.00 175.10 172.51 1ao8 n ASP 111 N 4.00 0.13 -4.60 3.54 8.00 -1.26 -4.98 116.55 121.38 1ao8 n ASP 111 Ca -0.24 0.23 -0.43 0.00 0.71 0.00 0.00 54.79 55.06 1ao8 n ASP 111 Cb 0.51 0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.70 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 -1.58 4.12 -0.69 -3.53 2.01 -1.26 -3.59 115.64 111.13 1ao8 s THR 112 Ca 0.00 1.11 -0.13 0.00 0.31 0.00 0.00 61.69 62.98 1ao8 s THR 112 Cb 0.00 -4.59 0.18 0.00 0.01 0.00 0.00 72.50 68.10 1ao8 s THR 112 CO 0.00 -1.07 0.62 -0.76 -0.69 0.00 0.00 174.62 172.72 1ao8 s LEU 113 N 4.70 6.35 -0.22 4.42 1.43 0.22 0.08 118.68 135.67 1ao8 s LEU 113 Ca 0.48 -2.37 -0.21 0.00 -1.03 0.00 0.00 54.13 51.00 1ao8 s LEU 113 Cb -0.08 -2.16 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 1ao8 s LEU 113 CO 0.31 -0.65 0.65 -0.76 0.23 0.00 0.00 176.35 176.13 1ao8 s LEU 114 N 0.67 4.11 -0.02 1.79 1.43 -0.16 -2.37 118.68 124.14 1ao8 s LEU 114 Ca 0.12 0.82 0.03 0.00 -1.03 0.00 0.00 54.13 54.07 1ao8 s LEU 114 Cb -0.18 -2.91 -0.00 0.00 0.03 0.00 0.00 46.19 43.12 1ao8 s LEU 114 CO -0.04 -0.33 -0.10 0.54 0.23 0.00 0.00 176.35 176.66 1ao8 s VAL 115 N 2.18 0.80 -0.64 -1.59 0.11 -1.00 -2.38 120.40 117.87 1ao8 s VAL 115 Ca 0.29 -0.40 -0.15 0.00 -2.93 0.00 0.00 61.98 58.79 1ao8 s VAL 115 Cb -0.16 -0.69 0.16 0.00 -1.53 0.00 0.00 36.38 34.16 1ao8 s VAL 115 CO 0.10 0.24 0.59 -0.89 -3.33 0.00 0.00 175.10 171.80 1ao8 s THR 116 N -0.01 5.34 -0.19 5.04 2.01 -0.95 -1.75 115.64 125.14 1ao8 s THR 116 Ca 0.00 -1.82 -0.29 0.00 0.31 0.00 0.00 61.69 59.88 1ao8 s THR 116 Cb -0.06 -4.38 -0.01 0.00 0.01 0.00 0.00 72.50 68.05 1ao8 s THR 116 CO 0.00 -0.92 1.26 -0.13 -0.69 0.00 0.00 174.62 174.13 1ao8 s ARG 117 N 1.12 4.18 0.64 4.92 0.52 -0.87 -2.38 118.95 127.08 1ao8 s ARG 117 Ca 0.08 1.58 0.03 0.00 -0.52 0.00 0.00 55.73 56.90 1ao8 s ARG 117 Cb -0.23 -3.78 0.10 0.00 0.52 0.00 0.00 34.95 31.56 1ao8 s ARG 117 CO -0.01 -0.77 0.89 -0.51 0.02 0.00 0.00 175.30 174.92 1ao8 s LEU 118 N 3.62 3.09 -0.15 2.53 1.02 -0.85 -0.71 118.68 127.23 1ao8 s LEU 118 Ca 0.54 -0.43 -0.01 0.00 0.02 0.00 0.00 54.13 54.25 1ao8 s LEU 118 Cb -0.21 -2.08 -0.09 0.00 0.02 0.00 0.00 46.19 43.84 1ao8 s LEU 118 CO 0.15 -1.56 -0.15 0.00 0.02 0.00 0.00 176.35 174.81 1ao8 n ALA 119 N -2.56 1.77 -1.77 4.21 0.00 -0.68 -3.80 120.51 117.68 1ao8 n ALA 119 Ca 0.14 -0.62 -0.40 0.00 0.00 0.00 0.00 53.44 52.55 1ao8 n ALA 119 Cb 0.61 0.20 -0.02 0.00 0.00 0.00 0.00 19.45 20.24 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 -5.38 2.97 0.39 0.00 0.00 -0.58 -4.75 107.32 99.96 1ao8 s GLY 120 Ca -0.20 1.14 -0.06 0.00 0.00 0.00 0.00 44.72 45.59 1ao8 s GLY 120 CO 0.32 1.74 0.69 -0.56 0.00 0.00 0.00 173.10 175.29 1ao8 s SER 121 N -0.74 6.40 0.14 1.64 0.01 -1.26 -4.55 113.70 115.34 1ao8 s SER 121 Ca 0.52 0.89 -0.10 0.00 1.31 0.00 0.00 55.95 58.56 1ao8 s SER 121 Cb -0.36 -2.22 0.00 0.00 0.21 0.00 0.00 66.02 63.65 1ao8 s SER 121 CO 0.47 -0.39 0.29 -0.36 0.41 0.00 0.00 173.24 173.66 1ao8 s PHE 122 N -2.40 0.20 0.17 2.43 0.08 -1.26 -5.10 117.98 112.10 1ao8 s PHE 122 Ca 0.47 -0.58 0.09 0.00 0.12 0.00 0.00 56.93 57.03 1ao8 s PHE 122 Cb -0.10 0.02 -0.04 0.00 -0.57 0.00 0.00 43.02 42.33 1ao8 s PHE 122 CO 0.36 -0.68 -0.14 -2.00 -0.10 0.00 0.00 175.22 172.66 1ao8 s GLU 123 N -3.91 1.90 0.00 0.44 2.12 -1.26 -4.88 118.70 113.12 1ao8 s GLU 123 Ca 0.11 -1.30 0.00 0.00 0.36 0.00 0.00 54.97 54.14 1ao8 s GLU 123 Cb 0.03 -2.09 0.00 0.00 0.26 0.00 0.00 34.13 32.33 1ao8 s GLU 123 CO -0.05 0.44 0.00 0.41 -0.54 0.00 0.00 175.26 175.52 1ao8 n GLY 124 N 0.23 -1.50 0.04 -1.50 0.00 -1.26 -4.94 105.19 96.26 1ao8 n GLY 124 Ca -0.12 -1.03 -0.05 0.00 0.00 0.00 0.00 46.02 44.82 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 0.93 2.93 -4.57 1.61 8.00 -1.26 -4.91 116.55 119.29 1ao8 n ASP 125 Ca 0.00 -0.01 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 1ao8 n ASP 125 Cb 0.00 0.59 -0.03 0.00 -0.02 0.00 0.00 41.12 41.66 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ao8 s THR 126 N -2.21 3.52 0.34 -3.53 2.01 -1.22 -4.97 115.64 109.58 1ao8 s THR 126 Ca -0.06 0.42 0.08 0.00 0.31 0.00 0.00 61.69 62.45 1ao8 s THR 126 Cb 0.03 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 1ao8 s THR 126 CO 0.34 -0.86 0.14 -0.54 -0.69 0.00 0.00 174.62 173.01 1ao8 s LYS 127 N 6.21 2.38 0.26 4.92 1.02 -1.26 -1.04 119.74 132.23 1ao8 s LYS 127 Ca 0.66 -1.54 -0.18 0.00 0.02 0.00 0.00 55.97 54.93 1ao8 s LYS 127 Cb -0.14 -2.18 -0.08 0.00 -0.52 0.00 0.00 37.83 34.90 1ao8 s LYS 127 CO 0.25 0.11 0.73 1.41 -0.92 0.00 0.00 175.35 176.93 1ao8 s MET 128 N -3.85 4.16 1.01 1.68 -2.45 -1.11 -4.75 119.30 114.00 1ao8 s MET 128 Ca 0.38 0.79 -0.12 0.00 -1.25 0.00 0.00 55.69 55.49 1ao8 s MET 128 Cb -0.03 -2.71 0.20 0.00 1.25 0.00 0.00 34.83 33.54 1ao8 s MET 128 CO 0.23 0.31 1.08 0.96 1.05 0.00 0.00 175.02 178.64 1ao8 s ILE 129 N -1.69 2.22 -0.75 10.11 -4.36 -1.26 -4.91 121.20 120.55 1ao8 s ILE 129 Ca 0.47 0.07 -0.27 0.00 -0.26 0.00 0.00 60.65 60.66 1ao8 s ILE 129 Cb -0.14 -2.25 0.03 0.00 1.25 0.00 0.00 42.46 41.35 1ao8 s ILE 129 CO 0.20 -0.09 1.29 -2.16 0.24 0.00 0.00 174.94 174.41 1ao8 s PRO 130 N -4.66 3.20 0.14 0.37 0.04 -1.26 -5.02 135.00 127.81 1ao8 s PRO 130 Ca 0.66 -0.27 -0.06 0.00 0.04 0.00 0.00 61.00 61.37 1ao8 s PRO 130 Cb -0.22 -4.23 -0.06 0.00 0.04 0.00 0.00 34.50 30.03 1ao8 s PRO 130 CO 0.60 -2.15 0.40 -0.51 0.04 0.00 0.00 177.00 175.38 1ao8 s LEU 131 N 5.72 4.27 -0.52 -3.56 1.43 -1.26 -5.04 118.68 119.73 1ao8 s LEU 131 Ca 0.36 0.67 -0.24 0.00 -1.03 0.00 0.00 54.13 53.89 1ao8 s LEU 131 Cb -0.08 -3.29 0.04 0.00 0.03 0.00 0.00 46.19 42.89 1ao8 s LEU 131 CO 0.14 0.06 0.89 0.21 0.23 0.00 0.00 176.35 177.88 1ao8 s ASN 132 N -2.29 6.37 0.00 2.29 3.84 -1.26 -4.88 114.94 119.01 1ao8 s ASN 132 Ca 0.40 -0.28 0.14 0.00 0.21 0.00 0.00 52.86 53.33 1ao8 s ASN 132 Cb -0.12 -2.42 0.44 0.00 -0.55 0.00 0.00 41.25 38.60 1ao8 s ASN 132 CO 0.23 -1.12 1.34 0.79 -2.79 0.00 0.00 177.10 175.55 1ao8 n TRP 133 N 7.19 0.40 0.01 0.43 7.02 -1.26 -3.89 117.44 127.33 1ao8 n TRP 133 Ca 0.02 -0.20 -0.09 0.00 -1.02 0.00 0.00 57.50 56.21 1ao8 n TRP 133 Cb 0.48 0.00 -0.14 0.00 -2.42 0.00 0.00 31.31 29.23 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 2.11 0.05 -0.96 -0.99 3.58 -2.04 -3.33 116.42 114.84 1ao8 h ASP 134 Ca 0.00 -0.08 -0.59 0.00 0.42 0.00 0.00 57.03 56.78 1ao8 h ASP 134 Cb 0.48 -0.01 -0.29 0.00 1.72 0.00 0.00 39.33 41.23 1ao8 h ASP 134 CO 0.00 1.07 0.76 0.47 -2.88 0.00 0.00 179.24 178.66 1ao8 n ASP 135 N -3.17 5.99 -4.12 2.28 9.92 -1.25 -4.93 116.55 121.27 1ao8 n ASP 135 Ca -0.13 -3.66 -0.10 0.00 -0.53 0.00 0.00 54.79 50.36 1ao8 n ASP 135 Cb 1.02 -0.92 -0.09 0.00 -0.64 0.00 0.00 41.12 40.49 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 -3.48 0.84 0.02 1.24 0.40 -1.25 -3.79 117.98 111.96 1ao8 s PHE 136 Ca 0.59 -1.15 -0.04 0.00 -0.60 0.00 0.00 56.93 55.73 1ao8 s PHE 136 Cb 0.48 -0.36 -0.01 0.00 0.51 0.00 0.00 43.02 43.63 1ao8 s PHE 136 CO 0.04 -0.65 0.06 0.99 0.70 0.00 0.00 175.22 176.36 1ao8 s THR 137 N -4.07 0.12 -0.12 0.64 2.01 -0.78 -4.91 115.64 108.52 1ao8 s THR 137 Ca 0.28 -0.96 -0.06 0.00 0.31 0.00 0.00 61.69 61.26 1ao8 s THR 137 Cb 0.06 -0.60 -0.04 0.00 0.01 0.00 0.00 72.50 71.93 1ao8 s THR 137 CO 0.06 -0.53 0.08 -0.75 -0.69 0.00 0.00 174.62 172.79 1ao8 s LYS 138 N -1.98 3.42 0.00 4.92 2.20 -1.26 -1.28 119.74 125.76 1ao8 s LYS 138 Ca -0.11 -0.26 0.00 0.00 -0.36 0.00 0.00 55.97 55.24 1ao8 s LYS 138 Cb -0.05 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.19 1ao8 s LYS 138 CO -0.02 0.64 0.00 1.33 -0.36 0.00 0.00 175.35 176.94 1ao8 n VAL 139 N 2.38 0.00 -4.75 4.02 0.24 -1.18 -5.00 118.33 114.04 1ao8 n VAL 139 Ca -0.19 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.78 1ao8 n VAL 139 Cb 0.54 -0.50 -0.13 0.00 -1.47 0.00 0.00 33.84 32.28 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 -3.97 4.27 -0.28 -1.34 0.01 -1.25 -5.04 113.70 106.11 1ao8 s SER 140 Ca 0.00 -0.16 -0.00 0.00 1.31 0.00 0.00 55.95 57.10 1ao8 s SER 140 Cb 0.00 -1.15 0.17 0.00 0.21 0.00 0.00 66.02 65.25 1ao8 s SER 140 CO 0.00 0.31 0.50 -0.55 0.41 0.00 0.00 173.24 173.91 1ao8 s SER 141 N -0.48 -0.65 -0.25 2.44 0.15 -1.26 -0.60 113.70 113.05 1ao8 s SER 141 Ca 0.07 0.39 -0.10 0.00 0.70 0.00 0.00 55.95 57.00 1ao8 s SER 141 Cb -0.12 1.66 -0.05 0.00 -1.71 0.00 0.00 66.02 65.81 1ao8 s SER 141 CO 0.02 -0.29 0.16 -0.60 1.20 0.00 0.00 173.24 173.73 1ao8 s ARG 142 N 2.71 4.00 -0.03 5.44 3.52 -0.36 -4.96 118.95 129.27 1ao8 s ARG 142 Ca 0.15 -0.30 -0.13 0.00 -0.13 0.00 0.00 55.73 55.32 1ao8 s ARG 142 Cb -0.14 -3.56 -0.05 0.00 -1.56 0.00 0.00 34.95 29.64 1ao8 s ARG 142 CO -0.21 -0.03 0.35 0.99 -0.81 0.00 0.00 175.30 175.59 1ao8 s THR 143 N 1.30 5.14 -0.04 4.11 2.01 -1.26 -1.09 115.64 125.80 1ao8 s THR 143 Ca 0.07 0.70 -0.01 0.00 0.31 0.00 0.00 61.69 62.76 1ao8 s THR 143 Cb -0.14 -3.65 0.03 0.00 0.01 0.00 0.00 72.50 68.75 1ao8 s THR 143 CO 0.06 0.57 0.09 -0.69 -0.69 0.00 0.00 174.62 173.96 1ao8 s VAL 144 N -0.97 -0.08 -0.13 3.82 1.01 -0.91 -4.99 120.40 118.15 1ao8 s VAL 144 Ca 0.22 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.41 1ao8 s VAL 144 Cb -0.16 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 36.04 1ao8 s VAL 144 CO 0.11 0.10 -0.06 -1.61 0.00 0.00 0.00 175.10 173.63 1ao8 s GLU 145 N 1.31 3.45 0.10 2.72 2.02 -1.26 -2.47 118.70 124.57 1ao8 s GLU 145 Ca -0.07 -0.56 -0.01 0.00 0.02 0.00 0.00 54.97 54.36 1ao8 s GLU 145 Cb -0.12 -2.80 0.02 0.00 0.10 0.00 0.00 34.13 31.33 1ao8 s GLU 145 CO -0.04 0.31 0.14 -3.47 0.02 0.00 0.00 175.26 172.22 1ao8 n ASP 146 N 3.29 0.13 -0.06 -0.19 2.03 -1.26 -4.96 116.55 115.53 1ao8 n ASP 146 Ca -0.18 -1.13 -0.00 0.00 0.52 0.00 0.00 54.79 54.00 1ao8 n ASP 146 Cb 0.53 -0.10 0.27 0.00 -0.72 0.00 0.00 41.12 41.10 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 -0.59 1.19 -2.02 5.18 1.35 -2.00 -3.43 112.91 112.60 1ao8 h THR 147 Ca -0.05 -0.68 -0.49 0.00 -0.55 0.00 0.00 66.41 64.64 1ao8 h THR 147 Cb 0.16 0.73 -0.03 0.00 -1.73 0.00 0.00 68.15 67.27 1ao8 h THR 147 CO 0.04 0.25 -0.47 0.20 -0.25 0.00 0.00 175.52 175.30 1ao8 s ASN 148 N -6.65 5.57 0.13 5.36 -0.87 -1.26 -5.03 114.94 112.20 1ao8 s ASN 148 Ca -0.09 -0.30 0.08 0.00 -1.57 0.00 0.00 52.86 50.98 1ao8 s ASN 148 Cb 0.16 -1.27 -0.18 0.00 -0.02 0.00 0.00 41.25 39.94 1ao8 s ASN 148 CO 0.77 -0.20 1.28 1.55 -2.57 0.00 0.00 177.10 177.93 1ao8 h PRO 149 N 1.30 0.00 0.00 -0.60 0.13 -2.01 -3.26 132.00 127.56 1ao8 h PRO 149 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 1ao8 h PRO 149 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1ao8 h PRO 149 CO 0.59 0.93 -0.30 0.00 -0.23 0.00 0.00 178.00 178.99 1ao8 h ALA 150 N 1.05 0.83 -0.84 -0.56 0.00 -1.95 -3.20 119.26 114.59 1ao8 h ALA 150 Ca -0.02 -0.28 -0.45 0.00 0.00 0.00 0.00 54.91 54.16 1ao8 h ALA 150 Cb 1.74 -0.05 -0.26 0.00 0.00 0.00 0.00 17.79 19.22 1ao8 h ALA 150 CO 0.12 0.38 0.58 1.28 0.00 0.00 0.00 179.25 181.61 1ao8 n LEU 151 N -3.21 6.31 -4.85 0.00 4.77 -1.23 -1.53 117.00 117.27 1ao8 n LEU 151 Ca 0.02 -3.37 -0.33 0.00 -0.03 0.00 0.00 56.01 52.30 1ao8 n LEU 151 Cb 0.62 -0.82 -0.06 0.00 -2.33 0.00 0.00 43.42 40.83 1ao8 n LEU 151 CO 0.37 1.02 0.39 -0.89 -1.33 0.00 0.00 177.39 176.96 1ao8 s THR 152 N -2.95 4.70 0.05 -5.08 2.01 -1.21 -4.06 115.64 109.11 1ao8 s THR 152 Ca 0.49 0.93 -0.09 0.00 0.31 0.00 0.00 61.69 63.33 1ao8 s THR 152 Cb 0.41 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 69.27 1ao8 s THR 152 CO 0.08 -0.11 0.18 -1.38 -0.69 0.00 0.00 174.62 172.70 1ao8 s HIS 153 N -1.90 0.10 -0.11 4.92 -3.43 -1.03 -1.69 115.29 112.15 1ao8 s HIS 153 Ca 0.52 -0.40 -0.03 0.00 -0.80 0.00 0.00 55.06 54.34 1ao8 s HIS 153 Cb -0.11 -0.05 0.05 0.00 -1.43 0.00 0.00 32.58 31.04 1ao8 s HIS 153 CO 0.18 -0.46 0.10 0.99 -2.00 0.00 0.00 174.74 173.56 1ao8 s THR 154 N -2.99 -0.15 -0.46 -5.38 2.01 0.11 -2.15 115.64 106.63 1ao8 s THR 154 Ca -0.02 0.16 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 1ao8 s THR 154 Cb 0.01 -0.37 0.01 0.00 0.01 0.00 0.00 72.50 72.16 1ao8 s THR 154 CO -0.06 -0.02 1.43 -0.31 -0.69 0.00 0.00 174.62 174.97 1ao8 s TYR 155 N 2.20 2.33 -0.17 4.92 2.02 -0.25 -2.06 117.35 126.35 1ao8 s TYR 155 Ca 0.04 0.62 -0.07 0.00 -0.37 0.00 0.00 57.07 57.29 1ao8 s TYR 155 Cb -0.14 -4.33 -0.04 0.00 -0.40 0.00 0.00 41.96 37.05 1ao8 s TYR 155 CO -0.06 -2.00 0.06 -1.21 -1.57 0.00 0.00 175.55 170.76 1ao8 s GLU 156 N 5.18 3.84 -0.34 -0.62 2.02 -0.72 -1.22 118.70 126.84 1ao8 s GLU 156 Ca 0.59 -0.33 -0.06 0.00 0.02 0.00 0.00 54.97 55.18 1ao8 s GLU 156 Cb -0.13 -3.17 0.04 0.00 0.10 0.00 0.00 34.13 30.98 1ao8 s GLU 156 CO 0.30 0.36 0.11 0.08 0.02 0.00 0.00 175.26 176.13 1ao8 s VAL 157 N 0.13 3.79 -0.17 2.63 1.01 0.23 -2.38 120.40 125.64 1ao8 s VAL 157 Ca 0.05 -1.14 -0.06 0.00 0.00 0.00 0.00 61.98 60.82 1ao8 s VAL 157 Cb -0.12 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1ao8 s VAL 157 CO 0.01 -0.19 0.05 0.26 0.00 0.00 0.00 175.10 175.23 1ao8 s TRP 158 N 1.40 3.23 0.27 5.22 0.52 -1.00 -3.12 118.94 125.47 1ao8 s TRP 158 Ca -0.02 0.06 0.11 0.00 0.02 0.00 0.00 56.10 56.28 1ao8 s TRP 158 Cb -0.20 -2.03 -0.05 0.00 -1.15 0.00 0.00 33.47 30.05 1ao8 s TRP 158 CO 0.03 0.19 -0.11 -0.65 0.02 0.00 0.00 176.95 176.43 1ao8 s GLN 159 N 0.17 1.96 0.58 4.98 1.11 -0.41 -0.61 119.66 127.45 1ao8 s GLN 159 Ca 0.04 -1.61 -0.15 0.00 0.01 0.00 0.00 55.36 53.65 1ao8 s GLN 159 Cb -0.12 -1.95 -0.05 0.00 -1.01 0.00 0.00 33.01 29.88 1ao8 s GLN 159 CO 0.01 0.34 1.03 0.21 0.01 0.00 0.00 175.29 176.89 1ao8 s LYS 160 N -3.59 3.50 -0.64 2.91 2.20 -1.24 -1.87 119.74 121.02 1ao8 s LYS 160 Ca 0.31 1.06 -0.27 0.00 -0.36 0.00 0.00 55.97 56.71 1ao8 s LYS 160 Cb -0.06 -2.06 -0.00 0.00 -1.51 0.00 0.00 37.83 34.20 1ao8 s LYS 160 CO 0.17 -0.65 1.66 0.15 -0.36 0.00 0.00 175.35 176.32 1ao8 s LYS 161 N -4.26 2.86 0.00 4.03 1.02 -1.25 -4.80 119.74 117.34 1ao8 s LYS 161 Ca 0.61 0.38 0.00 0.00 0.02 0.00 0.00 55.97 56.98 1ao8 s LYS 161 Cb -0.13 -4.30 0.00 0.00 -0.52 0.00 0.00 37.83 32.87 1ao8 s LYS 161 CO 0.38 -2.48 0.00 0.00 -0.92 0.00 0.00 175.35 172.33