#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 0.12 0.30 2.41 0.00 0.53 -4.23 121.76 120.89 1ao8 s ALA 2 Ca 0.00 0.29 -0.27 0.00 0.00 0.00 0.00 51.96 51.98 1ao8 s ALA 2 Cb 0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 23.12 22.39 1ao8 s ALA 2 CO 0.00 -0.47 0.94 -0.06 0.00 0.00 0.00 175.76 176.16 1ao8 s PHE 3 N 2.10 3.77 -0.25 0.00 0.40 -0.89 -0.19 117.98 122.92 1ao8 s PHE 3 Ca 0.03 1.81 -0.04 0.00 -0.60 0.00 0.00 56.93 58.13 1ao8 s PHE 3 Cb -0.12 -2.93 0.14 0.00 0.51 0.00 0.00 43.02 40.62 1ao8 s PHE 3 CO -0.04 0.28 0.46 -1.17 0.70 0.00 0.00 175.22 175.46 1ao8 s LEU 4 N -1.82 -0.87 0.08 -0.37 2.96 -0.67 -1.00 118.68 116.98 1ao8 s LEU 4 Ca 0.48 0.65 -0.16 0.00 -0.22 0.00 0.00 54.13 54.87 1ao8 s LEU 4 Cb -0.20 1.53 0.03 0.00 0.50 0.00 0.00 46.19 48.05 1ao8 s LEU 4 CO 0.26 -0.27 0.39 -1.66 -1.32 0.00 0.00 176.35 173.74 1ao8 s TRP 5 N 2.67 -0.20 -0.11 5.38 -2.14 -0.97 -4.39 118.94 119.18 1ao8 s TRP 5 Ca 0.11 0.02 -0.02 0.00 2.66 0.00 0.00 56.10 58.87 1ao8 s TRP 5 Cb -0.14 0.21 -0.03 0.00 -3.10 0.00 0.00 33.47 30.40 1ao8 s TRP 5 CO -0.17 -0.62 -0.03 0.00 -2.66 0.00 0.00 176.95 173.47 1ao8 s ALA 6 N -3.10 3.10 0.17 2.67 0.00 -1.26 -2.15 121.76 121.18 1ao8 s ALA 6 Ca -0.01 -0.83 -0.11 0.00 0.00 0.00 0.00 51.96 51.00 1ao8 s ALA 6 Cb 0.01 -1.44 0.00 0.00 0.00 0.00 0.00 23.12 21.69 1ao8 s ALA 6 CO -0.07 0.44 0.34 1.14 0.00 0.00 0.00 175.76 177.62 1ao8 s GLN 7 N -0.40 1.19 0.09 0.00 -2.07 -0.92 -4.32 119.66 113.24 1ao8 s GLN 7 Ca 0.07 -1.06 0.01 0.00 -1.82 0.00 0.00 55.36 52.55 1ao8 s GLN 7 Cb -0.12 0.41 0.01 0.00 -1.09 0.00 0.00 33.01 32.22 1ao8 s GLN 7 CO 0.02 -0.45 0.07 -0.40 -1.32 0.00 0.00 175.29 173.21 1ao8 n ASP 8 N -0.24 1.27 0.25 12.60 5.75 -1.23 -1.99 116.55 132.96 1ao8 n ASP 8 Ca -0.09 -1.32 0.09 0.00 -0.01 0.00 0.00 54.79 53.46 1ao8 n ASP 8 Cb 0.63 -0.01 0.66 0.00 -1.03 0.00 0.00 41.12 41.36 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 0.00 -0.11 0.11 0.11 -1.80 -2.49 114.38 110.20 1ao8 h ARG 9 Ca -0.06 0.00 -0.18 0.00 0.10 0.00 0.00 59.98 59.84 1ao8 h ARG 9 Cb 0.22 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.31 1ao8 h ARG 9 CO 0.09 0.10 -0.62 -0.44 0.10 0.00 0.00 179.97 179.20 1ao8 h ASP 10 N 0.00 0.73 0.00 0.08 3.32 -1.90 -3.48 116.42 115.18 1ao8 h ASP 10 Ca -0.00 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.40 1ao8 h ASP 10 Cb 0.20 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1ao8 h ASP 10 CO 0.01 1.27 0.00 0.61 -1.72 0.00 0.00 179.24 179.41 1ao8 n GLY 11 N 0.75 1.66 3.75 2.75 0.00 -0.94 -5.09 105.19 108.07 1ao8 n GLY 11 Ca -0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 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 4.24 -0.14 0.99 2.96 -1.26 -3.44 118.68 122.03 1ao8 s LEU 12 Ca 0.00 0.33 0.14 0.00 -0.22 0.00 0.00 54.13 54.38 1ao8 s LEU 12 Cb 0.00 -2.16 -0.20 0.00 0.50 0.00 0.00 46.19 44.33 1ao8 s LEU 12 CO 0.00 0.18 0.08 2.30 -1.32 0.00 0.00 176.35 177.60 1ao8 n ILE 13 N 3.36 0.96 -3.21 6.68 -5.35 -0.98 -3.55 119.36 117.26 1ao8 n ILE 13 Ca -0.15 -0.63 -0.02 0.00 -0.27 0.00 0.00 62.75 61.68 1ao8 n ILE 13 Cb 0.52 -0.52 0.00 0.00 -1.74 0.00 0.00 39.64 37.91 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 2.00 1.95 3.34 3.28 0.00 -1.21 -4.84 105.19 109.72 1ao8 n GLY 14 Ca -0.23 -1.10 0.02 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.03 0.44 -1.68 1.61 2.20 0.55 -3.79 119.74 117.03 1ao8 s LYS 15 Ca 0.03 0.95 0.00 0.00 -0.36 0.00 0.00 55.97 56.59 1ao8 s LYS 15 Cb -0.01 0.55 0.00 0.00 -1.51 0.00 0.00 37.83 36.86 1ao8 s LYS 15 CO 0.02 -0.31 0.00 -0.25 -0.36 0.00 0.00 175.35 174.45 1ao8 n ASP 16 N 5.33 -5.26 0.00 1.43 9.92 -1.26 -1.72 116.55 124.99 1ao8 n ASP 16 Ca -0.07 0.14 0.00 0.00 -0.53 0.00 0.00 54.79 54.33 1ao8 n ASP 16 Cb 0.51 -4.47 0.00 0.00 -0.64 0.00 0.00 41.12 36.52 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 -0.81 2.52 3.97 0.44 0.00 -1.26 -4.99 105.19 105.06 1ao8 n GLY 17 Ca -0.21 -0.60 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.42 2.92 0.33 1.61 -3.43 -0.70 -4.86 115.29 110.74 1ao8 s HIS 18 Ca 0.00 0.01 -0.08 0.00 -0.80 0.00 0.00 55.06 54.19 1ao8 s HIS 18 Cb 0.00 -2.66 -0.06 0.00 -1.43 0.00 0.00 32.58 28.43 1ao8 s HIS 18 CO 0.00 -0.76 0.65 -0.51 -2.00 0.00 0.00 174.74 172.12 1ao8 s LEU 19 N -4.71 3.98 0.09 5.38 1.43 -1.26 -0.33 118.68 123.26 1ao8 s LEU 19 Ca 0.56 0.94 0.03 0.00 -1.03 0.00 0.00 54.13 54.62 1ao8 s LEU 19 Cb -0.10 -3.77 -0.24 0.00 0.03 0.00 0.00 46.19 42.11 1ao8 s LEU 19 CO 0.38 -0.27 1.17 1.55 0.23 0.00 0.00 176.35 179.41 1ao8 h PRO 20 N 1.63 0.10 0.00 1.29 0.13 -1.88 -3.47 132.00 129.81 1ao8 h PRO 20 Ca -0.47 -0.18 -0.46 0.00 -0.87 0.00 0.00 66.00 64.02 1ao8 h PRO 20 Cb 1.19 0.07 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1ao8 h PRO 20 CO 0.65 1.05 -0.13 -2.67 -0.23 0.00 0.00 178.00 176.67 1ao8 n TRP 21 N -3.40 -1.70 -3.50 1.56 2.14 -1.26 -5.10 117.44 106.18 1ao8 n TRP 21 Ca -0.05 -1.93 -0.29 0.00 2.07 0.00 0.00 57.50 57.30 1ao8 n TRP 21 Cb 0.98 -0.45 -0.12 0.00 -0.81 0.00 0.00 31.31 30.92 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 -2.26 1.05 -0.38 -2.67 2.46 -1.26 -5.08 115.29 107.15 1ao8 s HIS 22 Ca 0.43 -1.93 -0.02 0.00 0.47 0.00 0.00 55.06 54.01 1ao8 s HIS 22 Cb -0.03 -1.10 0.10 0.00 -0.13 0.00 0.00 32.58 31.41 1ao8 s HIS 22 CO 0.27 -0.82 0.15 -1.17 -2.47 0.00 0.00 174.74 170.71 1ao8 s LEU 23 N 0.69 4.97 0.32 8.88 2.96 -1.26 -4.94 118.68 130.30 1ao8 s LEU 23 Ca 0.21 -1.90 0.15 0.00 -0.22 0.00 0.00 54.13 52.37 1ao8 s LEU 23 Cb -0.17 -1.79 0.47 0.00 0.50 0.00 0.00 46.19 45.20 1ao8 s LEU 23 CO -0.04 -0.48 1.64 1.55 -1.32 0.00 0.00 176.35 177.71 1ao8 h PRO 24 N 8.00 0.00 -0.40 0.98 0.14 -1.99 -3.11 132.00 135.62 1ao8 h PRO 24 Ca -0.14 0.00 -0.03 0.00 0.14 0.00 0.00 66.00 65.97 1ao8 h PRO 24 Cb 1.05 0.00 -0.02 0.00 0.14 0.00 0.00 31.00 32.17 1ao8 h PRO 24 CO 0.65 0.51 0.12 0.22 0.14 0.00 0.00 178.00 179.64 1ao8 h ASP 25 N 0.00 0.52 0.41 1.44 1.82 -1.99 -1.72 116.42 116.90 1ao8 h ASP 25 Ca -0.01 -0.06 -0.12 0.00 -0.39 0.00 0.00 57.03 56.45 1ao8 h ASP 25 Cb 1.05 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 40.91 1ao8 h ASP 25 CO 0.07 0.50 -0.52 -0.78 -1.61 0.00 0.00 179.24 176.90 1ao8 h ASP 26 N 0.57 0.14 -0.33 2.28 1.82 -1.97 -2.87 116.42 116.06 1ao8 h ASP 26 Ca 0.14 -0.07 -0.03 0.00 -0.39 0.00 0.00 57.03 56.67 1ao8 h ASP 26 Cb 0.17 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 40.12 1ao8 h ASP 26 CO -0.01 0.64 0.11 -0.07 -1.61 0.00 0.00 179.24 178.30 1ao8 h LEU 27 N 0.10 0.54 -0.86 2.28 3.38 -1.39 -1.67 115.31 117.68 1ao8 h LEU 27 Ca 0.00 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1ao8 h LEU 27 Cb 0.96 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.54 1ao8 h LEU 27 CO 0.07 0.54 0.13 0.45 0.09 0.00 0.00 178.44 179.72 1ao8 h HIS 28 N 0.58 1.02 -0.12 1.13 3.86 -1.36 -2.12 115.15 118.14 1ao8 h HIS 28 Ca 0.14 -0.12 -0.15 0.00 -1.16 0.00 0.00 60.37 59.08 1ao8 h HIS 28 Cb 0.21 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.38 1ao8 h HIS 28 CO 0.01 0.85 -0.56 -0.92 0.86 0.00 0.00 177.93 178.17 1ao8 h TYR 29 N 0.93 0.46 -0.65 2.45 3.20 -1.40 -2.86 116.97 119.10 1ao8 h TYR 29 Ca 0.19 -0.17 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1ao8 h TYR 29 Cb 0.36 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.52 1ao8 h TYR 29 CO 0.02 0.84 0.18 0.35 -1.64 0.00 0.00 178.16 177.92 1ao8 h PHE 30 N 0.28 1.07 -0.50 -3.82 3.57 -0.88 -1.18 116.94 115.47 1ao8 h PHE 30 Ca 0.00 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.33 1ao8 h PHE 30 Cb 1.07 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 1ao8 h PHE 30 CO 0.03 0.88 0.08 -0.09 -2.23 0.00 0.00 178.31 176.98 1ao8 h ARG 31 N 0.95 0.79 0.00 1.11 2.43 -1.30 -2.22 114.38 116.14 1ao8 h ARG 31 Ca 0.21 -0.18 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 1ao8 h ARG 31 Cb 0.33 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1ao8 h ARG 31 CO -0.00 0.74 -0.57 0.00 -1.51 0.00 0.00 179.97 178.63 1ao8 h ALA 32 N 1.33 1.05 -0.88 2.80 0.00 -1.23 -2.52 119.26 119.81 1ao8 h ALA 32 Ca 0.16 -0.52 -0.57 0.00 0.00 0.00 0.00 54.91 53.98 1ao8 h ALA 32 Cb 0.34 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 17.78 1ao8 h ALA 32 CO 0.01 0.72 0.73 1.04 0.00 0.00 0.00 179.25 181.75 1ao8 n GLN 33 N -3.85 2.41 0.00 0.00 1.13 -0.49 -4.33 117.38 112.25 1ao8 n GLN 33 Ca -0.01 -2.85 0.00 0.00 -1.94 0.00 0.00 57.00 52.20 1ao8 n GLN 33 Cb 0.58 -2.12 0.00 0.00 0.11 0.00 0.00 30.24 28.81 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 -0.71 0.00 -1.87 5.09 -2.24 -1.12 -4.98 114.28 108.46 1ao8 n THR 34 Ca 0.55 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.93 1ao8 n THR 34 Cb 0.84 -0.19 0.01 0.00 -2.10 0.00 0.00 70.33 68.89 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 -1.64 2.21 -1.21 2.28 -7.23 -0.96 -2.21 120.40 111.64 1ao8 s VAL 35 Ca 0.00 0.19 -0.00 0.00 -1.81 0.00 0.00 61.98 60.36 1ao8 s VAL 35 Cb 0.00 -3.12 0.00 0.00 0.56 0.00 0.00 36.38 33.82 1ao8 s VAL 35 CO 0.00 0.03 0.05 0.61 -0.31 0.00 0.00 175.10 175.48 1ao8 n GLY 36 N 0.59 -0.21 3.07 2.32 0.00 -1.26 -4.97 105.19 104.74 1ao8 n GLY 36 Ca 0.04 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.45 0.86 -3.99 1.61 5.02 -0.94 -4.62 118.16 113.64 1ao8 n LYS 37 Ca -0.16 -1.99 -0.35 0.00 -2.02 0.00 0.00 58.31 53.79 1ao8 n LYS 37 Cb 0.62 2.32 -0.08 0.00 -0.02 0.00 0.00 35.03 37.87 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 -2.37 5.02 -0.29 -0.18 1.01 -0.04 -2.95 121.20 121.40 1ao8 s ILE 38 Ca 0.16 0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.77 1ao8 s ILE 38 Cb -0.03 -3.22 -0.00 0.00 0.01 0.00 0.00 42.46 39.22 1ao8 s ILE 38 CO 0.12 0.54 0.10 -0.32 0.00 0.00 0.00 174.94 175.37 1ao8 s MET 39 N -0.31 3.29 -0.25 2.79 1.75 -0.37 -1.73 119.30 124.47 1ao8 s MET 39 Ca 0.09 -0.73 -0.07 0.00 -1.25 0.00 0.00 55.69 53.73 1ao8 s MET 39 Cb -0.12 -3.41 -0.03 0.00 2.84 0.00 0.00 34.83 34.11 1ao8 s MET 39 CO 0.01 -0.38 0.08 0.08 -0.65 0.00 0.00 175.02 174.16 1ao8 s VAL 40 N 1.56 4.33 0.05 10.11 1.01 -0.45 -1.62 120.40 135.39 1ao8 s VAL 40 Ca 0.04 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.84 1ao8 s VAL 40 Cb -0.17 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 1ao8 s VAL 40 CO 0.04 0.32 -0.06 0.68 0.00 0.00 0.00 175.10 176.07 1ao8 s VAL 41 N 1.61 0.44 0.00 2.92 -7.23 -1.01 -2.50 120.40 114.63 1ao8 s VAL 41 Ca 0.06 -1.31 0.00 0.00 -1.81 0.00 0.00 61.98 58.92 1ao8 s VAL 41 Cb -0.15 -0.87 0.00 0.00 0.56 0.00 0.00 36.38 35.92 1ao8 s VAL 41 CO 0.04 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 174.85 1ao8 n GLY 42 N 1.01 0.58 0.07 2.32 0.00 -0.43 -2.25 105.19 106.49 1ao8 n GLY 42 Ca -0.20 -1.69 -0.13 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.25 1.61 2.43 -1.92 -2.16 114.38 114.09 1ao8 h ARG 43 Ca 0.00 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 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 0.83 0.03 -0.09 -1.51 0.00 0.00 179.97 179.24 1ao8 h ARG 44 N -1.00 0.36 0.02 0.20 9.65 -1.97 -0.70 114.38 120.94 1ao8 h ARG 44 Ca -0.05 -0.05 -0.24 0.00 -1.10 0.00 0.00 59.98 58.54 1ao8 h ARG 44 Cb 0.89 -0.06 0.01 0.00 -1.39 0.00 0.00 29.97 29.41 1ao8 h ARG 44 CO -0.03 0.36 -1.00 1.15 2.80 0.00 0.00 179.97 183.26 1ao8 h THR 45 N 0.36 1.39 -0.27 0.20 2.02 -1.90 -1.71 112.91 112.99 1ao8 h THR 45 Ca 0.09 -2.49 -0.07 0.00 0.77 0.00 0.00 66.41 64.70 1ao8 h THR 45 Cb 0.19 2.48 -0.01 0.00 -1.74 0.00 0.00 68.15 69.07 1ao8 h THR 45 CO 0.00 0.74 -0.11 0.22 0.37 0.00 0.00 175.52 176.75 1ao8 h TYR 46 N 0.23 0.63 0.00 3.16 3.20 -0.80 -2.91 116.97 120.49 1ao8 h TYR 46 Ca -0.09 -0.15 -0.05 0.00 3.14 0.00 0.00 58.73 61.57 1ao8 h TYR 46 Cb 1.64 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.76 1ao8 h TYR 46 CO 0.07 0.79 -0.26 0.93 -1.64 0.00 0.00 178.16 178.05 1ao8 h GLU 47 N 0.30 0.00 0.00 1.82 4.39 -1.20 -2.98 114.58 116.91 1ao8 h GLU 47 Ca 0.06 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.73 1ao8 h GLU 47 Cb 0.61 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1ao8 h GLU 47 CO 0.04 0.26 -0.14 0.66 -1.16 0.00 0.00 179.01 178.66 1ao8 h SER 48 N 0.00 0.00 -4.05 1.42 4.64 -1.10 -3.43 113.55 111.03 1ao8 h SER 48 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1ao8 h SER 48 Cb 0.84 0.00 0.10 0.00 -0.31 0.00 0.00 62.40 63.03 1ao8 h SER 48 CO 0.03 0.14 0.50 -0.36 -0.87 0.00 0.00 176.83 176.27 1ao8 s PHE 49 N -4.72 2.57 -0.10 4.77 0.08 -1.13 -4.96 117.98 114.49 1ao8 s PHE 49 Ca -0.04 1.50 -0.11 0.00 0.12 0.00 0.00 56.93 58.40 1ao8 s PHE 49 Cb 0.16 -3.48 -0.09 0.00 -0.57 0.00 0.00 43.02 39.04 1ao8 s PHE 49 CO 0.69 -2.02 0.33 -1.00 -0.10 0.00 0.00 175.22 173.12 1ao8 h PRO 50 N 1.44 -0.06 -4.54 0.24 0.13 -1.89 -3.42 132.00 123.90 1ao8 h PRO 50 Ca -0.50 0.00 -0.72 0.00 -0.87 0.00 0.00 66.00 63.91 1ao8 h PRO 50 Cb 1.28 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.21 1ao8 h PRO 50 CO 0.57 0.25 -0.25 0.21 -0.23 0.00 0.00 178.00 178.55 1ao8 s LYS 51 N -2.04 3.02 -0.06 0.86 2.47 -1.26 -5.05 119.74 117.67 1ao8 s LYS 51 Ca -0.07 -1.14 0.03 0.00 -1.56 0.00 0.00 55.97 53.24 1ao8 s LYS 51 Cb -0.01 -4.08 -0.02 0.00 -1.46 0.00 0.00 37.83 32.26 1ao8 s LYS 51 CO 0.24 -1.01 -0.15 1.03 0.16 0.00 0.00 175.35 175.63 1ao8 s ARG 52 N 1.91 2.63 0.93 4.03 0.52 -1.26 -4.04 118.95 123.67 1ao8 s ARG 52 Ca 0.07 -0.70 -0.14 0.00 -0.52 0.00 0.00 55.73 54.44 1ao8 s ARG 52 Cb -0.22 -2.41 0.19 0.00 0.52 0.00 0.00 34.95 33.04 1ao8 s ARG 52 CO 0.09 0.56 1.28 -1.25 0.02 0.00 0.00 175.30 176.00 1ao8 s PRO 53 N -0.55 0.77 -0.30 3.54 0.04 -1.26 -5.11 135.00 132.12 1ao8 s PRO 53 Ca 0.08 -0.51 -0.14 0.00 0.04 0.00 0.00 61.00 60.47 1ao8 s PRO 53 Cb -0.11 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1ao8 s PRO 53 CO 0.01 -2.29 0.31 -0.51 0.04 0.00 0.00 177.00 174.56 1ao8 s LEU 54 N -5.79 4.22 1.05 -3.56 1.43 -1.26 -5.08 118.68 109.70 1ao8 s LEU 54 Ca 0.73 -0.04 -0.18 0.00 -1.03 0.00 0.00 54.13 53.61 1ao8 s LEU 54 Cb -0.04 -2.29 0.24 0.00 0.03 0.00 0.00 46.19 44.14 1ao8 s LEU 54 CO 0.52 -0.21 1.30 -2.16 0.23 0.00 0.00 176.35 176.03 1ao8 s PRO 55 N 1.94 -0.08 -1.68 1.29 0.05 -1.26 -4.29 135.00 130.96 1ao8 s PRO 55 Ca 0.11 -0.45 -0.01 0.00 0.05 0.00 0.00 61.00 60.70 1ao8 s PRO 55 Cb -0.16 -1.77 0.00 0.00 0.05 0.00 0.00 34.50 32.62 1ao8 s PRO 55 CO 0.11 -2.89 0.11 0.39 0.05 0.00 0.00 177.00 174.76 1ao8 n GLU 56 N -4.09 -2.18 -3.63 4.56 -0.58 -1.26 -4.92 120.64 108.54 1ao8 n GLU 56 Ca 0.16 0.96 0.03 0.00 -0.42 0.00 0.00 57.16 57.89 1ao8 n GLU 56 Cb 0.59 -5.61 -0.00 0.00 -0.57 0.00 0.00 31.44 25.85 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 -5.12 0.22 -0.30 3.49 1.70 -1.26 -4.02 118.95 113.65 1ao8 s ARG 57 Ca 0.05 -0.13 -0.15 0.00 -0.47 0.00 0.00 55.73 55.04 1ao8 s ARG 57 Cb -0.02 0.07 -0.03 0.00 -0.57 0.00 0.00 34.95 34.40 1ao8 s ARG 57 CO 0.07 -0.10 0.37 0.99 -1.08 0.00 0.00 175.30 175.54 1ao8 s THR 58 N -2.21 5.17 -0.12 4.99 2.01 -1.15 -4.98 115.64 119.34 1ao8 s THR 58 Ca 0.16 0.33 -0.28 0.00 0.31 0.00 0.00 61.69 62.21 1ao8 s THR 58 Cb 0.06 -3.75 -0.01 0.00 0.01 0.00 0.00 72.50 68.80 1ao8 s THR 58 CO -0.05 0.04 0.93 0.20 -0.69 0.00 0.00 174.62 175.05 1ao8 s ASN 59 N 1.69 7.14 -0.36 3.53 0.02 -1.26 -1.23 114.94 124.47 1ao8 s ASN 59 Ca 0.13 1.40 0.00 0.00 -1.02 0.00 0.00 52.86 53.37 1ao8 s ASN 59 Cb -0.16 -2.51 0.12 0.00 0.02 0.00 0.00 41.25 38.72 1ao8 s ASN 59 CO 0.11 -0.41 0.17 -0.69 0.02 0.00 0.00 177.10 176.30 1ao8 s VAL 60 N 1.97 0.80 0.11 1.60 1.01 -0.64 -1.85 120.40 123.41 1ao8 s VAL 60 Ca 0.44 -1.81 -0.22 0.00 0.00 0.00 0.00 61.98 60.40 1ao8 s VAL 60 Cb -0.18 -1.59 -0.07 0.00 0.00 0.00 0.00 36.38 34.54 1ao8 s VAL 60 CO 0.16 -0.83 0.65 -0.69 0.00 0.00 0.00 175.10 174.39 1ao8 s VAL 61 N 1.11 4.59 -0.19 2.92 1.01 -0.84 -2.40 120.40 126.59 1ao8 s VAL 61 Ca 0.14 1.41 -0.05 0.00 0.00 0.00 0.00 61.98 63.48 1ao8 s VAL 61 Cb -0.21 -3.99 0.07 0.00 0.00 0.00 0.00 36.38 32.25 1ao8 s VAL 61 CO -0.11 0.54 0.10 -0.22 0.00 0.00 0.00 175.10 175.41 1ao8 s LEU 62 N -1.13 0.38 -0.01 3.92 2.96 -0.95 -1.65 118.68 122.19 1ao8 s LEU 62 Ca 0.32 -0.74 0.02 0.00 -0.22 0.00 0.00 54.13 53.50 1ao8 s LEU 62 Cb -0.21 -0.26 0.02 0.00 0.50 0.00 0.00 46.19 46.25 1ao8 s LEU 62 CO 0.22 -0.37 0.76 1.07 -1.32 0.00 0.00 176.35 176.72 1ao8 n THR 63 N 5.27 0.41 -2.22 3.68 5.66 -1.26 -4.43 114.28 121.40 1ao8 n THR 63 Ca -0.07 -0.44 -0.19 0.00 -3.05 0.00 0.00 64.05 60.31 1ao8 n THR 63 Cb 0.48 0.68 -0.02 0.00 -1.55 0.00 0.00 70.33 69.92 1ao8 n THR 63 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1ao8 n HIS 64 N -0.25 -0.89 -4.26 1.09 8.25 -1.26 -4.96 115.22 112.94 1ao8 n HIS 64 Ca 0.01 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.28 1ao8 n HIS 64 Cb 0.48 -3.55 -0.16 0.00 1.12 0.00 0.00 29.99 27.89 1ao8 n HIS 64 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1ao8 s GLN 65 N -4.71 0.79 -0.41 -0.41 0.74 -1.26 -5.02 119.66 109.37 1ao8 s GLN 65 Ca 0.00 -0.21 0.05 0.00 0.05 0.00 0.00 55.36 55.25 1ao8 s GLN 65 Cb 0.00 -0.77 0.65 0.00 1.10 0.00 0.00 33.01 33.99 1ao8 s GLN 65 CO 0.00 0.05 1.83 -0.85 -0.55 0.00 0.00 175.29 175.77 1ao8 n GLU 66 N 3.47 2.28 -0.03 1.67 0.00 -1.26 -4.27 120.64 122.50 1ao8 n GLU 66 Ca -0.20 -3.05 -0.02 0.00 0.00 0.00 0.00 57.16 53.89 1ao8 n GLU 66 Cb 0.54 -2.12 -0.07 0.00 0.00 0.00 0.00 31.44 29.79 1ao8 n GLU 66 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1ao8 n ASP 67 N -1.08 2.85 -4.65 -1.84 8.00 -1.26 -4.96 116.55 113.61 1ao8 n ASP 67 Ca 0.54 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.62 1ao8 n ASP 67 Cb 1.55 0.87 -0.03 0.00 -0.02 0.00 0.00 41.12 43.49 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1ao8 s TYR 68 N -2.31 1.43 -0.17 1.24 5.04 -1.26 -4.97 117.35 116.35 1ao8 s TYR 68 Ca -0.04 -0.16 -0.03 0.00 -2.44 0.00 0.00 57.07 54.40 1ao8 s TYR 68 Cb 0.03 -4.13 -0.02 0.00 0.35 0.00 0.00 41.96 38.20 1ao8 s TYR 68 CO 0.37 -4.94 -0.07 -0.65 -1.34 0.00 0.00 175.55 168.92 1ao8 s GLN 69 N 4.64 3.45 -0.21 4.97 -0.21 -1.26 -5.05 119.66 125.99 1ao8 s GLN 69 Ca 0.86 -0.62 -0.04 0.00 0.02 0.00 0.00 55.36 55.58 1ao8 s GLN 69 Cb -0.39 -2.86 0.11 0.00 1.00 0.00 0.00 33.01 30.87 1ao8 s GLN 69 CO 0.38 0.05 0.37 0.00 -2.12 0.00 0.00 175.29 173.97 1ao8 s ALA 70 N 0.83 -1.01 0.32 6.09 0.00 -1.26 -5.15 121.76 121.58 1ao8 s ALA 70 Ca -0.02 1.07 -0.23 0.00 0.00 0.00 0.00 51.96 52.78 1ao8 s ALA 70 Cb -0.15 -1.47 -0.10 0.00 0.00 0.00 0.00 23.12 21.40 1ao8 s ALA 70 CO 0.01 -1.03 0.88 -0.65 0.00 0.00 0.00 175.76 174.98 1ao8 s GLN 71 N 2.54 4.41 0.00 0.00 -1.52 -1.26 -3.78 119.66 120.05 1ao8 s GLN 71 Ca 0.07 1.15 0.00 0.00 -1.95 0.00 0.00 55.36 54.62 1ao8 s GLN 71 Cb -0.14 -2.67 0.00 0.00 -0.22 0.00 0.00 33.01 29.98 1ao8 s GLN 71 CO -0.14 0.24 0.00 0.41 -0.25 0.00 0.00 175.29 175.55 1ao8 n GLY 72 N 0.30 0.77 3.25 3.09 0.00 -1.26 -4.76 105.19 106.58 1ao8 n GLY 72 Ca 0.02 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.83 -0.41 4.61 0.00 -1.25 -4.76 121.76 117.12 1ao8 s ALA 73 Ca 0.00 0.42 -0.20 0.00 0.00 0.00 0.00 51.96 52.18 1ao8 s ALA 73 Cb 0.00 0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.16 1ao8 s ALA 73 CO 0.00 -0.26 0.60 0.08 0.00 0.00 0.00 175.76 176.18 1ao8 s VAL 74 N -1.20 4.90 -0.19 0.00 1.01 -0.77 -4.93 120.40 119.21 1ao8 s VAL 74 Ca -0.12 0.15 -0.09 0.00 0.00 0.00 0.00 61.98 61.92 1ao8 s VAL 74 Cb -0.05 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 1ao8 s VAL 74 CO 0.04 -0.48 0.09 -0.69 0.00 0.00 0.00 175.10 174.06 1ao8 s VAL 75 N 2.66 5.05 0.35 2.92 1.01 -1.26 -1.98 120.40 129.13 1ao8 s VAL 75 Ca 0.21 0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.34 1ao8 s VAL 75 Cb -0.15 -3.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 1ao8 s VAL 75 CO 0.17 0.45 0.03 0.68 0.00 0.00 0.00 175.10 176.42 1ao8 s VAL 76 N 0.40 2.61 -0.21 2.92 -7.23 -0.66 -4.94 120.40 113.30 1ao8 s VAL 76 Ca 0.05 -1.95 0.19 0.00 -1.81 0.00 0.00 61.98 58.46 1ao8 s VAL 76 Cb -0.12 -2.82 0.47 0.00 0.56 0.00 0.00 36.38 34.48 1ao8 s VAL 76 CO -0.01 -0.18 1.15 1.41 -0.31 0.00 0.00 175.10 177.16 1ao8 n HIS 77 N -0.98 1.21 -3.65 2.82 8.25 -1.26 -4.35 115.22 117.27 1ao8 n HIS 77 Ca -0.04 -1.76 -0.07 0.00 -0.26 0.00 0.00 57.72 55.59 1ao8 n HIS 77 Cb 0.62 -0.24 -0.07 0.00 1.12 0.00 0.00 29.99 31.42 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 -3.34 -0.92 0.23 0.41 -1.08 -1.26 -4.83 116.67 105.88 1ao8 s ASP 78 Ca 0.35 1.47 -0.06 0.00 -0.52 0.00 0.00 52.55 53.78 1ao8 s ASP 78 Cb 0.36 1.37 0.23 0.00 -1.46 0.00 0.00 42.92 43.41 1ao8 s ASP 78 CO -0.05 -0.24 1.81 0.58 0.52 0.00 0.00 175.17 177.79 1ao8 h VAL 79 N 5.08 1.25 -0.45 1.11 2.07 -2.00 -2.09 116.25 121.22 1ao8 h VAL 79 Ca -0.30 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 66.40 1ao8 h VAL 79 Cb 1.22 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1ao8 h VAL 79 CO 0.17 0.32 0.07 0.00 0.02 0.00 0.00 177.57 178.15 1ao8 h ALA 80 N 1.24 1.29 -0.40 1.67 0.00 -2.00 -2.24 119.26 118.82 1ao8 h ALA 80 Ca 0.26 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1ao8 h ALA 80 Cb 0.18 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1ao8 h ALA 80 CO -0.03 0.49 -0.08 0.00 0.00 0.00 0.00 179.25 179.63 1ao8 h ALA 81 N 1.42 1.11 -0.63 0.00 0.00 -1.80 -0.76 119.26 118.60 1ao8 h ALA 81 Ca 0.15 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1ao8 h ALA 81 Cb 0.30 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1ao8 h ALA 81 CO 0.00 0.56 0.23 0.28 0.00 0.00 0.00 179.25 180.32 1ao8 h VAL 82 N 0.63 1.23 0.00 0.00 2.07 -0.95 -1.17 116.25 118.07 1ao8 h VAL 82 Ca 0.12 -0.75 -0.22 0.00 0.82 0.00 0.00 66.70 66.67 1ao8 h VAL 82 Cb 0.52 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1ao8 h VAL 82 CO 0.03 0.29 -0.92 -0.26 0.02 0.00 0.00 177.57 176.73 1ao8 h PHE 83 N 0.92 0.49 -0.03 1.57 0.04 -1.22 -3.13 116.94 115.57 1ao8 h PHE 83 Ca 0.21 -0.27 -0.07 0.00 2.80 0.00 0.00 57.97 60.64 1ao8 h PHE 83 Cb 0.22 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.30 1ao8 h PHE 83 CO 0.02 1.09 -0.32 0.00 -0.60 0.00 0.00 178.31 178.49 1ao8 h ALA 84 N 0.83 1.41 -0.58 2.45 0.00 -0.69 -2.49 119.26 120.18 1ao8 h ALA 84 Ca -0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1ao8 h ALA 84 Cb 1.55 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.25 1ao8 h ALA 84 CO 0.15 0.44 0.25 -0.92 0.00 0.00 0.00 179.25 179.17 1ao8 h TYR 85 N 0.06 0.83 -0.07 0.00 3.20 -1.17 0.13 116.97 119.94 1ao8 h TYR 85 Ca 0.01 -0.04 -0.21 0.00 3.14 0.00 0.00 58.73 61.63 1ao8 h TYR 85 Cb 0.60 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1ao8 h TYR 85 CO 0.00 0.63 -0.81 0.00 -1.64 0.00 0.00 178.16 176.33 1ao8 h ALA 86 N 1.45 0.45 -0.41 1.82 0.00 -1.52 -2.83 119.26 118.23 1ao8 h ALA 86 Ca 0.20 -0.64 -0.10 0.00 0.00 0.00 0.00 54.91 54.37 1ao8 h ALA 86 Cb 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1ao8 h ALA 86 CO -0.02 0.76 -0.14 -0.22 0.00 0.00 0.00 179.25 179.63 1ao8 h LYS 87 N 0.32 0.81 0.00 0.00 1.63 -1.09 -2.70 116.57 115.54 1ao8 h LYS 87 Ca -0.05 -0.33 -0.03 0.00 -0.85 0.00 0.00 60.65 59.39 1ao8 h LYS 87 Cb 1.42 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 33.01 1ao8 h LYS 87 CO 0.15 0.95 -0.15 0.37 -3.45 0.00 0.00 179.45 177.31 1ao8 h GLN 88 N 0.62 0.00 -4.39 1.90 4.15 -1.00 -3.35 115.11 113.05 1ao8 h GLN 88 Ca 0.10 0.00 -0.71 0.00 0.77 0.00 0.00 58.65 58.81 1ao8 h GLN 88 Cb 0.67 0.00 -0.32 0.00 0.21 0.00 0.00 27.48 28.04 1ao8 h GLN 88 CO 0.05 0.15 -0.48 -1.01 -1.93 0.00 0.00 178.83 175.61 1ao8 s HIS 89 N -4.63 3.52 0.17 3.99 3.76 -1.02 -4.93 115.29 116.16 1ao8 s HIS 89 Ca -0.04 -2.20 0.21 0.00 -0.15 0.00 0.00 55.06 52.88 1ao8 s HIS 89 Cb 0.16 -3.34 0.82 0.00 1.11 0.00 0.00 32.58 31.32 1ao8 s HIS 89 CO 0.68 -0.98 1.79 -1.00 -0.85 0.00 0.00 174.74 174.38 1ao8 h PRO 90 N 8.19 0.00 -0.87 8.40 0.14 -1.71 -2.94 132.00 143.20 1ao8 h PRO 90 Ca -0.16 0.00 -0.27 0.00 0.14 0.00 0.00 66.00 65.71 1ao8 h PRO 90 Cb 1.06 0.00 -0.16 0.00 0.14 0.00 0.00 31.00 32.03 1ao8 h PRO 90 CO 0.77 0.30 0.34 -0.25 0.14 0.00 0.00 178.00 179.30 1ao8 n ASP 91 N -3.50 4.14 -3.85 1.44 9.92 -1.26 -4.89 116.55 118.55 1ao8 n ASP 91 Ca -0.00 -3.13 -0.12 0.00 -0.53 0.00 0.00 54.79 51.00 1ao8 n ASP 91 Cb 0.46 -0.74 -0.12 0.00 -0.64 0.00 0.00 41.12 40.08 1ao8 n ASP 91 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1ao8 s GLN 92 N -2.65 0.20 0.34 -1.24 -0.21 -1.11 -4.88 119.66 110.10 1ao8 s GLN 92 Ca 0.47 0.01 0.08 0.00 0.02 0.00 0.00 55.36 55.94 1ao8 s GLN 92 Cb 0.38 0.09 -0.04 0.00 1.00 0.00 0.00 33.01 34.44 1ao8 s GLN 92 CO 0.11 -0.03 0.13 -1.21 -2.12 0.00 0.00 175.29 172.16 1ao8 s GLU 93 N -0.28 2.33 -0.24 2.91 8.01 -1.26 -4.90 118.70 125.27 1ao8 s GLU 93 Ca -0.03 -1.58 -0.10 0.00 0.01 0.00 0.00 54.97 53.26 1ao8 s GLU 93 Cb -0.03 -2.14 -0.05 0.00 -4.31 0.00 0.00 34.13 27.61 1ao8 s GLU 93 CO 0.00 0.11 0.15 -1.17 0.01 0.00 0.00 175.26 174.36 1ao8 s LEU 94 N -3.83 4.04 -0.09 1.80 2.96 -1.26 -0.86 118.68 121.45 1ao8 s LEU 94 Ca 0.37 0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.40 1ao8 s LEU 94 Cb -0.02 -2.08 -0.01 0.00 0.50 0.00 0.00 46.19 44.57 1ao8 s LEU 94 CO 0.22 0.06 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.44 1ao8 s VAL 95 N 1.06 2.57 -0.27 1.68 1.01 -0.71 -0.34 120.40 125.40 1ao8 s VAL 95 Ca 0.07 -0.86 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 1ao8 s VAL 95 Cb -0.14 -2.01 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 1ao8 s VAL 95 CO 0.04 0.56 0.10 -0.63 0.00 0.00 0.00 175.10 175.17 1ao8 s ILE 96 N -0.00 4.47 -0.15 2.22 -1.09 0.74 -1.34 121.20 126.04 1ao8 s ILE 96 Ca -0.06 -0.23 0.11 0.00 -2.23 0.00 0.00 60.65 58.24 1ao8 s ILE 96 Cb -0.15 -3.16 -0.17 0.00 -1.58 0.00 0.00 42.46 37.41 1ao8 s ILE 96 CO 0.05 0.25 0.01 0.00 -1.23 0.00 0.00 174.94 174.01 1ao8 n ALA 97 N 4.95 1.63 0.00 9.38 0.00 -1.04 -1.68 120.51 133.75 1ao8 n ALA 97 Ca -0.15 -0.94 0.00 0.00 0.00 0.00 0.00 53.44 52.35 1ao8 n ALA 97 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.92 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 2.19 -1.78 0.00 0.00 0.00 -1.25 -4.77 105.19 99.57 1ao8 n GLY 98 Ca -0.26 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.55 1ao8 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ao8 n GLY 99 N -0.26 1.04 0.27 -0.02 0.00 -1.26 -1.32 105.19 103.64 1ao8 n GLY 99 Ca 0.00 -1.68 -0.05 0.00 0.00 0.00 0.00 46.02 44.30 1ao8 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ao8 h ALA 100 N -1.63 1.07 -0.06 4.61 0.00 -1.93 -1.92 119.26 119.40 1ao8 h ALA 100 Ca 0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1ao8 h ALA 100 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1ao8 h ALA 100 CO 0.00 0.57 -0.25 0.37 0.00 0.00 0.00 179.25 179.94 1ao8 h GLN 101 N 0.66 0.10 0.03 0.00 4.15 -1.99 -2.37 115.11 115.69 1ao8 h GLN 101 Ca 0.12 -0.03 -0.24 0.00 0.77 0.00 0.00 58.65 59.27 1ao8 h GLN 101 Cb 0.54 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.22 1ao8 h GLN 101 CO 0.03 0.35 -1.00 0.82 -1.93 0.00 0.00 178.83 177.10 1ao8 h ILE 102 N 0.09 1.42 -0.27 2.39 1.08 -1.69 -3.08 117.51 117.44 1ao8 h ILE 102 Ca 0.01 -2.56 -0.07 0.00 -0.39 0.00 0.00 64.86 61.85 1ao8 h ILE 102 Cb 0.50 2.52 -0.02 0.00 -3.07 0.00 0.00 36.82 36.75 1ao8 h ILE 102 CO 0.04 0.76 -0.13 -0.26 -0.69 0.00 0.00 178.15 177.86 1ao8 h PHE 103 N 0.20 0.50 -0.08 1.37 0.04 -0.97 -2.28 116.94 115.71 1ao8 h PHE 103 Ca -0.09 -0.07 -0.11 0.00 2.80 0.00 0.00 57.97 60.49 1ao8 h PHE 103 Cb 1.66 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 39.66 1ao8 h PHE 103 CO 0.06 0.58 -0.44 1.15 -0.60 0.00 0.00 178.31 179.06 1ao8 h THR 104 N 0.43 1.32 -0.37 -1.55 2.02 -1.43 -1.84 112.91 111.50 1ao8 h THR 104 Ca 0.08 -1.58 -0.16 0.00 0.77 0.00 0.00 66.41 65.51 1ao8 h THR 104 Cb 0.49 1.75 -0.00 0.00 -1.74 0.00 0.00 68.15 68.65 1ao8 h THR 104 CO 0.03 0.47 -0.40 0.00 0.37 0.00 0.00 175.52 175.99 1ao8 h ALA 105 N 1.39 0.54 -0.92 6.16 0.00 -1.34 -3.09 119.26 122.01 1ao8 h ALA 105 Ca 0.01 -0.46 -0.57 0.00 0.00 0.00 0.00 54.91 53.89 1ao8 h ALA 105 Cb 0.85 -0.11 -0.29 0.00 0.00 0.00 0.00 17.79 18.23 1ao8 h ALA 105 CO 0.07 0.66 0.56 1.19 0.00 0.00 0.00 179.25 181.73 1ao8 n PHE 106 N -4.07 2.95 0.08 0.00 3.72 -0.98 -4.51 117.46 114.65 1ao8 n PHE 106 Ca -0.03 -2.48 -0.06 0.00 -0.05 0.00 0.00 57.45 54.83 1ao8 n PHE 106 Cb 0.55 -1.11 -0.07 0.00 -0.94 0.00 0.00 39.48 37.91 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 1.63 0.00 -1.02 -1.08 3.64 -1.25 -3.22 116.57 115.28 1ao8 h LYS 107 Ca 0.56 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 59.42 1ao8 h LYS 107 Cb 1.56 0.00 -0.28 0.00 -0.41 0.00 0.00 32.23 33.10 1ao8 h LYS 107 CO 1.26 0.92 0.67 -0.25 -2.27 0.00 0.00 179.45 179.78 1ao8 n ASP 108 N -3.42 4.77 -2.78 4.20 9.92 -1.26 -4.58 116.55 123.41 1ao8 n ASP 108 Ca -0.00 -3.55 -0.07 0.00 -0.53 0.00 0.00 54.79 50.65 1ao8 n ASP 108 Cb 0.88 -0.86 0.03 0.00 -0.64 0.00 0.00 41.12 40.52 1ao8 n ASP 108 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1ao8 n ASP 109 N -0.95 -3.07 -3.65 -2.24 8.00 -1.21 -5.13 116.55 108.30 1ao8 n ASP 109 Ca 0.56 -3.09 -0.14 0.00 0.71 0.00 0.00 54.79 52.84 1ao8 n ASP 109 Cb 1.33 1.70 -0.08 0.00 -0.02 0.00 0.00 41.12 44.05 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 0.73 0.00 0.00 2.53 0.11 -1.26 -4.84 120.40 117.67 1ao8 s VAL 110 Ca 0.31 -0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.36 1ao8 s VAL 110 Cb 0.11 -0.93 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 1ao8 s VAL 110 CO -0.15 -0.00 0.00 -0.90 -3.33 0.00 0.00 175.10 170.72 1ao8 n ASP 111 N 2.70 2.49 -4.50 3.54 5.75 -1.26 -4.97 116.55 120.30 1ao8 n ASP 111 Ca -0.14 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.22 1ao8 n ASP 111 Cb 0.55 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.55 1ao8 n ASP 111 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1ao8 s THR 112 N -1.85 5.23 -0.65 2.12 2.01 -1.26 -2.41 115.64 118.83 1ao8 s THR 112 Ca 0.00 -0.36 -0.15 0.00 0.31 0.00 0.00 61.69 61.49 1ao8 s THR 112 Cb 0.00 -3.86 0.16 0.00 0.01 0.00 0.00 72.50 68.81 1ao8 s THR 112 CO 0.00 -0.20 0.60 -0.76 -0.69 0.00 0.00 174.62 173.57 1ao8 s LEU 113 N 1.81 6.40 -0.16 4.42 1.43 0.77 -2.10 118.68 131.26 1ao8 s LEU 113 Ca 0.07 -2.13 -0.20 0.00 -1.03 0.00 0.00 54.13 50.85 1ao8 s LEU 113 Cb -0.18 -2.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 1ao8 s LEU 113 CO 0.11 -0.75 0.58 -0.76 0.23 0.00 0.00 176.35 175.76 1ao8 s LEU 114 N 1.07 4.20 -0.01 1.79 1.43 -0.17 -1.94 118.68 125.05 1ao8 s LEU 114 Ca 0.09 0.85 -0.08 0.00 -1.03 0.00 0.00 54.13 53.96 1ao8 s LEU 114 Cb -0.23 -2.83 0.01 0.00 0.03 0.00 0.00 46.19 43.17 1ao8 s LEU 114 CO -0.01 -0.16 0.16 0.54 0.23 0.00 0.00 176.35 177.11 1ao8 s VAL 115 N 1.36 0.07 -0.40 -1.59 0.11 -1.05 -2.29 120.40 116.60 1ao8 s VAL 115 Ca 0.28 -0.58 -0.07 0.00 -2.93 0.00 0.00 61.98 58.68 1ao8 s VAL 115 Cb -0.16 -0.43 0.08 0.00 -1.53 0.00 0.00 36.38 34.34 1ao8 s VAL 115 CO 0.11 -0.32 0.22 -0.89 -3.33 0.00 0.00 175.10 170.90 1ao8 s THR 116 N -1.18 3.92 -0.15 5.04 2.01 -0.92 -1.90 115.64 122.47 1ao8 s THR 116 Ca -0.13 -1.52 -0.28 0.00 0.31 0.00 0.00 61.69 60.07 1ao8 s THR 116 Cb -0.07 -3.44 -0.01 0.00 0.01 0.00 0.00 72.50 69.00 1ao8 s THR 116 CO 0.02 -0.50 0.98 -0.13 -0.69 0.00 0.00 174.62 174.30 1ao8 s ARG 117 N 1.35 4.35 0.50 4.92 3.00 -0.97 -2.16 118.95 129.95 1ao8 s ARG 117 Ca 0.03 1.30 0.09 0.00 0.00 0.00 0.00 55.73 57.15 1ao8 s ARG 117 Cb -0.23 -3.58 0.05 0.00 0.00 0.00 0.00 34.95 31.20 1ao8 s ARG 117 CO 0.01 -0.41 0.69 -0.51 0.00 0.00 0.00 175.30 175.07 1ao8 s LEU 118 N 2.38 3.37 -0.14 2.53 1.02 -0.84 -0.31 118.68 126.70 1ao8 s LEU 118 Ca 0.45 -0.63 0.00 0.00 0.02 0.00 0.00 54.13 53.97 1ao8 s LEU 118 Cb -0.17 -2.15 -0.09 0.00 0.02 0.00 0.00 46.19 43.80 1ao8 s LEU 118 CO 0.13 -1.06 -0.13 0.00 0.02 0.00 0.00 176.35 175.31 1ao8 n ALA 119 N -2.06 1.73 -1.77 4.21 0.00 -0.58 -3.80 120.51 118.24 1ao8 n ALA 119 Ca 0.12 -0.59 -0.40 0.00 0.00 0.00 0.00 53.44 52.57 1ao8 n ALA 119 Cb 0.60 0.19 0.00 0.00 0.00 0.00 0.00 19.45 20.25 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 -5.34 2.93 0.30 0.00 0.00 -1.03 -4.76 107.32 99.42 1ao8 s GLY 120 Ca -0.19 1.38 -0.12 0.00 0.00 0.00 0.00 44.72 45.78 1ao8 s GLY 120 CO 0.32 1.99 0.67 -1.35 0.00 0.00 0.00 173.10 174.73 1ao8 s SER 121 N -0.54 6.69 -0.05 1.64 1.04 -1.26 -4.56 113.70 116.65 1ao8 s SER 121 Ca 0.57 1.13 -0.14 0.00 0.48 0.00 0.00 55.95 57.99 1ao8 s SER 121 Cb -0.42 -2.31 0.03 0.00 0.10 0.00 0.00 66.02 63.42 1ao8 s SER 121 CO 0.54 -0.18 0.33 -0.36 0.98 0.00 0.00 173.24 174.55 1ao8 s PHE 122 N -1.98 -0.26 -0.02 5.02 0.08 -1.26 -5.10 117.98 114.46 1ao8 s PHE 122 Ca 0.51 0.50 0.06 0.00 0.12 0.00 0.00 56.93 58.13 1ao8 s PHE 122 Cb -0.11 0.12 -0.02 0.00 -0.57 0.00 0.00 43.02 42.44 1ao8 s PHE 122 CO 0.20 -0.33 -0.21 -1.83 -0.10 0.00 0.00 175.22 172.96 1ao8 s GLU 123 N -0.85 2.25 0.00 0.44 -1.05 -1.26 -4.77 118.70 113.45 1ao8 s GLU 123 Ca -0.09 -0.85 0.00 0.00 -0.15 0.00 0.00 54.97 53.88 1ao8 s GLU 123 Cb -0.04 -2.19 0.00 0.00 -0.44 0.00 0.00 34.13 31.46 1ao8 s GLU 123 CO 0.03 0.58 0.00 0.41 0.95 0.00 0.00 175.26 177.23 1ao8 n GLY 124 N 2.27 2.99 0.11 -3.83 0.00 -1.26 -5.00 105.19 100.47 1ao8 n GLY 124 Ca -0.17 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1ao8 n GLY 124 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ao8 n ASP 125 N 0.00 3.38 -4.69 1.61 9.92 -1.26 -5.00 116.55 120.51 1ao8 n ASP 125 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.84 1ao8 n ASP 125 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 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 -1.95 4.05 0.24 -3.53 2.01 -1.25 -5.02 115.64 110.19 1ao8 s THR 126 Ca 0.00 1.41 0.02 0.00 0.31 0.00 0.00 61.69 63.43 1ao8 s THR 126 Cb 0.00 -3.91 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 1ao8 s THR 126 CO 0.00 0.02 0.04 -0.54 -0.69 0.00 0.00 174.62 173.45 1ao8 s LYS 127 N 2.08 1.35 0.31 4.92 1.02 -1.26 -2.31 119.74 125.85 1ao8 s LYS 127 Ca 0.59 -1.70 -0.19 0.00 0.02 0.00 0.00 55.97 54.69 1ao8 s LYS 127 Cb -0.27 -0.44 -0.09 0.00 -0.52 0.00 0.00 37.83 36.51 1ao8 s LYS 127 CO 0.24 -0.19 0.79 1.41 -0.92 0.00 0.00 175.35 176.68 1ao8 s MET 128 N -3.94 4.18 0.97 1.68 -2.45 -1.22 -4.79 119.30 113.73 1ao8 s MET 128 Ca 0.32 0.87 -0.12 0.00 -1.25 0.00 0.00 55.69 55.52 1ao8 s MET 128 Cb 0.07 -2.57 0.17 0.00 1.25 0.00 0.00 34.83 33.75 1ao8 s MET 128 CO 0.10 0.22 1.08 0.96 1.05 0.00 0.00 175.02 178.43 1ao8 s ILE 129 N -1.83 2.38 -0.77 10.11 -4.36 -1.26 -4.93 121.20 120.53 1ao8 s ILE 129 Ca 0.51 0.12 -0.26 0.00 -0.26 0.00 0.00 60.65 60.77 1ao8 s ILE 129 Cb -0.13 -2.44 0.04 0.00 1.25 0.00 0.00 42.46 41.18 1ao8 s ILE 129 CO 0.19 -0.16 1.28 -2.16 0.24 0.00 0.00 174.94 174.32 1ao8 s PRO 130 N -4.78 3.24 0.23 0.37 0.04 -1.26 -5.02 135.00 127.82 1ao8 s PRO 130 Ca 0.65 -0.42 0.05 0.00 0.04 0.00 0.00 61.00 61.32 1ao8 s PRO 130 Cb -0.20 -4.35 -0.03 0.00 0.04 0.00 0.00 34.50 29.95 1ao8 s PRO 130 CO 0.59 -2.13 0.35 -0.51 0.04 0.00 0.00 177.00 175.34 1ao8 s LEU 131 N 5.47 4.31 -0.08 -3.56 1.43 -1.26 -5.07 118.68 119.91 1ao8 s LEU 131 Ca 0.35 0.07 -0.25 0.00 -1.03 0.00 0.00 54.13 53.27 1ao8 s LEU 131 Cb -0.08 -2.85 -0.03 0.00 0.03 0.00 0.00 46.19 43.26 1ao8 s LEU 131 CO 0.11 -0.05 0.80 0.21 0.23 0.00 0.00 176.35 177.65 1ao8 s ASN 132 N -3.89 7.07 -0.10 2.29 3.84 -1.26 -4.93 114.94 117.96 1ao8 s ASN 132 Ca 0.34 1.30 0.15 0.00 0.21 0.00 0.00 52.86 54.86 1ao8 s ASN 132 Cb -0.09 -2.46 -0.22 0.00 -0.55 0.00 0.00 41.25 37.93 1ao8 s ASN 132 CO 0.29 -0.23 0.17 0.79 -2.79 0.00 0.00 177.10 175.33 1ao8 n TRP 133 N 4.21 0.00 0.28 0.43 7.02 -1.26 -4.37 117.44 123.74 1ao8 n TRP 133 Ca 0.02 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.64 1ao8 n TRP 133 Cb 0.51 -0.62 0.86 0.00 -2.42 0.00 0.00 31.31 29.63 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 0.00 0.00 -0.85 -0.99 3.32 -2.04 -1.34 116.42 114.52 1ao8 h ASP 134 Ca -0.26 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.25 1ao8 h ASP 134 Cb 1.51 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.81 1ao8 h ASP 134 CO 0.01 0.00 0.69 0.47 -1.72 0.00 0.00 179.24 178.70 1ao8 n ASP 135 N -3.97 6.28 -3.74 6.45 9.92 -1.26 -4.91 116.55 125.32 1ao8 n ASP 135 Ca -0.02 -3.52 -0.11 0.00 -0.53 0.00 0.00 54.79 50.61 1ao8 n ASP 135 Cb 0.11 -0.94 -0.06 0.00 -0.64 0.00 0.00 41.12 39.59 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 -3.13 -0.08 0.03 1.24 0.08 -0.51 -4.15 117.98 111.47 1ao8 s PHE 136 Ca 0.53 -0.18 0.02 0.00 0.12 0.00 0.00 56.93 57.42 1ao8 s PHE 136 Cb 0.43 0.11 -0.02 0.00 -0.57 0.00 0.00 43.02 42.97 1ao8 s PHE 136 CO 0.02 -0.57 -0.07 0.99 -0.10 0.00 0.00 175.22 175.49 1ao8 s THR 137 N -3.24 0.46 -0.29 0.64 2.01 -0.56 -4.92 115.64 109.74 1ao8 s THR 137 Ca -0.00 -0.87 -0.25 0.00 0.31 0.00 0.00 61.69 60.88 1ao8 s THR 137 Cb 0.01 -0.51 0.00 0.00 0.01 0.00 0.00 72.50 72.02 1ao8 s THR 137 CO -0.08 -0.29 0.84 -0.75 -0.69 0.00 0.00 174.62 173.65 1ao8 s LYS 138 N -1.25 4.04 -0.18 4.92 2.20 -1.26 -1.43 119.74 126.77 1ao8 s LYS 138 Ca -0.08 0.75 0.06 0.00 -0.36 0.00 0.00 55.97 56.35 1ao8 s LYS 138 Cb -0.08 -3.71 -0.16 0.00 -1.51 0.00 0.00 37.83 32.37 1ao8 s LYS 138 CO 0.00 -0.67 -0.09 0.28 -0.36 0.00 0.00 175.35 174.51 1ao8 n VAL 139 N 5.51 1.12 -4.24 4.02 0.31 -1.15 -4.99 118.33 118.92 1ao8 n VAL 139 Ca 0.05 -0.53 -0.20 0.00 -0.01 0.00 0.00 64.34 63.66 1ao8 n VAL 139 Cb 0.48 -0.97 -0.12 0.00 -0.91 0.00 0.00 33.84 32.32 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 -5.55 2.07 -0.20 4.52 0.15 -1.25 -5.07 113.70 108.37 1ao8 s SER 140 Ca -0.20 -0.73 -0.27 0.00 0.70 0.00 0.00 55.95 55.45 1ao8 s SER 140 Cb 0.06 -0.08 0.08 0.00 -1.71 0.00 0.00 66.02 64.36 1ao8 s SER 140 CO 0.53 -0.08 0.74 -0.55 1.20 0.00 0.00 173.24 175.09 1ao8 s SER 141 N -2.16 -0.69 -0.10 5.45 0.15 -1.26 -2.28 113.70 112.81 1ao8 s SER 141 Ca 0.06 1.15 -0.03 0.00 0.70 0.00 0.00 55.95 57.82 1ao8 s SER 141 Cb -0.07 1.10 0.05 0.00 -1.71 0.00 0.00 66.02 65.38 1ao8 s SER 141 CO 0.03 -0.35 0.10 -0.60 1.20 0.00 0.00 173.24 173.62 1ao8 s ARG 142 N -0.16 0.00 -0.05 5.44 3.52 -0.59 -5.00 118.95 122.11 1ao8 s ARG 142 Ca -0.03 0.27 -0.21 0.00 -0.13 0.00 0.00 55.73 55.63 1ao8 s ARG 142 Cb -0.03 -0.89 -0.05 0.00 -1.56 0.00 0.00 34.95 32.43 1ao8 s ARG 142 CO 0.03 -0.45 0.60 0.99 -0.81 0.00 0.00 175.30 175.66 1ao8 s THR 143 N 2.20 5.02 -0.06 4.11 2.01 -1.26 -1.34 115.64 126.32 1ao8 s THR 143 Ca 0.04 1.23 0.00 0.00 0.31 0.00 0.00 61.69 63.28 1ao8 s THR 143 Cb -0.13 -3.94 0.02 0.00 0.01 0.00 0.00 72.50 68.46 1ao8 s THR 143 CO -0.06 0.35 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.49 1ao8 s VAL 144 N 0.31 0.57 -0.14 3.82 1.01 -0.80 -5.00 120.40 120.16 1ao8 s VAL 144 Ca 0.32 -0.09 -0.05 0.00 0.00 0.00 0.00 61.98 62.16 1ao8 s VAL 144 Cb -0.17 -0.62 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 1ao8 s VAL 144 CO 0.16 0.25 0.03 -0.70 0.00 0.00 0.00 175.10 174.84 1ao8 s GLU 145 N 1.26 3.55 0.00 2.72 2.12 -1.26 -2.46 118.70 124.63 1ao8 s GLU 145 Ca -0.05 -0.39 0.00 0.00 0.36 0.00 0.00 54.97 54.89 1ao8 s GLU 145 Cb -0.14 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.25 1ao8 s GLU 145 CO -0.02 0.44 0.00 -3.47 -0.54 0.00 0.00 175.26 171.67 1ao8 n ASP 146 N 2.96 0.00 -0.16 -1.70 2.03 -1.26 -4.99 116.55 113.44 1ao8 n ASP 146 Ca -0.18 -0.58 -0.08 0.00 0.52 0.00 0.00 54.79 54.48 1ao8 n ASP 146 Cb 0.53 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.93 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 -0.15 1.19 -1.77 5.18 1.35 -1.99 -3.44 112.91 113.28 1ao8 h THR 147 Ca 0.00 -0.56 -0.48 0.00 -0.55 0.00 0.00 66.41 64.81 1ao8 h THR 147 Cb 0.00 0.71 -0.03 0.00 -1.73 0.00 0.00 68.15 67.10 1ao8 h THR 147 CO 0.00 0.21 -0.41 0.20 -0.25 0.00 0.00 175.52 175.27 1ao8 s ASN 148 N -5.87 5.37 0.18 5.36 0.01 -1.26 -5.03 114.94 113.70 1ao8 s ASN 148 Ca -0.13 -0.49 0.09 0.00 -0.71 0.00 0.00 52.86 51.62 1ao8 s ASN 148 Cb 0.11 -0.93 -0.01 0.00 0.41 0.00 0.00 41.25 40.83 1ao8 s ASN 148 CO 0.76 -0.43 1.39 1.55 -1.51 0.00 0.00 177.10 178.86 1ao8 h PRO 149 N 1.13 0.00 0.00 -0.60 0.14 -2.00 -3.20 132.00 127.47 1ao8 h PRO 149 Ca -0.44 0.00 -0.06 0.00 0.14 0.00 0.00 66.00 65.64 1ao8 h PRO 149 Cb 1.26 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.39 1ao8 h PRO 149 CO 0.57 0.83 -0.28 0.00 0.14 0.00 0.00 178.00 179.26 1ao8 h ALA 150 N 1.17 0.96 -0.80 -0.56 0.00 -1.95 -2.97 119.26 115.11 1ao8 h ALA 150 Ca -0.01 -0.26 -0.38 0.00 0.00 0.00 0.00 54.91 54.26 1ao8 h ALA 150 Cb 1.54 -0.05 -0.23 0.00 0.00 0.00 0.00 17.79 19.05 1ao8 h ALA 150 CO 0.11 0.35 0.49 1.28 0.00 0.00 0.00 179.25 181.48 1ao8 n LEU 151 N -3.38 6.03 -4.79 0.00 4.77 -1.21 -2.47 117.00 115.95 1ao8 n LEU 151 Ca 0.00 -3.19 -0.39 0.00 -0.03 0.00 0.00 56.01 52.41 1ao8 n LEU 151 Cb 0.49 -0.77 -0.06 0.00 -2.33 0.00 0.00 43.42 40.75 1ao8 n LEU 151 CO 0.35 0.92 0.41 -0.89 -1.33 0.00 0.00 177.39 176.85 1ao8 s THR 152 N -2.75 4.49 0.04 -5.08 2.01 -1.12 -4.05 115.64 109.19 1ao8 s THR 152 Ca 0.48 1.52 -0.03 0.00 0.31 0.00 0.00 61.69 63.98 1ao8 s THR 152 Cb 0.40 -4.04 -0.02 0.00 0.01 0.00 0.00 72.50 68.84 1ao8 s THR 152 CO 0.10 0.51 0.03 -1.38 -0.69 0.00 0.00 174.62 173.18 1ao8 s HIS 153 N -1.17 0.35 -0.15 4.92 -3.43 -1.03 -1.53 115.29 113.24 1ao8 s HIS 153 Ca 0.34 -0.76 -0.03 0.00 -0.80 0.00 0.00 55.06 53.81 1ao8 s HIS 153 Cb -0.21 -0.25 0.05 0.00 -1.43 0.00 0.00 32.58 30.74 1ao8 s HIS 153 CO 0.24 -0.35 0.06 0.99 -2.00 0.00 0.00 174.74 173.67 1ao8 s THR 154 N -3.07 0.18 -0.41 -5.38 2.01 0.58 -1.90 115.64 107.65 1ao8 s THR 154 Ca -0.01 -0.19 -0.28 0.00 0.31 0.00 0.00 61.69 61.52 1ao8 s THR 154 Cb 0.02 -0.68 -0.01 0.00 0.01 0.00 0.00 72.50 71.84 1ao8 s THR 154 CO -0.07 -0.13 1.75 -0.31 -0.69 0.00 0.00 174.62 175.17 1ao8 s TYR 155 N 2.02 1.87 -0.13 4.92 2.02 -0.45 -2.28 117.35 125.32 1ao8 s TYR 155 Ca 0.02 0.67 -0.03 0.00 -0.37 0.00 0.00 57.07 57.36 1ao8 s TYR 155 Cb -0.15 -4.15 -0.03 0.00 -0.40 0.00 0.00 41.96 37.22 1ao8 s TYR 155 CO -0.07 -2.64 -0.01 -1.21 -1.57 0.00 0.00 175.55 170.04 1ao8 s GLU 156 N 5.87 3.41 -0.30 -0.62 2.02 -0.80 -1.54 118.70 126.74 1ao8 s GLU 156 Ca 0.74 -0.46 -0.00 0.00 0.02 0.00 0.00 54.97 55.26 1ao8 s GLU 156 Cb -0.19 -2.89 0.06 0.00 0.10 0.00 0.00 34.13 31.22 1ao8 s GLU 156 CO 0.30 0.44 -0.00 0.08 0.02 0.00 0.00 175.26 176.10 1ao8 s VAL 157 N -0.16 2.79 -0.31 2.63 1.01 -0.97 -2.52 120.40 122.88 1ao8 s VAL 157 Ca 0.04 -1.56 -0.13 0.00 0.00 0.00 0.00 61.98 60.34 1ao8 s VAL 157 Cb -0.13 -2.67 -0.03 0.00 0.00 0.00 0.00 36.38 33.56 1ao8 s VAL 157 CO 0.02 -0.17 0.25 0.26 0.00 0.00 0.00 175.10 175.46 1ao8 s TRP 158 N 1.19 3.22 0.32 5.22 0.52 -0.82 -2.92 118.94 125.67 1ao8 s TRP 158 Ca -0.04 0.01 0.07 0.00 0.02 0.00 0.00 56.10 56.16 1ao8 s TRP 158 Cb -0.20 -2.48 -0.03 0.00 -1.15 0.00 0.00 33.47 29.62 1ao8 s TRP 158 CO -0.03 -0.28 0.31 -0.65 0.02 0.00 0.00 176.95 176.32 1ao8 s GLN 159 N 1.82 2.85 0.57 4.98 -0.21 -0.51 -0.16 119.66 128.99 1ao8 s GLN 159 Ca 0.08 -1.19 -0.17 0.00 0.02 0.00 0.00 55.36 54.10 1ao8 s GLN 159 Cb -0.17 -2.56 -0.05 0.00 1.00 0.00 0.00 33.01 31.24 1ao8 s GLN 159 CO 0.11 0.15 1.06 0.21 -2.12 0.00 0.00 175.29 174.71 1ao8 s LYS 160 N -4.00 3.38 -0.00 2.91 2.20 -1.01 -1.49 119.74 121.72 1ao8 s LYS 160 Ca 0.40 1.29 -0.12 0.00 -0.36 0.00 0.00 55.97 57.18 1ao8 s LYS 160 Cb -0.07 -2.04 -0.07 0.00 -1.51 0.00 0.00 37.83 34.15 1ao8 s LYS 160 CO 0.27 -0.77 0.78 0.87 -0.36 0.00 0.00 175.35 176.13 1ao8 h LYS 161 N 0.71 -0.41 -0.00 4.03 1.57 -1.92 -3.44 116.57 117.11 1ao8 h LYS 161 Ca -0.48 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1ao8 h LYS 161 Cb 1.23 0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1ao8 h LYS 161 CO 0.57 -0.27 0.00 0.00 -0.57 0.00 0.00 179.45 179.18