#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 -0.25 0.32 6.98 0.00 -0.13 -3.91 121.76 124.77 1ao8 s ALA 2 Ca 0.00 0.47 -0.28 0.00 0.00 0.00 0.00 51.96 52.15 1ao8 s ALA 2 Cb 0.00 -1.06 -0.10 0.00 0.00 0.00 0.00 23.12 21.97 1ao8 s ALA 2 CO 0.00 -0.85 1.15 -0.06 0.00 0.00 0.00 175.76 176.00 1ao8 s PHE 3 N 2.32 3.38 -0.21 0.00 0.40 -0.78 -1.98 117.98 121.11 1ao8 s PHE 3 Ca 0.04 1.62 -0.04 0.00 -0.60 0.00 0.00 56.93 57.95 1ao8 s PHE 3 Cb -0.14 -3.37 0.10 0.00 0.51 0.00 0.00 43.02 40.13 1ao8 s PHE 3 CO -0.09 -0.93 0.30 -1.17 0.70 0.00 0.00 175.22 174.03 1ao8 s LEU 4 N -1.75 -0.37 0.03 -0.37 2.96 -0.76 0.27 118.68 118.69 1ao8 s LEU 4 Ca 0.48 0.14 -0.16 0.00 -0.22 0.00 0.00 54.13 54.37 1ao8 s LEU 4 Cb -0.33 0.77 0.03 0.00 0.50 0.00 0.00 46.19 47.16 1ao8 s LEU 4 CO 0.42 -0.30 0.35 -1.66 -1.32 0.00 0.00 176.35 173.85 1ao8 s TRP 5 N 2.44 -0.19 -0.19 5.38 -2.14 -0.99 -4.43 118.94 118.82 1ao8 s TRP 5 Ca 0.08 0.14 -0.06 0.00 2.66 0.00 0.00 56.10 58.92 1ao8 s TRP 5 Cb -0.15 0.15 -0.03 0.00 -3.10 0.00 0.00 33.47 30.34 1ao8 s TRP 5 CO -0.13 -0.51 0.02 0.00 -2.66 0.00 0.00 176.95 173.67 1ao8 s ALA 6 N -2.31 3.16 0.19 2.67 0.00 -1.26 -2.26 121.76 121.95 1ao8 s ALA 6 Ca -0.06 -0.89 -0.00 0.00 0.00 0.00 0.00 51.96 51.00 1ao8 s ALA 6 Cb -0.01 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.26 1ao8 s ALA 6 CO -0.02 -0.00 0.09 1.14 0.00 0.00 0.00 175.76 176.98 1ao8 s GLN 7 N 0.73 1.14 0.21 0.00 -2.07 -0.89 -4.45 119.66 114.32 1ao8 s GLN 7 Ca 0.01 -1.59 0.01 0.00 -1.82 0.00 0.00 55.36 51.97 1ao8 s GLN 7 Cb -0.14 0.14 0.01 0.00 -1.09 0.00 0.00 33.01 31.93 1ao8 s GLN 7 CO 0.02 -0.31 0.08 -0.40 -1.32 0.00 0.00 175.29 173.35 1ao8 n ASP 8 N -0.24 2.15 0.26 12.60 5.68 -1.23 -2.18 116.55 133.58 1ao8 n ASP 8 Ca -0.01 -1.82 0.09 0.00 -0.50 0.00 0.00 54.79 52.55 1ao8 n ASP 8 Cb 0.65 0.07 0.67 0.00 -1.14 0.00 0.00 41.12 41.37 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 -0.25 0.11 0.11 -1.82 -2.30 114.38 110.23 1ao8 h ARG 9 Ca -0.15 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.79 1ao8 h ARG 9 Cb 0.51 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.59 1ao8 h ARG 9 CO 0.25 0.07 -0.37 -0.44 0.10 0.00 0.00 179.97 179.58 1ao8 h ASP 10 N 0.00 0.75 0.00 0.08 5.19 -1.91 -3.47 116.42 117.06 1ao8 h ASP 10 Ca -0.00 -0.52 0.00 0.00 -0.62 0.00 0.00 57.03 55.89 1ao8 h ASP 10 Cb 0.15 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.44 1ao8 h ASP 10 CO 0.01 1.12 0.00 0.61 -3.12 0.00 0.00 179.24 177.86 1ao8 n GLY 11 N 0.31 1.85 3.91 2.75 0.00 -0.87 -5.09 105.19 108.05 1ao8 n GLY 11 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 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 4.33 -0.02 0.99 2.96 -1.26 -3.21 118.68 122.47 1ao8 s LEU 12 Ca 0.00 0.38 0.26 0.00 -0.22 0.00 0.00 54.13 54.55 1ao8 s LEU 12 Cb 0.00 -3.05 0.44 0.00 0.50 0.00 0.00 46.19 44.08 1ao8 s LEU 12 CO 0.00 0.14 1.16 2.30 -1.32 0.00 0.00 176.35 178.63 1ao8 n ILE 13 N 0.28 0.11 0.00 6.68 -5.35 -0.40 -3.57 119.36 117.11 1ao8 n ILE 13 Ca -0.05 -1.16 0.00 0.00 -0.27 0.00 0.00 62.75 61.27 1ao8 n ILE 13 Cb 0.51 1.02 0.00 0.00 -1.74 0.00 0.00 39.64 39.44 1ao8 n ILE 13 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ao8 n GLY 14 N 0.40 2.93 3.51 3.28 0.00 -1.25 -4.87 105.19 109.19 1ao8 n GLY 14 Ca 0.06 -1.39 -0.02 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.11 0.53 -1.73 1.61 2.20 0.57 -3.05 119.74 117.75 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 0.71 0.00 0.00 -1.51 0.00 0.00 37.83 37.03 1ao8 s LYS 15 CO 0.00 -0.26 0.00 -0.25 -0.36 0.00 0.00 175.35 174.48 1ao8 n ASP 16 N 5.44 -5.26 0.00 1.43 9.92 -1.26 -1.76 116.55 125.05 1ao8 n ASP 16 Ca -0.10 0.17 0.00 0.00 -0.53 0.00 0.00 54.79 54.33 1ao8 n ASP 16 Cb 0.49 -4.49 0.00 0.00 -0.64 0.00 0.00 41.12 36.48 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 -0.76 2.53 3.93 0.44 0.00 -1.26 -5.00 105.19 105.07 1ao8 n GLY 17 Ca -0.21 -0.60 -0.25 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 3.37 0.49 1.61 -3.43 -0.73 -4.81 115.29 111.35 1ao8 s HIS 18 Ca 0.00 0.50 -0.19 0.00 -0.80 0.00 0.00 55.06 54.58 1ao8 s HIS 18 Cb 0.00 -2.33 -0.09 0.00 -1.43 0.00 0.00 32.58 28.73 1ao8 s HIS 18 CO 0.00 -0.36 0.98 -0.51 -2.00 0.00 0.00 174.74 172.85 1ao8 s LEU 19 N -4.66 3.76 0.08 5.38 1.43 -1.26 -0.32 118.68 123.08 1ao8 s LEU 19 Ca 0.48 1.67 -0.02 0.00 -1.03 0.00 0.00 54.13 55.23 1ao8 s LEU 19 Cb -0.10 -4.53 -0.27 0.00 0.03 0.00 0.00 46.19 41.32 1ao8 s LEU 19 CO 0.41 -0.56 1.15 1.55 0.23 0.00 0.00 176.35 179.13 1ao8 h PRO 20 N 1.32 0.21 0.00 1.29 0.13 -1.87 -3.45 132.00 129.63 1ao8 h PRO 20 Ca -0.48 -0.36 -0.58 0.00 -0.87 0.00 0.00 66.00 63.71 1ao8 h PRO 20 Cb 1.19 0.13 -0.07 0.00 0.13 0.00 0.00 31.00 32.38 1ao8 h PRO 20 CO 0.61 1.16 -0.32 -2.67 -0.23 0.00 0.00 178.00 176.55 1ao8 n TRP 21 N -3.49 -0.08 -3.73 1.56 2.14 -1.26 -5.06 117.44 107.52 1ao8 n TRP 21 Ca -0.07 -2.30 -0.30 0.00 2.07 0.00 0.00 57.50 56.90 1ao8 n TRP 21 Cb 1.01 -0.40 -0.15 0.00 -0.81 0.00 0.00 31.31 30.96 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 -2.67 1.66 -0.40 -2.67 2.46 -1.26 -5.08 115.29 107.32 1ao8 s HIS 22 Ca 0.21 -1.69 -0.02 0.00 0.47 0.00 0.00 55.06 54.02 1ao8 s HIS 22 Cb -0.02 -1.68 0.11 0.00 -0.13 0.00 0.00 32.58 30.87 1ao8 s HIS 22 CO 0.13 -0.87 0.19 -1.17 -2.47 0.00 0.00 174.74 170.55 1ao8 s LEU 23 N 1.63 5.20 0.24 8.88 2.96 -1.26 -4.93 118.68 131.40 1ao8 s LEU 23 Ca 0.09 -2.04 0.10 0.00 -0.22 0.00 0.00 54.13 52.07 1ao8 s LEU 23 Cb -0.17 -1.81 0.23 0.00 0.50 0.00 0.00 46.19 44.94 1ao8 s LEU 23 CO -0.25 -0.53 1.54 1.55 -1.32 0.00 0.00 176.35 177.34 1ao8 h PRO 24 N 8.01 0.00 -0.11 0.98 0.14 -1.99 -3.12 132.00 135.91 1ao8 h PRO 24 Ca -0.12 0.00 -0.09 0.00 0.14 0.00 0.00 66.00 65.93 1ao8 h PRO 24 Cb 1.05 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.17 1ao8 h PRO 24 CO 0.68 0.69 -0.32 0.22 0.14 0.00 0.00 178.00 179.41 1ao8 h ASP 25 N 0.00 0.22 0.55 1.44 3.58 -1.99 -2.48 116.42 117.73 1ao8 h ASP 25 Ca -0.01 -0.08 -0.11 0.00 0.42 0.00 0.00 57.03 57.26 1ao8 h ASP 25 Cb 1.25 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 42.22 1ao8 h ASP 25 CO 0.09 0.54 -0.51 -0.78 -2.88 0.00 0.00 179.24 175.70 1ao8 h ASP 26 N 0.19 0.00 -0.23 2.28 1.82 -1.97 -2.84 116.42 115.67 1ao8 h ASP 26 Ca 0.03 0.00 -0.02 0.00 -0.39 0.00 0.00 57.03 56.64 1ao8 h ASP 26 Cb 0.67 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.67 1ao8 h ASP 26 CO 0.05 0.51 0.09 -0.07 -1.61 0.00 0.00 179.24 178.20 1ao8 h LEU 27 N 0.00 0.39 -0.56 2.28 3.38 -1.49 -0.50 115.31 118.81 1ao8 h LEU 27 Ca -0.01 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1ao8 h LEU 27 Cb 0.92 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 1ao8 h LEU 27 CO 0.07 0.39 -0.16 0.45 0.09 0.00 0.00 178.44 179.27 1ao8 h HIS 28 N 0.43 1.12 -0.01 1.13 3.86 -1.52 -1.99 115.15 118.16 1ao8 h HIS 28 Ca 0.10 -0.25 -0.15 0.00 -1.16 0.00 0.00 60.37 58.92 1ao8 h HIS 28 Cb 0.15 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 1ao8 h HIS 28 CO 0.00 1.06 -0.68 -0.92 0.86 0.00 0.00 177.93 178.25 1ao8 h TYR 29 N 0.87 0.06 -0.22 2.45 3.20 -1.41 -2.92 116.97 118.99 1ao8 h TYR 29 Ca 0.12 -0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.83 1ao8 h TYR 29 Cb 0.73 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.98 1ao8 h TYR 29 CO 0.05 0.71 -0.43 0.35 -1.64 0.00 0.00 178.16 177.20 1ao8 h PHE 30 N 0.03 0.65 -0.38 -3.82 3.57 -0.87 -2.11 116.94 114.02 1ao8 h PHE 30 Ca -0.01 -0.19 -0.11 0.00 3.53 0.00 0.00 57.97 61.19 1ao8 h PHE 30 Cb 1.21 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 1ao8 h PHE 30 CO 0.01 0.88 -0.19 -0.09 -2.23 0.00 0.00 178.31 176.69 1ao8 h ARG 31 N 0.44 0.79 0.00 1.11 2.43 -1.28 -2.82 114.38 115.05 1ao8 h ARG 31 Ca 0.03 -0.35 -0.07 0.00 -0.81 0.00 0.00 59.98 58.79 1ao8 h ARG 31 Cb 0.93 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 1ao8 h ARG 31 CO 0.08 0.97 -0.31 0.00 -1.51 0.00 0.00 179.97 179.20 1ao8 h ALA 32 N 0.80 1.27 -0.86 2.80 0.00 -1.43 -2.03 119.26 119.81 1ao8 h ALA 32 Ca 0.08 -0.28 -0.53 0.00 0.00 0.00 0.00 54.91 54.18 1ao8 h ALA 32 Cb 0.74 -0.05 -0.26 0.00 0.00 0.00 0.00 17.79 18.22 1ao8 h ALA 32 CO 0.06 0.39 0.68 1.04 0.00 0.00 0.00 179.25 181.42 1ao8 n GLN 33 N -3.85 2.30 0.00 0.00 1.13 -0.80 -4.35 117.38 111.81 1ao8 n GLN 33 Ca -0.01 -2.73 0.00 0.00 -1.94 0.00 0.00 57.00 52.32 1ao8 n GLN 33 Cb 0.39 -2.07 0.00 0.00 0.11 0.00 0.00 30.24 28.67 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 -1.80 5.09 -2.24 -1.03 -4.98 114.28 108.61 1ao8 n THR 34 Ca 0.53 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.89 1ao8 n THR 34 Cb 0.99 -0.17 -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 -1.69 2.58 0.00 2.28 -7.23 -0.79 -2.01 120.40 113.54 1ao8 s VAL 35 Ca 0.00 0.20 0.00 0.00 -1.81 0.00 0.00 61.98 60.37 1ao8 s VAL 35 Cb 0.00 -3.13 0.00 0.00 0.56 0.00 0.00 36.38 33.81 1ao8 s VAL 35 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1ao8 n GLY 36 N 4.07 0.64 3.39 2.32 0.00 -1.26 -4.98 105.19 109.37 1ao8 n GLY 36 Ca 0.16 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.06 0.95 -3.48 1.61 5.02 -0.85 -4.67 118.16 115.68 1ao8 n LYS 37 Ca 0.00 -2.19 -0.43 0.00 -2.02 0.00 0.00 58.31 53.67 1ao8 n LYS 37 Cb 0.40 2.55 -0.10 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 -2.32 5.06 -0.30 -0.18 1.01 -0.87 -3.36 121.20 120.24 1ao8 s ILE 38 Ca 0.18 -0.84 -0.21 0.00 0.00 0.00 0.00 60.65 59.78 1ao8 s ILE 38 Cb -0.04 -3.88 -0.01 0.00 0.01 0.00 0.00 42.46 38.54 1ao8 s ILE 38 CO 0.13 -0.37 0.68 -0.32 0.00 0.00 0.00 174.94 175.06 1ao8 s MET 39 N 1.63 3.94 -0.27 2.79 1.75 -0.72 -0.99 119.30 127.43 1ao8 s MET 39 Ca 0.04 0.41 -0.09 0.00 -1.25 0.00 0.00 55.69 54.80 1ao8 s MET 39 Cb -0.20 -3.72 -0.03 0.00 2.84 0.00 0.00 34.83 33.71 1ao8 s MET 39 CO 0.08 -0.58 0.14 0.08 -0.65 0.00 0.00 175.02 174.09 1ao8 s VAL 40 N 2.69 4.82 0.03 10.11 1.01 -0.14 -1.61 120.40 137.31 1ao8 s VAL 40 Ca 0.27 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.21 1ao8 s VAL 40 Cb -0.15 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1ao8 s VAL 40 CO 0.11 0.25 -0.07 0.68 0.00 0.00 0.00 175.10 176.07 1ao8 s VAL 41 N 1.68 0.53 0.00 2.92 -7.23 -0.96 -2.40 120.40 114.94 1ao8 s VAL 41 Ca 0.06 -0.85 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 1ao8 s VAL 41 Cb -0.16 -0.55 0.00 0.00 0.56 0.00 0.00 36.38 36.23 1ao8 s VAL 41 CO 0.07 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.24 1ao8 n GLY 42 N 1.87 0.57 0.15 2.32 0.00 -0.61 -2.35 105.19 107.14 1ao8 n GLY 42 Ca -0.20 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 43.90 1ao8 n GLY 42 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ao8 h ARG 43 N 0.00 0.00 -0.02 1.61 3.08 -1.92 0.30 114.38 117.43 1ao8 h ARG 43 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1ao8 h ARG 43 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1ao8 h ARG 43 CO 0.00 0.55 -0.61 0.00 -1.07 0.00 0.00 179.97 178.84 1ao8 h ARG 44 N 0.00 0.06 0.01 0.04 3.08 -1.95 -2.49 114.38 113.13 1ao8 h ARG 44 Ca -0.01 -0.04 -0.32 0.00 0.07 0.00 0.00 59.98 59.68 1ao8 h ARG 44 Cb 1.01 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 31.01 1ao8 h ARG 44 CO 0.07 0.65 -1.93 2.41 -1.07 0.00 0.00 179.97 180.10 1ao8 n THR 45 N -3.83 1.55 -0.09 2.04 -1.04 -1.11 -3.63 114.28 108.18 1ao8 n THR 45 Ca -0.01 -0.81 -0.06 0.00 -2.04 0.00 0.00 64.05 61.13 1ao8 n THR 45 Cb 0.61 -0.91 0.13 0.00 -1.82 0.00 0.00 70.33 68.34 1ao8 n THR 45 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 1ao8 h TYR 46 N 0.00 0.85 0.00 -1.42 3.20 -0.39 -2.60 116.97 116.60 1ao8 h TYR 46 Ca -0.37 -0.16 -0.09 0.00 3.14 0.00 0.00 58.73 61.25 1ao8 h TYR 46 Cb 2.08 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 40.12 1ao8 h TYR 46 CO 0.00 0.85 -0.42 0.93 -1.64 0.00 0.00 178.16 177.88 1ao8 h GLU 47 N 0.70 0.00 0.00 1.82 5.08 -1.60 -3.05 114.58 117.52 1ao8 h GLU 47 Ca 0.12 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 1ao8 h GLU 47 Cb 0.60 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1ao8 h GLU 47 CO 0.04 0.42 -0.12 0.66 -1.00 0.00 0.00 179.01 179.01 1ao8 h SER 48 N 0.00 0.00 -4.06 1.42 4.64 -1.53 -3.42 113.55 110.60 1ao8 h SER 48 Ca -0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1ao8 h SER 48 Cb 1.06 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.22 1ao8 h SER 48 CO 0.05 0.12 0.46 -0.36 -0.87 0.00 0.00 176.83 176.23 1ao8 s PHE 49 N -4.69 2.71 -0.09 4.77 0.08 -1.16 -4.98 117.98 114.62 1ao8 s PHE 49 Ca -0.04 1.53 -0.08 0.00 0.12 0.00 0.00 56.93 58.47 1ao8 s PHE 49 Cb 0.16 -3.35 -0.06 0.00 -0.57 0.00 0.00 43.02 39.20 1ao8 s PHE 49 CO 0.66 -1.64 0.26 -1.00 -0.10 0.00 0.00 175.22 173.40 1ao8 h PRO 50 N 1.48 -0.09 -4.27 0.24 0.13 -1.89 -3.42 132.00 124.18 1ao8 h PRO 50 Ca -0.50 0.01 -0.72 0.00 -0.87 0.00 0.00 66.00 63.91 1ao8 h PRO 50 Cb 1.26 0.02 -0.30 0.00 0.13 0.00 0.00 31.00 32.11 1ao8 h PRO 50 CO 0.58 0.11 -0.39 0.21 -0.23 0.00 0.00 178.00 178.28 1ao8 s LYS 51 N -2.02 2.46 -0.07 0.86 2.36 -1.26 -5.07 119.74 117.00 1ao8 s LYS 51 Ca -0.05 -1.82 -0.08 0.00 -2.55 0.00 0.00 55.97 51.48 1ao8 s LYS 51 Cb -0.00 -3.90 -0.04 0.00 -1.05 0.00 0.00 37.83 32.83 1ao8 s LYS 51 CO 0.16 -1.19 0.20 1.03 1.55 0.00 0.00 175.35 177.11 1ao8 s ARG 52 N 1.26 3.54 0.88 4.03 0.52 -1.26 -4.02 118.95 123.89 1ao8 s ARG 52 Ca 0.07 -0.05 -0.12 0.00 -0.52 0.00 0.00 55.73 55.11 1ao8 s ARG 52 Cb -0.25 -3.17 0.16 0.00 0.52 0.00 0.00 34.95 32.21 1ao8 s ARG 52 CO -0.01 0.74 1.22 -1.25 0.02 0.00 0.00 175.30 176.01 1ao8 s PRO 53 N -1.22 1.11 -0.17 3.54 0.04 -1.26 -5.07 135.00 131.98 1ao8 s PRO 53 Ca 0.19 -0.48 -0.18 0.00 0.04 0.00 0.00 61.00 60.56 1ao8 s PRO 53 Cb -0.13 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 1ao8 s PRO 53 CO 0.08 -2.04 0.51 -0.51 0.04 0.00 0.00 177.00 175.08 1ao8 s LEU 54 N -5.66 4.20 0.90 -3.56 1.43 -1.26 -5.06 118.68 109.68 1ao8 s LEU 54 Ca 0.70 0.74 -0.14 0.00 -1.03 0.00 0.00 54.13 54.40 1ao8 s LEU 54 Cb -0.05 -2.71 0.15 0.00 0.03 0.00 0.00 46.19 43.60 1ao8 s LEU 54 CO 0.50 -0.11 1.24 -2.16 0.23 0.00 0.00 176.35 176.06 1ao8 s PRO 55 N 1.23 1.19 -1.69 1.29 0.04 -1.26 -4.21 135.00 131.59 1ao8 s PRO 55 Ca 0.25 -0.13 0.00 0.00 0.04 0.00 0.00 61.00 61.16 1ao8 s PRO 55 Cb -0.15 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1ao8 s PRO 55 CO 0.10 -2.08 0.00 -1.91 0.04 0.00 0.00 177.00 173.15 1ao8 n GLU 56 N -3.60 -1.58 -3.59 4.56 4.07 -1.26 -4.92 120.64 114.32 1ao8 n GLU 56 Ca 0.11 0.96 0.01 0.00 -0.06 0.00 0.00 57.16 58.19 1ao8 n GLU 56 Cb 0.60 -5.56 -0.01 0.00 -0.06 0.00 0.00 31.44 26.42 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 -4.98 0.21 -0.21 5.31 1.70 -1.26 -4.07 118.95 115.65 1ao8 s ARG 57 Ca 0.00 -0.11 -0.11 0.00 -0.47 0.00 0.00 55.73 55.04 1ao8 s ARG 57 Cb 0.00 0.07 -0.05 0.00 -0.57 0.00 0.00 34.95 34.41 1ao8 s ARG 57 CO 0.00 -0.09 0.19 0.99 -1.08 0.00 0.00 175.30 175.30 1ao8 s THR 58 N -2.23 5.36 -0.19 4.99 2.01 -1.21 -4.94 115.64 119.42 1ao8 s THR 58 Ca 0.14 0.28 -0.09 0.00 0.31 0.00 0.00 61.69 62.33 1ao8 s THR 58 Cb 0.05 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.99 1ao8 s THR 58 CO -0.05 0.38 0.10 0.20 -0.69 0.00 0.00 174.62 174.56 1ao8 s ASN 59 N 0.68 5.93 -0.37 3.53 0.01 -1.26 -1.75 114.94 121.70 1ao8 s ASN 59 Ca 0.10 0.16 0.02 0.00 -0.71 0.00 0.00 52.86 52.43 1ao8 s ASN 59 Cb -0.12 -2.03 0.11 0.00 0.41 0.00 0.00 41.25 39.62 1ao8 s ASN 59 CO 0.02 0.18 0.13 -0.69 -1.51 0.00 0.00 177.10 175.22 1ao8 s VAL 60 N 0.38 1.64 -0.12 1.60 1.01 -0.63 -0.47 120.40 123.80 1ao8 s VAL 60 Ca 0.06 -2.16 -0.29 0.00 0.00 0.00 0.00 61.98 59.58 1ao8 s VAL 60 Cb -0.12 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 1ao8 s VAL 60 CO -0.01 -0.71 1.02 -0.69 0.00 0.00 0.00 175.10 174.72 1ao8 s VAL 61 N 0.91 4.74 -0.33 2.92 1.01 -0.73 -2.26 120.40 126.66 1ao8 s VAL 61 Ca 0.13 2.02 -0.01 0.00 0.00 0.00 0.00 61.98 64.11 1ao8 s VAL 61 Cb -0.20 -4.30 0.07 0.00 0.00 0.00 0.00 36.38 31.95 1ao8 s VAL 61 CO -0.12 -0.03 0.06 -0.22 0.00 0.00 0.00 175.10 174.80 1ao8 s LEU 62 N 2.22 4.37 0.00 3.92 2.96 -0.99 -1.77 118.68 129.39 1ao8 s LEU 62 Ca 0.48 -1.60 0.05 0.00 -0.22 0.00 0.00 54.13 52.84 1ao8 s LEU 62 Cb -0.18 -1.73 -0.02 0.00 0.50 0.00 0.00 46.19 44.76 1ao8 s LEU 62 CO 0.16 -0.35 0.26 1.07 -1.32 0.00 0.00 176.35 176.17 1ao8 n THR 63 N 4.56 0.00 -1.49 3.68 5.66 -1.26 -4.33 114.28 121.11 1ao8 n THR 63 Ca -0.08 -1.90 -0.08 0.00 -3.05 0.00 0.00 64.05 58.94 1ao8 n THR 63 Cb 0.43 0.98 0.18 0.00 -1.55 0.00 0.00 70.33 70.37 1ao8 n THR 63 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 1ao8 n HIS 64 N -0.51 1.34 -4.26 1.09 -0.00 -1.26 -4.76 115.22 106.86 1ao8 n HIS 64 Ca 0.05 -1.72 -0.34 0.00 0.46 0.00 0.00 57.72 56.17 1ao8 n HIS 64 Cb 0.49 -0.54 -0.14 0.00 -0.12 0.00 0.00 29.99 29.68 1ao8 n HIS 64 CO 0.00 0.00 0.00 -1.14 0.46 0.00 0.00 176.34 175.66 1ao8 s GLN 65 N -3.31 3.38 0.00 1.57 2.00 -1.26 -4.98 119.66 117.07 1ao8 s GLN 65 Ca 0.46 -0.65 0.27 0.00 -2.00 0.00 0.00 55.36 53.44 1ao8 s GLN 65 Cb 0.41 -2.85 0.87 0.00 0.80 0.00 0.00 33.01 32.25 1ao8 s GLN 65 CO -0.00 -0.02 1.64 0.39 -0.50 0.00 0.00 175.29 176.80 1ao8 n GLU 66 N 4.24 0.75 -0.62 1.67 1.02 -1.26 -3.76 120.64 122.67 1ao8 n GLU 66 Ca -0.18 -0.40 0.08 0.00 -0.02 0.00 0.00 57.16 56.64 1ao8 n GLU 66 Cb 0.52 -1.49 0.32 0.00 -0.02 0.00 0.00 31.44 30.77 1ao8 n GLU 66 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1ao8 n ASP 67 N -0.78 4.65 -4.40 1.62 2.03 -1.26 -4.86 116.55 113.55 1ao8 n ASP 67 Ca 0.12 -2.87 -0.45 0.00 0.52 0.00 0.00 54.79 52.11 1ao8 n ASP 67 Cb 0.33 -0.59 -0.03 0.00 -0.72 0.00 0.00 41.12 40.11 1ao8 n ASP 67 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1ao8 s TYR 68 N -2.61 3.19 -0.42 -0.67 5.04 -1.25 -5.00 117.35 115.63 1ao8 s TYR 68 Ca 0.47 -1.31 -0.13 0.00 -2.44 0.00 0.00 57.07 53.66 1ao8 s TYR 68 Cb 0.36 -4.09 0.05 0.00 0.35 0.00 0.00 41.96 38.63 1ao8 s TYR 68 CO 0.14 -1.32 0.31 -0.65 -1.34 0.00 0.00 175.55 172.68 1ao8 s GLN 69 N 2.23 2.89 -0.22 4.97 -0.21 -1.26 -4.94 119.66 123.12 1ao8 s GLN 69 Ca 0.21 -1.21 0.02 0.00 0.02 0.00 0.00 55.36 54.40 1ao8 s GLN 69 Cb -0.14 -3.95 0.05 0.00 1.00 0.00 0.00 33.01 29.97 1ao8 s GLN 69 CO -0.02 -0.86 -0.12 0.00 -2.12 0.00 0.00 175.29 172.17 1ao8 s ALA 70 N 1.60 2.23 0.24 6.09 0.00 -1.26 -5.11 121.76 125.56 1ao8 s ALA 70 Ca 0.04 -1.40 -0.30 0.00 0.00 0.00 0.00 51.96 50.30 1ao8 s ALA 70 Cb -0.21 -1.38 -0.09 0.00 0.00 0.00 0.00 23.12 21.44 1ao8 s ALA 70 CO 0.07 -0.90 1.05 -0.65 0.00 0.00 0.00 175.76 175.33 1ao8 s GLN 71 N 1.28 4.69 0.00 0.00 1.11 -1.26 -3.40 119.66 122.09 1ao8 s GLN 71 Ca -0.03 1.68 0.00 0.00 0.01 0.00 0.00 55.36 57.02 1ao8 s GLN 71 Cb -0.17 -3.24 0.00 0.00 -1.01 0.00 0.00 33.01 28.59 1ao8 s GLN 71 CO -0.08 0.27 0.00 0.41 0.01 0.00 0.00 175.29 175.90 1ao8 n GLY 72 N 1.51 2.72 3.81 3.09 0.00 -1.26 -4.68 105.19 110.38 1ao8 n GLY 72 Ca -0.00 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.66 3.67 -0.57 4.61 0.00 -1.22 -4.75 121.76 121.84 1ao8 s ALA 73 Ca 0.00 -1.62 -0.12 0.00 0.00 0.00 0.00 51.96 50.21 1ao8 s ALA 73 Cb 0.00 -1.10 0.14 0.00 0.00 0.00 0.00 23.12 22.16 1ao8 s ALA 73 CO 0.00 0.09 0.49 0.08 0.00 0.00 0.00 175.76 176.42 1ao8 s VAL 74 N -2.28 4.85 -0.40 0.00 1.01 0.38 -4.87 120.40 119.09 1ao8 s VAL 74 Ca 0.38 -1.87 -0.29 0.00 0.00 0.00 0.00 61.98 60.20 1ao8 s VAL 74 Cb -0.06 -4.11 0.02 0.00 0.00 0.00 0.00 36.38 32.23 1ao8 s VAL 74 CO 0.25 -0.87 1.11 -0.69 0.00 0.00 0.00 175.10 174.90 1ao8 s VAL 75 N 1.15 4.35 0.47 2.92 1.01 -1.26 -1.77 120.40 127.28 1ao8 s VAL 75 Ca 0.08 1.48 0.07 0.00 0.00 0.00 0.00 61.98 63.60 1ao8 s VAL 75 Cb -0.24 -4.51 0.01 0.00 0.00 0.00 0.00 36.38 31.63 1ao8 s VAL 75 CO -0.01 -0.75 0.42 0.68 0.00 0.00 0.00 175.10 175.44 1ao8 s VAL 76 N 4.07 2.29 -0.09 2.92 -7.23 -0.73 -4.96 120.40 116.67 1ao8 s VAL 76 Ca 0.47 -1.37 0.15 0.00 -1.81 0.00 0.00 61.98 59.42 1ao8 s VAL 76 Cb -0.10 -2.65 0.29 0.00 0.56 0.00 0.00 36.38 34.48 1ao8 s VAL 76 CO 0.24 0.00 1.16 1.41 -0.31 0.00 0.00 175.10 177.60 1ao8 n HIS 77 N -1.67 -0.12 -3.64 2.82 8.25 -1.26 -4.17 115.22 115.43 1ao8 n HIS 77 Ca 0.03 -0.94 -0.05 0.00 -0.26 0.00 0.00 57.72 56.50 1ao8 n HIS 77 Cb 0.63 0.32 -0.06 0.00 1.12 0.00 0.00 29.99 32.00 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 -1.81 -0.97 0.32 0.41 1.01 -1.26 -5.03 116.67 109.35 1ao8 s ASP 78 Ca 0.17 1.47 0.02 0.00 0.71 0.00 0.00 52.55 54.93 1ao8 s ASP 78 Cb 0.25 1.65 0.55 0.00 1.01 0.00 0.00 42.92 46.39 1ao8 s ASP 78 CO -0.09 -0.22 1.91 0.58 0.21 0.00 0.00 175.17 177.56 1ao8 h VAL 79 N 5.30 1.19 -0.12 -1.27 2.07 -2.00 -1.75 116.25 119.67 1ao8 h VAL 79 Ca -0.26 -0.62 -0.09 0.00 0.82 0.00 0.00 66.70 66.55 1ao8 h VAL 79 Cb 1.19 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1ao8 h VAL 79 CO 0.14 0.24 -0.34 0.00 0.02 0.00 0.00 177.57 177.63 1ao8 h ALA 80 N 1.49 1.20 -0.47 1.67 0.00 -2.00 -2.79 119.26 118.35 1ao8 h ALA 80 Ca 0.17 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1ao8 h ALA 80 Cb 0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ao8 h ALA 80 CO -0.01 0.54 -0.19 0.00 0.00 0.00 0.00 179.25 179.59 1ao8 h ALA 81 N 1.43 0.78 -0.02 0.00 0.00 -1.73 -1.37 119.26 118.34 1ao8 h ALA 81 Ca 0.03 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1ao8 h ALA 81 Cb 0.71 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1ao8 h ALA 81 CO 0.05 0.66 -0.15 0.28 0.00 0.00 0.00 179.25 180.10 1ao8 h VAL 82 N 0.82 1.12 0.06 0.00 2.07 -1.20 -2.07 116.25 117.05 1ao8 h VAL 82 Ca 0.11 -0.55 -0.25 0.00 0.82 0.00 0.00 66.70 66.83 1ao8 h VAL 82 Cb 0.74 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 1ao8 h VAL 82 CO 0.06 0.16 -1.18 -0.26 0.02 0.00 0.00 177.57 176.37 1ao8 h PHE 83 N 0.03 0.24 -0.58 1.57 0.04 -1.30 -3.19 116.94 113.75 1ao8 h PHE 83 Ca 0.01 -0.17 -0.07 0.00 2.80 0.00 0.00 57.97 60.53 1ao8 h PHE 83 Cb 0.28 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.40 1ao8 h PHE 83 CO 0.00 1.15 0.07 0.00 -0.60 0.00 0.00 178.31 178.93 1ao8 h ALA 84 N 0.79 1.04 -0.64 2.45 0.00 -0.60 0.08 119.26 122.38 1ao8 h ALA 84 Ca -0.09 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 1ao8 h ALA 84 Cb 1.88 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.42 1ao8 h ALA 84 CO 0.16 0.61 0.08 -0.92 0.00 0.00 0.00 179.25 179.18 1ao8 h TYR 85 N 0.89 1.15 -0.21 0.00 3.20 -1.48 -1.80 116.97 118.72 1ao8 h TYR 85 Ca 0.18 -0.17 -0.16 0.00 3.14 0.00 0.00 58.73 61.71 1ao8 h TYR 85 Cb 0.42 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1ao8 h TYR 85 CO 0.03 0.98 -0.54 0.00 -1.64 0.00 0.00 178.16 176.99 1ao8 h ALA 86 N 1.02 0.67 -0.34 1.82 0.00 -1.47 -2.40 119.26 118.56 1ao8 h ALA 86 Ca 0.19 -0.51 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1ao8 h ALA 86 Cb 0.47 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1ao8 h ALA 86 CO 0.02 0.69 -0.01 -0.22 0.00 0.00 0.00 179.25 179.73 1ao8 h LYS 87 N 0.47 0.53 0.00 0.00 3.64 -0.73 -2.19 116.57 118.29 1ao8 h LYS 87 Ca 0.01 -0.12 -0.14 0.00 -1.27 0.00 0.00 60.65 59.14 1ao8 h LYS 87 Cb 1.09 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1ao8 h LYS 87 CO 0.11 0.56 -0.67 1.96 -2.27 0.00 0.00 179.45 179.14 1ao8 h GLN 88 N 0.51 0.00 -4.45 1.90 1.08 -1.17 -3.40 115.11 109.57 1ao8 h GLN 88 Ca 0.11 0.00 -0.72 0.00 -1.45 0.00 0.00 58.65 56.59 1ao8 h GLN 88 Cb 0.34 0.00 -0.24 0.00 -0.05 0.00 0.00 27.48 27.53 1ao8 h GLN 88 CO 0.01 0.67 -0.43 -1.01 -0.95 0.00 0.00 178.83 177.11 1ao8 s HIS 89 N -3.26 3.27 -0.05 2.96 3.76 -0.82 -4.92 115.29 116.22 1ao8 s HIS 89 Ca 0.00 -1.04 0.13 0.00 -0.15 0.00 0.00 55.06 54.01 1ao8 s HIS 89 Cb 0.11 -2.81 0.05 0.00 1.11 0.00 0.00 32.58 31.04 1ao8 s HIS 89 CO 0.76 -0.74 1.43 -1.00 -0.85 0.00 0.00 174.74 174.35 1ao8 h PRO 90 N 8.56 0.00 -0.87 8.40 0.13 -1.80 -3.23 132.00 143.19 1ao8 h PRO 90 Ca -0.26 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.60 1ao8 h PRO 90 Cb 1.10 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.07 1ao8 h PRO 90 CO 0.76 0.62 0.34 -0.25 -0.23 0.00 0.00 178.00 179.25 1ao8 n ASP 91 N -3.29 4.13 -3.66 1.44 8.00 -1.26 -4.82 116.55 117.08 1ao8 n ASP 91 Ca 0.01 -3.13 -0.16 0.00 0.71 0.00 0.00 54.79 52.23 1ao8 n ASP 91 Cb 0.77 -0.74 -0.15 0.00 -0.02 0.00 0.00 41.12 40.98 1ao8 n ASP 91 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1ao8 s GLN 92 N -2.64 0.07 0.67 -1.24 -0.21 -1.22 -4.87 119.66 110.22 1ao8 s GLN 92 Ca 0.47 0.60 0.01 0.00 0.02 0.00 0.00 55.36 56.46 1ao8 s GLN 92 Cb 0.38 -0.23 0.13 0.00 1.00 0.00 0.00 33.01 34.29 1ao8 s GLN 92 CO 0.11 -0.31 0.92 0.39 -2.12 0.00 0.00 175.29 174.28 1ao8 n GLU 93 N 5.33 -0.01 -4.35 2.91 1.02 -1.26 -4.86 120.64 119.41 1ao8 n GLU 93 Ca -0.05 -2.57 -0.34 0.00 -0.02 0.00 0.00 57.16 54.18 1ao8 n GLU 93 Cb 0.50 -0.59 -0.11 0.00 -0.02 0.00 0.00 31.44 31.22 1ao8 n GLU 93 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1ao8 s LEU 94 N 0.00 3.40 -0.07 -4.62 2.96 -1.26 -2.05 118.68 117.04 1ao8 s LEU 94 Ca 0.62 -0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.52 1ao8 s LEU 94 Cb -0.04 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.85 1ao8 s LEU 94 CO 0.41 0.23 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.82 1ao8 s VAL 95 N 0.03 1.33 -0.22 1.68 1.01 -0.16 -0.96 120.40 123.12 1ao8 s VAL 95 Ca 0.01 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.34 1ao8 s VAL 95 Cb -0.13 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 1ao8 s VAL 95 CO 0.02 0.40 0.02 -0.63 0.00 0.00 0.00 175.10 174.91 1ao8 s ILE 96 N 0.56 4.02 -0.11 2.22 -1.09 -0.84 -0.97 121.20 124.98 1ao8 s ILE 96 Ca -0.15 -0.28 0.13 0.00 -2.23 0.00 0.00 60.65 58.12 1ao8 s ILE 96 Cb -0.16 -2.84 -0.19 0.00 -1.58 0.00 0.00 42.46 37.69 1ao8 s ILE 96 CO 0.05 0.40 0.11 0.00 -1.23 0.00 0.00 174.94 174.27 1ao8 n ALA 97 N 4.51 1.86 0.00 9.38 0.00 -1.01 -1.83 120.51 133.42 1ao8 n ALA 97 Ca -0.17 -0.80 0.00 0.00 0.00 0.00 0.00 53.44 52.47 1ao8 n ALA 97 Cb 0.52 -0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.81 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 2.02 -0.71 0.00 0.00 0.00 -1.25 -4.75 105.19 100.50 1ao8 n GLY 98 Ca -0.18 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 -0.43 0.58 0.26 -0.02 0.00 -1.26 -1.57 105.19 102.74 1ao8 n GLY 99 Ca 0.00 -1.56 -0.03 0.00 0.00 0.00 0.00 46.02 44.43 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 -1.91 1.17 0.00 4.61 0.00 -1.93 -2.15 119.26 119.05 1ao8 h ALA 100 Ca 0.00 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1ao8 h ALA 100 Cb 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1ao8 h ALA 100 CO 0.00 0.53 -0.16 1.96 0.00 0.00 0.00 179.25 181.58 1ao8 h GLN 101 N 0.50 0.00 0.22 0.00 4.20 -2.00 -1.86 115.11 116.18 1ao8 h GLN 101 Ca 0.09 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.48 1ao8 h GLN 101 Cb 0.54 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.35 1ao8 h GLN 101 CO 0.03 0.16 -1.42 0.82 -0.67 0.00 0.00 178.83 177.75 1ao8 h ILE 102 N 0.00 1.34 -0.81 2.54 1.08 -1.67 -3.18 117.51 116.81 1ao8 h ILE 102 Ca -0.00 -2.80 -0.04 0.00 -0.39 0.00 0.00 64.86 61.63 1ao8 h ILE 102 Cb 0.28 3.02 -0.04 0.00 -3.07 0.00 0.00 36.82 37.02 1ao8 h ILE 102 CO 0.02 0.83 0.37 -0.26 -0.69 0.00 0.00 178.15 178.42 1ao8 h PHE 103 N 0.13 1.19 -0.31 1.37 0.04 -0.97 -2.04 116.94 116.35 1ao8 h PHE 103 Ca -0.23 -0.07 -0.03 0.00 2.80 0.00 0.00 57.97 60.44 1ao8 h PHE 103 Cb 2.12 -0.36 -0.02 0.00 2.20 0.00 0.00 35.95 39.89 1ao8 h PHE 103 CO 0.11 0.87 0.05 1.15 -0.60 0.00 0.00 178.31 179.90 1ao8 h THR 104 N 1.16 1.16 -0.47 -1.55 2.02 -1.43 -1.75 112.91 112.05 1ao8 h THR 104 Ca 0.28 -0.59 -0.08 0.00 0.77 0.00 0.00 66.41 66.79 1ao8 h THR 104 Cb 0.15 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1ao8 h THR 104 CO -0.03 0.21 -0.03 0.00 0.37 0.00 0.00 175.52 176.04 1ao8 h ALA 105 N 1.62 0.64 -0.97 6.16 0.00 -1.36 -2.97 119.26 122.38 1ao8 h ALA 105 Ca 0.10 -0.29 -0.67 0.00 0.00 0.00 0.00 54.91 54.05 1ao8 h ALA 105 Cb 0.22 -0.17 -0.31 0.00 0.00 0.00 0.00 17.79 17.53 1ao8 h ALA 105 CO 0.00 0.47 0.70 1.19 0.00 0.00 0.00 179.25 181.60 1ao8 n PHE 106 N -4.32 3.18 0.05 0.00 3.72 -0.92 -4.51 117.46 114.66 1ao8 n PHE 106 Ca 0.00 -2.93 -0.06 0.00 -0.05 0.00 0.00 57.45 54.41 1ao8 n PHE 106 Cb 0.33 -1.33 -0.11 0.00 -0.94 0.00 0.00 39.48 37.43 1ao8 n PHE 106 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1ao8 h LYS 107 N 2.05 0.00 -1.01 -1.08 3.64 -1.16 -3.27 116.57 115.74 1ao8 h LYS 107 Ca 0.58 0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 59.46 1ao8 h LYS 107 Cb 0.87 0.00 -0.29 0.00 -0.41 0.00 0.00 32.23 32.40 1ao8 h LYS 107 CO 1.50 0.85 0.64 -0.25 -2.27 0.00 0.00 179.45 179.93 1ao8 n ASP 108 N -3.28 4.24 -2.75 4.20 8.00 -1.26 -4.60 116.55 121.10 1ao8 n ASP 108 Ca -0.03 -3.53 -0.05 0.00 0.71 0.00 0.00 54.79 51.90 1ao8 n ASP 108 Cb 0.94 -0.84 0.02 0.00 -0.02 0.00 0.00 41.12 41.22 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 -3.20 -3.56 -2.24 8.00 -1.23 -5.14 116.55 108.18 1ao8 n ASP 109 Ca 0.56 -2.93 -0.16 0.00 0.71 0.00 0.00 54.79 52.97 1ao8 n ASP 109 Cb 1.47 1.72 -0.06 0.00 -0.02 0.00 0.00 41.12 44.23 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 0.82 0.00 0.10 2.53 0.11 -1.26 -4.86 120.40 117.83 1ao8 s VAL 110 Ca 0.30 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.35 1ao8 s VAL 110 Cb 0.07 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.92 1ao8 s VAL 110 CO -0.11 0.00 0.00 0.47 -3.33 0.00 0.00 175.10 172.13 1ao8 n ASP 111 N 1.37 0.28 -4.65 3.54 9.92 -1.25 -4.96 116.55 120.80 1ao8 n ASP 111 Ca -0.17 0.16 -0.41 0.00 -0.53 0.00 0.00 54.79 53.84 1ao8 n ASP 111 Cb 0.57 0.00 -0.05 0.00 -0.64 0.00 0.00 41.12 41.00 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 4.91 -0.39 -3.53 2.01 -1.26 -3.29 115.64 112.09 1ao8 s THR 112 Ca 0.00 1.41 -0.06 0.00 0.31 0.00 0.00 61.69 63.34 1ao8 s THR 112 Cb 0.00 -4.05 0.08 0.00 0.01 0.00 0.00 72.50 68.54 1ao8 s THR 112 CO 0.00 -0.00 0.19 -0.76 -0.69 0.00 0.00 174.62 173.36 1ao8 s LEU 113 N 2.48 4.92 -0.14 4.42 1.43 -0.90 -1.86 118.68 129.04 1ao8 s LEU 113 Ca 0.32 -1.57 -0.15 0.00 -1.03 0.00 0.00 54.13 51.71 1ao8 s LEU 113 Cb -0.16 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 1ao8 s LEU 113 CO 0.09 -0.48 0.33 -0.76 0.23 0.00 0.00 176.35 175.76 1ao8 s LEU 114 N 1.33 4.27 -0.04 1.79 1.43 0.14 -2.20 118.68 125.40 1ao8 s LEU 114 Ca 0.03 0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 53.59 1ao8 s LEU 114 Cb -0.22 -2.45 0.03 0.00 0.03 0.00 0.00 46.19 43.58 1ao8 s LEU 114 CO 0.00 0.11 0.32 0.54 0.23 0.00 0.00 176.35 177.55 1ao8 s VAL 115 N 0.33 0.04 -0.31 -1.59 0.11 -1.01 -2.35 120.40 115.63 1ao8 s VAL 115 Ca 0.19 -0.37 -0.08 0.00 -2.93 0.00 0.00 61.98 58.79 1ao8 s VAL 115 Cb -0.14 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.13 1ao8 s VAL 115 CO 0.06 -0.20 0.11 -0.89 -3.33 0.00 0.00 175.10 170.85 1ao8 s THR 116 N -1.00 4.18 -0.33 5.04 2.01 -0.96 -1.00 115.64 123.58 1ao8 s THR 116 Ca -0.11 -0.64 -0.23 0.00 0.31 0.00 0.00 61.69 61.03 1ao8 s THR 116 Cb -0.05 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.30 1ao8 s THR 116 CO 0.03 0.05 0.75 -0.13 -0.69 0.00 0.00 174.62 174.63 1ao8 s ARG 117 N 1.53 3.84 0.51 4.92 0.52 -0.52 -2.10 118.95 127.66 1ao8 s ARG 117 Ca 0.03 0.37 -0.00 0.00 -0.52 0.00 0.00 55.73 55.61 1ao8 s ARG 117 Cb -0.17 -3.77 0.01 0.00 0.52 0.00 0.00 34.95 31.54 1ao8 s ARG 117 CO 0.04 -0.74 0.75 -0.51 0.02 0.00 0.00 175.30 174.86 1ao8 s LEU 118 N 2.93 3.43 -0.17 2.53 1.02 -0.93 -0.81 118.68 126.69 1ao8 s LEU 118 Ca 0.30 0.25 0.03 0.00 0.02 0.00 0.00 54.13 54.72 1ao8 s LEU 118 Cb -0.14 -3.11 -0.12 0.00 0.02 0.00 0.00 46.19 42.85 1ao8 s LEU 118 CO 0.14 -0.94 -0.13 0.00 0.02 0.00 0.00 176.35 175.45 1ao8 n ALA 119 N -2.27 1.64 -1.77 4.21 0.00 -0.92 -3.83 120.51 117.56 1ao8 n ALA 119 Ca 0.04 -0.75 -0.39 0.00 0.00 0.00 0.00 53.44 52.34 1ao8 n ALA 119 Cb 0.58 0.09 -0.01 0.00 0.00 0.00 0.00 19.45 20.11 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 -5.53 2.93 0.47 0.00 0.00 -0.82 -4.81 107.32 99.56 1ao8 s GLY 120 Ca -0.21 1.13 -0.10 0.00 0.00 0.00 0.00 44.72 45.54 1ao8 s GLY 120 CO 0.41 1.71 0.84 -1.35 0.00 0.00 0.00 173.10 174.71 1ao8 s SER 121 N -0.82 6.43 0.19 1.64 1.04 -1.26 -4.64 113.70 116.29 1ao8 s SER 121 Ca 0.55 1.18 -0.11 0.00 0.48 0.00 0.00 55.95 58.04 1ao8 s SER 121 Cb -0.36 -2.35 -0.00 0.00 0.10 0.00 0.00 66.02 63.41 1ao8 s SER 121 CO 0.46 -0.53 0.37 -0.36 0.98 0.00 0.00 173.24 174.16 1ao8 s PHE 122 N -2.60 0.32 0.04 5.02 0.08 -1.26 -5.11 117.98 114.47 1ao8 s PHE 122 Ca 0.52 -0.67 0.07 0.00 0.12 0.00 0.00 56.93 56.97 1ao8 s PHE 122 Cb -0.10 0.07 -0.02 0.00 -0.57 0.00 0.00 43.02 42.40 1ao8 s PHE 122 CO 0.38 -0.83 -0.21 -2.00 -0.10 0.00 0.00 175.22 172.46 1ao8 s GLU 123 N -3.97 1.45 -0.04 0.44 2.56 -1.26 -4.92 118.70 112.95 1ao8 s GLU 123 Ca 0.18 -0.94 -0.23 0.00 0.00 0.00 0.00 54.97 53.97 1ao8 s GLU 123 Cb 0.02 -1.55 0.08 0.00 2.00 0.00 0.00 34.13 34.67 1ao8 s GLU 123 CO 0.02 0.40 1.05 0.41 -0.56 0.00 0.00 175.26 176.58 1ao8 n GLY 124 N 1.89 0.23 0.06 -1.50 0.00 -1.26 -4.92 105.19 99.70 1ao8 n GLY 124 Ca -0.17 -0.99 -0.06 0.00 0.00 0.00 0.00 46.02 44.80 1ao8 n GLY 124 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ao8 n ASP 125 N -0.85 2.27 -4.71 1.61 5.75 -1.26 -4.96 116.55 114.41 1ao8 n ASP 125 Ca 0.04 -0.01 -0.42 0.00 -0.01 0.00 0.00 54.79 54.39 1ao8 n ASP 125 Cb 0.46 0.64 -0.03 0.00 -1.03 0.00 0.00 41.12 41.16 1ao8 n ASP 125 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1ao8 s THR 126 N -2.28 3.61 0.05 2.12 2.01 -1.17 -4.99 115.64 114.98 1ao8 s THR 126 Ca -0.08 1.12 -0.00 0.00 0.31 0.00 0.00 61.69 63.04 1ao8 s THR 126 Cb 0.04 -3.72 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 1ao8 s THR 126 CO 0.45 0.06 -0.04 -0.54 -0.69 0.00 0.00 174.62 173.86 1ao8 s LYS 127 N 1.44 0.55 0.39 4.92 1.02 -1.26 -1.28 119.74 125.52 1ao8 s LYS 127 Ca 0.63 -1.02 -0.23 0.00 0.02 0.00 0.00 55.97 55.37 1ao8 s LYS 127 Cb -0.33 0.08 -0.10 0.00 -0.52 0.00 0.00 37.83 36.95 1ao8 s LYS 127 CO 0.29 -0.07 0.95 1.41 -0.92 0.00 0.00 175.35 177.02 1ao8 s MET 128 N -2.98 4.35 0.89 1.68 -2.45 -1.20 -4.81 119.30 114.79 1ao8 s MET 128 Ca -0.01 1.23 -0.11 0.00 -1.25 0.00 0.00 55.69 55.55 1ao8 s MET 128 Cb 0.01 -2.44 0.13 0.00 1.25 0.00 0.00 34.83 33.78 1ao8 s MET 128 CO -0.06 0.07 1.09 0.96 1.05 0.00 0.00 175.02 178.14 1ao8 s ILE 129 N -1.93 2.68 -0.28 10.11 -4.36 -1.26 -4.97 121.20 121.19 1ao8 s ILE 129 Ca 0.57 0.22 -0.29 0.00 -0.26 0.00 0.00 60.65 60.90 1ao8 s ILE 129 Cb -0.14 -2.61 0.01 0.00 1.25 0.00 0.00 42.46 40.98 1ao8 s ILE 129 CO 0.18 -0.29 1.04 -2.16 0.24 0.00 0.00 174.94 173.95 1ao8 s PRO 130 N -4.85 4.14 0.54 0.37 0.04 -1.26 -5.04 135.00 128.94 1ao8 s PRO 130 Ca 0.64 1.16 0.01 0.00 0.04 0.00 0.00 61.00 62.85 1ao8 s PRO 130 Cb -0.19 -3.69 0.01 0.00 0.04 0.00 0.00 34.50 30.66 1ao8 s PRO 130 CO 0.57 -0.77 0.07 -0.51 0.04 0.00 0.00 177.00 176.41 1ao8 s LEU 131 N 3.41 2.26 -0.22 -3.56 1.43 -1.26 -5.12 118.68 115.61 1ao8 s LEU 131 Ca 0.44 -1.64 -0.09 0.00 -1.03 0.00 0.00 54.13 51.81 1ao8 s LEU 131 Cb -0.14 -0.77 -0.04 0.00 0.03 0.00 0.00 46.19 45.27 1ao8 s LEU 131 CO 0.11 -0.97 0.10 0.21 0.23 0.00 0.00 176.35 176.03 1ao8 s ASN 132 N -3.98 5.73 -0.13 2.29 3.84 -1.26 -4.96 114.94 116.47 1ao8 s ASN 132 Ca 0.06 0.04 0.18 0.00 0.21 0.00 0.00 52.86 53.35 1ao8 s ASN 132 Cb -0.00 -2.01 -0.26 0.00 -0.55 0.00 0.00 41.25 38.42 1ao8 s ASN 132 CO 0.04 0.09 0.20 0.79 -2.79 0.00 0.00 177.10 175.42 1ao8 n TRP 133 N 4.10 0.00 0.29 0.43 7.02 -1.26 -4.29 117.44 123.73 1ao8 n TRP 133 Ca -0.16 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.46 1ao8 n TRP 133 Cb 0.52 -0.77 0.86 0.00 -2.42 0.00 0.00 31.31 29.50 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 -0.90 -0.99 3.32 -2.03 -0.82 116.42 115.00 1ao8 h ASP 134 Ca -0.34 0.00 -0.48 0.00 0.02 0.00 0.00 57.03 56.24 1ao8 h ASP 134 Cb 1.74 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 41.01 1ao8 h ASP 134 CO 0.02 0.01 0.61 -0.67 -1.72 0.00 0.00 179.24 177.48 1ao8 n ASP 135 N -3.95 3.90 -3.70 6.45 2.03 -1.26 -4.86 116.55 115.16 1ao8 n ASP 135 Ca -0.03 -3.46 -0.11 0.00 0.52 0.00 0.00 54.79 51.71 1ao8 n ASP 135 Cb 0.09 -0.82 -0.11 0.00 -0.72 0.00 0.00 41.12 39.56 1ao8 n ASP 135 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1ao8 s PHE 136 N -3.00 -0.54 0.12 -0.67 0.40 -0.31 -3.54 117.98 110.43 1ao8 s PHE 136 Ca 0.52 1.17 0.03 0.00 -0.60 0.00 0.00 56.93 58.05 1ao8 s PHE 136 Cb 0.43 0.21 -0.04 0.00 0.51 0.00 0.00 43.02 44.13 1ao8 s PHE 136 CO 0.09 -0.33 0.16 0.99 0.70 0.00 0.00 175.22 176.84 1ao8 s THR 137 N 1.47 4.81 -0.36 0.64 2.01 -0.78 -4.83 115.64 118.60 1ao8 s THR 137 Ca -0.09 -0.81 -0.23 0.00 0.31 0.00 0.00 61.69 60.88 1ao8 s THR 137 Cb -0.09 -3.41 0.01 0.00 0.01 0.00 0.00 72.50 69.02 1ao8 s THR 137 CO -0.12 -0.00 0.78 -0.75 -0.69 0.00 0.00 174.62 173.84 1ao8 s LYS 138 N -2.84 3.75 -0.13 4.92 2.20 -1.26 -1.74 119.74 124.63 1ao8 s LYS 138 Ca 0.32 0.31 -0.12 0.00 -0.36 0.00 0.00 55.97 56.11 1ao8 s LYS 138 Cb -0.11 -3.81 -0.09 0.00 -1.51 0.00 0.00 37.83 32.31 1ao8 s LYS 138 CO 0.25 -0.84 0.17 0.28 -0.36 0.00 0.00 175.35 174.85 1ao8 h VAL 139 N 5.74 0.55 -2.91 4.02 2.07 -1.73 -3.49 116.25 120.51 1ao8 h VAL 139 Ca -0.25 -1.48 -0.45 0.00 0.82 0.00 0.00 66.70 65.33 1ao8 h VAL 139 Cb 1.09 1.11 -0.14 0.00 -1.52 0.00 0.00 31.29 31.83 1ao8 h VAL 139 CO 0.91 0.19 -0.64 -0.44 0.02 0.00 0.00 177.57 177.61 1ao8 s SER 140 N -5.94 2.33 -0.31 0.57 0.01 -1.24 -5.04 113.70 104.08 1ao8 s SER 140 Ca -0.12 -1.29 -0.00 0.00 1.31 0.00 0.00 55.95 55.84 1ao8 s SER 140 Cb 0.01 -0.08 0.19 0.00 0.21 0.00 0.00 66.02 66.35 1ao8 s SER 140 CO 0.30 -0.52 0.78 -0.55 0.41 0.00 0.00 173.24 173.65 1ao8 s SER 141 N -3.43 -1.13 -0.07 2.44 0.15 -1.26 -2.41 113.70 107.98 1ao8 s SER 141 Ca 0.33 -0.04 -0.25 0.00 0.70 0.00 0.00 55.95 56.69 1ao8 s SER 141 Cb 0.07 1.64 -0.03 0.00 -1.71 0.00 0.00 66.02 65.98 1ao8 s SER 141 CO 0.13 -0.19 0.75 -0.60 1.20 0.00 0.00 173.24 174.53 1ao8 s ARG 142 N 2.63 4.44 -0.19 5.44 6.06 -0.94 -4.91 118.95 131.48 1ao8 s ARG 142 Ca 0.17 0.97 -0.10 0.00 -2.50 0.00 0.00 55.73 54.26 1ao8 s ARG 142 Cb -0.05 -3.46 -0.05 0.00 0.06 0.00 0.00 34.95 31.45 1ao8 s ARG 142 CO -0.21 0.01 0.14 0.99 -2.50 0.00 0.00 175.30 173.73 1ao8 s THR 143 N 0.96 5.41 0.13 4.11 2.01 -1.26 -0.87 115.64 126.13 1ao8 s THR 143 Ca 0.40 0.22 0.04 0.00 0.31 0.00 0.00 61.69 62.66 1ao8 s THR 143 Cb -0.18 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 1ao8 s THR 143 CO 0.19 0.46 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.79 1ao8 s VAL 144 N 0.20 1.09 0.05 3.82 1.01 -0.47 -5.00 120.40 121.11 1ao8 s VAL 144 Ca 0.09 -1.92 -0.02 0.00 0.00 0.00 0.00 61.98 60.14 1ao8 s VAL 144 Cb -0.11 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1ao8 s VAL 144 CO -0.01 -0.68 0.01 -1.83 0.00 0.00 0.00 175.10 172.59 1ao8 s GLU 145 N -3.42 0.61 0.00 2.72 4.04 -1.26 -2.22 118.70 119.17 1ao8 s GLU 145 Ca 0.13 -1.08 0.00 0.00 0.04 0.00 0.00 54.97 54.05 1ao8 s GLU 145 Cb 0.01 0.22 0.00 0.00 0.02 0.00 0.00 34.13 34.38 1ao8 s GLU 145 CO 0.00 -0.13 0.00 -3.47 -1.84 0.00 0.00 175.26 169.82 1ao8 n ASP 146 N 0.29 1.95 0.18 0.83 -0.08 -1.26 -4.94 116.55 113.53 1ao8 n ASP 146 Ca -0.16 -0.68 0.05 0.00 -1.51 0.00 0.00 54.79 52.49 1ao8 n ASP 146 Cb 0.60 0.00 0.48 0.00 2.34 0.00 0.00 41.12 44.55 1ao8 n ASP 146 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1ao8 h THR 147 N 0.67 1.12 -1.81 5.18 1.35 -2.02 -3.43 112.91 113.96 1ao8 h THR 147 Ca 0.00 -0.55 -0.52 0.00 -0.55 0.00 0.00 66.41 64.78 1ao8 h THR 147 Cb 0.00 1.20 -0.06 0.00 -1.73 0.00 0.00 68.15 67.56 1ao8 h THR 147 CO 0.00 0.17 -0.49 0.20 -0.25 0.00 0.00 175.52 175.15 1ao8 s ASN 148 N -6.96 4.90 0.10 5.36 -0.87 -1.26 -5.04 114.94 111.17 1ao8 s ASN 148 Ca -0.05 -0.70 0.01 0.00 -1.57 0.00 0.00 52.86 50.55 1ao8 s ASN 148 Cb 0.16 -0.77 -0.25 0.00 -0.02 0.00 0.00 41.25 40.37 1ao8 s ASN 148 CO 0.71 -0.37 1.21 1.55 -2.57 0.00 0.00 177.10 177.63 1ao8 h PRO 149 N 1.39 0.14 -0.03 -0.60 0.13 -1.99 -3.27 132.00 127.77 1ao8 h PRO 149 Ca -0.44 -0.23 -0.15 0.00 -0.87 0.00 0.00 66.00 64.32 1ao8 h PRO 149 Cb 1.25 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 1ao8 h PRO 149 CO 0.61 1.11 -0.64 0.00 -0.23 0.00 0.00 178.00 178.85 1ao8 h ALA 150 N 0.79 0.86 0.00 -0.56 0.00 -1.96 -2.78 119.26 115.62 1ao8 h ALA 150 Ca -0.07 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.26 1ao8 h ALA 150 Cb 1.87 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1ao8 h ALA 150 CO 0.17 0.78 0.00 1.28 0.00 0.00 0.00 179.25 181.47 1ao8 n LEU 151 N -3.81 0.00 -4.74 0.00 4.77 -1.24 -1.94 117.00 110.04 1ao8 n LEU 151 Ca -0.02 0.49 -0.41 0.00 -0.03 0.00 0.00 56.01 56.04 1ao8 n LEU 151 Cb 0.64 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1ao8 n LEU 151 CO 0.44 -0.08 1.01 0.41 -1.33 0.00 0.00 177.39 177.83 1ao8 n THR 152 N -1.49 2.47 -4.01 -5.08 -1.04 -1.05 -4.46 114.28 99.62 1ao8 n THR 152 Ca 0.06 -0.50 -0.09 0.00 -2.04 0.00 0.00 64.05 61.48 1ao8 n THR 152 Cb 0.28 -1.76 -0.08 0.00 -1.82 0.00 0.00 70.33 66.95 1ao8 n THR 152 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 1ao8 s HIS 153 N -1.17 0.50 -0.12 -1.42 -3.43 -0.94 -2.17 115.29 106.54 1ao8 s HIS 153 Ca 0.59 -0.89 -0.04 0.00 -0.80 0.00 0.00 55.06 53.92 1ao8 s HIS 153 Cb -0.49 -0.20 0.06 0.00 -1.43 0.00 0.00 32.58 30.52 1ao8 s HIS 153 CO 0.60 -0.61 0.15 0.99 -2.00 0.00 0.00 174.74 173.86 1ao8 s THR 154 N -3.97 -0.22 0.21 -5.38 2.01 0.01 -1.36 115.64 106.94 1ao8 s THR 154 Ca 0.17 0.16 -0.30 0.00 0.31 0.00 0.00 61.69 62.03 1ao8 s THR 154 Cb 0.05 -0.41 -0.09 0.00 0.01 0.00 0.00 72.50 72.06 1ao8 s THR 154 CO -0.02 -0.01 1.27 -0.31 -0.69 0.00 0.00 174.62 174.86 1ao8 s TYR 155 N 2.25 3.31 -0.06 4.92 2.02 -0.05 -1.43 117.35 128.30 1ao8 s TYR 155 Ca 0.04 1.31 0.04 0.00 -0.37 0.00 0.00 57.07 58.09 1ao8 s TYR 155 Cb -0.14 -3.54 0.00 0.00 -0.40 0.00 0.00 41.96 37.88 1ao8 s TYR 155 CO -0.07 -1.62 -0.18 -1.21 -1.57 0.00 0.00 175.55 170.89 1ao8 s GLU 156 N -0.31 2.13 -0.40 -0.62 0.41 -0.17 -2.22 118.70 117.52 1ao8 s GLU 156 Ca 0.54 -0.64 0.02 0.00 -0.41 0.00 0.00 54.97 54.48 1ao8 s GLU 156 Cb -0.35 -1.74 0.11 0.00 -1.78 0.00 0.00 34.13 30.36 1ao8 s GLU 156 CO 0.39 0.18 0.14 0.08 -0.49 0.00 0.00 175.26 175.55 1ao8 s VAL 157 N 0.28 2.67 0.41 2.63 1.01 -1.01 -2.40 120.40 123.99 1ao8 s VAL 157 Ca -0.11 -2.42 -0.02 0.00 0.00 0.00 0.00 61.98 59.43 1ao8 s VAL 157 Cb -0.15 -2.90 -0.03 0.00 0.00 0.00 0.00 36.38 33.31 1ao8 s VAL 157 CO 0.04 -0.66 0.66 0.26 0.00 0.00 0.00 175.10 175.40 1ao8 s TRP 158 N 0.77 3.50 0.04 5.22 0.52 -0.94 -1.91 118.94 126.14 1ao8 s TRP 158 Ca 0.11 0.53 -0.09 0.00 0.02 0.00 0.00 56.10 56.67 1ao8 s TRP 158 Cb -0.21 -2.10 0.00 0.00 -1.15 0.00 0.00 33.47 30.01 1ao8 s TRP 158 CO -0.06 -0.09 0.19 -0.65 0.02 0.00 0.00 176.95 176.36 1ao8 s GLN 159 N -4.52 0.68 0.36 4.98 -0.21 -0.71 -2.12 119.66 118.12 1ao8 s GLN 159 Ca 0.44 -0.60 -0.27 0.00 0.02 0.00 0.00 55.36 54.94 1ao8 s GLN 159 Cb -0.10 0.28 -0.09 0.00 1.00 0.00 0.00 33.01 34.10 1ao8 s GLN 159 CO 0.40 -0.19 1.25 0.21 -2.12 0.00 0.00 175.29 174.83 1ao8 s LYS 160 N -2.46 4.20 -0.05 2.91 2.20 -1.21 -1.86 119.74 123.47 1ao8 s LYS 160 Ca -0.06 2.06 -0.02 0.00 -0.36 0.00 0.00 55.97 57.59 1ao8 s LYS 160 Cb -0.02 -2.89 -0.01 0.00 -1.51 0.00 0.00 37.83 33.40 1ao8 s LYS 160 CO -0.03 -0.27 0.11 0.87 -0.36 0.00 0.00 175.35 175.67 1ao8 h LYS 161 N 3.04 -0.07 0.00 4.03 1.57 -1.94 -3.46 116.57 119.75 1ao8 h LYS 161 Ca -0.49 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1ao8 h LYS 161 Cb 1.23 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1ao8 h LYS 161 CO 0.64 -0.04 0.00 0.00 -0.57 0.00 0.00 179.45 179.48