#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dao s HIS -8 N 0.00 -0.04 -0.42 4.41 5.65 -1.26 -5.10 115.29 118.53 3dao s HIS -8 Ca 0.00 0.35 0.02 0.00 0.25 0.00 0.00 55.06 55.68 3dao s HIS -8 Cb 0.00 -0.40 0.13 0.00 -1.18 0.00 0.00 32.58 31.13 3dao s HIS -8 CO 0.00 -0.27 0.21 -1.01 -0.65 0.00 0.00 174.74 173.01 3dao s HIS -7 N 2.23 2.02 -0.03 3.88 4.02 -1.26 -5.07 115.29 121.08 3dao s HIS -7 Ca 0.04 -2.35 0.06 0.00 1.02 0.00 0.00 55.06 53.83 3dao s HIS -7 Cb -0.13 -1.92 -0.01 0.00 -1.02 0.00 0.00 32.58 29.51 3dao s HIS -7 CO -0.05 -0.80 -0.20 -2.00 1.02 0.00 0.00 174.74 172.71 3dao s GLU -6 N 0.56 1.75 -0.19 1.40 2.12 -1.26 -5.13 118.70 117.96 3dao s GLU -6 Ca 0.16 -0.71 -0.19 0.00 0.36 0.00 0.00 54.97 54.59 3dao s GLU -6 Cb -0.23 -1.63 -0.03 0.00 0.26 0.00 0.00 34.13 32.50 3dao s GLU -6 CO -0.04 0.39 0.54 -0.80 -0.54 0.00 0.00 175.26 174.81 3dao s ASN -5 N -0.34 6.61 -0.70 -1.70 0.01 -1.26 -5.01 114.94 112.56 3dao s ASN -5 Ca 0.04 0.74 -0.06 0.00 -0.71 0.00 0.00 52.86 52.87 3dao s ASN -5 Cb -0.09 -2.31 0.18 0.00 0.41 0.00 0.00 41.25 39.45 3dao s ASN -5 CO 0.00 -0.17 0.55 -0.76 -1.51 0.00 0.00 177.10 175.21 3dao s LEU -4 N 1.54 5.65 0.60 0.60 1.43 -1.26 -4.94 118.68 122.31 3dao s LEU -4 Ca 0.26 -2.90 0.38 0.00 -1.03 0.00 0.00 54.13 50.84 3dao s LEU -4 Cb -0.16 -1.95 1.84 0.00 0.03 0.00 0.00 46.19 45.95 3dao s LEU -4 CO 0.10 -0.40 2.16 1.88 0.23 0.00 0.00 176.35 180.32 3dao h TYR -3 N 7.12 0.00 -0.62 0.29 0.05 -1.97 -2.85 116.97 118.98 3dao h TYR -3 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.81 3dao h TYR -3 Cb 0.96 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.70 3dao h TYR -3 CO 0.80 0.01 0.00 1.19 -1.05 0.00 0.00 178.16 179.11 3dao n PHE -2 N -3.14 1.18 -0.05 4.88 3.72 -1.26 -3.95 117.46 118.83 3dao n PHE -2 Ca -0.01 -0.57 0.00 0.00 -0.05 0.00 0.00 57.45 56.81 3dao n PHE -2 Cb 0.20 -0.14 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 3dao n PHE -2 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3dao n GLN -1 N 1.15 3.82 0.00 -1.08 1.13 -1.08 -4.60 117.38 116.72 3dao n GLN -1 Ca 0.24 -0.11 0.00 0.00 -1.94 0.00 0.00 57.00 55.18 3dao n GLN -1 Cb 0.75 -0.55 0.00 0.00 0.11 0.00 0.00 30.24 30.55 3dao n GLN -1 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dao n GLY 0 N 0.58 -0.96 0.45 1.08 0.00 -1.24 -5.12 105.19 99.98 3dao n GLY 0 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.31 3dao n GLY 0 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dao n ILE 2 N 0.00 0.00 0.10 -0.61 2.08 -1.25 -5.06 119.36 114.61 3dao n ILE 2 Ca 0.00 0.00 0.02 0.00 0.56 0.00 0.00 62.75 63.33 3dao n ILE 2 Cb 0.00 -0.03 -0.03 0.00 -0.75 0.00 0.00 39.64 38.83 3dao n ILE 2 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 3dao n LYS 3 N 0.27 2.69 -3.75 0.38 4.76 0.10 -4.89 118.16 117.73 3dao n LYS 3 Ca 0.00 -0.02 -0.13 0.00 -2.87 0.00 0.00 58.31 55.29 3dao n LYS 3 Cb 0.00 -0.92 -0.13 0.00 -1.84 0.00 0.00 35.03 32.14 3dao n LYS 3 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3dao s LEU 4 N -2.80 0.65 -0.12 -0.35 0.20 -0.81 -1.02 118.68 114.44 3dao s LEU 4 Ca -0.00 0.44 0.03 0.00 0.69 0.00 0.00 54.13 55.29 3dao s LEU 4 Cb 0.03 0.63 0.00 0.00 -0.43 0.00 0.00 46.19 46.42 3dao s LEU 4 CO 0.19 -0.14 -0.22 -0.63 -0.29 0.00 0.00 176.35 175.26 3dao s ILE 5 N 1.01 2.17 -0.04 6.68 1.01 0.23 -1.38 121.20 130.88 3dao s ILE 5 Ca -0.07 -0.97 0.07 0.00 0.00 0.00 0.00 60.65 59.68 3dao s ILE 5 Cb -0.09 -1.85 -0.01 0.00 0.01 0.00 0.00 42.46 40.52 3dao s ILE 5 CO -0.06 0.55 -0.24 0.00 0.00 0.00 0.00 174.94 175.19 3dao s ALA 6 N 0.53 2.06 0.00 9.38 0.00 0.11 -0.33 121.76 133.53 3dao s ALA 6 Ca -0.14 -1.03 -0.01 0.00 0.00 0.00 0.00 51.96 50.78 3dao s ALA 6 Cb -0.17 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 3dao s ALA 6 CO 0.05 0.45 0.01 -0.08 0.00 0.00 0.00 175.76 176.19 3dao s THR 7 N -0.36 0.05 1.04 0.00 -1.32 -0.52 -1.46 115.64 113.07 3dao s THR 7 Ca 0.03 -0.45 -0.14 0.00 -1.21 0.00 0.00 61.69 59.92 3dao s THR 7 Cb -0.11 -0.17 0.21 0.00 -1.51 0.00 0.00 72.50 70.92 3dao s THR 7 CO 0.01 -0.25 1.11 -0.62 -2.21 0.00 0.00 174.62 172.66 3dao s ASP 8 N -0.74 2.30 0.02 8.08 -1.08 -1.08 -0.39 116.67 123.78 3dao s ASP 8 Ca -0.08 1.00 -0.02 0.00 -0.52 0.00 0.00 52.55 52.93 3dao s ASP 8 Cb -0.05 -1.55 -0.01 0.00 -1.46 0.00 0.00 42.92 39.85 3dao s ASP 8 CO -0.00 -3.31 -0.03 -0.38 0.52 0.00 0.00 175.17 171.97 3dao n ILE 9 N -4.27 0.54 -2.11 4.11 5.41 -1.26 -4.36 119.36 117.42 3dao n ILE 9 Ca 0.07 0.21 -0.43 0.00 1.00 0.00 0.00 62.75 63.61 3dao n ILE 9 Cb 0.58 -1.38 -0.03 0.00 -0.71 0.00 0.00 39.64 38.10 3dao n ILE 9 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 3dao s ASP 10 N -5.28 6.62 0.00 4.38 1.01 -1.26 -0.73 116.67 121.40 3dao s ASP 10 Ca -0.03 1.95 0.00 0.00 0.71 0.00 0.00 52.55 55.19 3dao s ASP 10 Cb 0.00 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.40 3dao s ASP 10 CO 0.04 -1.01 0.00 0.61 0.21 0.00 0.00 175.17 175.02 3dao n GLY 11 N 4.22 1.88 0.31 0.21 0.00 0.10 -4.83 105.19 107.08 3dao n GLY 11 Ca 0.17 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.00 3dao n GLY 11 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3dao n THR 12 N -2.00 1.29 -0.09 2.61 -1.04 -0.76 -4.62 114.28 109.66 3dao n THR 12 Ca 0.00 -0.16 -0.10 0.00 -2.04 0.00 0.00 64.05 61.75 3dao n THR 12 Cb 0.00 -1.92 -0.13 0.00 -1.82 0.00 0.00 70.33 66.46 3dao n THR 12 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3dao n LEU 13 N -4.08 0.70 -3.93 -4.42 4.77 0.09 -4.14 117.00 105.98 3dao n LEU 13 Ca -0.34 -0.03 -0.09 0.00 -0.03 0.00 0.00 56.01 55.52 3dao n LEU 13 Cb 0.69 0.15 -0.08 0.00 -2.33 0.00 0.00 43.42 41.85 3dao n LEU 13 CO 0.07 0.54 -0.11 0.68 -1.33 0.00 0.00 177.39 177.23 3dao s VAL 14 N -2.43 0.12 0.31 4.08 -7.23 -1.11 -4.83 120.40 109.31 3dao s VAL 14 Ca -0.14 -1.35 -0.30 0.00 -1.81 0.00 0.00 61.98 58.39 3dao s VAL 14 Cb 0.06 -1.55 -0.12 0.00 0.56 0.00 0.00 36.38 35.33 3dao s VAL 14 CO 0.67 -0.57 1.51 1.17 -0.31 0.00 0.00 175.10 177.58 3dao n LYS 15 N -0.09 2.53 -1.62 4.82 4.81 -1.26 -0.72 118.16 126.63 3dao n LYS 15 Ca -0.12 0.90 -0.55 0.00 -0.87 0.00 0.00 58.31 57.66 3dao n LYS 15 Cb 0.63 -2.63 -0.07 0.00 0.02 0.00 0.00 35.03 32.98 3dao n LYS 15 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 3dao n ASP 16 N 1.67 1.54 0.00 3.14 2.03 -1.26 -1.03 116.55 122.65 3dao n ASP 16 Ca 0.07 1.12 0.00 0.00 0.52 0.00 0.00 54.79 56.50 3dao n ASP 16 Cb 0.36 -1.12 0.00 0.00 -0.72 0.00 0.00 41.12 39.65 3dao n ASP 16 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dao n GLY 17 N 2.86 1.12 3.77 0.27 0.00 -1.26 -5.02 105.19 106.92 3dao n GLY 17 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 3dao n GLY 17 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dao s SER 18 N -3.09 6.37 0.00 1.61 0.15 -0.19 -4.91 113.70 113.64 3dao s SER 18 Ca 0.00 2.76 0.23 0.00 0.70 0.00 0.00 55.95 59.64 3dao s SER 18 Cb 0.00 -2.65 0.09 0.00 -1.71 0.00 0.00 66.02 61.75 3dao s SER 18 CO 0.00 -0.82 1.16 0.18 1.20 0.00 0.00 173.24 174.96 3dao n LEU 19 N 0.31 2.48 -4.41 3.45 4.77 -1.26 -4.95 117.00 117.39 3dao n LEU 19 Ca 0.02 -0.88 -0.30 0.00 -0.03 0.00 0.00 56.01 54.83 3dao n LEU 19 Cb 0.42 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.38 3dao n LEU 19 CO 0.58 0.43 -0.54 -0.76 -1.33 0.00 0.00 177.39 175.78 3dao s LEU 20 N -2.21 2.39 -0.07 2.23 1.43 -1.26 -4.66 118.68 116.53 3dao s LEU 20 Ca 0.23 -0.59 -0.14 0.00 -1.03 0.00 0.00 54.13 52.60 3dao s LEU 20 Cb 0.19 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 45.07 3dao s LEU 20 CO 0.43 0.23 0.34 -0.51 0.23 0.00 0.00 176.35 177.07 3dao s ILE 21 N -0.95 0.03 -0.01 -0.59 2.07 -1.26 -4.91 121.20 115.58 3dao s ILE 21 Ca 0.14 -0.25 -0.35 0.00 -1.41 0.00 0.00 60.65 58.78 3dao s ILE 21 Cb -0.10 -0.58 -0.14 0.00 0.13 0.00 0.00 42.46 41.78 3dao s ILE 21 CO 0.05 -0.14 1.69 -0.67 -1.91 0.00 0.00 174.94 173.96 3dao n ASP 22 N 1.98 2.95 0.34 4.50 -0.08 -1.26 -4.85 116.55 120.13 3dao n ASP 22 Ca -0.18 1.04 0.23 0.00 -1.51 0.00 0.00 54.79 54.37 3dao n ASP 22 Cb 0.57 -1.34 1.22 0.00 2.34 0.00 0.00 41.12 43.91 3dao n ASP 22 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3dao h PRO 23 N 7.22 0.00 0.00 -0.67 0.13 -2.01 -0.98 132.00 135.69 3dao h PRO 23 Ca -0.47 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 3dao h PRO 23 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 3dao h PRO 23 CO 0.91 0.00 -0.10 1.49 -0.23 0.00 0.00 178.00 180.07 3dao h GLU 24 N 0.00 0.00 -0.45 0.86 4.81 -2.06 -2.24 114.58 115.50 3dao h GLU 24 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3dao h GLU 24 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3dao h GLU 24 CO 0.00 0.10 0.00 0.66 -0.73 0.00 0.00 179.01 179.04 3dao n TYR 25 N -4.17 0.00 0.00 0.92 4.01 -0.38 -1.14 117.16 116.40 3dao n TYR 25 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 3dao n TYR 25 Cb 0.18 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 3dao n TYR 25 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3dao n SER 27 N 0.61 0.00 -0.14 7.72 2.88 -0.84 -1.03 113.62 122.81 3dao n SER 27 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3dao n SER 27 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 3dao n SER 27 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 3dao h VAL 28 N 0.00 1.27 -0.57 2.46 2.07 -1.42 -2.09 116.25 117.96 3dao h VAL 28 Ca 0.00 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 3dao h VAL 28 Cb 0.00 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3dao h VAL 28 CO 0.00 0.37 0.25 0.40 0.02 0.00 0.00 177.57 178.60 3dao h ILE 29 N 0.58 1.22 -0.63 4.57 2.04 -1.31 -0.80 117.51 123.17 3dao h ILE 29 Ca 0.11 -0.66 0.04 0.00 1.00 0.00 0.00 64.86 65.36 3dao h ILE 29 Cb 0.53 0.59 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 3dao h ILE 29 CO 0.03 0.26 0.36 -0.78 0.00 0.00 0.00 178.15 178.02 3dao h ASP 30 N 0.78 0.56 -0.76 1.72 3.58 -1.76 -0.63 116.42 119.91 3dao h ASP 30 Ca 0.19 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.64 3dao h ASP 30 Cb 0.17 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 3dao h ASP 30 CO -0.02 0.38 0.38 0.03 -2.88 0.00 0.00 179.24 177.13 3dao h ARG 31 N 0.69 1.08 -0.54 0.28 3.08 -0.74 -0.46 114.38 117.77 3dao h ARG 31 Ca 0.27 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 3dao h ARG 31 Cb 0.11 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 3dao h ARG 31 CO -0.14 0.83 0.24 -0.07 -1.07 0.00 0.00 179.97 179.76 3dao h LEU 32 N 1.06 0.72 -0.45 3.04 3.38 -0.46 -1.24 115.31 121.36 3dao h LEU 32 Ca 0.26 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 3dao h LEU 32 Cb 0.09 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3dao h LEU 32 CO -0.04 0.67 -0.04 0.40 0.09 0.00 0.00 178.44 179.52 3dao h ILE 33 N 0.73 1.27 0.00 1.22 2.04 -0.92 -1.91 117.51 119.95 3dao h ILE 33 Ca 0.18 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 3dao h ILE 33 Cb 0.15 1.09 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3dao h ILE 33 CO -0.02 0.38 -0.04 0.44 0.00 0.00 0.00 178.15 178.91 3dao h ASP 34 N 0.66 0.00 0.78 1.72 3.32 -0.80 0.10 116.42 122.20 3dao h ASP 34 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3dao h ASP 34 Cb 0.56 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.11 3dao h ASP 34 CO 0.03 0.04 -0.03 0.29 -1.72 0.00 0.00 179.24 177.86 3dao n LYS 35 N -3.42 0.21 0.00 3.56 5.02 -0.49 -4.90 118.16 118.14 3dao n LYS 35 Ca -0.02 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 3dao n LYS 35 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 3dao n LYS 35 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dao n GLY 36 N 1.40 0.95 3.77 0.72 0.00 0.36 -5.09 105.19 107.31 3dao n GLY 36 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 3dao n GLY 36 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dao s ILE 37 N -2.00 4.57 -0.13 -0.61 1.01 -0.85 -4.96 121.20 118.24 3dao s ILE 37 Ca 0.00 1.58 -0.24 0.00 0.00 0.00 0.00 60.65 62.00 3dao s ILE 37 Cb 0.00 -4.08 -0.03 0.00 0.01 0.00 0.00 42.46 38.36 3dao s ILE 37 CO 0.00 0.47 0.75 -0.63 0.00 0.00 0.00 174.94 175.53 3dao s ILE 38 N -0.73 4.97 -0.16 2.92 1.01 -0.19 -4.01 121.20 125.02 3dao s ILE 38 Ca 0.35 1.48 -0.01 0.00 0.00 0.00 0.00 60.65 62.47 3dao s ILE 38 Cb -0.21 -4.07 -0.01 0.00 0.01 0.00 0.00 42.46 38.17 3dao s ILE 38 CO 0.24 0.13 -0.10 0.12 0.00 0.00 0.00 174.94 175.32 3dao s PHE 39 N 1.58 2.87 -0.12 3.97 2.19 -1.26 -0.60 117.98 126.60 3dao s PHE 39 Ca 0.36 -0.70 0.02 0.00 0.33 0.00 0.00 56.93 56.94 3dao s PHE 39 Cb -0.17 -1.92 0.01 0.00 -1.31 0.00 0.00 43.02 39.63 3dao s PHE 39 CO 0.14 -0.29 -0.18 0.08 1.83 0.00 0.00 175.22 176.81 3dao s VAL 40 N 0.64 1.71 -0.23 3.12 1.01 0.56 -1.68 120.40 125.53 3dao s VAL 40 Ca -0.06 -0.77 -0.24 0.00 0.00 0.00 0.00 61.98 60.91 3dao s VAL 40 Cb -0.15 -1.54 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 3dao s VAL 40 CO 0.03 0.48 0.81 -0.69 0.00 0.00 0.00 175.10 175.73 3dao s VAL 41 N 0.93 4.86 -0.37 2.92 1.01 -0.45 -1.44 120.40 127.85 3dao s VAL 41 Ca -0.07 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.46 3dao s VAL 41 Cb -0.15 -4.10 0.12 0.00 0.00 0.00 0.00 36.38 32.25 3dao s VAL 41 CO -0.02 -0.04 0.18 0.00 0.00 0.00 0.00 175.10 175.23 3dao s SER 43 N 1.01 0.26 0.05 0.00 0.15 -0.92 -3.47 113.70 110.78 3dao s SER 43 Ca 0.15 -1.05 0.22 0.00 0.70 0.00 0.00 55.95 55.97 3dao s SER 43 Cb -0.22 0.32 0.92 0.00 -1.71 0.00 0.00 66.02 65.33 3dao s SER 43 CO -0.09 -0.75 1.71 0.61 1.20 0.00 0.00 173.24 175.92 3dao n GLY 44 N -0.09 -1.30 3.75 9.45 0.00 -1.26 -0.71 105.19 115.03 3dao n GLY 44 Ca -0.08 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 3dao n GLY 44 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dao s ARG 45 N -3.04 2.26 0.62 1.61 0.52 -1.26 -3.52 118.95 116.14 3dao s ARG 45 Ca 0.10 1.45 -0.16 0.00 -0.52 0.00 0.00 55.73 56.59 3dao s ARG 45 Cb 0.14 -1.88 -0.02 0.00 0.52 0.00 0.00 34.95 33.71 3dao s ARG 45 CO 0.42 -1.68 1.11 -0.65 0.02 0.00 0.00 175.30 174.52 3dao s GLN 46 N -4.33 3.01 0.25 3.54 1.11 -1.26 -0.80 119.66 121.18 3dao s GLN 46 Ca 0.67 1.44 -0.03 0.00 0.01 0.00 0.00 55.36 57.45 3dao s GLN 46 Cb -0.22 -1.97 0.47 0.00 -1.01 0.00 0.00 33.01 30.27 3dao s GLN 46 CO 0.48 -1.09 1.76 0.35 0.01 0.00 0.00 175.29 176.80 3dao h PHE 47 N 0.41 0.66 -0.50 0.91 3.57 -1.95 -2.00 116.94 118.04 3dao h PHE 47 Ca -0.48 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.03 3dao h PHE 47 Cb 1.25 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.79 3dao h PHE 47 CO 0.54 0.16 0.19 0.66 -2.23 0.00 0.00 178.31 177.63 3dao h SER 48 N 0.57 0.65 -0.35 0.41 4.64 -1.92 0.96 113.55 118.51 3dao h SER 48 Ca 0.42 -0.08 -0.15 0.00 -0.47 0.00 0.00 61.79 61.52 3dao h SER 48 Cb 0.58 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 3dao h SER 48 CO -0.35 0.59 -0.35 -1.28 -0.87 0.00 0.00 176.83 174.57 3dao h SER 49 N 0.71 0.92 -0.19 4.97 0.87 -1.75 -1.66 113.55 117.42 3dao h SER 49 Ca 0.17 -0.47 -0.01 0.00 -1.23 0.00 0.00 61.79 60.25 3dao h SER 49 Cb 0.15 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 3dao h SER 49 CO -0.02 1.20 0.08 -0.33 -0.53 0.00 0.00 176.83 177.23 3dao h GLU 50 N 0.66 0.28 -0.24 2.24 5.08 -0.83 -2.37 114.58 119.39 3dao h GLU 50 Ca 0.06 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 3dao h GLU 50 Cb 0.94 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 3dao h GLU 50 CO 0.09 0.34 -0.14 0.35 -1.00 0.00 0.00 179.01 178.65 3dao h PHE 51 N 0.15 0.44 -0.14 4.33 3.57 -0.80 -2.28 116.94 122.21 3dao h PHE 51 Ca 0.06 -0.07 -0.18 0.00 3.53 0.00 0.00 57.97 61.31 3dao h PHE 51 Cb 0.17 -0.12 0.01 0.00 2.79 0.00 0.00 35.95 38.80 3dao h PHE 51 CO -0.01 0.55 -0.63 0.87 -2.23 0.00 0.00 178.31 176.86 3dao h LYS 52 N 0.38 0.67 -0.40 1.11 6.56 -1.23 -2.81 116.57 120.85 3dao h LYS 52 Ca 0.07 -0.53 -0.04 0.00 -1.06 0.00 0.00 60.65 59.08 3dao h LYS 52 Cb 0.48 0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 32.23 3dao h LYS 52 CO 0.03 1.15 0.06 1.25 -2.06 0.00 0.00 179.45 179.88 3dao h LEU 53 N 0.34 0.57 -3.68 2.94 5.85 -1.14 -2.17 115.31 118.01 3dao h LEU 53 Ca -0.04 -0.10 -0.25 0.00 0.84 0.00 0.00 57.88 58.33 3dao h LEU 53 Cb 1.26 -0.15 -0.15 0.00 0.37 0.00 0.00 40.66 41.99 3dao h LEU 53 CO 0.13 0.60 0.27 0.49 -0.34 0.00 0.00 178.44 179.58 3dao n PHE 54 N -4.30 2.19 -0.27 1.25 3.01 -0.88 -4.76 117.46 113.70 3dao n PHE 54 Ca 0.02 -1.39 0.07 0.00 1.01 0.00 0.00 57.45 57.17 3dao n PHE 54 Cb 0.22 -0.67 0.19 0.00 -0.01 0.00 0.00 39.48 39.21 3dao n PHE 54 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dao h ALA 55 N 1.90 0.94 0.00 4.37 0.00 -1.11 -1.37 119.26 123.99 3dao h ALA 55 Ca 0.31 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.44 3dao h ALA 55 Cb 2.24 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 20.39 3dao h ALA 55 CO 0.70 -0.42 -0.03 -1.35 0.00 0.00 0.00 179.25 178.15 3dao h PRO 56 N 0.16 0.00 0.00 0.00 0.11 -1.87 -2.85 132.00 127.55 3dao h PRO 56 Ca 0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.52 3dao h PRO 56 Cb 0.82 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.85 3dao h PRO 56 CO -0.63 0.03 -0.47 0.44 -0.21 0.00 0.00 178.00 177.17 3dao n ILE 57 N -4.07 1.39 0.27 4.15 -5.35 -0.77 -4.86 119.36 110.13 3dao n ILE 57 Ca -0.03 -2.10 0.10 0.00 -0.27 0.00 0.00 62.75 60.45 3dao n ILE 57 Cb 0.12 0.10 0.74 0.00 -1.74 0.00 0.00 39.64 38.86 3dao n ILE 57 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3dao h LYS 58 N 0.59 0.00 0.00 6.28 2.10 -1.03 -1.77 116.57 122.74 3dao h LYS 58 Ca -0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 3dao h LYS 58 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 3dao h LYS 58 CO 0.02 0.00 0.00 -2.39 -2.00 0.00 0.00 179.45 175.08 3dao n HIS 59 N -4.29 0.00 0.46 0.07 1.44 -1.26 -3.42 115.22 108.22 3dao n HIS 59 Ca -0.03 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.73 3dao n HIS 59 Cb 0.09 -0.39 0.01 0.00 0.12 0.00 0.00 29.99 29.82 3dao n HIS 59 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3dao n LYS 60 N -1.39 1.58 -3.91 -1.40 5.02 -0.67 -4.82 118.16 112.57 3dao n LYS 60 Ca 0.08 -0.78 -0.22 0.00 -2.02 0.00 0.00 58.31 55.37 3dao n LYS 60 Cb 0.22 -1.13 -0.02 0.00 -0.02 0.00 0.00 35.03 34.08 3dao n LYS 60 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dao s LEU 61 N -1.41 4.29 0.11 -0.35 1.43 -1.22 -4.79 118.68 116.74 3dao s LEU 61 Ca 0.10 0.12 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 3dao s LEU 61 Cb 0.09 -2.91 -0.04 0.00 0.03 0.00 0.00 46.19 43.36 3dao s LEU 61 CO 0.22 -0.08 0.11 -0.76 0.23 0.00 0.00 176.35 176.07 3dao s LEU 62 N -3.93 3.82 -0.06 1.79 1.43 -0.67 -4.13 118.68 116.92 3dao s LEU 62 Ca 0.35 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.41 3dao s LEU 62 Cb -0.09 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.67 3dao s LEU 62 CO 0.30 0.13 -0.07 -0.31 0.23 0.00 0.00 176.35 176.62 3dao s TYR 63 N -1.53 1.08 -0.20 0.29 1.51 -0.03 -1.34 117.35 117.13 3dao s TYR 63 Ca 0.30 -0.38 -0.02 0.00 -1.01 0.00 0.00 57.07 55.95 3dao s TYR 63 Cb -0.11 -0.88 -0.00 0.00 -0.11 0.00 0.00 41.96 40.85 3dao s TYR 63 CO 0.23 -0.27 -0.08 0.42 -1.11 0.00 0.00 175.55 174.74 3dao s ILE 64 N 0.98 3.06 0.25 2.71 1.01 0.90 -0.76 121.20 129.36 3dao s ILE 64 Ca -0.10 -0.60 0.11 0.00 0.00 0.00 0.00 60.65 60.06 3dao s ILE 64 Cb -0.15 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.91 3dao s ILE 64 CO 0.00 0.46 -0.19 0.42 0.00 0.00 0.00 174.94 175.63 3dao s THR 65 N 1.33 2.28 -1.51 2.92 -4.23 -0.35 -2.16 115.64 113.92 3dao s THR 65 Ca 0.04 -2.31 -0.05 0.00 -1.18 0.00 0.00 61.69 58.19 3dao s THR 65 Cb -0.14 -2.21 0.02 0.00 1.34 0.00 0.00 72.50 71.51 3dao s THR 65 CO -0.05 -0.41 0.57 0.47 -0.54 0.00 0.00 174.62 174.66 3dao n ASP 66 N -0.45 -5.69 -0.28 3.99 8.00 0.02 -1.48 116.55 120.65 3dao n ASP 66 Ca -0.07 -0.29 -0.04 0.00 0.71 0.00 0.00 54.79 55.11 3dao n ASP 66 Cb 0.60 -4.62 -0.02 0.00 -0.02 0.00 0.00 41.12 37.06 3dao n ASP 66 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dao n GLY 67 N -1.44 0.66 0.00 0.44 0.00 0.11 -3.23 105.19 101.73 3dao n GLY 67 Ca -0.10 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.40 3dao n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dao n GLY 68 N -2.16 1.19 0.21 -0.02 0.00 -0.55 -2.80 105.19 101.08 3dao n GLY 68 Ca -0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.09 3dao n GLY 68 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dao h THR 69 N 0.00 0.18 -3.65 2.61 2.02 -1.42 -3.42 112.91 109.24 3dao h THR 69 Ca 0.00 -1.15 -0.26 0.00 0.77 0.00 0.00 66.41 65.77 3dao h THR 69 Cb 0.00 1.99 -0.30 0.00 -1.74 0.00 0.00 68.15 68.10 3dao h THR 69 CO 0.00 0.10 -0.72 -0.69 0.37 0.00 0.00 175.52 174.57 3dao s VAL 70 N -3.26 -0.01 -0.13 3.16 1.01 -1.19 -0.63 120.40 119.34 3dao s VAL 70 Ca 0.05 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.14 3dao s VAL 70 Cb 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 36.38 36.41 3dao s VAL 70 CO 0.66 0.04 -0.21 -0.69 0.00 0.00 0.00 175.10 174.90 3dao s VAL 71 N 0.44 1.98 0.11 2.92 1.01 -0.10 -1.21 120.40 125.54 3dao s VAL 71 Ca -0.04 -0.93 -0.15 0.00 0.00 0.00 0.00 61.98 60.86 3dao s VAL 71 Cb -0.05 -1.75 0.03 0.00 0.00 0.00 0.00 36.38 34.60 3dao s VAL 71 CO -0.01 0.53 0.37 0.00 0.00 0.00 0.00 175.10 175.99 3dao s ARG 72 N 0.84 1.01 0.62 2.72 1.70 0.06 0.06 118.95 125.96 3dao s ARG 72 Ca -0.07 -0.70 0.03 0.00 -0.47 0.00 0.00 55.73 54.52 3dao s ARG 72 Cb -0.15 0.44 0.08 0.00 -0.57 0.00 0.00 34.95 34.75 3dao s ARG 72 CO -0.02 -0.38 0.85 0.95 -1.08 0.00 0.00 175.30 175.62 3dao s THR 73 N -3.63 2.37 0.59 4.99 -4.23 0.40 -0.85 115.64 115.29 3dao s THR 73 Ca 0.02 -0.73 0.37 0.00 -1.18 0.00 0.00 61.69 60.17 3dao s THR 73 Cb 0.02 -2.64 0.40 0.00 1.34 0.00 0.00 72.50 71.62 3dao s THR 73 CO -0.11 0.00 2.29 -0.65 -0.54 0.00 0.00 174.62 175.62 3dao h PRO 74 N -0.11 0.00 0.00 3.99 0.11 -1.85 -3.21 132.00 130.93 3dao h PRO 74 Ca -0.37 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.64 3dao h PRO 74 Cb 1.28 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 3dao h PRO 74 CO 0.44 0.01 -1.52 1.63 -0.21 0.00 0.00 178.00 178.36 3dao n LYS 75 N -3.42 1.74 -4.01 1.05 4.76 -1.26 -5.05 118.16 111.97 3dao n LYS 75 Ca -0.03 -0.03 -0.14 0.00 -2.87 0.00 0.00 58.31 55.24 3dao n LYS 75 Cb 0.10 -1.22 -0.14 0.00 -1.84 0.00 0.00 35.03 31.93 3dao n LYS 75 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 3dao s GLU 76 N -2.36 0.22 -0.05 1.97 2.12 -1.21 -5.13 118.70 114.25 3dao s GLU 76 Ca -0.04 -0.13 -0.30 0.00 0.36 0.00 0.00 54.97 54.87 3dao s GLU 76 Cb 0.04 -0.19 -0.02 0.00 0.26 0.00 0.00 34.13 34.22 3dao s GLU 76 CO 0.36 0.05 0.99 0.42 -0.54 0.00 0.00 175.26 176.54 3dao s ILE 77 N -0.15 4.83 -0.17 -3.70 1.01 -1.26 -0.45 121.20 121.31 3dao s ILE 77 Ca 0.00 2.05 -0.02 0.00 0.00 0.00 0.00 60.65 62.68 3dao s ILE 77 Cb -0.02 -4.32 -0.23 0.00 0.01 0.00 0.00 42.46 37.91 3dao s ILE 77 CO -0.00 0.08 0.17 0.18 0.00 0.00 0.00 174.94 175.37 3dao n LEU 78 N 4.44 2.61 -3.69 2.97 4.77 0.11 -4.95 117.00 123.25 3dao n LEU 78 Ca 0.07 0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 56.02 3dao n LEU 78 Cb 0.50 -0.95 -0.09 0.00 -2.33 0.00 0.00 43.42 40.55 3dao n LEU 78 CO 0.52 0.85 0.21 -0.75 -1.33 0.00 0.00 177.39 176.90 3dao s LYS 79 N -2.55 0.60 0.13 3.23 2.47 -0.79 -5.01 119.74 117.83 3dao s LYS 79 Ca -0.26 0.80 0.05 0.00 -1.56 0.00 0.00 55.97 55.00 3dao s LYS 79 Cb 0.07 0.24 -0.04 0.00 -1.46 0.00 0.00 37.83 36.65 3dao s LYS 79 CO 0.72 -0.09 -0.11 0.95 0.16 0.00 0.00 175.35 176.97 3dao s THR 80 N 0.58 1.19 -0.60 3.43 -4.23 -1.26 -0.93 115.64 113.82 3dao s THR 80 Ca -0.02 -1.90 0.05 0.00 -1.18 0.00 0.00 61.69 58.64 3dao s THR 80 Cb -0.05 -1.68 0.19 0.00 1.34 0.00 0.00 72.50 72.30 3dao s THR 80 CO -0.03 -0.62 0.51 -1.22 -0.54 0.00 0.00 174.62 172.72 3dao n TYR 81 N 0.12 2.10 0.00 3.99 4.02 0.19 -4.99 117.16 122.60 3dao n TYR 81 Ca -0.13 -4.00 0.00 0.00 -0.01 0.00 0.00 57.90 53.77 3dao n TYR 81 Cb 0.59 -0.39 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 3dao n TYR 81 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3dao n PRO 82 N 1.91 0.00 -4.24 -0.72 -0.04 -1.26 -4.48 135.00 126.16 3dao n PRO 82 Ca 0.24 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.39 3dao n PRO 82 Cb 0.40 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.78 3dao n PRO 82 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dao s ASP 84 N -1.00 4.88 0.21 3.54 1.01 -1.26 -4.77 116.67 119.27 3dao s ASP 84 Ca 0.00 -0.16 -0.10 0.00 0.71 0.00 0.00 52.55 53.00 3dao s ASP 84 Cb 0.00 -1.16 0.27 0.00 1.01 0.00 0.00 42.92 43.05 3dao s ASP 84 CO 0.00 0.22 1.72 -0.08 0.21 0.00 0.00 175.17 177.24 3dao h GLU 85 N 3.88 0.29 -0.06 8.23 4.81 -1.98 -0.54 114.58 129.21 3dao h GLU 85 Ca -0.48 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3dao h GLU 85 Cb 1.17 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.48 3dao h GLU 85 CO 0.57 0.19 0.02 -0.44 -0.73 0.00 0.00 179.01 178.62 3dao h ASP 86 N 0.30 0.07 0.16 1.04 3.32 -2.01 -1.10 116.42 118.20 3dao h ASP 86 Ca 0.30 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 3dao h ASP 86 Cb 0.42 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.95 3dao h ASP 86 CO -0.36 0.08 -0.08 0.40 -1.72 0.00 0.00 179.24 177.56 3dao h ILE 87 N 0.09 0.17 -0.47 0.35 2.04 -1.55 -2.18 117.51 115.96 3dao h ILE 87 Ca 0.02 -0.94 -0.07 0.00 1.00 0.00 0.00 64.86 64.87 3dao h ILE 87 Cb 0.03 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 3dao h ILE 87 CO -0.00 0.05 0.01 4.11 0.00 0.00 0.00 178.15 182.32 3dao h TRP 88 N -1.04 0.83 -0.15 1.37 5.08 -1.35 -1.97 115.95 118.72 3dao h TRP 88 Ca -0.02 -0.11 -0.10 0.00 1.08 0.00 0.00 58.89 59.73 3dao h TRP 88 Cb 0.25 -0.23 -0.01 0.00 -3.00 0.00 0.00 29.16 26.17 3dao h TRP 88 CO 0.02 0.77 -0.36 0.87 -1.28 0.00 0.00 178.44 178.46 3dao h LYS 89 N 0.73 0.31 -1.35 0.12 1.57 -1.35 -0.69 116.57 115.92 3dao h LYS 89 Ca 0.14 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3dao h LYS 89 Cb 0.44 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.74 3dao h LYS 89 CO 0.02 0.63 0.00 0.41 -0.57 0.00 0.00 179.45 179.94 3dao n GLY 90 N -0.26 0.62 2.22 3.86 0.00 -0.74 -1.51 105.19 109.36 3dao n GLY 90 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3dao n GLY 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dao n ARG 93 N 0.00 0.00 0.00 0.00 1.74 -0.57 -1.93 116.66 115.90 3dao n ARG 93 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3dao n ARG 93 Cb 0.00 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 3dao n ARG 93 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3dao n VAL 95 N 0.73 0.00 -0.23 1.55 0.31 -1.26 -0.87 118.33 118.56 3dao n VAL 95 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.27 3dao n VAL 95 Cb 0.00 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 32.97 3dao n VAL 95 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3dao h ARG 96 N 0.00 0.91 0.00 5.55 2.43 -1.67 -2.23 114.38 119.37 3dao h ARG 96 Ca 0.00 -0.11 -0.32 0.00 -0.81 0.00 0.00 59.98 58.74 3dao h ARG 96 Cb 0.00 -0.18 -0.06 0.00 -0.42 0.00 0.00 29.97 29.32 3dao h ARG 96 CO 0.00 0.69 -1.95 -0.25 -1.51 0.00 0.00 179.97 176.95 3dao n ASP 97 N -4.53 0.58 -0.02 -3.80 8.00 -0.05 -4.61 116.55 112.13 3dao n ASP 97 Ca 0.05 0.27 0.01 0.00 0.71 0.00 0.00 54.79 55.83 3dao n ASP 97 Cb 0.09 0.30 -0.01 0.00 -0.02 0.00 0.00 41.12 41.49 3dao n ASP 97 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3dao n GLU 98 N -2.94 4.98 -3.31 -1.24 1.02 -1.24 -4.75 120.64 113.16 3dao n GLU 98 Ca -0.23 -0.12 -0.26 0.00 -0.02 0.00 0.00 57.16 56.53 3dao n GLU 98 Cb 1.09 -0.68 -0.07 0.00 -0.02 0.00 0.00 31.44 31.76 3dao n GLU 98 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3dao n LEU 99 N -0.82 3.20 0.25 -4.62 4.77 -0.84 -4.97 117.00 113.97 3dao n LEU 99 Ca 0.01 -5.35 0.08 0.00 -0.03 0.00 0.00 56.01 50.72 3dao n LEU 99 Cb 0.04 -0.40 0.64 0.00 -2.33 0.00 0.00 43.42 41.36 3dao n LEU 99 CO 0.03 2.11 1.08 1.55 -1.33 0.00 0.00 177.39 180.83 3dao h PRO 100 N 3.94 0.01 -0.00 3.23 0.13 -1.82 -1.21 132.00 136.28 3dao h PRO 100 Ca 0.17 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3dao h PRO 100 Cb 0.68 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 3dao h PRO 100 CO 0.76 0.01 -0.04 0.00 -0.23 0.00 0.00 178.00 178.50 3dao n ALA 101 N -2.54 2.45 -2.79 -0.56 0.00 -1.26 -4.88 120.51 110.92 3dao n ALA 101 Ca -0.02 -0.13 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 3dao n ALA 101 Cb 0.10 -1.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.06 3dao n ALA 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dao n ASP 103 N -1.13 3.04 -3.51 0.00 8.00 -0.23 -4.89 116.55 117.83 3dao n ASP 103 Ca -0.08 -3.22 -0.11 0.00 0.71 0.00 0.00 54.79 52.09 3dao n ASP 103 Cb 0.58 0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 42.12 3dao n ASP 103 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3dao s TYR 104 N -2.88 -0.41 0.06 1.24 1.13 -1.26 -0.24 117.35 115.00 3dao s TYR 104 Ca 0.04 0.15 -0.09 0.00 -1.41 0.00 0.00 57.07 55.76 3dao s TYR 104 Cb 0.00 0.45 0.00 0.00 -1.10 0.00 0.00 41.96 41.32 3dao s TYR 104 CO 0.03 -0.81 0.19 -0.59 -2.51 0.00 0.00 175.55 171.86 3dao s PHE 105 N -3.77 0.11 0.35 -3.49 -0.71 -0.22 -4.63 117.98 105.62 3dao s PHE 105 Ca 0.02 -0.44 0.09 0.00 -1.04 0.00 0.00 56.93 55.56 3dao s PHE 105 Cb -0.00 -0.05 -0.07 0.00 -1.21 0.00 0.00 43.02 41.69 3dao s PHE 105 CO -0.12 -0.48 -0.07 0.00 -1.34 0.00 0.00 175.22 173.20 3dao s ALA 106 N -3.23 2.97 -0.03 1.99 0.00 -0.36 -0.37 121.76 122.72 3dao s ALA 106 Ca 0.00 -2.13 -0.06 0.00 0.00 0.00 0.00 51.96 49.78 3dao s ALA 106 Cb 0.02 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.16 3dao s ALA 106 CO -0.08 0.03 0.13 0.00 0.00 0.00 0.00 175.76 175.85 3dao s ALA 107 N -2.65 -0.32 0.60 0.00 0.00 -0.15 -0.58 121.76 118.66 3dao s ALA 107 Ca 0.33 0.16 0.03 0.00 0.00 0.00 0.00 51.96 52.49 3dao s ALA 107 Cb 0.04 -0.09 0.11 0.00 0.00 0.00 0.00 23.12 23.17 3dao s ALA 107 CO 0.17 -0.12 0.78 0.25 0.00 0.00 0.00 175.76 176.83 3dao n THR 108 N 2.38 0.00 0.28 0.00 -2.24 0.17 -0.83 114.28 114.04 3dao n THR 108 Ca -0.17 -1.46 0.10 0.00 -2.27 0.00 0.00 64.05 60.25 3dao n THR 108 Cb 0.58 -0.81 0.45 0.00 -2.10 0.00 0.00 70.33 68.45 3dao n THR 108 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3dao n PRO 109 N -2.36 0.13 0.00 -0.78 -0.02 -1.26 -3.63 135.00 127.08 3dao n PRO 109 Ca 0.14 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 3dao n PRO 109 Cb 0.50 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 3dao n PRO 109 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3dao n ASP 110 N -2.08 3.85 -3.56 2.55 8.00 -1.26 -4.66 116.55 119.39 3dao n ASP 110 Ca 0.01 -0.03 -0.11 0.00 0.71 0.00 0.00 54.79 55.37 3dao n ASP 110 Cb 0.12 0.83 -0.04 0.00 -0.02 0.00 0.00 41.12 42.02 3dao n ASP 110 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3dao s PHE 111 N -1.60 -0.32 0.08 1.24 -0.71 -1.24 -5.02 117.98 110.41 3dao s PHE 111 Ca 0.00 0.04 0.06 0.00 -1.04 0.00 0.00 56.93 55.98 3dao s PHE 111 Cb 0.00 0.37 -0.04 0.00 -1.21 0.00 0.00 43.02 42.14 3dao s PHE 111 CO 0.00 -0.76 -0.05 0.00 -1.34 0.00 0.00 175.22 173.07 3dao s PHE 113 N -1.23 0.17 0.20 0.00 -0.71 0.25 -1.08 117.98 115.58 3dao s PHE 113 Ca 0.23 -0.45 -0.19 0.00 -1.04 0.00 0.00 56.93 55.48 3dao s PHE 113 Cb -0.11 -0.12 0.04 0.00 -1.21 0.00 0.00 43.02 41.62 3dao s PHE 113 CO 0.15 -0.38 0.56 0.00 -1.34 0.00 0.00 175.22 174.21 3dao s ALA 114 N -2.57 -1.11 -0.17 1.99 0.00 -0.08 -1.22 121.76 118.59 3dao s ALA 114 Ca -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.82 3dao s ALA 114 Cb -0.01 0.86 0.01 0.00 0.00 0.00 0.00 23.12 23.97 3dao s ALA 114 CO -0.04 -0.83 -0.16 -2.00 0.00 0.00 0.00 175.76 172.73 3dao s GLU 115 N -3.85 3.12 -0.37 0.00 2.12 -1.26 -0.70 118.70 117.75 3dao s GLU 115 Ca 0.08 -0.78 -0.29 0.00 0.36 0.00 0.00 54.97 54.34 3dao s GLU 115 Cb -0.02 -2.64 0.02 0.00 0.26 0.00 0.00 34.13 31.75 3dao s GLU 115 CO -0.04 -0.12 1.17 0.34 -0.54 0.00 0.00 175.26 176.08 3dao s ASP 116 N 1.12 6.74 0.00 -1.70 2.15 -1.26 -4.83 116.67 118.89 3dao s ASP 116 Ca 0.01 0.89 0.23 0.00 0.43 0.00 0.00 52.55 54.11 3dao s ASP 116 Cb -0.14 -2.54 0.48 0.00 -0.30 0.00 0.00 42.92 40.42 3dao s ASP 116 CO -0.06 -1.08 1.43 0.61 -0.17 0.00 0.00 175.17 175.90 3dao n GLY 117 N 4.36 1.69 1.00 2.66 0.00 -1.26 -4.94 105.19 108.70 3dao n GLY 117 Ca 0.13 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.43 3dao n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dao n GLY 118 N 1.49 0.72 3.74 -0.02 0.00 -1.26 -5.07 105.19 104.79 3dao n GLY 118 Ca 0.20 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 3dao n GLY 118 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dao s SER 119 N -2.24 4.21 0.00 1.61 1.04 -1.26 -4.92 113.70 112.14 3dao s SER 119 Ca 0.00 1.99 0.27 0.00 0.48 0.00 0.00 55.95 58.69 3dao s SER 119 Cb 0.00 -2.54 1.39 0.00 0.10 0.00 0.00 66.02 64.97 3dao s SER 119 CO 0.00 -2.24 1.92 -0.81 0.98 0.00 0.00 173.24 173.09 3dao n PRO 120 N -3.43 0.45 -0.00 4.02 -0.04 -1.26 -3.49 135.00 131.25 3dao n PRO 120 Ca 0.10 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.67 3dao n PRO 120 Cb 0.52 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 3dao n PRO 120 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3dao n ILE 121 N -1.24 0.00 -0.24 0.52 -5.35 -1.26 -4.63 119.36 107.16 3dao n ILE 121 Ca 0.14 -0.26 0.04 0.00 -0.27 0.00 0.00 62.75 62.39 3dao n ILE 121 Cb 0.20 0.53 0.16 0.00 -1.74 0.00 0.00 39.64 38.78 3dao n ILE 121 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 3dao h PHE 122 N 0.00 0.36 0.00 4.28 3.57 -1.95 -1.35 116.94 121.84 3dao h PHE 122 Ca 0.00 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 3dao h PHE 122 Cb 0.53 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 3dao h PHE 122 CO 0.00 -0.00 -0.09 1.12 -2.23 0.00 0.00 178.31 177.11 3dao h HIS 123 N 0.34 0.00 -0.03 0.41 2.07 -1.82 -1.91 115.15 114.21 3dao h HIS 123 Ca 0.38 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.89 3dao h HIS 123 Cb 0.59 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.57 3dao h HIS 123 CO -0.21 0.09 -0.05 -0.07 -3.07 0.00 0.00 177.93 174.61 3dao h LEU 124 N 0.00 0.03 -0.52 6.12 3.38 -1.55 0.84 115.31 123.61 3dao h LEU 124 Ca -0.00 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3dao h LEU 124 Cb 0.31 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 3dao h LEU 124 CO 0.01 0.09 0.21 -0.07 0.09 0.00 0.00 178.44 178.77 3dao h LEU 125 N 0.04 0.25 0.04 1.67 3.38 -1.46 0.12 115.31 119.34 3dao h LEU 125 Ca 0.01 0.05 -0.38 0.00 0.09 0.00 0.00 57.88 57.65 3dao h LEU 125 Cb 0.12 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3dao h LEU 125 CO 0.01 0.17 -2.32 0.54 0.09 0.00 0.00 178.44 176.93 3dao n ARG 126 N -4.96 0.68 0.24 1.13 1.74 -1.03 -2.62 116.66 111.83 3dao n ARG 126 Ca 0.05 0.19 0.13 0.00 -0.77 0.00 0.00 57.85 57.46 3dao n ARG 126 Cb 0.19 -1.58 0.36 0.00 -1.02 0.00 0.00 32.46 30.41 3dao n ARG 126 CO 0.00 0.00 0.00 0.38 -1.52 0.00 0.00 177.63 176.49 3dao h ASP 127 N -0.03 0.00 0.00 0.55 2.03 -0.88 -2.45 116.42 115.64 3dao h ASP 127 Ca -0.54 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 55.71 3dao h ASP 127 Cb 1.92 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 40.41 3dao h ASP 127 CO -0.05 0.04 -1.22 -0.24 -1.03 0.00 0.00 179.24 176.74 3dao n SER 128 N -3.12 3.93 -0.85 4.15 2.88 -0.06 -4.62 113.62 115.94 3dao n SER 128 Ca 0.02 -0.01 0.12 0.00 -1.33 0.00 0.00 58.87 57.67 3dao n SER 128 Cb 0.45 0.22 0.15 0.00 -0.75 0.00 0.00 64.21 64.29 3dao n SER 128 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 3dao n TYR 129 N -2.39 0.00 -2.89 0.66 4.02 -0.69 -4.96 117.16 110.91 3dao n TYR 129 Ca -0.06 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.62 3dao n TYR 129 Cb 0.59 -0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.92 3dao n TYR 129 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dao n GLY 130 N 1.33 -0.51 3.79 2.72 0.00 -0.92 -4.95 105.19 106.65 3dao n GLY 130 Ca 0.14 0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 3dao n GLY 130 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dao s PHE 131 N -3.01 3.59 0.42 1.61 0.08 -1.08 -4.98 117.98 114.62 3dao s PHE 131 Ca 0.22 1.74 -0.08 0.00 0.12 0.00 0.00 56.93 58.93 3dao s PHE 131 Cb -0.10 -2.92 -0.05 0.00 -0.57 0.00 0.00 43.02 39.37 3dao s PHE 131 CO 0.27 0.09 0.76 -1.21 -0.10 0.00 0.00 175.22 175.03 3dao s GLU 132 N -2.31 3.67 -0.15 0.44 2.02 -1.26 -4.49 118.70 116.62 3dao s GLU 132 Ca 0.53 0.32 -0.06 0.00 0.02 0.00 0.00 54.97 55.78 3dao s GLU 132 Cb -0.17 -2.41 0.07 0.00 0.10 0.00 0.00 34.13 31.72 3dao s GLU 132 CO 0.22 -0.08 0.34 0.50 0.02 0.00 0.00 175.26 176.25 3dao s ARG 134 N -4.17 0.26 0.04 1.61 6.06 -0.24 -4.49 118.95 118.02 3dao s ARG 134 Ca 0.49 0.80 -0.24 0.00 -2.50 0.00 0.00 55.73 54.28 3dao s ARG 134 Cb -0.10 0.05 -0.06 0.00 0.06 0.00 0.00 34.95 34.91 3dao s ARG 134 CO 0.37 -0.22 0.71 -2.00 -2.50 0.00 0.00 175.30 171.66 3dao s GLU 135 N 2.03 4.44 0.14 5.12 2.12 -1.26 -0.91 118.70 130.38 3dao s GLU 135 Ca -0.04 0.97 0.08 0.00 0.36 0.00 0.00 54.97 56.34 3dao s GLU 135 Cb -0.11 -3.35 -0.04 0.00 0.26 0.00 0.00 34.13 30.89 3dao s GLU 135 CO -0.11 0.32 -0.17 0.14 -0.54 0.00 0.00 175.26 174.90 3dao s VAL 136 N -0.15 1.63 -0.12 3.70 -7.23 0.12 -4.91 120.40 113.44 3dao s VAL 136 Ca 0.36 -1.76 -0.27 0.00 -1.81 0.00 0.00 61.98 58.51 3dao s VAL 136 Cb -0.20 -1.67 -0.23 0.00 0.56 0.00 0.00 36.38 34.84 3dao s VAL 136 CO 0.21 -0.29 0.78 0.44 -0.31 0.00 0.00 175.10 175.94 3dao h ASP 137 N 3.54 -0.01 -2.62 4.85 3.32 -1.97 -3.37 116.42 120.15 3dao h ASP 137 Ca -0.42 -0.85 -0.60 0.00 0.02 0.00 0.00 57.03 55.17 3dao h ASP 137 Cb 1.20 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.35 3dao h ASP 137 CO 0.48 0.88 -0.81 -0.67 -1.72 0.00 0.00 179.24 177.40 3dao n ASP 138 N -4.66 1.08 -0.30 6.45 -0.08 -1.26 -4.96 116.55 112.82 3dao n ASP 138 Ca -0.09 -2.76 0.03 0.00 -1.51 0.00 0.00 54.79 50.46 3dao n ASP 138 Cb 0.41 -0.64 0.17 0.00 2.34 0.00 0.00 41.12 43.40 3dao n ASP 138 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 3dao h ILE 139 N 4.34 0.93 0.00 5.18 2.10 -1.96 0.36 117.51 128.46 3dao h ILE 139 Ca 0.21 -0.29 0.00 0.00 1.08 0.00 0.00 64.86 65.86 3dao h ILE 139 Cb 0.84 0.01 0.00 0.00 -1.09 0.00 0.00 36.82 36.58 3dao h ILE 139 CO 0.53 0.15 0.00 0.35 -1.08 0.00 0.00 178.15 178.10 3dao n THR 140 N -4.71 0.04 1.15 2.19 -2.24 -1.26 -2.36 114.28 107.08 3dao n THR 140 Ca 0.14 0.01 0.12 0.00 -2.27 0.00 0.00 64.05 62.05 3dao n THR 140 Cb 0.27 -0.60 0.21 0.00 -2.10 0.00 0.00 70.33 68.11 3dao n THR 140 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3dao n ARG 141 N -1.05 1.62 -2.18 -0.78 3.00 0.11 -4.95 116.66 112.44 3dao n ARG 141 Ca 0.18 -1.22 -0.40 0.00 -0.01 0.00 0.00 57.85 56.39 3dao n ARG 141 Cb 0.11 -1.47 -0.02 0.00 0.00 0.00 0.00 32.46 31.07 3dao n ARG 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 3dao s LEU 142 N -2.22 4.42 -0.59 0.55 1.43 -1.00 -4.98 118.68 116.30 3dao s LEU 142 Ca 0.27 2.61 -0.02 0.00 -1.03 0.00 0.00 54.13 55.95 3dao s LEU 142 Cb 0.20 -3.68 0.15 0.00 0.03 0.00 0.00 46.19 42.89 3dao s LEU 142 CO 0.42 -0.50 0.40 -0.62 0.23 0.00 0.00 176.35 176.28 3dao s ASP 143 N -0.59 5.14 0.06 2.29 -1.08 -1.26 -5.05 116.67 116.18 3dao s ASP 143 Ca 0.49 -2.78 -0.00 0.00 -0.52 0.00 0.00 52.55 49.73 3dao s ASP 143 Cb -0.38 -1.83 -0.04 0.00 -1.46 0.00 0.00 42.92 39.21 3dao s ASP 143 CO 0.50 -0.37 -0.04 -0.13 0.52 0.00 0.00 175.17 175.65 3dao s ARG 144 N 0.04 0.68 -0.10 4.34 0.52 -1.26 -5.07 118.95 118.10 3dao s ARG 144 Ca 0.16 -1.26 0.14 0.00 -0.52 0.00 0.00 55.73 54.25 3dao s ARG 144 Cb -0.21 0.09 0.28 0.00 0.52 0.00 0.00 34.95 35.63 3dao s ARG 144 CO -0.03 -0.09 1.14 0.27 0.02 0.00 0.00 175.30 176.61 3dao n ASN 145 N 0.06 1.47 -1.09 0.23 6.94 -1.26 -4.81 115.26 116.81 3dao n ASN 145 Ca -0.13 -2.89 0.05 0.00 -0.02 0.00 0.00 54.58 51.58 3dao n ASN 145 Cb 0.61 -0.38 0.10 0.00 -2.36 0.00 0.00 39.78 37.74 3dao n ASN 145 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 3dao n ASP 146 N -0.76 1.28 -4.59 0.53 5.75 -1.26 -4.85 116.55 112.65 3dao n ASP 146 Ca 0.12 -2.77 -0.43 0.00 -0.01 0.00 0.00 54.79 51.70 3dao n ASP 146 Cb 0.74 -0.39 -0.04 0.00 -1.03 0.00 0.00 41.12 40.40 3dao n ASP 146 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3dao s ILE 147 N -1.33 4.54 -0.05 2.12 -1.09 -1.26 -4.06 121.20 120.06 3dao s ILE 147 Ca 0.35 1.03 0.21 0.00 -2.23 0.00 0.00 60.65 60.00 3dao s ILE 147 Cb 0.37 -4.37 -0.31 0.00 -1.58 0.00 0.00 42.46 36.56 3dao s ILE 147 CO -0.12 -0.65 0.40 2.30 -1.23 0.00 0.00 174.94 175.64 3dao n ILE 148 N 6.15 0.20 -3.76 2.92 -5.35 -0.01 -4.51 119.36 115.01 3dao n ILE 148 Ca 0.07 -0.53 -0.13 0.00 -0.27 0.00 0.00 62.75 61.89 3dao n ILE 148 Cb 0.48 -0.05 -0.10 0.00 -1.74 0.00 0.00 39.64 38.23 3dao n ILE 148 CO 0.00 0.00 0.00 -0.75 -1.76 0.00 0.00 176.55 174.04 3dao s LYS 149 N -3.31 0.52 -0.05 6.28 2.20 -1.14 -4.50 119.74 119.74 3dao s LYS 149 Ca -0.08 0.18 0.02 0.00 -0.36 0.00 0.00 55.97 55.72 3dao s LYS 149 Cb 0.12 0.24 0.02 0.00 -1.51 0.00 0.00 37.83 36.70 3dao s LYS 149 CO 0.86 -0.11 -0.08 0.12 -0.36 0.00 0.00 175.35 175.78 3dao s PHE 150 N -0.50 1.05 -0.05 4.03 2.19 -0.59 -0.98 117.98 123.14 3dao s PHE 150 Ca -0.06 -0.34 0.02 0.00 0.33 0.00 0.00 56.93 56.88 3dao s PHE 150 Cb -0.04 -0.83 0.01 0.00 -1.31 0.00 0.00 43.02 40.85 3dao s PHE 150 CO 0.02 -0.22 -0.10 0.99 1.83 0.00 0.00 175.22 177.74 3dao s THR 151 N 0.78 0.92 -0.07 0.12 2.01 0.50 -0.36 115.64 119.54 3dao s THR 151 Ca -0.13 -0.39 -0.14 0.00 0.31 0.00 0.00 61.69 61.34 3dao s THR 151 Cb -0.15 -0.85 -0.05 0.00 0.01 0.00 0.00 72.50 71.47 3dao s THR 151 CO 0.02 0.30 0.37 -0.69 -0.69 0.00 0.00 174.62 173.92 3dao s VAL 152 N 0.50 5.17 -0.05 3.82 1.01 0.01 -1.06 120.40 129.80 3dao s VAL 152 Ca -0.09 0.73 0.05 0.00 0.00 0.00 0.00 61.98 62.66 3dao s VAL 152 Cb -0.13 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 3dao s VAL 152 CO 0.02 0.50 -0.21 0.12 0.00 0.00 0.00 175.10 175.53 3dao s PHE 153 N -0.43 2.02 -0.06 5.22 5.36 0.67 -1.70 117.98 129.06 3dao s PHE 153 Ca 0.21 -0.58 -0.11 0.00 -0.96 0.00 0.00 56.93 55.50 3dao s PHE 153 Cb -0.15 -1.34 0.02 0.00 -0.34 0.00 0.00 43.02 41.21 3dao s PHE 153 CO 0.10 -0.18 0.26 -1.58 -1.46 0.00 0.00 175.22 172.36 3dao s HIS 154 N -0.07 -0.21 0.41 10.12 5.65 -0.61 -1.06 115.29 129.51 3dao s HIS 154 Ca -0.03 0.47 0.27 0.00 0.25 0.00 0.00 55.06 56.02 3dao s HIS 154 Cb -0.12 0.08 1.44 0.00 -1.18 0.00 0.00 32.58 32.79 3dao s HIS 154 CO 0.03 -0.24 2.07 -1.35 -0.65 0.00 0.00 174.74 174.60 3dao h PRO 155 N 4.96 0.00 0.00 2.88 0.11 -1.88 -3.36 132.00 134.71 3dao h PRO 155 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3dao h PRO 155 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3dao h PRO 155 CO 0.36 0.12 0.00 -0.40 -0.21 0.00 0.00 178.00 177.87 3dao n ASP 156 N -3.65 0.00 -1.40 -2.05 5.75 -1.26 -4.59 116.55 109.36 3dao n ASP 156 Ca -0.02 -0.55 0.03 0.00 -0.01 0.00 0.00 54.79 54.24 3dao n ASP 156 Cb 0.24 0.00 0.08 0.00 -1.03 0.00 0.00 41.12 40.41 3dao n ASP 156 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3dao n LYS 157 N 0.00 0.82 0.04 0.11 4.76 -1.21 -4.82 118.16 117.86 3dao n LYS 157 Ca 0.00 -2.64 -0.11 0.00 -2.87 0.00 0.00 58.31 52.69 3dao n LYS 157 Cb 0.14 -0.75 -0.05 0.00 -1.84 0.00 0.00 35.03 32.54 3dao n LYS 157 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3dao h GLU 159 N -0.17 0.41 -0.53 0.00 4.81 -1.84 -0.49 114.58 116.76 3dao h GLU 159 Ca 0.05 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 3dao h GLU 159 Cb 0.24 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 3dao h GLU 159 CO -0.13 0.31 0.34 0.93 -0.73 0.00 0.00 179.01 179.72 3dao h GLU 160 N 0.39 0.66 0.00 1.92 3.07 -1.86 -1.10 114.58 117.66 3dao h GLU 160 Ca 0.11 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 58.87 3dao h GLU 160 Cb -0.00 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.75 3dao h GLU 160 CO -0.02 0.43 -0.29 -0.07 -1.40 0.00 0.00 179.01 177.66 3dao h LEU 161 N 0.68 0.00 0.00 1.33 3.38 -0.41 -2.82 115.31 117.47 3dao h LEU 161 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3dao h LEU 161 Cb -0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.72 3dao h LEU 161 CO -0.07 0.29 -0.38 0.00 0.09 0.00 0.00 178.44 178.37 3dao h THR 163 N 0.00 1.27 -0.30 0.00 2.02 -0.95 0.12 112.91 115.07 3dao h THR 163 Ca 0.00 -1.30 -0.11 0.00 0.77 0.00 0.00 66.41 65.77 3dao h THR 163 Cb 0.86 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 3dao h THR 163 CO 0.00 0.45 -0.28 -0.65 0.37 0.00 0.00 175.52 175.41 3dao h PRO 164 N 0.81 0.60 0.00 6.66 0.11 -1.76 -3.40 132.00 135.03 3dao h PRO 164 Ca 0.12 -0.25 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3dao h PRO 164 Cb 0.71 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.79 3dao h PRO 164 CO 0.05 0.82 -0.62 0.28 -0.21 0.00 0.00 178.00 178.33 3dao n VAL 165 N -4.09 0.00 0.08 3.15 0.31 -1.24 -4.81 118.33 111.73 3dao n VAL 165 Ca -0.01 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.19 3dao n VAL 165 Cb 0.44 -1.08 -0.08 0.00 -0.91 0.00 0.00 33.84 32.22 3dao n VAL 165 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 3dao h PHE 166 N 0.00 -0.16 -0.09 3.52 3.57 -1.67 -1.67 116.94 120.45 3dao h PHE 166 Ca 0.00 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 3dao h PHE 166 Cb 0.62 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.40 3dao h PHE 166 CO 0.00 0.05 0.04 0.82 -2.23 0.00 0.00 178.31 176.98 3dao h ILE 167 N -0.34 1.14 0.00 1.41 2.04 -1.21 -2.09 117.51 118.46 3dao h ILE 167 Ca -0.02 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.41 3dao h ILE 167 Cb 0.28 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 3dao h ILE 167 CO 0.03 0.12 -0.12 -0.65 0.00 0.00 0.00 178.15 177.53 3dao h PRO 168 N -0.01 0.00 -0.10 2.37 0.11 -1.76 -0.49 132.00 132.12 3dao h PRO 168 Ca 0.03 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.01 3dao h PRO 168 Cb 0.16 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 3dao h PRO 168 CO -0.00 0.12 -0.51 0.00 -0.21 0.00 0.00 178.00 177.39 3dao h ALA 169 N 1.88 0.95 -0.00 -0.75 0.00 -0.63 -3.37 119.26 117.34 3dao h ALA 169 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3dao h ALA 169 Cb 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3dao h ALA 169 CO 0.02 0.67 -0.06 0.91 0.00 0.00 0.00 179.25 180.78 3dao n TRP 170 N -3.94 0.00 0.87 0.00 7.02 -0.92 -4.73 117.44 115.74 3dao n TRP 170 Ca -0.02 0.00 0.10 0.00 -1.02 0.00 0.00 57.50 56.56 3dao n TRP 170 Cb 0.56 0.00 0.50 0.00 -2.42 0.00 0.00 31.31 29.94 3dao n TRP 170 CO 0.00 0.00 0.00 0.27 -2.02 0.00 0.00 177.69 175.94 3dao n ASN 171 N -0.47 0.00 -0.09 -0.99 6.94 -0.24 -1.03 115.26 119.38 3dao n ASN 171 Ca 0.01 0.24 -0.09 0.00 -0.02 0.00 0.00 54.58 54.72 3dao n ASN 171 Cb 0.05 -0.39 -0.14 0.00 -2.36 0.00 0.00 39.78 36.94 3dao n ASN 171 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 3dao n LYS 172 N -1.39 1.10 0.15 -3.83 4.76 -1.26 -4.45 118.16 113.23 3dao n LYS 172 Ca 0.08 -0.01 0.12 0.00 -2.87 0.00 0.00 58.31 55.62 3dao n LYS 172 Cb 0.21 -1.46 0.13 0.00 -1.84 0.00 0.00 35.03 32.07 3dao n LYS 172 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 3dao h LYS 173 N 0.00 0.00 -3.88 1.97 1.57 -1.76 -3.47 116.57 110.99 3dao h LYS 173 Ca -0.48 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.19 3dao h LYS 173 Cb 2.08 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 34.29 3dao h LYS 173 CO 0.03 0.00 -0.23 0.00 -0.57 0.00 0.00 179.45 178.68 3dao s ALA 174 N -3.25 0.13 -0.31 3.86 0.00 -0.20 -4.39 121.76 117.61 3dao s ALA 174 Ca 0.05 -1.10 -0.15 0.00 0.00 0.00 0.00 51.96 50.76 3dao s ALA 174 Cb 0.08 1.14 -0.03 0.00 0.00 0.00 0.00 23.12 24.32 3dao s ALA 174 CO 0.71 -0.79 0.35 -1.58 0.00 0.00 0.00 175.76 174.45 3dao s HIS 175 N -3.98 3.22 -0.06 0.00 2.46 0.45 -4.38 115.29 113.00 3dao s HIS 175 Ca 0.27 0.15 0.04 0.00 0.47 0.00 0.00 55.06 55.98 3dao s HIS 175 Cb 0.01 -2.61 -0.02 0.00 -0.13 0.00 0.00 32.58 29.83 3dao s HIS 175 CO 0.10 -0.33 -0.18 -0.51 -2.47 0.00 0.00 174.74 171.36 3dao s LEU 176 N 2.01 2.51 -0.13 8.88 1.02 -1.26 -1.02 118.68 130.69 3dao s LEU 176 Ca 0.12 -0.32 -0.07 0.00 0.02 0.00 0.00 54.13 53.89 3dao s LEU 176 Cb -0.16 -1.50 0.05 0.00 0.02 0.00 0.00 46.19 44.60 3dao s LEU 176 CO 0.11 0.29 0.31 0.00 0.02 0.00 0.00 176.35 177.08 3dao s ALA 177 N -0.38 -0.76 0.29 4.21 0.00 -0.32 -4.99 121.76 119.80 3dao s ALA 177 Ca 0.04 1.22 -0.29 0.00 0.00 0.00 0.00 51.96 52.93 3dao s ALA 177 Cb -0.12 -0.76 -0.09 0.00 0.00 0.00 0.00 23.12 22.14 3dao s ALA 177 CO 0.02 -0.23 1.08 0.00 0.00 0.00 0.00 175.76 176.63 3dao s ALA 178 N 1.34 3.37 -0.07 0.00 0.00 -1.26 -0.69 121.76 124.45 3dao s ALA 178 Ca -0.09 0.85 0.02 0.00 0.00 0.00 0.00 51.96 52.73 3dao s ALA 178 Cb -0.10 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 19.73 3dao s ALA 178 CO -0.10 -0.13 -0.10 0.00 0.00 0.00 0.00 175.76 175.43 3dao s ALA 179 N -1.22 1.14 0.00 0.00 0.00 0.16 -4.93 121.76 116.90 3dao s ALA 179 Ca 0.46 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 52.06 3dao s ALA 179 Cb -0.30 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.23 3dao s ALA 179 CO 0.39 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.55 3dao n GLY 180 N 4.06 0.93 0.69 0.00 0.00 -1.26 -2.32 105.19 107.28 3dao n GLY 180 Ca -0.21 -0.72 0.09 0.00 0.00 0.00 0.00 46.02 45.17 3dao n GLY 180 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3dao n LYS 181 N 0.00 1.56 -0.01 1.61 2.85 -1.26 -4.55 118.16 118.36 3dao n LYS 181 Ca 0.00 -1.49 0.08 0.00 -1.05 0.00 0.00 58.31 55.85 3dao n LYS 181 Cb 0.00 -1.35 -0.12 0.00 -0.65 0.00 0.00 35.03 32.91 3dao n LYS 181 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3dao n GLU 182 N 0.88 0.77 -4.28 -1.58 4.71 -1.22 -1.90 120.64 118.01 3dao n GLU 182 Ca 0.10 -0.12 -0.20 0.00 -0.01 0.00 0.00 57.16 56.94 3dao n GLU 182 Cb 0.45 -1.38 -0.13 0.00 -1.01 0.00 0.00 31.44 29.37 3dao n GLU 182 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 3dao s TRP 183 N -3.04 1.25 -0.18 -0.32 0.52 -0.98 -1.57 118.94 114.62 3dao s TRP 183 Ca -0.03 -0.40 -0.01 0.00 0.02 0.00 0.00 56.10 55.68 3dao s TRP 183 Cb 0.11 -0.73 0.05 0.00 -1.15 0.00 0.00 33.47 31.76 3dao s TRP 183 CO 0.71 0.05 -0.01 0.08 0.02 0.00 0.00 176.95 177.80 3dao s VAL 184 N -1.03 0.87 -0.13 4.03 1.01 -0.69 -0.67 120.40 123.80 3dao s VAL 184 Ca 0.00 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 3dao s VAL 184 Cb -0.09 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 3dao s VAL 184 CO 0.02 -0.03 0.10 -1.81 0.00 0.00 0.00 175.10 173.38 3dao s ASP 185 N 1.72 6.00 -0.04 3.32 1.01 0.14 -0.81 116.67 128.01 3dao s ASP 185 Ca -0.01 0.32 0.03 0.00 0.71 0.00 0.00 52.55 53.61 3dao s ASP 185 Cb -0.16 -1.91 0.01 0.00 1.01 0.00 0.00 42.92 41.86 3dao s ASP 185 CO -0.07 0.36 -0.11 0.00 0.21 0.00 0.00 175.17 175.55 3dao s ASN 187 N 0.33 1.20 0.66 0.00 4.22 -0.19 -1.54 114.94 119.63 3dao s ASN 187 Ca -0.07 -1.63 -0.16 0.00 -2.14 0.00 0.00 52.86 48.86 3dao s ASN 187 Cb -0.12 0.53 0.00 0.00 1.28 0.00 0.00 41.25 42.94 3dao s ASN 187 CO 0.02 -1.04 1.19 0.00 -2.04 0.00 0.00 177.10 175.22 3dao s ALA 188 N -3.58 2.35 0.41 3.54 0.00 -1.26 -0.41 121.76 122.81 3dao s ALA 188 Ca 0.39 0.86 -0.25 0.00 0.00 0.00 0.00 51.96 52.95 3dao s ALA 188 Cb 0.03 -3.43 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 3dao s ALA 188 CO 0.23 -1.47 1.22 0.21 0.00 0.00 0.00 175.76 175.94 3dao s LYS 189 N -3.73 3.99 0.00 0.00 2.20 -1.26 -3.27 119.74 117.67 3dao s LYS 189 Ca 0.74 1.96 0.00 0.00 -0.36 0.00 0.00 55.97 58.31 3dao s LYS 189 Cb -0.28 -2.69 0.00 0.00 -1.51 0.00 0.00 37.83 33.35 3dao s LYS 189 CO 0.40 -0.41 0.00 0.41 -0.36 0.00 0.00 175.35 175.39 3dao n GLY 190 N 0.65 0.74 3.73 5.54 0.00 -1.26 -4.99 105.19 109.60 3dao n GLY 190 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 3dao n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dao s VAL 191 N -2.34 4.96 0.16 1.61 1.01 -1.20 -4.94 120.40 119.65 3dao s VAL 191 Ca 0.00 1.47 -0.20 0.00 0.00 0.00 0.00 61.98 63.24 3dao s VAL 191 Cb 0.00 -4.04 0.05 0.00 0.00 0.00 0.00 36.38 32.39 3dao s VAL 191 CO 0.00 0.30 0.55 -0.94 0.00 0.00 0.00 175.10 175.01 3dao s SER 192 N 0.47 -0.42 0.19 3.32 1.04 -1.26 -5.00 113.70 112.04 3dao s SER 192 Ca 0.37 -0.19 -0.13 0.00 0.48 0.00 0.00 55.95 56.48 3dao s SER 192 Cb -0.18 0.57 0.10 0.00 0.10 0.00 0.00 66.02 66.60 3dao s SER 192 CO 0.19 -0.98 1.85 0.11 0.98 0.00 0.00 173.24 175.39 3dao h LYS 193 N 2.12 0.81 -0.34 4.02 1.57 -1.78 -2.30 116.57 120.67 3dao h LYS 193 Ca -0.32 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.31 3dao h LYS 193 Cb 1.29 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 3dao h LYS 193 CO 0.39 0.55 -0.16 2.35 -0.57 0.00 0.00 179.45 182.00 3dao h TRP 194 N 0.82 0.68 -0.11 -1.35 2.91 -1.91 0.46 115.95 117.45 3dao h TRP 194 Ca 0.22 -0.13 -0.01 0.00 1.13 0.00 0.00 58.89 60.11 3dao h TRP 194 Cb -0.08 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 28.40 3dao h TRP 194 CO -0.03 0.74 0.04 1.15 -1.03 0.00 0.00 178.44 179.31 3dao h THR 195 N 0.55 1.16 -0.35 2.65 2.02 -1.88 0.25 112.91 117.31 3dao h THR 195 Ca 0.09 -0.49 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 3dao h THR 195 Cb 0.60 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 3dao h THR 195 CO 0.04 0.15 0.18 0.00 0.37 0.00 0.00 175.52 176.25 3dao h ALA 196 N 0.87 0.45 -0.50 6.16 0.00 -1.32 -2.37 119.26 122.55 3dao h ALA 196 Ca 0.04 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 3dao h ALA 196 Cb 0.19 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3dao h ALA 196 CO -0.00 0.01 0.05 1.25 0.00 0.00 0.00 179.25 180.55 3dao h LEU 197 N 0.44 0.77 -1.40 0.00 5.85 -0.74 -1.99 115.31 118.23 3dao h LEU 197 Ca 0.12 -0.17 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 3dao h LEU 197 Cb 0.10 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3dao h LEU 197 CO -0.02 0.81 -0.05 0.28 -0.34 0.00 0.00 178.44 179.12 3dao h SER 198 N 0.77 0.30 -0.55 1.25 0.02 -0.28 0.44 113.55 115.50 3dao h SER 198 Ca 0.16 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.09 3dao h SER 198 Cb 0.39 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.82 3dao h SER 198 CO 0.01 0.40 0.32 0.22 -1.14 0.00 0.00 176.83 176.64 3dao h TYR 199 N 0.32 0.59 -0.23 3.45 3.20 -0.84 -0.74 116.97 122.72 3dao h TYR 199 Ca 0.07 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.83 3dao h TYR 199 Cb 0.30 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 3dao h TYR 199 CO 0.01 0.33 -0.35 -0.07 -1.64 0.00 0.00 178.16 176.43 3dao h LEU 200 N 0.63 0.71 -0.44 2.82 3.38 -1.13 -1.12 115.31 120.16 3dao h LEU 200 Ca 0.23 -0.52 0.05 0.00 0.09 0.00 0.00 57.88 57.73 3dao h LEU 200 Cb 0.06 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.56 3dao h LEU 200 CO -0.11 1.09 0.15 0.40 0.09 0.00 0.00 178.44 180.06 3dao h ILE 201 N 0.35 0.86 -0.63 1.22 2.04 -0.69 -0.69 117.51 119.97 3dao h ILE 201 Ca 0.02 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.71 3dao h ILE 201 Cb 0.93 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3dao h ILE 201 CO 0.08 0.06 0.14 -0.78 0.00 0.00 0.00 178.15 177.65 3dao h ASP 202 N 0.32 0.95 -0.05 1.72 1.82 -1.13 -1.22 116.42 118.83 3dao h ASP 202 Ca 0.20 -0.20 -0.05 0.00 -0.39 0.00 0.00 57.03 56.59 3dao h ASP 202 Cb 0.20 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 39.94 3dao h ASP 202 CO -0.21 0.93 -0.11 -0.09 -1.61 0.00 0.00 179.24 178.15 3dao h ARG 203 N 0.95 0.33 -0.71 0.28 2.43 -0.10 -2.11 114.38 115.45 3dao h ARG 203 Ca 0.20 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3dao h ARG 203 Cb 0.36 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3dao h ARG 203 CO 0.00 0.44 0.00 1.19 -1.51 0.00 0.00 179.97 180.10 3dao n PHE 204 N -4.26 1.04 -3.82 2.20 3.72 -0.37 -4.96 117.46 111.01 3dao n PHE 204 Ca -0.00 -0.52 -0.26 0.00 -0.05 0.00 0.00 57.45 56.62 3dao n PHE 204 Cb 0.27 -0.04 0.03 0.00 -0.94 0.00 0.00 39.48 38.80 3dao n PHE 204 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3dao n ASP 205 N 1.52 -3.31 -4.87 4.37 8.00 -0.79 -4.98 116.55 116.49 3dao n ASP 205 Ca 0.24 -0.79 -0.25 0.00 0.71 0.00 0.00 54.79 54.70 3dao n ASP 205 Cb 0.66 -3.99 -0.04 0.00 -0.02 0.00 0.00 41.12 37.72 3dao n ASP 205 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3dao s LEU 206 N -7.03 4.03 -0.28 0.64 1.43 -0.51 -5.04 118.68 111.91 3dao s LEU 206 Ca 0.38 -0.03 -0.11 0.00 -1.03 0.00 0.00 54.13 53.35 3dao s LEU 206 Cb -0.19 -2.61 -0.05 0.00 0.03 0.00 0.00 46.19 43.37 3dao s LEU 206 CO 0.82 0.04 0.19 -0.76 0.23 0.00 0.00 176.35 176.86 3dao s LEU 207 N -3.31 4.02 0.45 1.79 1.43 -1.26 -4.65 118.68 117.15 3dao s LEU 207 Ca 0.33 -0.05 0.09 0.00 -1.03 0.00 0.00 54.13 53.46 3dao s LEU 207 Cb -0.10 -2.11 0.30 0.00 0.03 0.00 0.00 46.19 44.31 3dao s LEU 207 CO 0.26 -0.06 0.81 -2.65 0.23 0.00 0.00 176.35 174.94 3dao n PRO 208 N 5.06 0.02 0.27 1.29 -0.02 -1.26 -0.11 135.00 140.25 3dao n PRO 208 Ca -0.14 0.70 0.14 0.00 -2.02 0.00 0.00 63.50 62.18 3dao n PRO 208 Cb 0.52 -1.83 0.78 0.00 -0.02 0.00 0.00 33.50 32.96 3dao n PRO 208 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3dao h ASP 209 N 0.00 0.00 -0.46 2.55 3.32 -1.91 -1.78 116.42 118.15 3dao h ASP 209 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 3dao h ASP 209 Cb 1.74 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.29 3dao h ASP 209 CO -0.00 0.09 0.00 -0.62 -1.72 0.00 0.00 179.24 176.99 3dao n GLU 210 N -3.64 2.40 -5.06 3.56 1.02 0.85 -4.28 120.64 115.48 3dao n GLU 210 Ca -0.02 -1.78 -0.32 0.00 -0.02 0.00 0.00 57.16 55.02 3dao n GLU 210 Cb 0.20 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 29.97 3dao n GLU 210 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3dao s VAL 211 N -1.52 2.56 -0.10 2.62 1.01 -1.09 0.00 120.40 123.87 3dao s VAL 211 Ca 0.33 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.44 3dao s VAL 211 Cb 0.19 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.60 3dao s VAL 211 CO 0.19 0.57 -0.18 0.00 0.00 0.00 0.00 175.10 175.68 3dao s PHE 214 N -0.79 2.06 0.30 0.00 0.40 -0.54 -0.98 117.98 118.44 3dao s PHE 214 Ca 0.08 -0.40 -0.20 0.00 -0.60 0.00 0.00 56.93 55.82 3dao s PHE 214 Cb -0.09 -1.33 0.03 0.00 0.51 0.00 0.00 43.02 42.14 3dao s PHE 214 CO 0.02 -0.04 0.73 0.20 0.70 0.00 0.00 175.22 176.83 3dao s GLY 215 N -0.53 0.03 0.00 4.36 0.00 -0.57 -2.62 107.32 107.99 3dao s GLY 215 Ca 0.08 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.38 3dao s GLY 215 CO -0.01 -0.15 0.00 2.09 0.00 0.00 0.00 173.10 175.03 3dao n ASP 216 N -0.68 0.00 -4.41 1.64 5.75 -1.26 -2.28 116.55 115.32 3dao n ASP 216 Ca -0.05 0.00 -0.23 0.00 -0.01 0.00 0.00 54.79 54.50 3dao n ASP 216 Cb 0.59 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.58 3dao n ASP 216 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3dao s ASN 217 N 0.00 2.52 0.34 -1.12 3.84 -1.26 -4.29 114.94 114.97 3dao s ASN 217 Ca 0.00 -1.44 0.10 0.00 0.21 0.00 0.00 52.86 51.73 3dao s ASN 217 Cb 0.00 0.04 0.85 0.00 -0.55 0.00 0.00 41.25 41.59 3dao s ASN 217 CO 0.00 -0.67 1.79 0.25 -2.79 0.00 0.00 177.10 175.68 3dao h LEU 218 N 2.03 0.67 0.00 3.21 5.85 -1.98 0.16 115.31 125.25 3dao h LEU 218 Ca -0.40 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.40 3dao h LEU 218 Cb 1.25 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3dao h LEU 218 CO 0.68 0.24 0.00 -0.46 -0.34 0.00 0.00 178.44 178.55 3dao n ASN 219 N -4.70 0.00 -0.20 1.25 0.23 -1.26 -1.92 115.26 108.66 3dao n ASN 219 Ca 0.23 -0.90 0.12 0.00 -0.53 0.00 0.00 54.58 53.50 3dao n ASN 219 Cb 0.63 0.00 0.15 0.00 -2.08 0.00 0.00 39.78 38.48 3dao n ASN 219 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 3dao n ASP 220 N -0.99 1.15 -0.05 0.53 8.00 0.57 -4.58 116.55 121.19 3dao n ASP 220 Ca 0.20 -0.93 -0.08 0.00 0.71 0.00 0.00 54.79 54.70 3dao n ASP 220 Cb 0.09 0.42 -0.02 0.00 -0.02 0.00 0.00 41.12 41.59 3dao n ASP 220 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3dao h ILE 221 N 1.00 0.78 0.00 0.53 2.04 -1.45 -1.67 117.51 118.75 3dao h ILE 221 Ca 0.00 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3dao h ILE 221 Cb 0.57 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 3dao h ILE 221 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 178.15 179.36 3dao n GLU 222 N -5.20 0.14 0.00 2.37 2.13 -1.26 -0.91 120.64 117.90 3dao n GLU 222 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3dao n GLU 222 Cb 0.13 -1.28 0.00 0.00 0.27 0.00 0.00 31.44 30.56 3dao n GLU 222 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 3dao n LEU 224 N 0.72 0.00 -0.16 4.31 4.77 -0.63 -1.37 117.00 124.64 3dao n LEU 224 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 3dao n LEU 224 Cb 0.06 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.14 3dao n LEU 224 CO 0.00 0.00 0.72 1.56 -1.33 0.00 0.00 177.39 178.34 3dao h GLN 225 N 0.00 0.90 0.00 3.23 4.20 -1.02 -3.36 115.11 119.06 3dao h GLN 225 Ca 0.00 -0.35 -0.22 0.00 0.06 0.00 0.00 58.65 58.15 3dao h GLN 225 Cb 0.00 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 3dao h GLN 225 CO 0.00 1.00 -1.49 -0.91 -0.67 0.00 0.00 178.83 176.76 3dao h ASN 226 N 0.74 0.00 -3.93 1.46 2.35 -1.48 -3.46 115.58 111.26 3dao h ASN 226 Ca 0.12 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.34 3dao h ASN 226 Cb 0.67 0.00 0.09 0.00 0.05 0.00 0.00 38.32 39.12 3dao h ASN 226 CO 0.05 0.76 0.68 0.00 -1.65 0.00 0.00 177.43 177.27 3dao s ALA 227 N -2.78 3.43 0.30 -0.83 0.00 -1.26 -4.63 121.76 115.99 3dao s ALA 227 Ca -0.03 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.30 3dao s ALA 227 Cb 0.08 -3.53 0.52 0.00 0.00 0.00 0.00 23.12 20.19 3dao s ALA 227 CO 0.82 -0.87 1.92 0.78 0.00 0.00 0.00 175.76 178.40 3dao h GLY 228 N 2.98 1.31 -5.21 0.00 0.00 -0.84 -3.41 103.07 97.90 3dao h GLY 228 Ca -0.50 -0.42 -0.42 0.00 0.00 0.00 0.00 47.33 45.99 3dao h GLY 228 CO 0.64 0.32 -0.79 -1.50 0.00 0.00 0.00 176.54 175.21 3dao s ILE 229 N -5.91 0.82 0.02 2.60 2.07 -1.02 -5.04 121.20 114.74 3dao s ILE 229 Ca -0.11 -0.44 -0.19 0.00 -1.41 0.00 0.00 60.65 58.49 3dao s ILE 229 Cb 0.20 -0.69 0.04 0.00 0.13 0.00 0.00 42.46 42.14 3dao s ILE 229 CO 0.80 0.23 0.44 -0.94 -1.91 0.00 0.00 174.94 173.56 3dao s SER 230 N -0.20 -0.33 -0.02 4.50 1.04 -1.26 -2.28 113.70 115.15 3dao s SER 230 Ca 0.03 0.11 0.02 0.00 0.48 0.00 0.00 55.95 56.59 3dao s SER 230 Cb -0.04 0.42 0.01 0.00 0.10 0.00 0.00 66.02 66.51 3dao s SER 230 CO -0.00 -0.63 -0.07 -0.31 0.98 0.00 0.00 173.24 173.21 3dao s TYR 231 N -2.13 0.76 -0.11 5.02 1.51 -0.15 -1.36 117.35 120.89 3dao s TYR 231 Ca -0.07 -0.18 -0.03 0.00 -1.01 0.00 0.00 57.07 55.78 3dao s TYR 231 Cb -0.01 -0.57 -0.03 0.00 -0.11 0.00 0.00 41.96 41.23 3dao s TYR 231 CO 0.00 -0.10 0.01 0.00 -1.11 0.00 0.00 175.55 174.35 3dao s ALA 232 N 0.29 3.27 0.47 3.71 0.00 -0.31 -1.51 121.76 127.68 3dao s ALA 232 Ca -0.04 -0.80 -0.25 0.00 0.00 0.00 0.00 51.96 50.88 3dao s ALA 232 Cb -0.08 -1.56 -0.08 0.00 0.00 0.00 0.00 23.12 21.40 3dao s ALA 232 CO 0.00 0.48 1.41 1.33 0.00 0.00 0.00 175.76 178.99 3dao n VAL 233 N 2.53 2.97 0.31 0.00 0.24 -0.97 -1.44 118.33 121.97 3dao n VAL 233 Ca -0.18 -0.50 0.17 0.00 -2.04 0.00 0.00 64.34 61.79 3dao n VAL 233 Cb 0.53 -1.80 0.71 0.00 -1.47 0.00 0.00 33.84 31.81 3dao n VAL 233 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3dao h SER 234 N 2.13 0.00 -0.15 -1.34 4.64 -0.80 -1.11 113.55 116.92 3dao h SER 234 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 3dao h SER 234 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 3dao h SER 234 CO 0.60 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.10 3dao n ASN 235 N -2.88 1.70 -4.76 4.97 6.94 -1.26 -4.95 115.26 115.02 3dao n ASN 235 Ca 0.00 -1.69 -0.32 0.00 -0.02 0.00 0.00 54.58 52.55 3dao n ASN 235 Cb 0.25 -0.09 0.08 0.00 -2.36 0.00 0.00 39.78 37.66 3dao n ASN 235 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3dao s ALA 236 N -1.81 2.26 0.61 -2.53 0.00 -0.42 -4.98 121.76 114.89 3dao s ALA 236 Ca 0.33 0.46 -0.18 0.00 0.00 0.00 0.00 51.96 52.57 3dao s ALA 236 Cb 0.18 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 3dao s ALA 236 CO 0.27 -1.67 0.95 2.89 0.00 0.00 0.00 175.76 178.20 3dao n ARG 237 N -3.08 0.85 -0.29 0.00 1.85 -1.26 -4.74 116.66 109.99 3dao n ARG 237 Ca 0.10 0.33 0.15 0.00 -1.00 0.00 0.00 57.85 57.43 3dao n ARG 237 Cb 0.52 -2.16 0.41 0.00 -1.05 0.00 0.00 32.46 30.19 3dao n ARG 237 CO 0.00 0.00 0.00 0.37 -0.01 0.00 0.00 177.63 177.99 3dao h GLN 238 N 0.41 0.59 -0.26 2.89 -0.00 -1.97 -0.85 115.11 115.92 3dao h GLN 238 Ca -0.48 -0.04 -0.07 0.00 -0.00 0.00 0.00 58.65 58.06 3dao h GLN 238 Cb 1.37 -0.13 -0.01 0.00 0.00 0.00 0.00 27.48 28.70 3dao h GLN 238 CO 0.50 0.39 -0.16 0.93 0.00 0.00 0.00 178.83 180.50 3dao h GLU 239 N 0.61 0.44 -0.20 1.69 3.07 -1.99 -0.62 114.58 117.58 3dao h GLU 239 Ca 0.50 -0.13 -0.15 0.00 -0.50 0.00 0.00 59.36 59.08 3dao h GLU 239 Cb 0.95 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 3dao h GLU 239 CO -0.24 0.59 -0.45 0.28 -1.40 0.00 0.00 179.01 177.79 3dao h VAL 240 N 0.41 1.32 -0.55 3.13 2.07 -1.51 -2.06 116.25 119.06 3dao h VAL 240 Ca 0.07 -1.67 0.02 0.00 0.82 0.00 0.00 66.70 65.94 3dao h VAL 240 Cb 0.52 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 32.11 3dao h VAL 240 CO 0.03 0.52 0.35 0.40 0.02 0.00 0.00 177.57 178.89 3dao h ILE 241 N 0.36 1.10 -0.54 4.57 1.08 -1.22 -2.10 117.51 120.76 3dao h ILE 241 Ca 0.00 -0.24 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 3dao h ILE 241 Cb 1.05 0.34 -0.03 0.00 -3.07 0.00 0.00 36.82 35.11 3dao h ILE 241 CO 0.10 0.13 0.27 0.00 -0.69 0.00 0.00 178.15 177.96 3dao h ALA 242 N 1.22 1.47 0.00 1.87 0.00 -0.98 -2.88 119.26 119.97 3dao h ALA 242 Ca 0.21 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3dao h ALA 242 Cb -0.03 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 3dao h ALA 242 CO -0.07 0.43 -0.59 0.00 0.00 0.00 0.00 179.25 179.02 3dao h ALA 243 N 1.55 0.79 -2.36 0.00 0.00 -0.74 -3.46 119.26 115.05 3dao h ALA 243 Ca 0.19 -0.54 -0.50 0.00 0.00 0.00 0.00 54.91 54.06 3dao h ALA 243 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3dao h ALA 243 CO -0.03 0.74 0.03 0.00 0.00 0.00 0.00 179.25 179.99 3dao s ALA 244 N -3.29 3.43 0.13 0.00 0.00 -0.87 -3.31 121.76 117.84 3dao s ALA 244 Ca 0.01 -0.24 -0.08 0.00 0.00 0.00 0.00 51.96 51.65 3dao s ALA 244 Cb 0.11 -2.60 -0.07 0.00 0.00 0.00 0.00 23.12 20.55 3dao s ALA 244 CO 0.75 0.17 1.34 0.87 0.00 0.00 0.00 175.76 178.89 3dao h LYS 245 N 1.68 0.60 -4.69 0.00 6.56 -1.74 -3.48 116.57 115.51 3dao h LYS 245 Ca -0.47 -0.52 -0.31 0.00 -1.06 0.00 0.00 60.65 58.29 3dao h LYS 245 Cb 1.18 0.12 -0.14 0.00 -0.57 0.00 0.00 32.23 32.82 3dao h LYS 245 CO 0.65 1.14 -0.58 -1.01 -2.06 0.00 0.00 179.45 177.59 3dao s HIS 246 N -3.61 1.35 0.15 -1.35 3.76 -0.46 -4.99 115.29 110.15 3dao s HIS 246 Ca -0.08 -1.47 0.11 0.00 -0.15 0.00 0.00 55.06 53.47 3dao s HIS 246 Cb 0.09 -0.61 -0.04 0.00 1.11 0.00 0.00 32.58 33.13 3dao s HIS 246 CO 0.88 -0.71 -0.23 0.95 -0.85 0.00 0.00 174.74 174.77 3dao s THR 247 N -3.93 2.47 0.41 1.30 -4.23 -1.26 -1.16 115.64 109.24 3dao s THR 247 Ca 0.40 -1.81 0.03 0.00 -1.18 0.00 0.00 61.69 59.13 3dao s THR 247 Cb 0.06 -2.15 -0.03 0.00 1.34 0.00 0.00 72.50 71.71 3dao s THR 247 CO 0.17 0.00 0.07 0.00 -0.54 0.00 0.00 174.62 174.32 3dao s ALA 249 N -3.11 2.22 0.91 0.00 0.00 -1.26 -0.21 121.76 120.30 3dao s ALA 249 Ca 0.23 -0.13 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 3dao s ALA 249 Cb 0.04 -3.13 0.14 0.00 0.00 0.00 0.00 23.12 20.16 3dao s ALA 249 CO 0.12 -1.74 1.09 -2.14 0.00 0.00 0.00 175.76 173.09 3dao s PRO 250 N -5.10 1.16 0.51 0.00 0.02 -1.26 -3.51 135.00 126.82 3dao s PRO 250 Ca 0.61 0.95 0.21 0.00 0.02 0.00 0.00 61.00 62.79 3dao s PRO 250 Cb -0.15 -1.79 1.30 0.00 0.02 0.00 0.00 34.50 33.88 3dao s PRO 250 CO 0.55 -2.34 2.02 0.10 -0.33 0.00 0.00 177.00 176.99 3dao h TYR 251 N -1.63 0.10 0.00 6.54 -0.00 -1.82 -0.52 116.97 119.64 3dao h TYR 251 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.24 3dao h TYR 251 Cb 1.28 -0.03 0.00 0.00 0.00 0.00 0.00 36.73 37.98 3dao h TYR 251 CO 0.44 0.04 0.00 -2.67 -0.00 0.00 0.00 178.16 175.97 3dao n TRP 252 N -4.43 0.00 -0.35 0.10 2.14 -1.26 -1.54 117.44 112.10 3dao n TRP 252 Ca 0.08 0.00 0.04 0.00 2.07 0.00 0.00 57.50 59.69 3dao n TRP 252 Cb 0.47 -0.21 0.10 0.00 -0.81 0.00 0.00 31.31 30.86 3dao n TRP 252 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 3dao n GLU 253 N -1.21 2.66 -3.86 -2.67 1.02 -0.24 -4.99 120.64 111.34 3dao n GLU 253 Ca 0.17 -1.99 -0.24 0.00 -0.02 0.00 0.00 57.16 55.08 3dao n GLU 253 Cb 0.21 -1.26 -0.00 0.00 -0.02 0.00 0.00 31.44 30.37 3dao n GLU 253 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3dao n ASN 254 N -0.39 -0.77 -0.08 1.62 3.02 -0.59 -4.89 115.26 113.18 3dao n ASN 254 Ca 0.08 -0.95 -0.10 0.00 -0.03 0.00 0.00 54.58 53.58 3dao n ASN 254 Cb 0.44 -3.38 -0.03 0.00 -0.61 0.00 0.00 39.78 36.19 3dao n ASN 254 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3dao h GLY 255 N -1.85 0.42 1.01 7.41 0.00 -1.50 -2.23 103.07 106.35 3dao h GLY 255 Ca -0.63 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 46.46 3dao h GLY 255 CO 0.60 0.22 0.53 -2.08 0.00 0.00 0.00 176.54 175.81 3dao h VAL 256 N 0.27 1.24 -0.93 4.60 2.07 -1.84 -2.13 116.25 119.52 3dao h VAL 256 Ca 0.09 -0.51 0.06 0.00 0.82 0.00 0.00 66.70 67.16 3dao h VAL 256 Cb 0.20 0.01 -0.06 0.00 -1.52 0.00 0.00 31.29 29.92 3dao h VAL 256 CO -0.01 0.25 0.59 0.25 0.02 0.00 0.00 177.57 178.67 3dao h LEU 257 N 1.19 0.94 -0.90 2.57 5.85 -1.83 -0.21 115.31 122.92 3dao h LEU 257 Ca 0.31 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.02 3dao h LEU 257 Cb -0.06 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.75 3dao h LEU 257 CO -0.06 0.60 0.41 0.28 -0.34 0.00 0.00 178.44 179.33 3dao h SER 258 N 1.08 1.09 -0.29 1.25 0.02 -0.80 0.05 113.55 115.95 3dao h SER 258 Ca 0.40 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 61.10 3dao h SER 258 Cb 0.16 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.42 3dao h SER 258 CO -0.17 0.91 -0.31 0.58 -1.14 0.00 0.00 176.83 176.70 3dao h VAL 259 N 1.19 1.30 -0.96 2.27 2.07 -1.05 -2.99 116.25 118.08 3dao h VAL 259 Ca 0.29 -1.49 0.05 0.00 0.82 0.00 0.00 66.70 66.37 3dao h VAL 259 Cb 0.10 1.59 -0.06 0.00 -1.52 0.00 0.00 31.29 31.41 3dao h VAL 259 CO -0.04 0.48 0.62 -0.07 0.02 0.00 0.00 177.57 178.58 3dao h LEU 260 N 0.46 1.02 -1.99 2.57 3.38 -0.54 -0.62 115.31 119.59 3dao h LEU 260 Ca 0.04 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3dao h LEU 260 Cb 0.89 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3dao h LEU 260 CO 0.08 0.68 -0.10 0.11 0.09 0.00 0.00 178.44 179.30 3dao h LYS 261 N 1.17 0.00 0.00 1.13 1.57 -0.90 -1.68 116.57 117.86 3dao h LYS 261 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3dao h LYS 261 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3dao h LYS 261 CO -0.13 0.10 0.00 0.66 -0.57 0.00 0.00 179.45 179.51 3dao h SER 262 N 0.00 0.00 0.67 0.86 4.64 -0.96 -2.13 113.55 116.63 3dao h SER 262 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dao h SER 262 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3dao h SER 262 CO 0.01 0.00 -0.20 0.49 -0.87 0.00 0.00 176.83 176.27 3dao n PHE 263 N -2.53 0.00 1.91 4.77 3.72 -0.63 -4.86 117.46 119.84 3dao n PHE 263 Ca 0.04 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.60 3dao n PHE 263 Cb 0.40 -0.33 0.87 0.00 -0.94 0.00 0.00 39.48 39.48 3dao n PHE 263 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99