#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zye s ALA 3 N 0.00 2.39 -1.15 0.55 0.00 -1.26 -4.97 121.76 117.32 1zye s ALA 3 Ca 0.00 -1.69 -0.20 0.00 0.00 0.00 0.00 51.96 50.08 1zye s ALA 3 Cb 0.00 0.84 0.07 0.00 0.00 0.00 0.00 23.12 24.03 1zye s ALA 3 CO 0.00 -0.38 1.55 0.08 0.00 0.00 0.00 175.76 177.02 1zye s VAL 4 N -3.39 4.14 0.00 0.00 1.01 -1.26 -2.80 120.40 118.09 1zye s VAL 4 Ca 0.32 -1.45 0.00 0.00 0.00 0.00 0.00 61.98 60.85 1zye s VAL 4 Cb 0.06 -5.09 0.00 0.00 0.00 0.00 0.00 36.38 31.34 1zye s VAL 4 CO 0.15 -1.93 0.00 0.35 0.00 0.00 0.00 175.10 173.67 1zye n THR 5 N 6.43 0.00 -3.91 3.92 -2.24 -1.10 -4.99 114.28 112.39 1zye n THR 5 Ca 0.40 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.96 1zye n THR 5 Cb 0.48 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 1zye n THR 5 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1zye s GLN 6 N 0.00 2.91 0.42 -0.78 -0.21 -1.12 -4.87 119.66 116.02 1zye s GLN 6 Ca 0.00 -1.12 -0.25 0.00 0.02 0.00 0.00 55.36 54.01 1zye s GLN 6 Cb 0.00 -2.59 -0.08 0.00 1.00 0.00 0.00 33.01 31.34 1zye s GLN 6 CO 0.00 0.24 1.31 -1.01 -2.12 0.00 0.00 175.29 173.71 1zye s HIS 7 N -2.19 2.75 0.46 0.91 3.76 -1.26 -1.73 115.29 118.00 1zye s HIS 7 Ca 0.37 1.40 -0.24 0.00 -0.15 0.00 0.00 55.06 56.45 1zye s HIS 7 Cb -0.07 -3.68 -0.07 0.00 1.11 0.00 0.00 32.58 29.87 1zye s HIS 7 CO 0.27 -2.18 1.28 0.00 -0.85 0.00 0.00 174.74 173.25 1zye s ALA 8 N -1.28 3.04 0.62 -1.40 0.00 0.26 -4.77 121.76 118.23 1zye s ALA 8 Ca 0.59 1.17 -0.18 0.00 0.00 0.00 0.00 51.96 53.54 1zye s ALA 8 Cb -0.38 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.22 1zye s ALA 8 CO 0.48 -0.94 0.94 -2.30 0.00 0.00 0.00 175.76 173.94 1zye n PRO 9 N -0.41 0.82 -2.08 0.00 -0.02 -1.26 -4.96 135.00 127.09 1zye n PRO 9 Ca 0.07 0.32 -0.36 0.00 -2.02 0.00 0.00 63.50 61.51 1zye n PRO 9 Cb 0.45 -2.15 0.02 0.00 -0.02 0.00 0.00 33.50 31.81 1zye n PRO 9 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1zye s TYR 10 N -1.55 2.47 -0.11 6.00 5.04 -1.26 -4.97 117.35 122.97 1zye s TYR 10 Ca 0.76 1.52 -0.10 0.00 -2.44 0.00 0.00 57.07 56.82 1zye s TYR 10 Cb -0.41 -3.42 0.03 0.00 0.35 0.00 0.00 41.96 38.51 1zye s TYR 10 CO 0.47 -2.03 0.29 -0.59 -1.34 0.00 0.00 175.55 172.35 1zye s PHE 11 N -1.66 -0.34 0.20 4.97 -0.12 -1.26 -5.00 117.98 114.77 1zye s PHE 11 Ca 0.76 0.81 0.04 0.00 -0.05 0.00 0.00 56.93 58.49 1zye s PHE 11 Cb -0.28 0.11 -0.05 0.00 -0.63 0.00 0.00 43.02 42.17 1zye s PHE 11 CO 0.31 -0.17 -0.05 0.21 -0.05 0.00 0.00 175.22 175.47 1zye s LYS 12 N 0.35 1.23 0.00 1.99 2.20 -1.26 -1.47 119.74 122.78 1zye s LYS 12 Ca -0.02 -1.58 0.00 0.00 -0.36 0.00 0.00 55.97 54.01 1zye s LYS 12 Cb -0.03 -0.64 0.00 0.00 -1.51 0.00 0.00 37.83 35.64 1zye s LYS 12 CO -0.01 -0.02 0.00 0.41 -0.36 0.00 0.00 175.35 175.37 1zye n GLY 13 N -0.33 2.81 3.71 5.54 0.00 -1.08 -5.00 105.19 110.83 1zye n GLY 13 Ca -0.07 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 1zye n GLY 13 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zye s THR 14 N -2.00 4.89 0.18 2.61 2.01 -1.26 -1.42 115.64 120.66 1zye s THR 14 Ca 0.00 1.91 0.11 0.00 0.31 0.00 0.00 61.69 64.02 1zye s THR 14 Cb 0.00 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 1zye s THR 14 CO 0.00 0.14 -0.23 0.00 -0.69 0.00 0.00 174.62 173.85 1zye s ALA 15 N 1.20 2.38 -0.75 7.40 0.00 -0.22 -0.92 121.76 130.85 1zye s ALA 15 Ca 0.48 -1.59 -0.23 0.00 0.00 0.00 0.00 51.96 50.62 1zye s ALA 15 Cb -0.20 -0.29 0.07 0.00 0.00 0.00 0.00 23.12 22.70 1zye s ALA 15 CO 0.23 0.39 1.08 0.08 0.00 0.00 0.00 175.76 177.54 1zye s VAL 16 N -1.72 4.26 -0.11 0.00 1.01 0.16 -0.91 120.40 123.10 1zye s VAL 16 Ca 0.19 -0.47 -0.07 0.00 0.00 0.00 0.00 61.98 61.63 1zye s VAL 16 Cb -0.08 -4.77 -0.06 0.00 0.00 0.00 0.00 36.38 31.48 1zye s VAL 16 CO 0.09 -1.57 0.13 0.58 0.00 0.00 0.00 175.10 174.33 1zye h VAL 17 N 6.03 0.36 0.00 2.92 2.07 -1.19 -3.01 116.25 123.43 1zye h VAL 17 Ca -0.17 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.07 1zye h VAL 17 Cb 1.05 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1zye h VAL 17 CO 1.21 0.12 0.00 -1.20 0.02 0.00 0.00 177.57 177.72 1zye n SER 18 N -4.73 0.00 -0.85 0.57 7.64 -1.26 -4.75 113.62 110.23 1zye n SER 18 Ca -0.03 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.97 1zye n SER 18 Cb 0.13 0.00 0.26 0.00 -1.01 0.00 0.00 64.21 63.59 1zye n SER 18 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zye n GLY 19 N 4.71 0.90 3.60 0.23 0.00 -1.26 -4.94 105.19 108.43 1zye n GLY 19 Ca 0.00 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.16 1zye n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1zye s GLU 20 N -1.81 2.14 0.30 1.61 2.02 -1.26 -5.09 118.70 116.61 1zye s GLU 20 Ca 0.34 -1.37 -0.27 0.00 0.02 0.00 0.00 54.97 53.69 1zye s GLU 20 Cb 0.21 -2.13 -0.10 0.00 0.10 0.00 0.00 34.13 32.21 1zye s GLU 20 CO 0.30 0.40 0.96 -0.06 0.02 0.00 0.00 175.26 176.88 1zye s PHE 21 N -2.05 3.73 -0.18 1.61 0.08 -1.26 -0.66 117.98 119.25 1zye s PHE 21 Ca 0.28 1.81 -0.13 0.00 0.12 0.00 0.00 56.93 59.00 1zye s PHE 21 Cb -0.07 -2.97 0.05 0.00 -0.57 0.00 0.00 43.02 39.46 1zye s PHE 21 CO 0.17 0.17 0.47 0.21 -0.10 0.00 0.00 175.22 176.15 1zye s LYS 22 N -1.82 0.50 -0.05 0.44 2.20 -0.09 -4.85 119.74 116.07 1zye s LYS 22 Ca 0.48 0.77 -0.30 0.00 -0.36 0.00 0.00 55.97 56.56 1zye s LYS 22 Cb -0.22 0.13 -0.05 0.00 -1.51 0.00 0.00 37.83 36.19 1zye s LYS 22 CO 0.27 -0.11 1.43 -1.21 -0.36 0.00 0.00 175.35 175.36 1zye s GLU 23 N 0.87 4.25 -0.01 4.03 0.41 -1.26 -1.05 118.70 125.94 1zye s GLU 23 Ca -0.05 1.95 0.04 0.00 -0.41 0.00 0.00 54.97 56.50 1zye s GLU 23 Cb -0.06 -3.70 -0.01 0.00 -1.78 0.00 0.00 34.13 28.58 1zye s GLU 23 CO -0.07 -0.66 -0.13 0.96 -0.49 0.00 0.00 175.26 174.87 1zye s ILE 24 N 2.99 1.03 0.24 -1.63 -4.36 -0.50 -4.96 121.20 114.00 1zye s ILE 24 Ca 0.64 -0.58 0.04 0.00 -0.26 0.00 0.00 60.65 60.49 1zye s ILE 24 Cb -0.30 -0.86 -0.05 0.00 1.25 0.00 0.00 42.46 42.50 1zye s ILE 24 CO 0.25 0.27 -0.01 -0.94 0.24 0.00 0.00 174.94 174.75 1zye s SER 25 N -0.35 1.95 0.43 4.36 1.04 -1.26 -2.64 113.70 117.22 1zye s SER 25 Ca 0.05 -1.22 0.20 0.00 0.48 0.00 0.00 55.95 55.46 1zye s SER 25 Cb -0.05 -0.01 1.14 0.00 0.10 0.00 0.00 66.02 67.20 1zye s SER 25 CO -0.00 -0.49 1.84 0.25 0.98 0.00 0.00 173.24 175.81 1zye h LEU 26 N 2.45 0.36 -1.99 2.42 5.85 -1.63 -0.51 115.31 122.25 1zye h LEU 26 Ca -0.38 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 1zye h LEU 26 Cb 1.22 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 1zye h LEU 26 CO 0.65 0.13 -0.01 0.44 -0.34 0.00 0.00 178.44 179.31 1zye h ASP 27 N 0.35 0.00 0.37 1.25 3.32 -1.96 -2.25 116.42 117.50 1zye h ASP 27 Ca 0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.54 1zye h ASP 27 Cb 1.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 1zye h ASP 27 CO -0.18 0.01 0.00 0.44 -1.72 0.00 0.00 179.24 177.79 1zye h ASP 28 N 0.00 0.00 -0.48 6.45 3.32 -1.49 -2.16 116.42 122.06 1zye h ASP 28 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1zye h ASP 28 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1zye h ASP 28 CO 0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 1zye n PHE 29 N -2.66 0.66 -1.67 4.55 3.72 -0.85 -4.96 117.46 116.26 1zye n PHE 29 Ca -0.01 -0.51 -0.45 0.00 -0.05 0.00 0.00 57.45 56.44 1zye n PHE 29 Cb 0.14 -0.03 -0.02 0.00 -0.94 0.00 0.00 39.48 38.63 1zye n PHE 29 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1zye n LYS 30 N 0.87 1.96 -1.10 -1.08 3.00 -0.82 -1.29 118.16 119.70 1zye n LYS 30 Ca 0.16 0.70 -0.03 0.00 -0.00 0.00 0.00 58.31 59.14 1zye n LYS 30 Cb 0.51 -2.32 -0.01 0.00 0.00 0.00 0.00 35.03 33.21 1zye n LYS 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1zye n GLY 31 N 1.90 0.43 3.34 3.14 0.00 0.26 -4.99 105.19 109.27 1zye n GLY 31 Ca 0.11 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 1zye n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zye s LYS 32 N -1.91 1.32 0.23 1.61 1.02 -0.41 -4.82 119.74 116.78 1zye s LYS 32 Ca 0.00 -1.55 -0.28 0.00 0.02 0.00 0.00 55.97 54.16 1zye s LYS 32 Cb 0.00 -1.18 -0.09 0.00 -0.52 0.00 0.00 37.83 36.05 1zye s LYS 32 CO 0.00 0.21 0.88 0.71 -0.92 0.00 0.00 175.35 176.23 1zye s TYR 33 N -2.75 3.92 -0.09 3.18 1.51 -0.84 -2.49 117.35 119.80 1zye s TYR 33 Ca 0.21 1.80 0.04 0.00 -1.01 0.00 0.00 57.07 58.11 1zye s TYR 33 Cb -0.02 -2.90 0.00 0.00 -0.11 0.00 0.00 41.96 38.94 1zye s TYR 33 CO 0.07 0.45 -0.21 -1.17 -1.11 0.00 0.00 175.55 173.58 1zye s LEU 34 N -1.29 1.98 -0.50 -1.29 0.20 0.57 0.02 118.68 118.37 1zye s LEU 34 Ca 0.40 -0.49 -0.10 0.00 0.69 0.00 0.00 54.13 54.64 1zye s LEU 34 Cb -0.24 -1.25 0.13 0.00 -0.43 0.00 0.00 46.19 44.40 1zye s LEU 34 CO 0.29 0.14 0.38 -0.69 -0.29 0.00 0.00 176.35 176.18 1zye s VAL 35 N 0.35 4.35 -0.23 1.68 1.01 -0.34 0.19 120.40 127.41 1zye s VAL 35 Ca -0.16 -1.83 -0.16 0.00 0.00 0.00 0.00 61.98 59.84 1zye s VAL 35 Cb -0.17 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1zye s VAL 35 CO 0.07 -0.80 0.40 -0.22 0.00 0.00 0.00 175.10 174.54 1zye s LEU 36 N 1.29 4.10 0.01 3.92 2.96 -0.48 -1.75 118.68 128.72 1zye s LEU 36 Ca 0.06 0.43 0.01 0.00 -0.22 0.00 0.00 54.13 54.41 1zye s LEU 36 Cb -0.26 -2.49 -0.01 0.00 0.50 0.00 0.00 46.19 43.94 1zye s LEU 36 CO -0.01 -0.13 -0.05 0.72 -1.32 0.00 0.00 176.35 175.56 1zye s PHE 37 N 1.68 0.41 -0.04 5.38 -0.71 -0.52 0.32 117.98 124.50 1zye s PHE 37 Ca 0.17 -0.19 -0.01 0.00 -1.04 0.00 0.00 56.93 55.86 1zye s PHE 37 Cb -0.15 -0.26 -0.04 0.00 -1.21 0.00 0.00 43.02 41.36 1zye s PHE 37 CO 0.09 -0.04 0.05 -0.06 -1.34 0.00 0.00 175.22 173.92 1zye s PHE 38 N -0.47 3.25 0.08 3.49 0.40 0.13 0.33 117.98 125.19 1zye s PHE 38 Ca -0.02 0.22 0.02 0.00 -0.60 0.00 0.00 56.93 56.55 1zye s PHE 38 Cb -0.04 -1.76 -0.04 0.00 0.51 0.00 0.00 43.02 41.69 1zye s PHE 38 CO -0.00 0.53 -0.08 1.52 0.70 0.00 0.00 175.22 177.89 1zye s TYR 39 N -1.06 0.87 0.00 0.36 1.13 0.92 -3.50 117.35 116.07 1zye s TYR 39 Ca 0.18 -0.75 0.00 0.00 -1.41 0.00 0.00 57.07 55.10 1zye s TYR 39 Cb -0.12 -0.50 0.00 0.00 -1.10 0.00 0.00 41.96 40.24 1zye s TYR 39 CO 0.09 -0.10 0.63 -2.30 -2.51 0.00 0.00 175.55 171.36 1zye n PRO 40 N 0.49 0.00 -3.91 -3.49 -0.02 -1.22 -4.21 135.00 122.64 1zye n PRO 40 Ca -0.16 0.18 -0.11 0.00 -2.02 0.00 0.00 63.50 61.40 1zye n PRO 40 Cb 0.58 -1.13 -0.11 0.00 -0.02 0.00 0.00 33.50 32.82 1zye n PRO 40 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1zye s LEU 41 N -1.92 1.87 0.89 2.45 1.43 -1.26 -3.80 118.68 118.35 1zye s LEU 41 Ca 0.00 -0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 52.78 1zye s LEU 41 Cb 0.00 0.32 0.13 0.00 0.03 0.00 0.00 46.19 46.68 1zye s LEU 41 CO 0.00 -0.24 1.16 -1.81 0.23 0.00 0.00 176.35 175.69 1zye s ASP 42 N -0.98 3.04 -1.96 2.29 1.01 -1.26 -3.81 116.67 114.99 1zye s ASP 42 Ca -0.11 2.22 0.00 0.00 0.71 0.00 0.00 52.55 55.38 1zye s ASP 42 Cb -0.06 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.29 1zye s ASP 42 CO 0.00 -3.03 0.00 0.49 0.21 0.00 0.00 175.17 172.84 1zye n PHE 43 N -4.07 -0.42 -3.74 4.23 3.72 -1.26 -4.98 117.46 110.94 1zye n PHE 43 Ca 0.12 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.18 1zye n PHE 43 Cb 0.52 -3.54 -0.05 0.00 -0.94 0.00 0.00 39.48 35.47 1zye n PHE 43 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1zye s THR 44 N -2.80 5.27 0.39 4.37 -4.23 -1.25 -5.00 115.64 112.40 1zye s THR 44 Ca 0.00 0.16 0.25 0.00 -1.18 0.00 0.00 61.69 60.91 1zye s THR 44 Cb 0.00 -3.58 0.26 0.00 1.34 0.00 0.00 72.50 70.52 1zye s THR 44 CO 0.00 0.32 2.03 -0.26 -0.54 0.00 0.00 174.62 176.17 1zye h PHE 45 N 3.81 0.00 0.00 3.99 0.04 -1.94 -3.12 116.94 119.72 1zye h PHE 45 Ca -0.49 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.07 1zye h PHE 45 Cb 1.19 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.31 1zye h PHE 45 CO 0.67 0.15 -1.07 0.28 -0.60 0.00 0.00 178.31 177.74 1zye h VAL 46 N 0.00 1.35 0.05 -0.55 2.07 -1.97 -3.41 116.25 113.78 1zye h VAL 46 Ca -0.00 -3.01 -0.24 0.00 0.82 0.00 0.00 66.70 64.27 1zye h VAL 46 Cb 0.39 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1zye h VAL 46 CO 0.02 0.77 -1.06 0.00 0.02 0.00 0.00 177.57 177.32 1zye h PRO 48 N 0.14 0.08 -0.38 0.00 0.13 -1.81 -3.05 132.00 127.11 1zye h PRO 48 Ca -0.09 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 64.94 1zye h PRO 48 Cb 1.73 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.85 1zye h PRO 48 CO 0.17 0.51 0.00 1.79 -0.23 0.00 0.00 178.00 180.25 1zye h THR 49 N 0.06 1.26 -0.36 1.56 1.35 -1.92 0.34 112.91 115.20 1zye h THR 49 Ca 0.00 -0.99 -0.13 0.00 -0.55 0.00 0.00 66.41 64.75 1zye h THR 49 Cb 0.82 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 1zye h THR 49 CO 0.06 0.33 -0.30 -0.08 -0.25 0.00 0.00 175.52 175.28 1zye h GLU 50 N 0.49 0.78 -0.38 4.72 4.81 -1.84 -1.83 114.58 121.33 1zye h GLU 50 Ca 0.11 -0.35 -0.11 0.00 -0.13 0.00 0.00 59.36 58.87 1zye h GLU 50 Cb 0.46 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1zye h GLU 50 CO 0.02 0.97 -0.21 0.82 -0.73 0.00 0.00 179.01 179.89 1zye h ILE 51 N 0.66 1.28 -0.23 2.32 2.04 -1.50 -3.05 117.51 119.03 1zye h ILE 51 Ca 0.08 -1.35 0.02 0.00 1.00 0.00 0.00 64.86 64.61 1zye h ILE 51 Cb 0.83 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 1zye h ILE 51 CO 0.07 0.45 0.09 0.40 0.00 0.00 0.00 178.15 179.16 1zye h ILE 52 N 0.61 0.96 -0.83 -0.67 2.04 -0.86 -1.93 117.51 116.83 1zye h ILE 52 Ca 0.08 -0.07 0.20 0.00 1.00 0.00 0.00 64.86 66.07 1zye h ILE 52 Cb 0.76 0.73 -0.13 0.00 -0.74 0.00 0.00 36.82 37.45 1zye h ILE 52 CO 0.06 0.04 0.24 0.00 0.00 0.00 0.00 178.15 178.49 1zye h ALA 53 N 1.14 1.17 -0.42 1.87 0.00 -1.32 0.17 119.26 121.87 1zye h ALA 53 Ca 0.10 0.19 -0.15 0.00 0.00 0.00 0.00 54.91 55.05 1zye h ALA 53 Cb 0.06 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1zye h ALA 53 CO -0.09 -0.39 -0.33 0.74 0.00 0.00 0.00 179.25 179.18 1zye h PHE 54 N 0.27 1.13 -0.75 0.00 0.04 -1.36 -2.81 116.94 113.46 1zye h PHE 54 Ca 0.50 -0.32 0.02 0.00 2.80 0.00 0.00 57.97 60.97 1zye h PHE 54 Cb 0.93 -0.25 -0.04 0.00 2.20 0.00 0.00 35.95 38.79 1zye h PHE 54 CO -0.24 1.15 0.50 1.03 -0.60 0.00 0.00 178.31 180.14 1zye h SER 55 N 0.80 0.82 0.29 2.17 0.87 0.05 -1.25 113.55 117.30 1zye h SER 55 Ca 0.08 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 1zye h SER 55 Cb 0.92 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.69 1zye h SER 55 CO 0.09 0.57 -0.14 0.44 -0.53 0.00 0.00 176.83 177.26 1zye h ASP 56 N 0.96 -0.33 0.00 6.23 3.32 -1.13 -3.25 116.42 122.21 1zye h ASP 56 Ca 0.29 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1zye h ASP 56 Cb -0.01 0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1zye h ASP 56 CO -0.08 -0.14 0.00 0.29 -1.72 0.00 0.00 179.24 177.59 1zye n LYS 57 N -3.60 0.55 -0.15 3.56 4.76 -1.07 -4.16 118.16 118.06 1zye n LYS 57 Ca -0.05 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.36 1zye n LYS 57 Cb 0.16 -1.04 0.05 0.00 -1.84 0.00 0.00 35.03 32.36 1zye n LYS 57 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1zye h ALA 58 N 2.18 0.43 -0.32 7.82 0.00 -1.26 -1.73 119.26 126.37 1zye h ALA 58 Ca 0.00 0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1zye h ALA 58 Cb 0.00 0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1zye h ALA 58 CO 0.00 -0.40 -0.03 0.66 0.00 0.00 0.00 179.25 179.48 1zye h SER 59 N 0.09 -0.20 -0.90 0.00 4.64 -1.85 -1.07 113.55 114.27 1zye h SER 59 Ca 0.24 0.08 0.20 0.00 -0.47 0.00 0.00 61.79 61.84 1zye h SER 59 Cb 0.36 0.16 -0.17 0.00 -0.31 0.00 0.00 62.40 62.44 1zye h SER 59 CO -0.42 -0.06 -0.15 -0.62 -0.87 0.00 0.00 176.83 174.70 1zye n GLU 60 N -5.21 -0.08 0.01 4.77 1.02 -0.66 -0.51 120.64 119.98 1zye n GLU 60 Ca 0.01 1.38 -0.12 0.00 -0.02 0.00 0.00 57.16 58.41 1zye n GLU 60 Cb 0.18 -2.10 -0.08 0.00 -0.02 0.00 0.00 31.44 29.42 1zye n GLU 60 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1zye h PHE 61 N 0.00 0.04 -0.90 -0.32 -1.00 -1.14 -2.98 116.94 110.64 1zye h PHE 61 Ca 0.46 -0.00 0.12 0.00 2.81 0.00 0.00 57.97 61.36 1zye h PHE 61 Cb 0.79 -0.01 -0.07 0.00 3.61 0.00 0.00 35.95 40.27 1zye h PHE 61 CO -0.62 0.22 0.58 0.45 -1.61 0.00 0.00 178.31 177.33 1zye h HIS 62 N -0.15 0.91 0.31 -0.55 3.86 0.26 -0.48 115.15 119.32 1zye h HIS 62 Ca 0.01 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 1zye h HIS 62 Cb 0.20 -0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.37 1zye h HIS 62 CO -0.01 0.38 -0.18 -0.44 0.86 0.00 0.00 177.93 178.54 1zye h ASP 63 N 0.81 -0.45 0.00 2.45 3.45 -0.75 -0.95 116.42 120.97 1zye h ASP 63 Ca 0.43 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.92 1zye h ASP 63 Cb 0.55 0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.45 1zye h ASP 63 CO -0.20 -0.29 0.00 1.33 -1.57 0.00 0.00 179.24 178.51 1zye n VAL 64 N -5.31 0.00 -2.72 -1.35 0.24 -0.73 -4.84 118.33 103.63 1zye n VAL 64 Ca -0.10 0.00 -0.08 0.00 -2.04 0.00 0.00 64.34 62.12 1zye n VAL 64 Cb 0.22 -0.30 0.04 0.00 -1.47 0.00 0.00 33.84 32.33 1zye n VAL 64 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1zye n ASN 65 N -0.09 -2.37 -3.77 -1.34 5.15 -0.36 -4.93 115.26 107.56 1zye n ASN 65 Ca 0.00 -0.28 -0.18 0.00 -0.60 0.00 0.00 54.58 53.52 1zye n ASN 65 Cb 0.13 -2.61 -0.17 0.00 -0.53 0.00 0.00 39.78 36.61 1zye n ASN 65 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1zye s GLU 67 N 1.42 3.61 -0.09 0.00 0.41 0.10 -2.84 118.70 121.32 1zye s GLU 67 Ca -0.04 0.12 -0.00 0.00 -0.41 0.00 0.00 54.97 54.64 1zye s GLU 67 Cb -0.13 -2.50 0.02 0.00 -1.78 0.00 0.00 34.13 29.75 1zye s GLU 67 CO -0.03 0.01 -0.05 0.08 -0.49 0.00 0.00 175.26 174.78 1zye s VAL 68 N -2.40 0.78 -0.10 2.63 1.01 -1.26 -1.19 120.40 119.86 1zye s VAL 68 Ca 0.46 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 62.31 1zye s VAL 68 Cb -0.10 -0.84 0.02 0.00 0.00 0.00 0.00 36.38 35.46 1zye s VAL 68 CO 0.36 0.32 -0.13 0.54 0.00 0.00 0.00 175.10 176.19 1zye s VAL 69 N 1.69 1.29 0.28 2.92 0.11 -0.72 -2.67 120.40 123.31 1zye s VAL 69 Ca 0.03 -0.52 -0.07 0.00 -2.93 0.00 0.00 61.98 58.49 1zye s VAL 69 Cb -0.13 -1.20 -0.06 0.00 -1.53 0.00 0.00 36.38 33.46 1zye s VAL 69 CO -0.06 0.40 0.57 0.00 -3.33 0.00 0.00 175.10 172.68 1zye s ALA 70 N 1.04 3.58 -0.01 1.54 0.00 -0.44 -1.43 121.76 126.05 1zye s ALA 70 Ca -0.07 -0.45 -0.08 0.00 0.00 0.00 0.00 51.96 51.37 1zye s ALA 70 Cb -0.15 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 20.61 1zye s ALA 70 CO -0.01 0.30 0.15 0.54 0.00 0.00 0.00 175.76 176.73 1zye s VAL 71 N -2.04 0.07 0.15 0.00 0.11 0.15 -1.21 120.40 117.63 1zye s VAL 71 Ca 0.45 -0.60 -0.20 0.00 -2.93 0.00 0.00 61.98 58.70 1zye s VAL 71 Cb -0.11 -0.42 0.06 0.00 -1.53 0.00 0.00 36.38 34.38 1zye s VAL 71 CO 0.28 -0.33 0.52 -0.94 -3.33 0.00 0.00 175.10 171.30 1zye s SER 72 N -1.21 -0.44 0.00 3.54 1.04 -1.19 -0.06 113.70 115.39 1zye s SER 72 Ca -0.13 -0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.19 1zye s SER 72 Cb -0.07 0.55 0.06 0.00 0.10 0.00 0.00 66.02 66.66 1zye s SER 72 CO 0.02 -0.93 0.41 1.33 0.98 0.00 0.00 173.24 175.04 1zye n VAL 73 N -0.32 0.00 -2.21 5.02 0.24 -1.25 -2.09 118.33 117.72 1zye n VAL 73 Ca -0.17 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.85 1zye n VAL 73 Cb 0.64 -0.38 0.02 0.00 -1.47 0.00 0.00 33.84 32.65 1zye n VAL 73 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1zye s ASP 74 N -1.70 5.98 0.63 -1.34 1.01 -1.26 -4.01 116.67 115.99 1zye s ASP 74 Ca 0.02 1.08 -0.18 0.00 0.71 0.00 0.00 52.55 54.18 1zye s ASP 74 Cb 0.01 -2.16 -0.02 0.00 1.01 0.00 0.00 42.92 41.76 1zye s ASP 74 CO 0.01 -0.90 1.23 -0.94 0.21 0.00 0.00 175.17 174.78 1zye s SER 75 N -4.21 4.88 0.48 0.27 1.04 -1.26 -3.48 113.70 111.41 1zye s SER 75 Ca 0.53 2.44 0.32 0.00 0.48 0.00 0.00 55.95 59.72 1zye s SER 75 Cb -0.11 -2.60 1.51 0.00 0.10 0.00 0.00 66.02 64.92 1zye s SER 75 CO 0.49 -1.81 1.97 1.12 0.98 0.00 0.00 173.24 175.99 1zye h HIS 76 N 0.59 0.00 -0.25 5.02 2.07 -1.93 -2.28 115.15 118.38 1zye h HIS 76 Ca -0.50 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 56.92 1zye h HIS 76 Cb 1.31 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.28 1zye h HIS 76 CO 0.45 0.00 -0.23 0.74 -3.07 0.00 0.00 177.93 175.82 1zye h PHE 77 N 0.00 0.71 -0.90 6.12 0.04 -1.99 -2.13 116.94 118.79 1zye h PHE 77 Ca 0.00 -0.21 0.04 0.00 2.80 0.00 0.00 57.97 60.60 1zye h PHE 77 Cb 0.28 -0.15 -0.05 0.00 2.20 0.00 0.00 35.95 38.23 1zye h PHE 77 CO 0.00 0.91 0.59 0.77 -0.60 0.00 0.00 178.31 179.98 1zye h SER 78 N 0.30 0.96 -0.21 2.17 0.02 -1.80 -0.84 113.55 114.15 1zye h SER 78 Ca 0.04 -0.01 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1zye h SER 78 Cb 0.78 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.09 1zye h SER 78 CO 0.06 0.65 0.12 0.45 -1.14 0.00 0.00 176.83 176.98 1zye h HIS 79 N 1.11 0.23 0.67 3.45 3.86 -1.28 -1.87 115.15 121.32 1zye h HIS 79 Ca 0.36 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.55 1zye h HIS 79 Cb 0.04 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.43 1zye h HIS 79 CO -0.00 0.14 -0.38 1.25 0.86 0.00 0.00 177.93 179.80 1zye h LEU 80 N 0.26 -0.95 -0.93 2.43 5.85 -1.04 -1.01 115.31 119.92 1zye h LEU 80 Ca 0.08 0.05 0.19 0.00 0.84 0.00 0.00 57.88 59.04 1zye h LEU 80 Cb -0.01 0.27 -0.17 0.00 0.37 0.00 0.00 40.66 41.11 1zye h LEU 80 CO -0.03 -0.61 -0.20 0.00 -0.34 0.00 0.00 178.44 177.26 1zye h ALA 81 N -0.71 0.68 -0.16 1.25 0.00 -1.14 0.24 119.26 119.41 1zye h ALA 81 Ca -0.09 0.35 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1zye h ALA 81 Cb 0.78 0.68 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1zye h ALA 81 CO 0.10 -0.41 0.02 2.35 0.00 0.00 0.00 179.25 181.31 1zye h TRP 82 N 0.00 0.30 -0.65 0.00 7.01 -1.08 -0.72 115.95 120.82 1zye h TRP 82 Ca 0.46 -0.05 0.13 0.00 2.11 0.00 0.00 58.89 61.54 1zye h TRP 82 Cb 0.74 -0.08 -0.12 0.00 -2.10 0.00 0.00 29.16 27.59 1zye h TRP 82 CO -0.68 0.46 -0.17 0.82 -2.79 0.00 0.00 178.44 176.07 1zye h ILE 83 N 0.05 0.33 0.00 2.65 2.04 -0.32 -1.38 117.51 120.88 1zye h ILE 83 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1zye h ILE 83 Cb 0.33 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1zye h ILE 83 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.74 1zye n ASN 84 N -5.44 0.00 -4.67 1.72 3.02 0.75 -2.03 115.26 108.61 1zye n ASN 84 Ca 0.08 -0.66 -0.41 0.00 -0.03 0.00 0.00 54.58 53.55 1zye n ASN 84 Cb 0.34 -0.03 -0.04 0.00 -0.61 0.00 0.00 39.78 39.44 1zye n ASN 84 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1zye s THR 85 N -2.07 4.87 0.40 3.41 2.01 -0.39 -4.96 115.64 118.91 1zye s THR 85 Ca 0.34 1.64 -0.27 0.00 0.31 0.00 0.00 61.69 63.72 1zye s THR 85 Cb 0.16 -4.14 -0.09 0.00 0.01 0.00 0.00 72.50 68.44 1zye s THR 85 CO 0.29 0.02 1.36 -2.84 -0.69 0.00 0.00 174.62 172.75 1zye s PRO 86 N 2.18 4.01 0.38 4.92 0.02 -1.26 -1.10 135.00 144.15 1zye s PRO 86 Ca 0.38 2.29 0.13 0.00 0.02 0.00 0.00 61.00 63.83 1zye s PRO 86 Cb -0.16 -2.83 0.96 0.00 0.02 0.00 0.00 34.50 32.48 1zye s PRO 86 CO 0.12 -0.50 1.83 0.00 -0.33 0.00 0.00 177.00 178.12 1zye h ARG 87 N 2.80 0.52 -0.94 5.54 3.08 -1.85 -1.56 114.38 121.96 1zye h ARG 87 Ca -0.50 -0.03 0.20 0.00 0.07 0.00 0.00 59.98 59.72 1zye h ARG 87 Cb 1.24 -0.12 -0.18 0.00 0.08 0.00 0.00 29.97 31.00 1zye h ARG 87 CO 0.63 0.35 -0.18 -0.22 -1.07 0.00 0.00 179.97 179.48 1zye h LYS 88 N 0.54 0.01 -0.99 0.04 3.64 -1.90 -2.04 116.57 115.87 1zye h LYS 88 Ca 0.50 -0.00 -0.67 0.00 -1.27 0.00 0.00 60.65 59.21 1zye h LYS 88 Cb 1.06 -0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 32.58 1zye h LYS 88 CO -0.24 0.00 0.79 0.09 -2.27 0.00 0.00 179.45 177.82 1zye n ASN 89 N -5.57 7.45 0.00 4.20 3.02 -0.60 -4.88 115.26 118.88 1zye n ASN 89 Ca 0.16 -3.78 0.00 0.00 -0.03 0.00 0.00 54.58 50.93 1zye n ASN 89 Cb 0.52 -0.94 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 1zye n ASN 89 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zye n GLY 90 N -0.92 1.33 0.00 7.41 0.00 -0.77 -4.94 105.19 107.31 1zye n GLY 90 Ca 0.62 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1zye n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1zye n GLY 91 N -2.00 -2.02 0.03 -0.02 0.00 -1.11 -4.90 105.19 95.17 1zye n GLY 91 Ca 0.00 -1.46 -0.02 0.00 0.00 0.00 0.00 46.02 44.54 1zye n GLY 91 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1zye n LEU 92 N 0.00 0.00 0.00 0.99 4.77 -0.97 -4.51 117.00 117.29 1zye n LEU 92 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1zye n LEU 92 Cb 0.00 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1zye n LEU 92 CO 0.00 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.81 1zye n GLY 93 N 2.38 -0.52 3.48 -0.72 0.00 -0.25 -4.73 105.19 104.83 1zye n GLY 93 Ca -0.10 -0.96 -0.50 0.00 0.00 0.00 0.00 46.02 44.47 1zye n GLY 93 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1zye n HIS 94 N -1.57 0.34 -4.77 1.61 -0.00 -1.26 -4.66 115.22 104.92 1zye n HIS 94 Ca 0.00 0.89 -0.25 0.00 -0.00 0.00 0.00 57.72 58.36 1zye n HIS 94 Cb 0.00 -2.09 -0.16 0.00 -0.00 0.00 0.00 29.99 27.74 1zye n HIS 94 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.34 177.75 1zye s MET 95 N -0.76 1.58 0.00 1.57 0.00 -1.26 -5.03 119.30 115.40 1zye s MET 95 Ca 0.70 -0.57 0.20 0.00 0.00 0.00 0.00 55.69 56.03 1zye s MET 95 Cb -0.95 -1.42 -0.12 0.00 0.00 0.00 0.00 34.83 32.35 1zye s MET 95 CO 0.56 0.25 0.93 0.09 0.00 0.00 0.00 175.02 176.85 1zye n ASN 96 N 3.05 1.42 -4.52 1.11 3.02 -1.26 -4.96 115.26 113.12 1zye n ASN 96 Ca -0.17 -1.21 -0.27 0.00 -0.03 0.00 0.00 54.58 52.89 1zye n ASN 96 Cb 0.53 0.75 -0.10 0.00 -0.61 0.00 0.00 39.78 40.35 1zye n ASN 96 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 1zye s ILE 97 N -2.61 2.92 0.29 2.41 -4.36 -1.26 -5.00 121.20 113.60 1zye s ILE 97 Ca 0.12 -1.70 -0.29 0.00 -0.26 0.00 0.00 60.65 58.52 1zye s ILE 97 Cb 0.16 -2.41 -0.10 0.00 1.25 0.00 0.00 42.46 41.36 1zye s ILE 97 CO 0.68 -0.06 1.31 0.00 0.24 0.00 0.00 174.94 177.11 1zye s ALA 98 N -1.56 3.51 -0.38 2.27 0.00 -1.09 -4.90 121.76 119.61 1zye s ALA 98 Ca 0.22 1.22 -0.04 0.00 0.00 0.00 0.00 51.96 53.36 1zye s ALA 98 Cb -0.09 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.63 1zye s ALA 98 CO 0.13 -0.60 0.15 -0.51 0.00 0.00 0.00 175.76 174.93 1zye s LEU 99 N -1.27 4.80 -0.07 0.00 1.02 -1.14 -1.33 118.68 120.69 1zye s LEU 99 Ca 0.51 -1.65 -0.18 0.00 0.02 0.00 0.00 54.13 52.84 1zye s LEU 99 Cb -0.39 -1.83 -0.05 0.00 0.02 0.00 0.00 46.19 43.94 1zye s LEU 99 CO 0.48 -0.45 0.48 -0.22 0.02 0.00 0.00 176.35 176.66 1zye s LEU 100 N 1.25 4.34 -0.10 1.79 2.96 -0.35 0.40 118.68 128.97 1zye s LEU 100 Ca 0.03 0.90 -0.20 0.00 -0.22 0.00 0.00 54.13 54.64 1zye s LEU 100 Cb -0.22 -2.70 -0.04 0.00 0.50 0.00 0.00 46.19 43.73 1zye s LEU 100 CO -0.01 0.09 0.54 -0.55 -1.32 0.00 0.00 176.35 175.10 1zye s SER 101 N 0.12 6.77 -0.61 3.68 0.15 -0.10 -3.17 113.70 120.54 1zye s SER 101 Ca 0.26 0.92 0.05 0.00 0.70 0.00 0.00 55.95 57.88 1zye s SER 101 Cb -0.16 -2.32 0.32 0.00 -1.71 0.00 0.00 66.02 62.15 1zye s SER 101 CO 0.12 -0.04 0.95 -0.67 1.20 0.00 0.00 173.24 174.80 1zye n ASP 102 N 3.73 4.48 -0.13 5.45 2.03 -0.89 -4.35 116.55 126.87 1zye n ASP 102 Ca -0.05 -3.65 0.05 0.00 0.52 0.00 0.00 54.79 51.66 1zye n ASP 102 Cb 0.51 -0.60 0.36 0.00 -0.72 0.00 0.00 41.12 40.67 1zye n ASP 102 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1zye h LEU 103 N 3.25 0.63 -0.95 -2.67 6.46 -1.70 -0.96 115.31 119.38 1zye h LEU 103 Ca 0.16 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.91 1zye h LEU 103 Cb 0.52 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.31 1zye h LEU 103 CO 0.84 0.43 0.00 0.35 -0.62 0.00 0.00 178.44 179.44 1zye n THR 104 N -4.47 0.30 -0.43 1.05 -2.24 -1.26 -4.88 114.28 102.36 1zye n THR 104 Ca 0.08 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1zye n THR 104 Cb 0.16 0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.57 1zye n THR 104 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1zye n LYS 105 N 0.22 0.00 0.20 -0.78 5.02 -0.36 -4.77 118.16 117.69 1zye n LYS 105 Ca 0.11 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.44 1zye n LYS 105 Cb 0.24 -4.23 0.42 0.00 -0.02 0.00 0.00 35.03 31.45 1zye n LYS 105 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1zye h GLN 106 N 0.00 0.00 0.15 1.97 1.08 -1.90 -0.59 115.11 115.82 1zye h GLN 106 Ca 0.00 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.94 1zye h GLN 106 Cb 0.00 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.44 1zye h GLN 106 CO 0.00 0.31 -1.25 0.82 -0.95 0.00 0.00 178.83 177.76 1zye h ILE 107 N 0.00 1.22 -0.57 2.54 2.04 -1.89 -1.34 117.51 119.51 1zye h ILE 107 Ca -0.00 -2.49 -0.04 0.00 1.00 0.00 0.00 64.86 63.32 1zye h ILE 107 Cb 0.59 2.93 -0.03 0.00 -0.74 0.00 0.00 36.82 39.57 1zye h ILE 107 CO 0.04 0.74 0.18 0.28 0.00 0.00 0.00 178.15 179.38 1zye h SER 108 N -0.23 0.79 0.05 1.72 0.02 -1.91 -1.12 113.55 112.88 1zye h SER 108 Ca -0.25 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 60.60 1zye h SER 108 Cb 1.80 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 64.11 1zye h SER 108 CO 0.13 0.75 -0.19 -0.09 -1.14 0.00 0.00 176.83 176.29 1zye h ARG 109 N 0.84 -0.32 0.00 3.45 2.43 -1.04 -0.60 114.38 119.13 1zye h ARG 109 Ca 0.19 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.37 1zye h ARG 109 Cb 0.24 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1zye h ARG 109 CO -0.01 -0.21 -0.07 -0.44 -1.51 0.00 0.00 179.97 177.73 1zye h ASP 110 N -0.33 0.00 -0.08 -3.80 3.32 -0.66 -0.48 116.42 114.38 1zye h ASP 110 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1zye h ASP 110 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1zye h ASP 110 CO -0.14 0.07 0.00 -1.22 -1.72 0.00 0.00 179.24 176.23 1zye n TYR 111 N -3.15 0.10 -3.77 4.55 4.02 -0.48 -4.55 117.16 113.87 1zye n TYR 111 Ca 0.02 -0.05 -0.27 0.00 -0.01 0.00 0.00 57.90 57.59 1zye n TYR 111 Cb 0.42 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.79 1zye n TYR 111 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1zye n GLY 112 N 1.10 -0.49 0.20 2.72 0.00 -0.19 -4.84 105.19 103.69 1zye n GLY 112 Ca 0.18 0.21 0.02 0.00 0.00 0.00 0.00 46.02 46.42 1zye n GLY 112 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1zye n VAL 113 N -4.74 0.80 -3.11 1.61 0.24 -0.26 -5.03 118.33 107.85 1zye n VAL 113 Ca -0.01 -0.90 -0.42 0.00 -2.04 0.00 0.00 64.34 60.97 1zye n VAL 113 Cb 0.56 0.61 -0.07 0.00 -1.47 0.00 0.00 33.84 33.48 1zye n VAL 113 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1zye s LEU 114 N -0.86 4.29 -0.42 1.34 2.96 -1.07 -0.20 118.68 124.72 1zye s LEU 114 Ca 0.07 0.07 -0.29 0.00 -0.22 0.00 0.00 54.13 53.76 1zye s LEU 114 Cb 0.04 -2.78 0.01 0.00 0.50 0.00 0.00 46.19 43.96 1zye s LEU 114 CO 0.05 -0.62 1.35 -0.76 -1.32 0.00 0.00 176.35 175.05 1zye s LEU 115 N 2.73 3.61 0.23 -0.68 1.02 -0.08 -4.85 118.68 120.66 1zye s LEU 115 Ca 0.24 0.78 -0.03 0.00 0.02 0.00 0.00 54.13 55.14 1zye s LEU 115 Cb -0.14 -3.54 0.23 0.00 0.02 0.00 0.00 46.19 42.76 1zye s LEU 115 CO 0.16 -1.38 1.64 -0.33 0.02 0.00 0.00 176.35 176.46 1zye h GLU 116 N 10.33 0.69 0.00 1.70 4.39 -1.94 -0.87 114.58 128.88 1zye h GLU 116 Ca -0.27 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 59.15 1zye h GLU 116 Cb 1.10 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1zye h GLU 116 CO 1.09 0.87 0.00 0.41 -1.16 0.00 0.00 179.01 180.23 1zye n GLY 117 N -0.23 -3.33 0.21 -3.84 0.00 -1.26 -2.89 105.19 93.85 1zye n GLY 117 Ca -0.00 0.56 0.11 0.00 0.00 0.00 0.00 46.02 46.68 1zye n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zye h PRO 118 N 0.00 0.00 -0.77 1.61 0.14 -1.99 -3.48 132.00 127.51 1zye h PRO 118 Ca 0.00 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.14 1zye h PRO 118 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.14 1zye h PRO 118 CO 0.00 0.13 0.00 0.41 0.14 0.00 0.00 178.00 178.68 1zye n GLY 119 N 0.86 0.91 3.24 1.56 0.00 -0.35 -5.10 105.19 106.31 1zye n GLY 119 Ca 0.03 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 1zye n GLY 119 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1zye s LEU 120 N -0.77 1.38 0.25 0.99 2.34 -1.09 -4.92 118.68 116.87 1zye s LEU 120 Ca 0.00 -0.96 -0.12 0.00 0.06 0.00 0.00 54.13 53.12 1zye s LEU 120 Cb 0.00 0.82 -0.08 0.00 -0.56 0.00 0.00 46.19 46.37 1zye s LEU 120 CO 0.00 -0.80 0.61 0.00 -1.06 0.00 0.00 176.35 175.10 1zye s ALA 121 N -3.98 3.49 0.95 1.48 0.00 -1.26 -0.90 121.76 121.55 1zye s ALA 121 Ca 0.17 -0.16 -0.13 0.00 0.00 0.00 0.00 51.96 51.84 1zye s ALA 121 Cb 0.05 -2.55 0.16 0.00 0.00 0.00 0.00 23.12 20.79 1zye s ALA 121 CO -0.02 0.45 1.12 -0.51 0.00 0.00 0.00 175.76 176.81 1zye s LEU 122 N -2.79 1.81 -1.30 0.00 1.43 0.72 -3.42 118.68 115.12 1zye s LEU 122 Ca 0.49 1.02 -0.15 0.00 -1.03 0.00 0.00 54.13 54.45 1zye s LEU 122 Cb -0.11 -3.27 0.10 0.00 0.03 0.00 0.00 46.19 42.94 1zye s LEU 122 CO 0.20 -2.82 1.76 0.54 0.23 0.00 0.00 176.35 176.25 1zye n ARG 123 N -3.95 3.23 -4.02 1.70 1.74 -1.00 -4.25 116.66 110.11 1zye n ARG 123 Ca 0.06 -3.35 -0.33 0.00 -0.77 0.00 0.00 57.85 53.47 1zye n ARG 123 Cb 0.59 -3.28 -0.06 0.00 -1.02 0.00 0.00 32.46 28.69 1zye n ARG 123 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1zye s GLY 124 N 3.32 2.08 -0.04 -0.13 0.00 -1.23 -0.61 107.32 110.71 1zye s GLY 124 Ca 0.48 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1zye s GLY 124 CO 0.02 -0.75 -0.02 -2.27 0.00 0.00 0.00 173.10 170.08 1zye s LEU 125 N -1.92 1.17 -0.06 0.66 0.20 0.20 0.20 118.68 119.13 1zye s LEU 125 Ca 0.26 -0.08 0.04 0.00 0.69 0.00 0.00 54.13 55.04 1zye s LEU 125 Cb -0.12 -0.35 -0.02 0.00 -0.43 0.00 0.00 46.19 45.26 1zye s LEU 125 CO 0.17 -0.09 -0.19 -0.36 -0.29 0.00 0.00 176.35 175.59 1zye s PHE 126 N 1.09 2.59 -0.37 5.38 0.08 0.15 -1.16 117.98 125.74 1zye s PHE 126 Ca -0.09 -0.46 -0.12 0.00 0.12 0.00 0.00 56.93 56.39 1zye s PHE 126 Cb -0.14 -1.64 0.02 0.00 -0.57 0.00 0.00 43.02 40.69 1zye s PHE 126 CO -0.01 -0.04 0.22 0.42 -0.10 0.00 0.00 175.22 175.71 1zye s ILE 127 N -0.35 4.78 -0.18 0.64 1.01 0.21 -1.38 121.20 125.93 1zye s ILE 127 Ca 0.03 -0.71 -0.05 0.00 0.00 0.00 0.00 60.65 59.92 1zye s ILE 127 Cb -0.12 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 1zye s ILE 127 CO 0.02 -0.19 -0.01 -0.63 0.00 0.00 0.00 174.94 174.13 1zye s ILE 128 N 1.60 4.09 0.65 2.92 1.01 0.13 0.37 121.20 131.97 1zye s ILE 128 Ca 0.03 -0.28 -0.09 0.00 0.00 0.00 0.00 60.65 60.31 1zye s ILE 128 Cb -0.19 -2.82 0.01 0.00 0.01 0.00 0.00 42.46 39.47 1zye s ILE 128 CO 0.08 0.46 1.02 1.51 0.00 0.00 0.00 174.94 178.01 1zye s ASP 129 N 0.58 5.58 0.64 3.58 1.47 0.11 -0.31 116.67 128.31 1zye s ASP 129 Ca -0.01 1.00 0.18 0.00 1.18 0.00 0.00 52.55 54.90 1zye s ASP 129 Cb -0.14 -1.90 0.82 0.00 -0.34 0.00 0.00 42.92 41.36 1zye s ASP 129 CO 0.02 -1.19 1.42 1.55 0.68 0.00 0.00 175.17 177.65 1zye h PRO 130 N -0.44 0.00 -0.36 2.11 0.13 -1.78 0.36 132.00 132.02 1zye h PRO 130 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1zye h PRO 130 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1zye h PRO 130 CO 0.63 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.49 1zye n ASN 131 N -2.96 2.95 -0.32 1.44 4.13 -1.26 -0.57 115.26 118.67 1zye n ASN 131 Ca 0.07 -1.92 -0.03 0.00 1.68 0.00 0.00 54.58 54.37 1zye n ASN 131 Cb 0.95 -0.23 -0.00 0.00 -1.54 0.00 0.00 39.78 38.96 1zye n ASN 131 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1zye n GLY 132 N 1.40 0.31 3.73 7.41 0.00 0.13 -4.99 105.19 113.17 1zye n GLY 132 Ca 0.18 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 45.06 1zye n GLY 132 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zye s VAL 133 N -2.14 5.31 -0.12 1.61 1.01 -1.25 -0.58 120.40 124.24 1zye s VAL 133 Ca 0.00 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 1zye s VAL 133 Cb 0.00 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 1zye s VAL 133 CO 0.00 0.46 1.19 0.27 0.00 0.00 0.00 175.10 177.02 1zye s ILE 134 N 0.23 4.36 -0.11 2.22 -5.25 -0.70 -0.71 121.20 121.23 1zye s ILE 134 Ca 0.08 1.66 0.20 0.00 -0.99 0.00 0.00 60.65 61.60 1zye s ILE 134 Cb -0.11 -4.07 -0.29 0.00 2.95 0.00 0.00 42.46 40.94 1zye s ILE 134 CO -0.01 -0.08 0.31 0.29 -1.79 0.00 0.00 174.94 173.66 1zye n LYS 135 N 5.88 0.67 -3.82 0.37 4.76 0.16 -2.70 118.16 123.48 1zye n LYS 135 Ca 0.12 -0.10 -0.12 0.00 -2.87 0.00 0.00 58.31 55.34 1zye n LYS 135 Cb 0.46 -1.53 -0.11 0.00 -1.84 0.00 0.00 35.03 32.01 1zye n LYS 135 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1zye s HIS 136 N -3.04 -0.13 -0.01 2.13 5.04 -1.16 -4.97 115.29 113.15 1zye s HIS 136 Ca -0.09 0.28 0.01 0.00 -1.54 0.00 0.00 55.06 53.73 1zye s HIS 136 Cb 0.10 0.04 0.01 0.00 0.04 0.00 0.00 32.58 32.77 1zye s HIS 136 CO 0.87 -0.22 -0.02 -0.48 -2.34 0.00 0.00 174.74 172.55 1zye s LEU 137 N -0.64 1.73 -0.03 8.88 0.05 -1.26 -0.62 118.68 126.79 1zye s LEU 137 Ca -0.07 -0.05 0.05 0.00 0.05 0.00 0.00 54.13 54.10 1zye s LEU 137 Cb -0.04 -0.19 -0.03 0.00 -2.05 0.00 0.00 46.19 43.88 1zye s LEU 137 CO 0.01 -0.01 -0.16 -0.44 -0.55 0.00 0.00 176.35 175.21 1zye s SER 138 N 0.29 3.92 -0.09 1.48 0.01 -0.31 -4.96 113.70 114.04 1zye s SER 138 Ca -0.03 -0.26 -0.01 0.00 1.31 0.00 0.00 55.95 56.96 1zye s SER 138 Cb -0.06 -0.76 0.03 0.00 0.21 0.00 0.00 66.02 65.44 1zye s SER 138 CO -0.01 0.32 -0.02 -0.69 0.41 0.00 0.00 173.24 173.26 1zye s VAL 139 N -0.77 0.57 -0.06 3.43 1.01 -1.26 -0.62 120.40 122.70 1zye s VAL 139 Ca 0.12 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.05 1zye s VAL 139 Cb -0.11 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1zye s VAL 139 CO 0.02 0.28 0.12 0.20 0.00 0.00 0.00 175.10 175.71 1zye s ASN 140 N 1.89 6.06 0.96 3.32 0.01 0.22 -4.98 114.94 122.41 1zye s ASN 140 Ca 0.05 0.32 -0.13 0.00 -0.71 0.00 0.00 52.86 52.39 1zye s ASN 140 Cb -0.12 -1.87 0.05 0.00 0.41 0.00 0.00 41.25 39.71 1zye s ASN 140 CO -0.06 0.33 0.43 -0.67 -1.51 0.00 0.00 177.10 175.63 1zye n ASP 141 N 1.54 -1.97 -0.31 -1.22 -0.08 -1.26 -2.37 116.55 110.89 1zye n ASP 141 Ca -0.16 0.31 0.10 0.00 -1.51 0.00 0.00 54.79 53.53 1zye n ASP 141 Cb 0.54 -1.21 0.22 0.00 2.34 0.00 0.00 41.12 43.00 1zye n ASP 141 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1zye h LEU 142 N -1.61 -0.46 -0.87 -2.67 3.38 -1.96 -3.06 115.31 108.06 1zye h LEU 142 Ca -0.44 0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1zye h LEU 142 Cb 1.28 0.44 0.00 0.00 0.09 0.00 0.00 40.66 42.47 1zye h LEU 142 CO 0.35 -0.27 0.00 -0.81 0.09 0.00 0.00 178.44 177.80 1zye n PRO 143 N -5.44 1.55 -4.08 1.13 -0.04 -1.26 -4.87 135.00 121.99 1zye n PRO 143 Ca 0.18 -0.85 -0.32 0.00 -0.04 0.00 0.00 63.50 62.48 1zye n PRO 143 Cb 0.61 -1.23 -0.16 0.00 -0.04 0.00 0.00 33.50 32.68 1zye n PRO 143 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1zye s VAL 144 N -1.71 1.84 0.47 0.52 1.01 -1.16 -5.07 120.40 116.30 1zye s VAL 144 Ca 0.20 -0.80 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 1zye s VAL 144 Cb 0.10 -1.69 -0.07 0.00 0.00 0.00 0.00 36.38 34.73 1zye s VAL 144 CO 0.14 0.50 1.21 -0.83 0.00 0.00 0.00 175.10 176.13 1zye s GLY 145 N 1.38 2.81 0.59 4.51 0.00 -1.26 -4.86 107.32 110.50 1zye s GLY 145 Ca 0.05 1.03 -0.13 0.00 0.00 0.00 0.00 44.72 45.67 1zye s GLY 145 CO -0.12 1.51 1.02 0.50 0.00 0.00 0.00 173.10 176.01 1zye s ARG 146 N -2.69 3.59 -0.47 2.90 0.52 -1.26 -5.07 118.95 116.47 1zye s ARG 146 Ca 0.64 0.89 -0.23 0.00 -0.52 0.00 0.00 55.73 56.51 1zye s ARG 146 Cb -0.31 -2.08 0.03 0.00 0.52 0.00 0.00 34.95 33.10 1zye s ARG 146 CO 0.38 -0.58 0.82 0.45 0.02 0.00 0.00 175.30 176.40 1zye s SER 147 N -3.62 6.41 0.27 0.23 0.15 -1.26 -4.94 113.70 110.94 1zye s SER 147 Ca 0.58 -0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.09 1zye s SER 147 Cb -0.12 -2.40 0.55 0.00 -1.71 0.00 0.00 66.02 62.35 1zye s SER 147 CO 0.45 -0.98 1.78 0.58 1.20 0.00 0.00 173.24 176.27 1zye h VAL 148 N 6.00 0.78 -0.17 4.45 2.07 -1.94 -1.83 116.25 125.61 1zye h VAL 148 Ca -0.25 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 67.05 1zye h VAL 148 Cb 1.08 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1zye h VAL 148 CO 0.99 0.13 0.02 -0.33 0.02 0.00 0.00 177.57 178.40 1zye h GLU 149 N 0.73 0.08 -0.54 1.57 4.39 -1.96 -2.03 114.58 116.82 1zye h GLU 149 Ca 0.48 -0.00 0.04 0.00 0.34 0.00 0.00 59.36 60.21 1zye h GLU 149 Cb 0.63 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.22 1zye h GLU 149 CO -0.34 0.05 0.30 1.49 -1.16 0.00 0.00 179.01 179.36 1zye h GLU 150 N 0.08 0.57 -0.56 2.33 4.57 -1.81 -1.05 114.58 118.71 1zye h GLU 150 Ca 0.08 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.26 1zye h GLU 150 Cb 0.08 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.50 1zye h GLU 150 CO -0.11 0.38 0.33 1.15 -1.18 0.00 0.00 179.01 179.57 1zye h THR 151 N 0.59 1.03 -0.46 0.32 2.02 -1.06 -1.18 112.91 114.17 1zye h THR 151 Ca 0.23 -0.22 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 1zye h THR 151 Cb 0.09 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 1zye h THR 151 CO -0.13 0.12 0.14 0.25 0.37 0.00 0.00 175.52 176.26 1zye h LEU 152 N 0.64 0.68 -0.56 2.58 5.85 -0.86 -1.32 115.31 122.31 1zye h LEU 152 Ca 0.24 -0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.84 1zye h LEU 152 Cb 0.07 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 40.84 1zye h LEU 152 CO -0.12 0.71 0.14 -0.09 -0.34 0.00 0.00 178.44 178.74 1zye h ARG 153 N 0.61 0.28 -0.89 1.25 2.43 -0.72 -1.97 114.38 115.37 1zye h ARG 153 Ca 0.15 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1zye h ARG 153 Cb 0.28 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.72 1zye h ARG 153 CO -0.00 0.19 0.54 -0.07 -1.51 0.00 0.00 179.97 179.12 1zye h LEU 154 N 0.29 1.07 -0.38 3.80 3.38 -0.48 -0.33 115.31 122.65 1zye h LEU 154 Ca 0.29 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 1zye h LEU 154 Cb 0.39 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1zye h LEU 154 CO -0.35 0.82 0.18 0.58 0.09 0.00 0.00 178.44 179.76 1zye h VAL 155 N 1.23 1.18 0.14 1.22 2.07 -0.55 -2.22 116.25 119.32 1zye h VAL 155 Ca 0.32 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 1zye h VAL 155 Cb -0.06 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1zye h VAL 155 CO -0.06 0.19 -0.07 0.11 0.02 0.00 0.00 177.57 177.76 1zye h LYS 156 N 0.48 -0.19 -0.90 1.57 1.57 -1.08 -2.58 116.57 115.44 1zye h LYS 156 Ca 0.13 0.01 0.19 0.00 -1.87 0.00 0.00 60.65 59.11 1zye h LYS 156 Cb 0.14 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.42 1zye h LYS 156 CO -0.02 -0.12 0.59 0.00 -0.57 0.00 0.00 179.45 179.33 1zye h ALA 157 N 0.66 2.06 -0.07 3.86 0.00 -0.79 0.72 119.26 125.69 1zye h ALA 157 Ca -0.02 0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 1zye h ALA 157 Cb 0.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1zye h ALA 157 CO 0.03 -0.34 -0.66 0.74 0.00 0.00 0.00 179.25 179.02 1zye h PHE 158 N 0.51 0.39 -0.25 0.00 0.04 -1.04 -2.31 116.94 114.27 1zye h PHE 158 Ca 0.47 -0.16 -0.16 0.00 2.80 0.00 0.00 57.97 60.93 1zye h PHE 158 Cb 1.02 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 39.11 1zye h PHE 158 CO -0.00 0.87 -0.46 1.96 -0.60 0.00 0.00 178.31 180.07 1zye h GLN 159 N 0.21 0.76 -0.14 1.51 4.20 -0.56 -2.68 115.11 118.41 1zye h GLN 159 Ca -0.01 -0.48 0.03 0.00 0.06 0.00 0.00 58.65 58.24 1zye h GLN 159 Cb 1.20 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.97 1zye h GLN 159 CO 0.11 1.10 -0.47 0.35 -0.67 0.00 0.00 178.83 179.26 1zye h PHE 160 N 0.50 -1.39 0.00 2.96 3.04 -1.09 -1.61 116.94 119.36 1zye h PHE 160 Ca 0.01 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.02 1zye h PHE 160 Cb 1.06 0.63 0.00 0.00 2.56 0.00 0.00 35.95 40.20 1zye h PHE 160 CO 0.08 -0.46 0.00 1.55 -2.02 0.00 0.00 178.31 177.46 1zye n VAL 161 N -4.99 0.76 -0.47 1.41 3.14 -0.88 -1.27 118.33 116.03 1zye n VAL 161 Ca -0.05 0.19 0.09 0.00 -2.96 0.00 0.00 64.34 61.61 1zye n VAL 161 Cb 0.32 -0.98 0.29 0.00 -1.06 0.00 0.00 33.84 32.41 1zye n VAL 161 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1zye n GLU 162 N -1.33 3.16 0.00 1.45 2.13 -0.62 -5.09 120.64 120.34 1zye n GLU 162 Ca 0.05 -2.62 0.00 0.00 0.66 0.00 0.00 57.16 55.25 1zye n GLU 162 Cb 0.11 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 30.18 1zye n GLU 162 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72