#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 1.53 -1.24 0.55 0.00 -1.26 -4.99 121.76 116.34 1zye s ALA 3 Ca 0.00 -1.80 -0.19 0.00 0.00 0.00 0.00 51.96 49.97 1zye s ALA 3 Cb 0.00 1.19 0.06 0.00 0.00 0.00 0.00 23.12 24.37 1zye s ALA 3 CO 0.00 -0.51 1.69 0.08 0.00 0.00 0.00 175.76 177.01 1zye s VAL 4 N -3.90 4.07 0.00 0.00 1.01 -1.26 -2.60 120.40 117.73 1zye s VAL 4 Ca 0.38 -1.68 0.00 0.00 0.00 0.00 0.00 61.98 60.68 1zye s VAL 4 Cb 0.07 -5.16 0.00 0.00 0.00 0.00 0.00 36.38 31.29 1zye s VAL 4 CO 0.13 -2.00 0.00 0.35 0.00 0.00 0.00 175.10 173.58 1zye n THR 5 N 6.51 0.00 -3.51 3.92 -2.24 -1.02 -4.95 114.28 112.98 1zye n THR 5 Ca 0.46 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 62.03 1zye n THR 5 Cb 0.47 0.00 -0.02 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 2.53 0.17 -0.78 -0.21 -1.07 -4.82 119.66 115.48 1zye s GLN 6 Ca 0.00 -1.55 -0.30 0.00 0.02 0.00 0.00 55.36 53.53 1zye s GLN 6 Cb 0.00 -2.40 -0.08 0.00 1.00 0.00 0.00 33.01 31.53 1zye s GLN 6 CO 0.00 -0.26 1.15 -1.01 -2.12 0.00 0.00 175.29 173.05 1zye s HIS 7 N -2.49 3.51 0.23 0.91 3.76 -1.26 -1.43 115.29 118.52 1zye s HIS 7 Ca 0.48 1.50 -0.32 0.00 -0.15 0.00 0.00 55.06 56.58 1zye s HIS 7 Cb -0.04 -3.35 -0.13 0.00 1.11 0.00 0.00 32.58 30.17 1zye s HIS 7 CO 0.28 -0.91 1.52 0.00 -0.85 0.00 0.00 174.74 174.78 1zye n ALA 8 N 2.59 1.60 -1.63 -1.40 0.00 -0.45 -4.85 120.51 116.38 1zye n ALA 8 Ca 0.04 0.41 -0.43 0.00 0.00 0.00 0.00 53.44 53.46 1zye n ALA 8 Cb 0.46 -2.35 -0.00 0.00 0.00 0.00 0.00 19.45 17.55 1zye n ALA 8 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1zye n PRO 9 N 2.58 1.59 -1.45 0.00 -0.02 -1.26 -4.94 135.00 131.50 1zye n PRO 9 Ca 0.13 0.56 -0.37 0.00 -2.02 0.00 0.00 63.50 61.80 1zye n PRO 9 Cb 0.32 -2.06 0.06 0.00 -0.02 0.00 0.00 33.50 31.80 1zye n PRO 9 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1zye n TYR 10 N 0.02 -0.09 -3.72 6.00 9.36 -1.26 -4.97 117.16 122.49 1zye n TYR 10 Ca 0.08 0.41 -0.14 0.00 3.32 0.00 0.00 57.90 61.57 1zye n TYR 10 Cb 0.36 -2.02 -0.09 0.00 -0.63 0.00 0.00 39.34 36.96 1zye n TYR 10 CO 0.00 0.00 0.00 -0.59 0.22 0.00 0.00 176.86 176.49 1zye s PHE 11 N -1.72 -0.39 0.06 2.98 -0.12 -1.26 -4.98 117.98 112.56 1zye s PHE 11 Ca 0.71 0.86 -0.00 0.00 -0.05 0.00 0.00 56.93 58.45 1zye s PHE 11 Cb -0.40 0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.11 1zye s PHE 11 CO 0.52 -0.31 -0.04 0.21 -0.05 0.00 0.00 175.22 175.55 1zye s LYS 12 N -0.40 0.66 0.00 1.99 2.20 -1.26 -1.38 119.74 121.55 1zye s LYS 12 Ca -0.05 -1.22 0.00 0.00 -0.36 0.00 0.00 55.97 54.34 1zye s LYS 12 Cb -0.03 0.09 0.00 0.00 -1.51 0.00 0.00 37.83 36.37 1zye s LYS 12 CO 0.03 -0.08 0.00 0.41 -0.36 0.00 0.00 175.35 175.35 1zye n GLY 13 N 0.15 3.32 3.72 5.54 0.00 -0.93 -4.99 105.19 112.00 1zye n GLY 13 Ca -0.14 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.51 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 4.20 0.30 2.61 2.01 -1.26 -1.95 115.64 119.55 1zye s THR 14 Ca 0.00 1.62 0.11 0.00 0.31 0.00 0.00 61.69 63.73 1zye s THR 14 Cb 0.00 -4.04 -0.05 0.00 0.01 0.00 0.00 72.50 68.42 1zye s THR 14 CO 0.00 0.15 -0.17 0.00 -0.69 0.00 0.00 174.62 173.91 1zye s ALA 15 N 0.87 2.81 -0.56 7.40 0.00 -0.18 -1.11 121.76 130.98 1zye s ALA 15 Ca 0.56 -1.93 -0.19 0.00 0.00 0.00 0.00 51.96 50.39 1zye s ALA 15 Cb -0.28 -0.21 0.09 0.00 0.00 0.00 0.00 23.12 22.72 1zye s ALA 15 CO 0.30 0.23 0.68 0.08 0.00 0.00 0.00 175.76 177.05 1zye s VAL 16 N -2.53 4.83 -0.21 0.00 1.01 -0.19 -1.14 120.40 122.16 1zye s VAL 16 Ca 0.31 -0.80 -0.21 0.00 0.00 0.00 0.00 61.98 61.28 1zye s VAL 16 Cb -0.03 -4.42 -0.19 0.00 0.00 0.00 0.00 36.38 31.73 1zye s VAL 16 CO 0.15 -1.02 0.22 0.58 0.00 0.00 0.00 175.10 175.04 1zye h VAL 17 N 5.90 0.91 0.00 2.92 2.07 -1.04 -2.47 116.25 124.54 1zye h VAL 17 Ca -0.29 -2.18 0.00 0.00 0.82 0.00 0.00 66.70 65.05 1zye h VAL 17 Cb 1.09 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 33.09 1zye h VAL 17 CO 1.05 0.33 0.00 -1.20 0.02 0.00 0.00 177.57 177.77 1zye n SER 18 N -4.41 0.00 -0.33 0.57 7.64 -1.26 -4.71 113.62 111.12 1zye n SER 18 Ca -0.32 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.64 1zye n SER 18 Cb 0.69 0.00 0.16 0.00 -1.01 0.00 0.00 64.21 64.05 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 4.23 4.28 3.34 0.23 0.00 -1.26 -4.86 105.19 111.15 1zye n GLY 19 Ca 0.00 -0.92 -0.22 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.51 1.31 0.20 1.61 2.02 -1.26 -5.12 118.70 114.95 1zye s GLU 20 Ca 0.30 -1.45 -0.30 0.00 0.02 0.00 0.00 54.97 53.54 1zye s GLU 20 Cb 0.25 -1.34 -0.08 0.00 0.10 0.00 0.00 34.13 33.06 1zye s GLU 20 CO 0.05 0.27 0.96 -0.06 0.02 0.00 0.00 175.26 176.50 1zye s PHE 21 N -2.17 3.90 -0.18 1.61 0.08 -1.26 -0.40 117.98 119.56 1zye s PHE 21 Ca 0.17 1.86 -0.12 0.00 0.12 0.00 0.00 56.93 58.96 1zye s PHE 21 Cb -0.05 -3.03 0.05 0.00 -0.57 0.00 0.00 43.02 39.42 1zye s PHE 21 CO 0.07 0.29 0.44 0.21 -0.10 0.00 0.00 175.22 176.13 1zye s LYS 22 N -0.79 0.46 0.08 0.44 2.20 -0.29 -4.89 119.74 116.94 1zye s LYS 22 Ca 0.43 0.76 -0.31 0.00 -0.36 0.00 0.00 55.97 56.50 1zye s LYS 22 Cb -0.26 0.09 -0.07 0.00 -1.51 0.00 0.00 37.83 36.08 1zye s LYS 22 CO 0.32 -0.12 1.44 -1.21 -0.36 0.00 0.00 175.35 175.41 1zye s GLU 23 N 1.00 4.29 0.01 4.03 0.41 -1.26 -1.01 118.70 126.17 1zye s GLU 23 Ca -0.06 2.09 0.04 0.00 -0.41 0.00 0.00 54.97 56.63 1zye s GLU 23 Cb -0.06 -3.38 -0.01 0.00 -1.78 0.00 0.00 34.13 28.89 1zye s GLU 23 CO -0.08 -0.53 -0.12 0.96 -0.49 0.00 0.00 175.26 175.00 1zye s ILE 24 N 1.68 0.92 0.29 -1.63 -4.36 -0.82 -4.93 121.20 112.35 1zye s ILE 24 Ca 0.66 -0.71 0.02 0.00 -0.26 0.00 0.00 60.65 60.36 1zye s ILE 24 Cb -0.36 -0.81 -0.05 0.00 1.25 0.00 0.00 42.46 42.48 1zye s ILE 24 CO 0.29 0.10 0.09 -0.94 0.24 0.00 0.00 174.94 174.73 1zye s SER 25 N -0.69 1.71 0.39 4.36 1.04 -1.26 -2.18 113.70 117.08 1zye s SER 25 Ca 0.02 -1.41 0.11 0.00 0.48 0.00 0.00 55.95 55.15 1zye s SER 25 Cb -0.06 0.11 0.89 0.00 0.10 0.00 0.00 66.02 67.07 1zye s SER 25 CO 0.00 -0.71 1.91 0.25 0.98 0.00 0.00 173.24 175.67 1zye h LEU 26 N 2.24 0.55 -1.27 2.42 5.85 -1.60 -2.61 115.31 120.89 1zye h LEU 26 Ca -0.39 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.40 1zye h LEU 26 Cb 1.25 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 1zye h LEU 26 CO 0.63 0.30 0.52 0.44 -0.34 0.00 0.00 178.44 179.99 1zye h ASP 27 N 0.59 0.80 0.00 1.25 3.32 -1.96 -1.37 116.42 119.06 1zye h ASP 27 Ca 0.38 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 1zye h ASP 27 Cb 0.65 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1zye h ASP 27 CO -0.15 0.54 0.20 0.47 -1.72 0.00 0.00 179.24 178.58 1zye n ASP 28 N -4.46 0.31 -0.41 6.45 8.00 -0.98 -0.78 116.55 124.67 1zye n ASP 28 Ca 0.11 0.55 0.04 0.00 0.71 0.00 0.00 54.79 56.20 1zye n ASP 28 Cb 0.15 -0.54 0.10 0.00 -0.02 0.00 0.00 41.12 40.81 1zye n ASP 28 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1zye n PHE 29 N -1.93 0.30 -1.65 1.24 3.72 -0.52 -4.96 117.46 113.67 1zye n PHE 29 Ca -0.01 -0.51 -0.51 0.00 -0.05 0.00 0.00 57.45 56.37 1zye n PHE 29 Cb 0.22 -0.04 -0.06 0.00 -0.94 0.00 0.00 39.48 38.66 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 0.11 1.53 -0.92 -1.08 3.00 0.04 -1.21 118.16 119.63 1zye n LYS 30 Ca 0.08 0.56 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1zye n LYS 30 Cb 0.37 -2.27 0.00 0.00 0.00 0.00 0.00 35.03 33.14 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 3.34 0.79 3.58 3.14 0.00 0.18 -5.01 105.19 111.21 1zye n GLY 31 Ca 0.20 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.19 1.98 0.26 1.61 1.02 -0.35 -4.73 119.74 119.34 1zye s LYS 32 Ca 0.00 -1.71 -0.19 0.00 0.02 0.00 0.00 55.97 54.09 1zye s LYS 32 Cb 0.00 -1.90 -0.09 0.00 -0.52 0.00 0.00 37.83 35.32 1zye s LYS 32 CO 0.00 0.23 0.75 0.71 -0.92 0.00 0.00 175.35 176.12 1zye s TYR 33 N -2.49 3.57 -0.06 3.18 1.51 -0.43 -2.62 117.35 120.00 1zye s TYR 33 Ca 0.32 1.38 0.03 0.00 -1.01 0.00 0.00 57.07 57.79 1zye s TYR 33 Cb -0.02 -2.62 0.01 0.00 -0.11 0.00 0.00 41.96 39.21 1zye s TYR 33 CO 0.18 0.25 -0.15 -1.17 -1.11 0.00 0.00 175.55 173.54 1zye s LEU 34 N -2.29 1.80 -0.41 -1.29 0.20 -0.04 0.28 118.68 116.93 1zye s LEU 34 Ca 0.47 -0.35 -0.06 0.00 0.69 0.00 0.00 54.13 54.88 1zye s LEU 34 Cb -0.15 -0.95 0.09 0.00 -0.43 0.00 0.00 46.19 44.76 1zye s LEU 34 CO 0.20 0.09 0.23 -0.69 -0.29 0.00 0.00 176.35 175.89 1zye s VAL 35 N 0.41 3.74 -0.22 1.68 1.01 -0.21 -0.12 120.40 126.68 1zye s VAL 35 Ca -0.12 -1.72 -0.09 0.00 0.00 0.00 0.00 61.98 60.06 1zye s VAL 35 Cb -0.15 -3.40 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 1zye s VAL 35 CO 0.04 -0.58 0.10 -0.22 0.00 0.00 0.00 175.10 174.44 1zye s LEU 36 N 1.29 3.84 -0.01 3.92 2.96 -0.23 -1.85 118.68 128.59 1zye s LEU 36 Ca 0.05 0.02 -0.03 0.00 -0.22 0.00 0.00 54.13 53.95 1zye s LEU 36 Cb -0.23 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.45 1zye s LEU 36 CO -0.01 0.08 0.07 0.72 -1.32 0.00 0.00 176.35 175.88 1zye s PHE 37 N 0.97 0.01 0.05 5.38 -0.71 -0.97 0.81 117.98 123.51 1zye s PHE 37 Ca 0.05 0.00 0.06 0.00 -1.04 0.00 0.00 56.93 56.00 1zye s PHE 37 Cb -0.14 -0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.61 1zye s PHE 37 CO 0.03 -0.11 -0.10 -0.06 -1.34 0.00 0.00 175.22 173.64 1zye s PHE 38 N -0.50 2.76 0.07 3.49 0.40 0.15 -0.36 117.98 123.98 1zye s PHE 38 Ca -0.06 -0.13 0.03 0.00 -0.60 0.00 0.00 56.93 56.17 1zye s PHE 38 Cb -0.04 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.96 1zye s PHE 38 CO 0.00 0.37 -0.09 1.52 0.70 0.00 0.00 175.22 177.72 1zye s TYR 39 N -1.07 0.83 0.00 0.36 1.13 0.16 -3.60 117.35 115.16 1zye s TYR 39 Ca 0.18 -0.61 0.00 0.00 -1.41 0.00 0.00 57.07 55.24 1zye s TYR 39 Cb -0.11 -0.48 0.00 0.00 -1.10 0.00 0.00 41.96 40.27 1zye s TYR 39 CO 0.10 -0.07 0.23 -2.30 -2.51 0.00 0.00 175.55 171.00 1zye n PRO 40 N 0.99 0.00 -4.08 -3.49 -0.02 -1.25 -4.29 135.00 122.86 1zye n PRO 40 Ca -0.19 0.11 -0.12 0.00 -2.02 0.00 0.00 63.50 61.27 1zye n PRO 40 Cb 0.56 -0.73 -0.11 0.00 -0.02 0.00 0.00 33.50 33.20 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 -0.67 2.31 0.81 2.45 1.43 -1.26 -4.02 118.68 119.72 1zye s LEU 41 Ca 0.00 -0.64 -0.11 0.00 -1.03 0.00 0.00 54.13 52.35 1zye s LEU 41 Cb 0.00 -0.12 0.08 0.00 0.03 0.00 0.00 46.19 46.18 1zye s LEU 41 CO 0.00 -0.27 1.09 -1.81 0.23 0.00 0.00 176.35 175.60 1zye s ASP 42 N -1.87 4.18 -2.02 2.29 1.01 -1.26 -3.77 116.67 115.23 1zye s ASP 42 Ca -0.06 1.70 0.00 0.00 0.71 0.00 0.00 52.55 54.90 1zye s ASP 42 Cb -0.07 -2.40 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1zye s ASP 42 CO -0.01 -2.22 0.00 0.49 0.21 0.00 0.00 175.17 173.64 1zye n PHE 43 N -3.64 -0.20 -3.55 4.23 3.72 -1.26 -4.98 117.46 111.79 1zye n PHE 43 Ca 0.08 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.15 1zye n PHE 43 Cb 0.54 -3.38 -0.05 0.00 -0.94 0.00 0.00 39.48 35.64 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 -2.70 5.06 0.26 4.37 -4.23 -1.25 -4.99 115.64 112.16 1zye s THR 44 Ca 0.00 0.40 0.22 0.00 -1.18 0.00 0.00 61.69 61.13 1zye s THR 44 Cb 0.00 -3.64 0.20 0.00 1.34 0.00 0.00 72.50 70.40 1zye s THR 44 CO 0.00 0.17 1.87 -0.26 -0.54 0.00 0.00 174.62 175.86 1zye h PHE 45 N 3.30 0.00 0.00 3.99 0.04 -1.93 -3.26 116.94 119.07 1zye h PHE 45 Ca -0.48 0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.08 1zye h PHE 45 Cb 1.18 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.30 1zye h PHE 45 CO 0.64 0.26 -1.12 0.28 -0.60 0.00 0.00 178.31 177.76 1zye h VAL 46 N 0.00 1.34 0.01 -0.55 2.07 -1.97 -3.40 116.25 113.75 1zye h VAL 46 Ca -0.00 -3.03 -0.23 0.00 0.82 0.00 0.00 66.70 64.26 1zye h VAL 46 Cb 0.66 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.08 1zye h VAL 46 CO 0.03 0.77 -0.97 0.00 0.02 0.00 0.00 177.57 177.42 1zye h PRO 48 N 0.22 0.33 -0.78 0.00 0.13 -1.79 -2.87 132.00 127.24 1zye h PRO 48 Ca -0.08 -0.14 -0.04 0.00 -0.87 0.00 0.00 66.00 64.86 1zye h PRO 48 Cb 1.61 -0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.70 1zye h PRO 48 CO 0.17 0.65 0.34 1.79 -0.23 0.00 0.00 178.00 180.71 1zye h THR 49 N 0.28 1.25 -0.22 1.56 1.35 -1.91 -0.82 112.91 114.41 1zye h THR 49 Ca 0.03 -0.77 -0.19 0.00 -0.55 0.00 0.00 66.41 64.93 1zye h THR 49 Cb 0.76 0.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.49 1zye h THR 49 CO 0.06 0.32 -0.62 -0.08 -0.25 0.00 0.00 175.52 174.94 1zye h GLU 50 N 1.12 0.75 0.47 4.72 4.81 -1.81 -0.05 114.58 124.59 1zye h GLU 50 Ca 0.26 -0.52 -0.02 0.00 -0.13 0.00 0.00 59.36 58.95 1zye h GLU 50 Cb 0.18 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1zye h GLU 50 CO -0.03 1.14 -0.22 0.82 -0.73 0.00 0.00 179.01 179.99 1zye h ILE 51 N 0.56 0.52 -0.63 2.32 2.04 -1.48 -2.93 117.51 117.91 1zye h ILE 51 Ca -0.01 -0.23 0.10 0.00 1.00 0.00 0.00 64.86 65.72 1zye h ILE 51 Cb 1.22 0.62 -0.12 0.00 -0.74 0.00 0.00 36.82 37.81 1zye h ILE 51 CO 0.13 0.04 -0.37 0.40 0.00 0.00 0.00 178.15 178.35 1zye h ILE 52 N -0.77 0.13 -0.97 -0.67 2.04 -1.19 -0.98 117.51 115.10 1zye h ILE 52 Ca -0.06 0.00 0.18 0.00 1.00 0.00 0.00 64.86 65.98 1zye h ILE 52 Cb 0.55 0.13 -0.18 0.00 -0.74 0.00 0.00 36.82 36.58 1zye h ILE 52 CO 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 178.15 177.97 1zye n ALA 53 N -3.18 0.13 -0.10 1.87 0.00 -0.03 -0.55 120.51 118.65 1zye n ALA 53 Ca 0.04 1.04 -0.12 0.00 0.00 0.00 0.00 53.44 54.41 1zye n ALA 53 Cb 0.36 -0.58 -0.04 0.00 0.00 0.00 0.00 19.45 19.19 1zye n ALA 53 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1zye h PHE 54 N 0.00 0.68 -0.99 0.00 0.04 -1.04 -2.51 116.94 113.12 1zye h PHE 54 Ca 0.43 -0.15 0.15 0.00 2.80 0.00 0.00 57.97 61.20 1zye h PHE 54 Cb 0.67 -0.16 -0.09 0.00 2.20 0.00 0.00 35.95 38.57 1zye h PHE 54 CO -0.78 0.80 0.62 1.03 -0.60 0.00 0.00 178.31 179.38 1zye h SER 55 N 0.36 0.84 0.37 2.17 0.87 0.16 -0.54 113.55 117.79 1zye h SER 55 Ca 0.07 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 1zye h SER 55 Cb 0.59 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1zye h SER 55 CO 0.03 0.39 -0.18 0.44 -0.53 0.00 0.00 176.83 176.99 1zye h ASP 56 N 0.87 -0.42 0.00 6.23 3.32 -0.66 -3.04 116.42 122.72 1zye h ASP 56 Ca 0.52 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.59 1zye h ASP 56 Cb 0.68 0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.33 1zye h ASP 56 CO -0.30 -0.20 0.00 0.29 -1.72 0.00 0.00 179.24 177.31 1zye n LYS 57 N -3.94 0.40 -0.06 3.56 4.76 -0.96 -4.12 118.16 117.81 1zye n LYS 57 Ca -0.06 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.30 1zye n LYS 57 Cb 0.20 -1.00 -0.01 0.00 -1.84 0.00 0.00 35.03 32.37 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 1.79 -0.09 -0.70 7.82 0.00 -0.98 -1.15 119.26 125.95 1zye h ALA 58 Ca 0.00 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1zye h ALA 58 Cb 0.00 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1zye h ALA 58 CO 0.00 -0.64 0.46 0.66 0.00 0.00 0.00 179.25 179.73 1zye h SER 59 N -0.22 0.67 -0.98 0.00 4.64 -1.83 -1.17 113.55 114.65 1zye h SER 59 Ca 0.14 -0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.66 1zye h SER 59 Cb 0.44 -0.15 -0.11 0.00 -0.31 0.00 0.00 62.40 62.28 1zye h SER 59 CO -0.39 0.44 0.58 -0.08 -0.87 0.00 0.00 176.83 176.51 1zye h GLU 60 N 0.76 0.68 -0.08 4.77 4.81 -1.52 0.80 114.58 124.81 1zye h GLU 60 Ca 0.29 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.45 1zye h GLU 60 Cb 0.19 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1zye h GLU 60 CO -0.09 0.45 -0.10 0.74 -0.73 0.00 0.00 179.01 179.28 1zye h PHE 61 N 0.70 0.25 -0.99 0.92 -1.00 -1.15 -3.07 116.94 112.60 1zye h PHE 61 Ca 0.58 -0.08 0.11 0.00 2.81 0.00 0.00 57.97 61.39 1zye h PHE 61 Cb 0.93 -0.05 -0.08 0.00 3.61 0.00 0.00 35.95 40.36 1zye h PHE 61 CO -0.02 0.66 0.62 0.45 -1.61 0.00 0.00 178.31 178.42 1zye h HIS 62 N -0.24 1.13 -0.12 -0.55 3.86 -0.57 -0.71 115.15 117.97 1zye h HIS 62 Ca 0.01 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.27 1zye h HIS 62 Cb 0.63 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.72 1zye h HIS 62 CO 0.10 0.48 -0.02 -0.44 0.86 0.00 0.00 177.93 178.90 1zye h ASP 63 N 1.01 -0.09 -0.05 2.45 3.45 -0.91 -1.48 116.42 120.82 1zye h ASP 63 Ca 0.48 0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.96 1zye h ASP 63 Cb 0.42 0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.25 1zye h ASP 63 CO -0.25 -0.03 0.01 1.33 -1.57 0.00 0.00 179.24 178.74 1zye n VAL 64 N -5.14 0.46 -3.43 -1.35 0.24 -0.67 -4.86 118.33 103.58 1zye n VAL 64 Ca -0.04 -0.10 -0.17 0.00 -2.04 0.00 0.00 64.34 61.98 1zye n VAL 64 Cb 0.08 -0.63 0.08 0.00 -1.47 0.00 0.00 33.84 31.91 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 0.14 -2.49 -3.87 -1.34 5.15 -0.56 -4.90 115.26 107.40 1zye n ASN 65 Ca 0.02 -0.64 -0.18 0.00 -0.60 0.00 0.00 54.58 53.18 1zye n ASN 65 Cb 0.39 -5.07 -0.16 0.00 -0.53 0.00 0.00 39.78 34.41 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 0.85 3.56 -0.11 0.00 0.41 0.14 -2.81 118.70 120.74 1zye s GLU 67 Ca -0.10 -0.11 -0.01 0.00 -0.41 0.00 0.00 54.97 54.34 1zye s GLU 67 Cb -0.13 -2.62 0.03 0.00 -1.78 0.00 0.00 34.13 29.63 1zye s GLU 67 CO -0.00 0.14 -0.05 0.08 -0.49 0.00 0.00 175.26 174.93 1zye s VAL 68 N -2.26 0.87 -0.09 2.63 1.01 -1.26 -1.04 120.40 120.26 1zye s VAL 68 Ca 0.43 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 62.18 1zye s VAL 68 Cb -0.10 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.33 1zye s VAL 68 CO 0.34 0.29 -0.17 0.54 0.00 0.00 0.00 175.10 176.10 1zye s VAL 69 N 1.76 1.54 0.06 2.92 0.11 -0.77 -3.18 120.40 122.84 1zye s VAL 69 Ca 0.04 -0.71 -0.06 0.00 -2.93 0.00 0.00 61.98 58.33 1zye s VAL 69 Cb -0.13 -1.38 -0.05 0.00 -1.53 0.00 0.00 36.38 33.30 1zye s VAL 69 CO -0.07 0.45 0.31 0.00 -3.33 0.00 0.00 175.10 172.45 1zye s ALA 70 N 0.64 3.84 -0.04 1.54 0.00 -0.48 -2.30 121.76 124.95 1zye s ALA 70 Ca -0.14 -0.58 -0.05 0.00 0.00 0.00 0.00 51.96 51.18 1zye s ALA 70 Cb -0.16 -2.08 0.01 0.00 0.00 0.00 0.00 23.12 20.89 1zye s ALA 70 CO 0.04 0.67 0.14 0.54 0.00 0.00 0.00 175.76 177.15 1zye s VAL 71 N -1.43 0.02 0.16 0.00 0.11 0.51 -0.55 120.40 119.22 1zye s VAL 71 Ca 0.33 -0.19 -0.11 0.00 -2.93 0.00 0.00 61.98 59.08 1zye s VAL 71 Cb -0.13 -0.26 0.00 0.00 -1.53 0.00 0.00 36.38 34.46 1zye s VAL 71 CO 0.20 -0.10 0.33 -0.94 -3.33 0.00 0.00 175.10 171.26 1zye s SER 72 N -0.30 -0.03 0.00 3.54 1.04 -1.19 -0.67 113.70 116.09 1zye s SER 72 Ca -0.04 -0.72 0.01 0.00 0.48 0.00 0.00 55.95 55.69 1zye s SER 72 Cb -0.03 0.46 0.08 0.00 0.10 0.00 0.00 66.02 66.63 1zye s SER 72 CO 0.00 -0.90 0.54 1.33 0.98 0.00 0.00 173.24 175.20 1zye n VAL 73 N -0.22 0.00 -2.19 5.02 0.24 -1.26 -1.35 118.33 118.57 1zye n VAL 73 Ca -0.10 0.00 -0.28 0.00 -2.04 0.00 0.00 64.34 61.92 1zye n VAL 73 Cb 0.63 -0.31 0.03 0.00 -1.47 0.00 0.00 33.84 32.72 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 -1.57 5.69 0.62 -1.34 1.01 -1.26 -4.04 116.67 115.78 1zye s ASP 74 Ca 0.02 0.96 -0.14 0.00 0.71 0.00 0.00 52.55 54.10 1zye s ASP 74 Cb 0.01 -1.93 -0.02 0.00 1.01 0.00 0.00 42.92 41.98 1zye s ASP 74 CO 0.02 -1.08 1.05 -0.94 0.21 0.00 0.00 175.17 174.43 1zye s SER 75 N -4.29 5.71 0.28 0.27 1.04 -1.26 -3.53 113.70 111.92 1zye s SER 75 Ca 0.55 1.73 0.25 0.00 0.48 0.00 0.00 55.95 58.95 1zye s SER 75 Cb -0.11 -2.52 0.99 0.00 0.10 0.00 0.00 66.02 64.49 1zye s SER 75 CO 0.48 -1.22 1.74 1.12 0.98 0.00 0.00 173.24 176.34 1zye h HIS 76 N 0.07 0.00 -0.13 5.02 2.07 -1.93 -2.14 115.15 118.11 1zye h HIS 76 Ca -0.46 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.00 1zye h HIS 76 Cb 1.21 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.19 1zye h HIS 76 CO 0.60 0.00 -0.16 0.74 -3.07 0.00 0.00 177.93 176.04 1zye h PHE 77 N 0.00 0.42 -0.42 6.12 0.04 -1.99 -2.34 116.94 118.77 1zye h PHE 77 Ca 0.00 -0.13 0.05 0.00 2.80 0.00 0.00 57.97 60.69 1zye h PHE 77 Cb 0.41 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.43 1zye h PHE 77 CO 0.00 0.76 0.14 0.77 -0.60 0.00 0.00 178.31 179.39 1zye h SER 78 N -0.05 0.14 -0.51 2.17 0.02 -1.83 -1.27 113.55 112.22 1zye h SER 78 Ca 0.02 0.05 0.10 0.00 -0.84 0.00 0.00 61.79 61.12 1zye h SER 78 Cb 0.71 0.04 -0.10 0.00 0.14 0.00 0.00 62.40 63.19 1zye h SER 78 CO 0.04 0.11 -0.15 0.45 -1.14 0.00 0.00 176.83 176.14 1zye h HIS 79 N 0.30 -0.34 0.55 3.45 3.86 -1.33 -0.74 115.15 120.89 1zye h HIS 79 Ca 0.20 0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.44 1zye h HIS 79 Cb 0.19 0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.88 1zye h HIS 79 CO -0.16 -0.24 -0.42 1.25 0.86 0.00 0.00 177.93 179.22 1zye h LEU 80 N -0.03 -1.09 -1.41 2.43 5.85 -0.95 -1.80 115.31 118.31 1zye h LEU 80 Ca 0.25 0.08 0.32 0.00 0.84 0.00 0.00 57.88 59.36 1zye h LEU 80 Cb 0.40 0.34 -0.10 0.00 0.37 0.00 0.00 40.66 41.68 1zye h LEU 80 CO -0.54 -0.61 0.73 0.00 -0.34 0.00 0.00 178.44 177.68 1zye h ALA 81 N -0.66 2.42 -0.07 1.25 0.00 -0.66 0.29 119.26 121.83 1zye h ALA 81 Ca -0.06 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 1zye h ALA 81 Cb 0.79 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.67 1zye h ALA 81 CO 0.01 -0.88 -0.61 2.35 0.00 0.00 0.00 179.25 180.11 1zye h TRP 82 N 0.29 0.76 -0.46 0.00 7.01 -0.81 -2.28 115.95 120.45 1zye h TRP 82 Ca 0.65 -0.36 0.06 0.00 2.11 0.00 0.00 58.89 61.36 1zye h TRP 82 Cb 1.84 -0.11 -0.05 0.00 -2.10 0.00 0.00 29.16 28.74 1zye h TRP 82 CO -0.00 1.16 0.15 0.82 -2.79 0.00 0.00 178.44 177.78 1zye h ILE 83 N 0.14 0.83 0.00 2.65 2.04 -0.05 -1.51 117.51 121.61 1zye h ILE 83 Ca -0.06 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1zye h ILE 83 Cb 1.28 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1zye h ILE 83 CO 0.12 0.06 0.00 0.59 0.00 0.00 0.00 178.15 178.92 1zye n ASN 84 N -5.03 0.00 -4.69 1.72 3.02 0.80 -2.46 115.26 108.63 1zye n ASN 84 Ca 0.04 -1.35 -0.38 0.00 -0.03 0.00 0.00 54.58 52.86 1zye n ASN 84 Cb 0.19 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.29 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 -2.00 5.23 0.29 3.41 2.01 -0.62 -4.97 115.64 118.98 1zye s THR 85 Ca 0.12 0.69 -0.29 0.00 0.31 0.00 0.00 61.69 62.52 1zye s THR 85 Cb 0.05 -3.71 -0.10 0.00 0.01 0.00 0.00 72.50 68.75 1zye s THR 85 CO 0.09 0.30 1.38 -2.84 -0.69 0.00 0.00 174.62 172.86 1zye s PRO 86 N 0.96 4.30 0.32 4.92 0.02 -1.26 -1.41 135.00 142.85 1zye s PRO 86 Ca 0.19 2.26 0.10 0.00 0.02 0.00 0.00 61.00 63.58 1zye s PRO 86 Cb -0.14 -3.09 0.96 0.00 0.02 0.00 0.00 34.50 32.24 1zye s PRO 86 CO 0.07 -0.32 1.65 0.00 -0.33 0.00 0.00 177.00 178.07 1zye h ARG 87 N 4.28 0.26 -0.95 5.54 3.08 -1.85 -0.66 114.38 124.09 1zye h ARG 87 Ca -0.47 -0.02 0.29 0.00 0.07 0.00 0.00 59.98 59.85 1zye h ARG 87 Cb 1.22 -0.06 -0.18 0.00 0.08 0.00 0.00 29.97 31.04 1zye h ARG 87 CO 0.72 0.17 0.10 1.17 -1.07 0.00 0.00 179.97 181.07 1zye n LYS 88 N -5.13 -0.07 -2.17 0.04 4.81 -1.26 -1.43 118.16 112.95 1zye n LYS 88 Ca 0.28 1.41 -0.34 0.00 -0.87 0.00 0.00 58.31 58.79 1zye n LYS 88 Cb 0.89 -2.28 0.02 0.00 0.02 0.00 0.00 35.03 33.68 1zye n LYS 88 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1zye n ASN 89 N -5.37 6.27 0.00 3.14 3.02 -0.27 -4.88 115.26 117.17 1zye n ASN 89 Ca 0.25 -3.79 0.00 0.00 -0.03 0.00 0.00 54.58 51.01 1zye n ASN 89 Cb 0.82 -0.79 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 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 -0.52 1.70 0.00 7.41 0.00 -0.52 -4.89 105.19 108.38 1zye n GLY 90 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.49 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 -2.52 0.04 -0.02 0.00 -1.14 -4.89 105.19 94.66 1zye n GLY 91 Ca 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.87 -4.40 117.00 117.50 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 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 1zye n LEU 92 CO 0.00 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1zye n GLY 93 N 2.15 0.60 3.62 -0.72 0.00 -0.50 -4.73 105.19 105.61 1zye n GLY 93 Ca -0.15 -0.87 -0.45 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.30 1.61 -4.97 1.61 -0.00 -1.26 -4.66 115.22 107.25 1zye n HIS 94 Ca 0.00 0.62 -0.27 0.00 -0.00 0.00 0.00 57.72 58.06 1zye n HIS 94 Cb 0.00 -2.33 -0.16 0.00 -0.00 0.00 0.00 29.99 27.50 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 -1.03 1.91 0.00 1.57 0.00 -1.26 -5.02 119.30 115.46 1zye s MET 95 Ca 0.64 -0.70 0.15 0.00 0.00 0.00 0.00 55.69 55.78 1zye s MET 95 Cb -0.71 -1.69 0.21 0.00 0.00 0.00 0.00 34.83 32.64 1zye s MET 95 CO 0.56 0.32 1.10 0.09 0.00 0.00 0.00 175.02 177.09 1zye n ASN 96 N 2.96 2.59 -4.47 1.11 3.02 -1.26 -4.94 115.26 114.27 1zye n ASN 96 Ca -0.17 -1.75 -0.25 0.00 -0.03 0.00 0.00 54.58 52.37 1zye n ASN 96 Cb 0.53 -0.09 -0.11 0.00 -0.61 0.00 0.00 39.78 39.50 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 -1.21 2.51 0.27 2.41 -4.36 -1.26 -4.94 121.20 114.62 1zye s ILE 97 Ca 0.22 -2.20 -0.29 0.00 -0.26 0.00 0.00 60.65 58.12 1zye s ILE 97 Cb 0.14 -2.27 -0.09 0.00 1.25 0.00 0.00 42.46 41.49 1zye s ILE 97 CO 0.20 -0.27 1.17 0.00 0.24 0.00 0.00 174.94 176.28 1zye s ALA 98 N -2.13 3.44 -0.40 2.27 0.00 -1.19 -4.88 121.76 118.85 1zye s ALA 98 Ca 0.26 0.99 -0.05 0.00 0.00 0.00 0.00 51.96 53.17 1zye s ALA 98 Cb -0.06 -3.38 0.10 0.00 0.00 0.00 0.00 23.12 19.77 1zye s ALA 98 CO 0.13 -0.32 0.21 -0.51 0.00 0.00 0.00 175.76 175.27 1zye s LEU 99 N -1.21 5.12 0.02 0.00 1.02 -0.93 -1.39 118.68 121.32 1zye s LEU 99 Ca 0.48 -1.82 -0.23 0.00 0.02 0.00 0.00 54.13 52.58 1zye s LEU 99 Cb -0.34 -1.87 -0.05 0.00 0.02 0.00 0.00 46.19 43.95 1zye s LEU 99 CO 0.42 -0.53 0.69 -0.22 0.02 0.00 0.00 176.35 176.74 1zye s LEU 100 N 1.24 4.43 -0.12 1.79 2.96 0.29 -1.02 118.68 128.24 1zye s LEU 100 Ca 0.05 1.32 -0.20 0.00 -0.22 0.00 0.00 54.13 55.08 1zye s LEU 100 Cb -0.23 -3.10 -0.04 0.00 0.50 0.00 0.00 46.19 43.32 1zye s LEU 100 CO -0.02 0.04 0.56 -0.55 -1.32 0.00 0.00 176.35 175.05 1zye s SER 101 N -0.04 6.75 -0.66 3.68 0.15 -0.27 -3.18 113.70 120.13 1zye s SER 101 Ca 0.35 0.90 0.03 0.00 0.70 0.00 0.00 55.95 57.93 1zye s SER 101 Cb -0.19 -2.33 0.36 0.00 -1.71 0.00 0.00 66.02 62.15 1zye s SER 101 CO 0.20 -0.08 1.33 -0.67 1.20 0.00 0.00 173.24 175.22 1zye n ASP 102 N 3.96 5.56 -0.28 5.45 2.03 -0.46 -4.42 116.55 128.39 1zye n ASP 102 Ca -0.05 -3.72 0.05 0.00 0.52 0.00 0.00 54.79 51.59 1zye n ASP 102 Cb 0.51 -0.72 0.19 0.00 -0.72 0.00 0.00 41.12 40.39 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 3.07 0.46 0.00 -2.67 6.46 -1.70 0.55 115.31 121.48 1zye h LEU 103 Ca 0.33 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 58.17 1zye h LEU 103 Cb 0.52 0.02 0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1zye h LEU 103 CO 0.99 0.21 0.00 0.35 -0.62 0.00 0.00 178.44 179.37 1zye n THR 104 N -4.90 0.00 -0.68 1.05 -2.24 -1.26 -4.86 114.28 101.39 1zye n THR 104 Ca 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1zye n THR 104 Cb 0.39 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 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 -0.85 -0.58 -0.04 -0.78 5.02 0.18 -4.81 118.16 116.31 1zye n LYS 105 Ca 0.13 0.14 -0.13 0.00 -2.02 0.00 0.00 58.31 56.44 1zye n LYS 105 Cb 0.06 -4.51 -0.00 0.00 -0.02 0.00 0.00 35.03 30.56 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 0.17 0.73 -0.09 1.97 1.08 -1.89 -1.95 115.11 115.14 1zye h GLN 106 Ca 0.00 -0.47 -0.07 0.00 -1.45 0.00 0.00 58.65 56.66 1zye h GLN 106 Cb 0.29 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1zye h GLN 106 CO 0.00 1.10 -0.21 0.82 -0.95 0.00 0.00 178.83 179.59 1zye h ILE 107 N 0.56 1.40 0.00 2.54 2.04 -1.89 -0.44 117.51 121.73 1zye h ILE 107 Ca 0.01 -1.53 -0.03 0.00 1.00 0.00 0.00 64.86 64.31 1zye h ILE 107 Cb 1.14 2.18 -0.00 0.00 -0.74 0.00 0.00 36.82 39.40 1zye h ILE 107 CO 0.12 0.44 -0.14 0.28 0.00 0.00 0.00 178.15 178.84 1zye h SER 108 N -0.17 0.00 0.21 1.72 0.02 -1.92 -2.08 113.55 111.33 1zye h SER 108 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1zye h SER 108 Cb 0.81 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.35 1zye h SER 108 CO 0.05 0.14 -0.10 -0.09 -1.14 0.00 0.00 176.83 175.69 1zye h ARG 109 N 0.00 -0.27 -0.07 3.45 2.43 -1.04 -0.80 114.38 118.09 1zye h ARG 109 Ca -0.00 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.21 1zye h ARG 109 Cb 0.26 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1zye h ARG 109 CO 0.02 0.05 0.05 -0.44 -1.51 0.00 0.00 179.97 178.14 1zye h ASP 110 N -0.60 0.00 0.14 -3.80 3.32 -0.66 0.23 116.42 115.05 1zye h ASP 110 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1zye h ASP 110 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1zye h ASP 110 CO 0.05 0.00 -0.22 -1.22 -1.72 0.00 0.00 179.24 176.13 1zye n TYR 111 N -4.35 0.00 -3.23 4.55 4.02 -0.82 -4.50 117.16 112.83 1zye n TYR 111 Ca -0.01 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.72 1zye n TYR 111 Cb 0.16 -0.08 0.06 0.00 -0.02 0.00 0.00 39.34 39.46 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 1.32 -0.10 0.00 2.72 0.00 0.80 -4.86 105.19 105.06 1zye n GLY 112 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -4.11 0.70 -2.89 1.61 0.24 -0.35 -5.01 118.33 108.51 1zye n VAL 113 Ca -0.02 -0.81 -0.43 0.00 -2.04 0.00 0.00 64.34 61.03 1zye n VAL 113 Cb 0.55 0.67 -0.04 0.00 -1.47 0.00 0.00 33.84 33.55 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 -0.70 4.27 -0.36 1.34 2.96 -0.91 -0.48 118.68 124.80 1zye s LEU 114 Ca 0.00 -0.50 -0.28 0.00 -0.22 0.00 0.00 54.13 53.13 1zye s LEU 114 Cb 0.00 -2.73 -0.04 0.00 0.50 0.00 0.00 46.19 43.92 1zye s LEU 114 CO 0.00 -1.20 2.05 -0.76 -1.32 0.00 0.00 176.35 175.13 1zye s LEU 115 N 3.75 3.44 0.30 -0.68 1.02 -0.22 -4.82 118.68 121.47 1zye s LEU 115 Ca 0.27 1.33 0.01 0.00 0.02 0.00 0.00 54.13 55.76 1zye s LEU 115 Cb -0.14 -3.21 0.47 0.00 0.02 0.00 0.00 46.19 43.34 1zye s LEU 115 CO 0.17 -2.09 1.84 -0.33 0.02 0.00 0.00 176.35 175.96 1zye h GLU 116 N 15.08 0.70 0.00 1.70 4.39 -1.94 -1.35 114.58 133.16 1zye h GLU 116 Ca -0.33 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1zye h GLU 116 Cb 1.21 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.76 1zye h GLU 116 CO 1.06 0.68 0.00 0.41 -1.16 0.00 0.00 179.01 179.99 1zye n GLY 117 N -0.84 -3.55 0.21 -3.84 0.00 -1.26 -3.22 105.19 92.69 1zye n GLY 117 Ca 0.03 0.65 0.10 0.00 0.00 0.00 0.00 46.02 46.80 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 -0.76 1.61 0.14 -1.99 -3.47 132.00 127.53 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 0.20 0.00 0.41 0.14 0.00 0.00 178.00 178.75 1zye n GLY 119 N 0.65 0.95 3.20 1.56 0.00 -0.52 -5.10 105.19 105.93 1zye n GLY 119 Ca 0.02 -0.49 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.76 1.57 0.37 0.99 2.34 -1.13 -4.94 118.68 117.12 1zye s LEU 120 Ca 0.00 -1.11 -0.09 0.00 0.06 0.00 0.00 54.13 52.99 1zye s LEU 120 Cb 0.00 0.54 -0.06 0.00 -0.56 0.00 0.00 46.19 46.11 1zye s LEU 120 CO 0.00 -0.77 0.70 0.00 -1.06 0.00 0.00 176.35 175.22 1zye s ALA 121 N -4.02 3.44 0.57 1.48 0.00 -1.26 -1.06 121.76 120.91 1zye s ALA 121 Ca 0.22 -0.33 -0.06 0.00 0.00 0.00 0.00 51.96 51.79 1zye s ALA 121 Cb 0.06 -2.57 -0.00 0.00 0.00 0.00 0.00 23.12 20.61 1zye s ALA 121 CO 0.01 0.06 0.90 -0.51 0.00 0.00 0.00 175.76 176.22 1zye s LEU 122 N -3.77 3.30 -1.29 0.00 1.43 0.37 -3.79 118.68 114.93 1zye s LEU 122 Ca 0.49 0.83 -0.18 0.00 -1.03 0.00 0.00 54.13 54.24 1zye s LEU 122 Cb -0.10 -3.70 0.03 0.00 0.03 0.00 0.00 46.19 42.44 1zye s LEU 122 CO 0.31 -0.96 1.90 0.54 0.23 0.00 0.00 176.35 178.37 1zye n ARG 123 N -2.55 2.79 -3.90 1.70 1.74 -1.01 -4.43 116.66 111.00 1zye n ARG 123 Ca 0.04 -2.91 -0.33 0.00 -0.77 0.00 0.00 57.85 53.88 1zye n ARG 123 Cb 0.57 -3.44 -0.05 0.00 -1.02 0.00 0.00 32.46 28.52 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 4.34 2.19 -0.02 -0.13 0.00 -1.24 -1.00 107.32 111.46 1zye s GLY 124 Ca 0.54 -0.77 0.00 0.00 0.00 0.00 0.00 44.72 44.50 1zye s GLY 124 CO 0.05 -0.68 0.00 -2.27 0.00 0.00 0.00 173.10 170.20 1zye s LEU 125 N -2.09 1.49 -0.03 0.66 0.20 0.68 0.32 118.68 119.90 1zye s LEU 125 Ca 0.30 -0.01 0.06 0.00 0.69 0.00 0.00 54.13 55.17 1zye s LEU 125 Cb -0.13 -0.13 -0.01 0.00 -0.43 0.00 0.00 46.19 45.49 1zye s LEU 125 CO 0.21 -0.06 -0.21 -0.36 -0.29 0.00 0.00 176.35 175.64 1zye s PHE 126 N 0.60 2.01 -0.37 5.38 0.08 0.24 -1.02 117.98 124.89 1zye s PHE 126 Ca -0.05 -0.48 -0.10 0.00 0.12 0.00 0.00 56.93 56.42 1zye s PHE 126 Cb -0.08 -1.31 0.04 0.00 -0.57 0.00 0.00 43.02 41.09 1zye s PHE 126 CO -0.01 -0.11 0.19 0.42 -0.10 0.00 0.00 175.22 175.61 1zye s ILE 127 N -0.30 4.36 -0.13 0.64 1.01 -0.48 -1.07 121.20 125.22 1zye s ILE 127 Ca 0.03 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.65 1zye s ILE 127 Cb -0.10 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.87 1zye s ILE 127 CO 0.01 -0.26 -0.02 -0.63 0.00 0.00 0.00 174.94 174.04 1zye s ILE 128 N 1.50 4.05 0.66 2.92 1.01 0.82 -0.56 121.20 131.61 1zye s ILE 128 Ca 0.01 -0.31 -0.08 0.00 0.00 0.00 0.00 60.65 60.26 1zye s ILE 128 Cb -0.20 -2.75 0.02 0.00 0.01 0.00 0.00 42.46 39.54 1zye s ILE 128 CO 0.05 0.52 1.01 1.51 0.00 0.00 0.00 174.94 178.03 1zye s ASP 129 N -0.02 5.39 0.64 3.58 1.47 0.45 -0.86 116.67 127.32 1zye s ASP 129 Ca 0.02 0.85 0.23 0.00 1.18 0.00 0.00 52.55 54.83 1zye s ASP 129 Cb -0.13 -1.70 1.15 0.00 -0.34 0.00 0.00 42.92 41.89 1zye s ASP 129 CO 0.02 -1.28 1.64 1.55 0.68 0.00 0.00 175.17 177.78 1zye h PRO 130 N -0.46 0.00 -0.04 2.11 0.13 -1.79 0.23 132.00 132.18 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 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1zye h PRO 130 CO 0.62 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.48 1zye n ASN 131 N -3.03 1.59 -0.04 1.44 4.13 -1.26 0.47 115.26 118.55 1zye n ASN 131 Ca 0.04 -1.55 0.00 0.00 1.68 0.00 0.00 54.58 54.75 1zye n ASN 131 Cb 0.72 -0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.95 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 1.18 0.56 3.53 7.41 0.00 0.81 -5.02 105.19 113.67 1zye n GLY 132 Ca 0.18 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.07 3.81 -0.06 1.61 1.01 -1.24 -1.34 120.40 122.12 1zye s VAL 133 Ca 0.00 -0.41 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1zye s VAL 133 Cb 0.00 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.73 1zye s VAL 133 CO 0.00 0.54 1.03 0.27 0.00 0.00 0.00 175.10 176.94 1zye s ILE 134 N -0.12 4.71 -0.12 2.22 -5.25 -0.52 -0.41 121.20 121.71 1zye s ILE 134 Ca 0.02 1.97 0.16 0.00 -0.99 0.00 0.00 60.65 61.80 1zye s ILE 134 Cb -0.13 -4.26 -0.23 0.00 2.95 0.00 0.00 42.46 40.79 1zye s ILE 134 CO 0.03 0.05 0.39 0.29 -1.79 0.00 0.00 174.94 173.90 1zye n LYS 135 N 4.67 0.70 -3.71 0.37 4.76 0.27 -2.45 118.16 122.78 1zye n LYS 135 Ca 0.08 -0.12 -0.14 0.00 -2.87 0.00 0.00 58.31 55.26 1zye n LYS 135 Cb 0.49 -1.35 -0.09 0.00 -1.84 0.00 0.00 35.03 32.24 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 -2.98 -0.44 0.03 2.13 5.04 -1.20 -4.98 115.29 112.88 1zye s HIS 136 Ca -0.04 1.00 0.02 0.00 -1.54 0.00 0.00 55.06 54.50 1zye s HIS 136 Cb 0.10 0.17 -0.02 0.00 0.04 0.00 0.00 32.58 32.88 1zye s HIS 136 CO 0.64 -0.30 -0.07 -0.48 -2.34 0.00 0.00 174.74 172.19 1zye s LEU 137 N -0.23 2.17 -0.05 8.88 0.05 -1.26 -1.39 118.68 126.85 1zye s LEU 137 Ca -0.04 -0.39 0.05 0.00 0.05 0.00 0.00 54.13 53.81 1zye s LEU 137 Cb -0.03 -0.22 -0.01 0.00 -2.05 0.00 0.00 46.19 43.88 1zye s LEU 137 CO 0.02 -0.10 -0.21 -0.44 -0.55 0.00 0.00 176.35 175.08 1zye s SER 138 N -1.05 2.55 -0.08 1.48 0.01 -0.19 -4.97 113.70 111.45 1zye s SER 138 Ca -0.05 -0.42 -0.01 0.00 1.31 0.00 0.00 55.95 56.78 1zye s SER 138 Cb -0.07 -0.71 0.03 0.00 0.21 0.00 0.00 66.02 65.48 1zye s SER 138 CO 0.00 0.19 -0.02 -0.69 0.41 0.00 0.00 173.24 173.14 1zye s VAL 139 N -0.04 0.51 0.03 3.43 1.01 -1.26 -0.23 120.40 123.85 1zye s VAL 139 Ca -0.04 0.02 0.03 0.00 0.00 0.00 0.00 61.98 61.99 1zye s VAL 139 Cb -0.13 -0.63 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1zye s VAL 139 CO 0.03 0.28 -0.02 0.20 0.00 0.00 0.00 175.10 175.59 1zye s ASN 140 N 1.81 4.96 0.66 3.32 0.01 -0.17 -4.98 114.94 120.55 1zye s ASN 140 Ca 0.03 -0.10 -0.17 0.00 -0.71 0.00 0.00 52.86 51.91 1zye s ASN 140 Cb -0.13 -1.22 -0.02 0.00 0.41 0.00 0.00 41.25 40.29 1zye s ASN 140 CO -0.05 0.25 0.97 -0.67 -1.51 0.00 0.00 177.10 176.08 1zye n ASP 141 N 1.15 0.66 -0.27 -1.22 2.03 -1.26 -2.40 116.55 115.24 1zye n ASP 141 Ca -0.13 0.74 0.13 0.00 0.52 0.00 0.00 54.79 56.04 1zye n ASP 141 Cb 0.52 -1.40 0.25 0.00 -0.72 0.00 0.00 41.12 39.77 1zye n ASP 141 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1zye n LEU 142 N -1.21 -0.07 -1.12 -2.67 4.77 -1.26 -2.68 117.00 112.76 1zye n LEU 142 Ca 0.14 1.34 0.04 0.00 -0.03 0.00 0.00 56.01 57.50 1zye n LEU 142 Cb 0.48 -0.50 0.20 0.00 -2.33 0.00 0.00 43.42 41.28 1zye n LEU 142 CO 0.49 -1.36 0.59 -0.81 -1.33 0.00 0.00 177.39 174.96 1zye n PRO 143 N -5.09 2.79 -4.02 3.23 -0.04 -1.26 -4.87 135.00 125.73 1zye n PRO 143 Ca 0.19 -1.57 -0.25 0.00 -0.04 0.00 0.00 63.50 61.83 1zye n PRO 143 Cb 0.63 -1.78 -0.17 0.00 -0.04 0.00 0.00 33.50 32.14 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 -1.82 0.89 0.43 0.52 1.01 -1.09 -5.07 120.40 115.27 1zye s VAL 144 Ca 0.28 -0.24 -0.21 0.00 0.00 0.00 0.00 61.98 61.80 1zye s VAL 144 Cb 0.20 -0.92 -0.10 0.00 0.00 0.00 0.00 36.38 35.56 1zye s VAL 144 CO 0.10 0.34 0.98 -0.83 0.00 0.00 0.00 175.10 175.68 1zye s GLY 145 N 1.51 2.47 0.60 4.51 0.00 -1.26 -4.84 107.32 110.31 1zye s GLY 145 Ca 0.00 0.47 -0.15 0.00 0.00 0.00 0.00 44.72 45.05 1zye s GLY 145 CO -0.05 0.78 1.04 0.50 0.00 0.00 0.00 173.10 175.37 1zye s ARG 146 N -3.07 3.38 -0.48 2.90 0.52 -1.26 -5.05 118.95 115.89 1zye s ARG 146 Ca 0.62 1.07 -0.22 0.00 -0.52 0.00 0.00 55.73 56.68 1zye s ARG 146 Cb -0.12 -2.05 0.03 0.00 0.52 0.00 0.00 34.95 33.33 1zye s ARG 146 CO 0.16 -0.75 0.77 0.45 0.02 0.00 0.00 175.30 175.95 1zye s SER 147 N -3.14 6.35 0.32 0.23 0.15 -1.26 -4.95 113.70 111.40 1zye s SER 147 Ca 0.61 -0.31 0.05 0.00 0.70 0.00 0.00 55.95 56.99 1zye s SER 147 Cb -0.14 -2.37 0.68 0.00 -1.71 0.00 0.00 66.02 62.48 1zye s SER 147 CO 0.41 -0.95 1.87 0.58 1.20 0.00 0.00 173.24 176.35 1zye h VAL 148 N 5.95 0.91 -0.32 4.45 2.07 -1.94 -1.49 116.25 125.88 1zye h VAL 148 Ca -0.25 -0.29 0.03 0.00 0.82 0.00 0.00 66.70 67.00 1zye h VAL 148 Cb 1.09 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1zye h VAL 148 CO 0.97 0.16 0.14 -0.33 0.02 0.00 0.00 177.57 178.53 1zye h GLU 149 N 0.85 0.29 -0.84 1.57 4.39 -1.96 -1.38 114.58 117.50 1zye h GLU 149 Ca 0.45 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 60.10 1zye h GLU 149 Cb 0.53 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.07 1zye h GLU 149 CO -0.21 0.19 0.42 1.49 -1.16 0.00 0.00 179.01 179.75 1zye h GLU 150 N 0.30 1.19 -0.55 2.33 4.57 -1.71 -0.74 114.58 119.97 1zye h GLU 150 Ca 0.14 -0.16 -0.11 0.00 -1.18 0.00 0.00 59.36 58.05 1zye h GLU 150 Cb 0.08 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 1zye h GLU 150 CO -0.12 0.90 -0.08 1.15 -1.18 0.00 0.00 179.01 179.68 1zye h THR 151 N 1.18 1.27 -0.58 0.32 2.02 -1.21 -1.76 112.91 114.15 1zye h THR 151 Ca 0.29 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.19 1zye h THR 151 Cb 0.09 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1zye h THR 151 CO -0.04 0.44 0.21 0.25 0.37 0.00 0.00 175.52 176.75 1zye h LEU 152 N 0.92 0.82 -0.89 2.58 5.85 -0.88 -1.14 115.31 122.57 1zye h LEU 152 Ca 0.15 -0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.75 1zye h LEU 152 Cb 0.65 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 1zye h LEU 152 CO 0.04 0.79 0.55 -0.09 -0.34 0.00 0.00 178.44 179.40 1zye h ARG 153 N 0.80 0.97 -0.14 1.25 2.43 -0.88 -2.22 114.38 116.59 1zye h ARG 153 Ca 0.19 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1zye h ARG 153 Cb 0.24 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1zye h ARG 153 CO -0.01 0.64 0.06 -0.07 -1.51 0.00 0.00 179.97 179.08 1zye h LEU 154 N 1.00 0.19 -0.15 3.80 3.38 -1.01 -0.45 115.31 122.08 1zye h LEU 154 Ca 0.39 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 58.25 1zye h LEU 154 Cb 0.20 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1zye h LEU 154 CO -0.18 0.30 -0.14 0.58 0.09 0.00 0.00 178.44 179.09 1zye h VAL 155 N 0.08 0.62 -0.19 1.22 2.07 -0.85 -2.03 116.25 117.17 1zye h VAL 155 Ca 0.05 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.61 1zye h VAL 155 Cb 0.16 0.62 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1zye h VAL 155 CO -0.00 0.00 -0.11 0.11 0.02 0.00 0.00 177.57 177.59 1zye h LYS 156 N -0.16 -0.09 -0.99 1.57 1.57 -1.33 -1.76 116.57 115.38 1zye h LYS 156 Ca 0.10 0.01 0.22 0.00 -1.87 0.00 0.00 60.65 59.10 1zye h LYS 156 Cb 0.30 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 32.53 1zye h LYS 156 CO -0.24 -0.06 0.62 0.00 -0.57 0.00 0.00 179.45 179.20 1zye h ALA 157 N 1.06 1.94 0.00 3.86 0.00 -0.73 -0.72 119.26 124.66 1zye h ALA 157 Ca 0.11 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.94 1zye h ALA 157 Cb 0.25 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1zye h ALA 157 CO -0.25 -0.31 -0.67 0.74 0.00 0.00 0.00 179.25 178.76 1zye h PHE 158 N 0.58 0.00 -0.08 0.00 0.04 -0.61 -2.28 116.94 114.59 1zye h PHE 158 Ca 0.56 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 61.25 1zye h PHE 158 Cb 1.13 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.28 1zye h PHE 158 CO -0.00 0.67 -0.26 1.96 -0.60 0.00 0.00 178.31 180.08 1zye h GLN 159 N 0.00 0.31 -0.22 1.51 4.20 -0.83 -2.86 115.11 117.22 1zye h GLN 159 Ca -0.01 -0.23 0.02 0.00 0.06 0.00 0.00 58.65 58.50 1zye h GLN 159 Cb 1.30 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 29.09 1zye h GLN 159 CO 0.09 0.86 -0.24 0.35 -0.67 0.00 0.00 178.83 179.22 1zye h PHE 160 N -0.17 -0.73 0.00 2.96 3.04 -1.16 -1.49 116.94 119.39 1zye h PHE 160 Ca -0.01 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.98 1zye h PHE 160 Cb 0.89 0.35 0.00 0.00 2.56 0.00 0.00 35.95 39.74 1zye h PHE 160 CO 0.12 -0.19 0.00 1.55 -2.02 0.00 0.00 178.31 177.77 1zye n VAL 161 N -3.84 1.14 -0.66 1.41 3.14 -0.86 -1.02 118.33 117.64 1zye n VAL 161 Ca -0.01 0.28 0.08 0.00 -2.96 0.00 0.00 64.34 61.74 1zye n VAL 161 Cb 0.13 -1.20 0.31 0.00 -1.06 0.00 0.00 33.84 32.02 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 -1.34 3.56 0.00 1.45 2.13 -0.57 -5.09 120.64 120.78 1zye n GLU 162 Ca 0.02 -2.78 0.00 0.00 0.66 0.00 0.00 57.16 55.06 1zye n GLU 162 Cb 0.04 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 29.93 1zye n GLU 162 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72