#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 1.33 -0.99 0.55 0.00 -1.26 -4.97 121.76 116.42 1zye s ALA 3 Ca 0.00 -1.68 -0.21 0.00 0.00 0.00 0.00 51.96 50.07 1zye s ALA 3 Cb 0.00 0.95 0.09 0.00 0.00 0.00 0.00 23.12 24.16 1zye s ALA 3 CO 0.00 -0.46 1.32 0.08 0.00 0.00 0.00 175.76 176.70 1zye s VAL 4 N -3.88 4.29 0.00 0.00 1.01 -1.26 -2.70 120.40 117.86 1zye s VAL 4 Ca 0.32 -1.18 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1zye s VAL 4 Cb 0.07 -4.94 0.00 0.00 0.00 0.00 0.00 36.38 31.51 1zye s VAL 4 CO 0.08 -1.75 0.00 0.35 0.00 0.00 0.00 175.10 173.78 1zye n THR 5 N 6.24 0.00 -2.88 3.92 -2.24 -1.05 -4.97 114.28 113.31 1zye n THR 5 Ca 0.30 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.89 1zye n THR 5 Cb 0.50 0.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.76 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 2.59 0.21 -0.78 -0.21 -1.10 -4.80 119.66 115.58 1zye s GLN 6 Ca 0.00 -1.16 -0.29 0.00 0.02 0.00 0.00 55.36 53.93 1zye s GLN 6 Cb 0.00 -2.64 -0.08 0.00 1.00 0.00 0.00 33.01 31.29 1zye s GLN 6 CO 0.00 -0.56 0.91 -1.01 -2.12 0.00 0.00 175.29 172.51 1zye s HIS 7 N -2.57 3.96 0.27 0.91 3.76 -1.26 -0.55 115.29 119.80 1zye s HIS 7 Ca 0.57 1.85 -0.30 0.00 -0.15 0.00 0.00 55.06 57.03 1zye s HIS 7 Cb -0.09 -2.94 -0.10 0.00 1.11 0.00 0.00 32.58 30.56 1zye s HIS 7 CO 0.36 0.45 1.40 0.00 -0.85 0.00 0.00 174.74 176.09 1zye s ALA 8 N -1.06 3.58 0.53 -1.40 0.00 -0.35 -4.83 121.76 118.22 1zye s ALA 8 Ca 0.40 1.29 -0.20 0.00 0.00 0.00 0.00 51.96 53.45 1zye s ALA 8 Cb -0.25 -3.53 -0.08 0.00 0.00 0.00 0.00 23.12 19.26 1zye s ALA 8 CO 0.31 -0.70 0.83 -2.30 0.00 0.00 0.00 175.76 173.89 1zye n PRO 9 N 1.96 0.91 -1.75 0.00 -0.02 -1.26 -4.93 135.00 129.91 1zye n PRO 9 Ca 0.05 0.34 -0.37 0.00 -2.02 0.00 0.00 63.50 61.50 1zye n PRO 9 Cb 0.41 -1.96 0.07 0.00 -0.02 0.00 0.00 33.50 32.00 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 -1.49 2.09 -0.07 6.00 5.04 -1.26 -4.95 117.35 122.71 1zye s TYR 10 Ca 0.69 1.49 -0.10 0.00 -2.44 0.00 0.00 57.07 56.72 1zye s TYR 10 Cb -0.48 -3.67 0.02 0.00 0.35 0.00 0.00 41.96 38.18 1zye s TYR 10 CO 0.53 -2.87 0.25 -0.59 -1.34 0.00 0.00 175.55 171.53 1zye s PHE 11 N -1.43 -0.23 0.10 4.97 -0.12 -1.26 -4.99 117.98 115.02 1zye s PHE 11 Ca 0.82 0.52 0.02 0.00 -0.05 0.00 0.00 56.93 58.24 1zye s PHE 11 Cb -0.37 0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.06 1zye s PHE 11 CO 0.39 -0.20 -0.06 0.21 -0.05 0.00 0.00 175.22 175.51 1zye s LYS 12 N -0.29 0.86 0.00 1.99 2.20 -1.26 -1.61 119.74 121.62 1zye s LYS 12 Ca -0.04 -1.35 0.00 0.00 -0.36 0.00 0.00 55.97 54.22 1zye s LYS 12 Cb -0.03 -0.23 0.00 0.00 -1.51 0.00 0.00 37.83 36.06 1zye s LYS 12 CO 0.01 -0.02 0.00 0.41 -0.36 0.00 0.00 175.35 175.39 1zye n GLY 13 N -0.06 2.83 3.70 5.54 0.00 -0.97 -4.99 105.19 111.24 1zye n GLY 13 Ca -0.12 -1.12 -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 4.71 0.31 2.61 2.01 -1.26 -2.17 115.64 119.85 1zye s THR 14 Ca 0.00 1.96 0.09 0.00 0.31 0.00 0.00 61.69 64.05 1zye s THR 14 Cb 0.00 -4.26 -0.05 0.00 0.01 0.00 0.00 72.50 68.21 1zye s THR 14 CO 0.00 0.06 0.06 0.00 -0.69 0.00 0.00 174.62 174.05 1zye s ALA 15 N 1.64 3.30 -0.61 7.40 0.00 0.45 -1.01 121.76 132.94 1zye s ALA 15 Ca 0.51 -1.80 -0.17 0.00 0.00 0.00 0.00 51.96 50.51 1zye s ALA 15 Cb -0.21 -0.66 0.13 0.00 0.00 0.00 0.00 23.12 22.39 1zye s ALA 15 CO 0.22 0.13 0.61 0.08 0.00 0.00 0.00 175.76 176.80 1zye s VAL 16 N -2.41 5.14 -0.13 0.00 1.01 -0.09 -0.91 120.40 123.01 1zye s VAL 16 Ca 0.35 -1.49 -0.07 0.00 0.00 0.00 0.00 61.98 60.77 1zye s VAL 16 Cb -0.03 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.88 1zye s VAL 16 CO 0.21 -0.99 0.03 0.58 0.00 0.00 0.00 175.10 174.93 1zye h VAL 17 N 5.75 0.24 0.00 2.92 2.07 -1.34 -2.81 116.25 123.08 1zye h VAL 17 Ca -0.23 -1.21 0.00 0.00 0.82 0.00 0.00 66.70 66.08 1zye h VAL 17 Cb 1.09 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1zye h VAL 17 CO 1.02 0.08 0.00 -1.20 0.02 0.00 0.00 177.57 177.49 1zye n SER 18 N -4.68 0.00 -1.03 0.57 7.64 -1.26 -4.69 113.62 110.16 1zye n SER 18 Ca -0.06 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.90 1zye n SER 18 Cb 0.18 0.00 0.25 0.00 -1.01 0.00 0.00 64.21 63.64 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 4.04 3.14 3.41 0.23 0.00 -1.26 -4.89 105.19 109.86 1zye n GLY 19 Ca 0.00 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 45.01 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 -1.82 1.46 0.22 1.61 2.02 -1.26 -5.12 118.70 115.81 1zye s GLU 20 Ca 0.38 -1.44 -0.28 0.00 0.02 0.00 0.00 54.97 53.65 1zye s GLU 20 Cb 0.26 -1.86 -0.09 0.00 0.10 0.00 0.00 34.13 32.54 1zye s GLU 20 CO 0.17 0.42 0.89 -0.06 0.02 0.00 0.00 175.26 176.70 1zye s PHE 21 N -1.39 3.96 -0.16 1.61 0.08 -1.26 -0.91 117.98 119.92 1zye s PHE 21 Ca 0.17 1.82 -0.14 0.00 0.12 0.00 0.00 56.93 58.91 1zye s PHE 21 Cb -0.09 -2.91 0.04 0.00 -0.57 0.00 0.00 43.02 39.49 1zye s PHE 21 CO 0.08 0.47 0.41 0.21 -0.10 0.00 0.00 175.22 176.29 1zye s LYS 22 N -1.20 0.47 0.08 0.44 2.20 -0.09 -4.88 119.74 116.76 1zye s LYS 22 Ca 0.40 0.60 -0.31 0.00 -0.36 0.00 0.00 55.97 56.30 1zye s LYS 22 Cb -0.25 0.20 -0.06 0.00 -1.51 0.00 0.00 37.83 36.21 1zye s LYS 22 CO 0.30 -0.07 1.23 -1.21 -0.36 0.00 0.00 175.35 175.24 1zye s GLU 23 N 0.38 4.42 0.06 4.03 0.41 -1.26 -0.41 118.70 126.32 1zye s GLU 23 Ca -0.01 1.83 0.03 0.00 -0.41 0.00 0.00 54.97 56.41 1zye s GLU 23 Cb -0.04 -3.32 -0.03 0.00 -1.78 0.00 0.00 34.13 28.97 1zye s GLU 23 CO -0.01 -0.27 -0.09 0.96 -0.49 0.00 0.00 175.26 175.35 1zye s ILE 24 N 0.97 0.70 0.24 -1.63 -4.36 -0.92 -4.93 121.20 111.27 1zye s ILE 24 Ca 0.59 -1.27 -0.05 0.00 -0.26 0.00 0.00 60.65 59.67 1zye s ILE 24 Cb -0.31 -0.88 -0.02 0.00 1.25 0.00 0.00 42.46 42.50 1zye s ILE 24 CO 0.30 -0.42 0.31 -0.94 0.24 0.00 0.00 174.94 174.42 1zye s SER 25 N -1.85 0.25 0.43 4.36 1.04 -1.26 -2.30 113.70 114.37 1zye s SER 25 Ca -0.05 -1.26 0.11 0.00 0.48 0.00 0.00 55.95 55.24 1zye s SER 25 Cb -0.08 0.50 0.97 0.00 0.10 0.00 0.00 66.02 67.51 1zye s SER 25 CO 0.00 -1.02 2.02 0.25 0.98 0.00 0.00 173.24 175.47 1zye h LEU 26 N 2.40 0.40 -1.37 2.42 5.85 -1.67 -2.52 115.31 120.82 1zye h LEU 26 Ca -0.31 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.43 1zye h LEU 26 Cb 1.25 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.16 1zye h LEU 26 CO 0.44 0.26 0.44 0.44 -0.34 0.00 0.00 178.44 179.68 1zye h ASP 27 N 0.46 0.73 0.01 1.25 3.32 -1.96 -2.03 116.42 118.19 1zye h ASP 27 Ca 0.22 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1zye h ASP 27 Cb 0.28 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1zye h ASP 27 CO -0.06 0.52 0.00 0.47 -1.72 0.00 0.00 179.24 178.45 1zye n ASP 28 N -4.45 0.00 -0.32 6.45 8.00 -0.95 -1.56 116.55 123.73 1zye n ASP 28 Ca 0.07 0.44 0.09 0.00 0.71 0.00 0.00 54.79 56.11 1zye n ASP 28 Cb 0.08 -0.45 0.17 0.00 -0.02 0.00 0.00 41.12 40.90 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 -1.45 0.25 -2.11 1.24 3.72 -0.76 -4.98 117.46 113.37 1zye n PHE 29 Ca 0.00 -1.02 -0.41 0.00 -0.05 0.00 0.00 57.45 55.97 1zye n PHE 29 Cb 0.00 -0.20 -0.03 0.00 -0.94 0.00 0.00 39.48 38.31 1zye n PHE 29 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1zye s LYS 30 N -2.90 4.33 -1.32 -1.08 2.47 -0.60 -2.53 119.74 118.11 1zye s LYS 30 Ca 0.35 2.18 0.00 0.00 -1.56 0.00 0.00 55.97 56.94 1zye s LYS 30 Cb 0.30 -3.16 0.00 0.00 -1.46 0.00 0.00 37.83 33.52 1zye s LYS 30 CO 0.04 -0.35 0.00 0.41 0.16 0.00 0.00 175.35 175.61 1zye n GLY 31 N 2.38 1.28 3.24 5.54 0.00 0.16 -4.99 105.19 112.80 1zye n GLY 31 Ca 0.07 -0.22 -0.15 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.94 1.02 0.13 1.61 1.02 -1.05 -4.81 119.74 114.71 1zye s LYS 32 Ca 0.00 -1.37 -0.28 0.00 0.02 0.00 0.00 55.97 54.35 1zye s LYS 32 Cb 0.00 -0.65 -0.07 0.00 -0.52 0.00 0.00 37.83 36.59 1zye s LYS 32 CO 0.00 0.09 0.87 0.71 -0.92 0.00 0.00 175.35 176.10 1zye s TYR 33 N -2.98 3.84 -0.14 3.18 1.51 -0.78 -2.64 117.35 119.35 1zye s TYR 33 Ca 0.13 1.71 0.02 0.00 -1.01 0.00 0.00 57.07 57.92 1zye s TYR 33 Cb 0.00 -2.93 0.01 0.00 -0.11 0.00 0.00 41.96 38.94 1zye s TYR 33 CO 0.01 0.33 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.41 1zye s LEU 34 N -0.44 1.97 -0.50 -1.29 0.20 0.94 0.91 118.68 120.48 1zye s LEU 34 Ca 0.42 -0.56 -0.15 0.00 0.69 0.00 0.00 54.13 54.52 1zye s LEU 34 Cb -0.23 -1.34 0.10 0.00 -0.43 0.00 0.00 46.19 44.29 1zye s LEU 34 CO 0.28 0.04 0.43 -0.69 -0.29 0.00 0.00 176.35 176.12 1zye s VAL 35 N 1.01 5.19 -0.25 1.68 1.01 0.98 -1.14 120.40 128.88 1zye s VAL 35 Ca -0.04 -1.26 -0.09 0.00 0.00 0.00 0.00 61.98 60.60 1zye s VAL 35 Cb -0.15 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 1zye s VAL 35 CO -0.05 -0.70 0.12 -0.22 0.00 0.00 0.00 175.10 174.25 1zye s LEU 36 N 1.62 3.74 0.01 3.92 2.96 -0.74 -1.28 118.68 128.91 1zye s LEU 36 Ca 0.04 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.89 1zye s LEU 36 Cb -0.27 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.40 1zye s LEU 36 CO 0.05 -0.00 -0.06 0.72 -1.32 0.00 0.00 176.35 175.74 1zye s PHE 37 N 1.43 0.56 0.05 5.38 -0.71 -0.77 0.30 117.98 124.22 1zye s PHE 37 Ca 0.06 -0.24 0.02 0.00 -1.04 0.00 0.00 56.93 55.74 1zye s PHE 37 Cb -0.15 -0.35 -0.04 0.00 -1.21 0.00 0.00 43.02 41.27 1zye s PHE 37 CO 0.06 -0.03 0.04 -0.06 -1.34 0.00 0.00 175.22 173.89 1zye s PHE 38 N -0.57 3.13 0.07 3.49 0.40 0.20 -0.41 117.98 124.30 1zye s PHE 38 Ca -0.02 0.08 0.00 0.00 -0.60 0.00 0.00 56.93 56.39 1zye s PHE 38 Cb -0.05 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.81 1zye s PHE 38 CO 0.00 0.50 -0.05 1.52 0.70 0.00 0.00 175.22 177.89 1zye s TYR 39 N -1.26 0.69 0.00 0.36 1.13 -0.30 -3.42 117.35 114.55 1zye s TYR 39 Ca 0.25 -0.96 0.00 0.00 -1.41 0.00 0.00 57.07 54.95 1zye s TYR 39 Cb -0.12 -0.44 0.00 0.00 -1.10 0.00 0.00 41.96 40.30 1zye s TYR 39 CO 0.17 -0.25 0.49 -2.30 -2.51 0.00 0.00 175.55 171.14 1zye n PRO 40 N 0.13 0.00 -3.87 -3.49 -0.02 -1.23 -4.36 135.00 122.16 1zye n PRO 40 Ca -0.14 0.07 -0.11 0.00 -2.02 0.00 0.00 63.50 61.30 1zye n PRO 40 Cb 0.60 -0.99 -0.10 0.00 -0.02 0.00 0.00 33.50 33.00 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 -1.12 1.57 0.57 2.45 1.43 -1.26 -4.03 118.68 118.30 1zye s LEU 41 Ca 0.00 -0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 52.70 1zye s LEU 41 Cb 0.00 0.66 -0.05 0.00 0.03 0.00 0.00 46.19 46.84 1zye s LEU 41 CO 0.00 -0.38 1.07 -1.81 0.23 0.00 0.00 176.35 175.47 1zye s ASP 42 N -1.42 5.82 -1.38 2.29 1.01 -1.26 -3.82 116.67 117.91 1zye s ASP 42 Ca -0.15 1.94 0.00 0.00 0.71 0.00 0.00 52.55 55.05 1zye s ASP 42 Cb -0.07 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.30 1zye s ASP 42 CO 0.01 -1.14 0.00 0.49 0.21 0.00 0.00 175.17 174.74 1zye n PHE 43 N -1.68 -0.16 -3.75 4.23 3.72 -1.26 -5.01 117.46 113.55 1zye n PHE 43 Ca 0.10 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.15 1zye n PHE 43 Cb 0.52 -2.57 -0.05 0.00 -0.94 0.00 0.00 39.48 36.44 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 -2.55 5.29 0.42 4.37 -4.23 -1.25 -4.99 115.64 112.70 1zye s THR 44 Ca 0.00 0.17 0.20 0.00 -1.18 0.00 0.00 61.69 60.88 1zye s THR 44 Cb 0.00 -3.57 0.22 0.00 1.34 0.00 0.00 72.50 70.49 1zye s THR 44 CO 0.00 0.35 2.01 -0.26 -0.54 0.00 0.00 174.62 176.17 1zye h PHE 45 N 3.92 0.00 0.04 3.99 0.04 -1.95 -3.23 116.94 119.75 1zye h PHE 45 Ca -0.50 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.04 1zye h PHE 45 Cb 1.20 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.35 1zye h PHE 45 CO 0.68 0.18 -1.01 0.28 -0.60 0.00 0.00 178.31 177.83 1zye h VAL 46 N 0.00 1.44 0.04 -0.55 2.07 -1.97 -3.41 116.25 113.88 1zye h VAL 46 Ca -0.00 -2.62 -0.25 0.00 0.82 0.00 0.00 66.70 64.65 1zye h VAL 46 Cb 0.37 2.56 0.01 0.00 -1.52 0.00 0.00 31.29 32.71 1zye h VAL 46 CO 0.02 0.78 -1.04 0.00 0.02 0.00 0.00 177.57 177.35 1zye h PRO 48 N 0.20 0.03 -0.35 0.00 0.13 -1.79 -2.95 132.00 127.28 1zye h PRO 48 Ca -0.10 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.91 1zye h PRO 48 Cb 1.70 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.82 1zye h PRO 48 CO 0.18 0.37 -0.21 1.79 -0.23 0.00 0.00 178.00 179.91 1zye h THR 49 N 0.03 1.27 -0.21 1.56 1.35 -1.90 -0.54 112.91 114.47 1zye h THR 49 Ca 0.00 -1.27 -0.17 0.00 -0.55 0.00 0.00 66.41 64.43 1zye h THR 49 Cb 0.61 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 1zye h THR 49 CO 0.04 0.42 -0.52 -0.08 -0.25 0.00 0.00 175.52 175.14 1zye h GLU 50 N 0.59 0.71 -0.20 4.72 4.81 -1.82 -2.09 114.58 121.31 1zye h GLU 50 Ca 0.09 -0.49 -0.02 0.00 -0.13 0.00 0.00 59.36 58.81 1zye h GLU 50 Cb 0.67 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 1zye h GLU 50 CO 0.05 1.11 0.06 0.82 -0.73 0.00 0.00 179.01 180.32 1zye h ILE 51 N 0.43 1.19 -0.50 2.32 2.04 -1.48 -2.78 117.51 118.73 1zye h ILE 51 Ca -0.01 -0.61 0.04 0.00 1.00 0.00 0.00 64.86 65.28 1zye h ILE 51 Cb 1.13 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 38.40 1zye h ILE 51 CO 0.11 0.19 0.26 0.40 0.00 0.00 0.00 178.15 179.11 1zye h ILE 52 N 0.14 0.96 -0.88 -0.67 2.04 -1.16 -2.25 117.51 115.70 1zye h ILE 52 Ca 0.06 -0.17 0.20 0.00 1.00 0.00 0.00 64.86 65.95 1zye h ILE 52 Cb 0.24 0.42 -0.12 0.00 -0.74 0.00 0.00 36.82 36.63 1zye h ILE 52 CO -0.00 0.09 0.40 0.00 0.00 0.00 0.00 178.15 178.64 1zye h ALA 53 N 1.27 1.39 -0.38 1.87 0.00 -1.21 -1.12 119.26 121.06 1zye h ALA 53 Ca 0.22 0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.14 1zye h ALA 53 Cb 0.12 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1zye h ALA 53 CO -0.15 -0.27 -0.26 0.74 0.00 0.00 0.00 179.25 179.31 1zye h PHE 54 N 0.46 1.00 -0.54 0.00 0.04 -1.16 -2.86 116.94 113.88 1zye h PHE 54 Ca 0.53 -0.27 0.06 0.00 2.80 0.00 0.00 57.97 61.08 1zye h PHE 54 Cb 0.94 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 38.82 1zye h PHE 54 CO -0.13 1.06 0.26 1.03 -0.60 0.00 0.00 178.31 179.93 1zye h SER 55 N 0.66 0.36 0.16 2.17 0.87 -0.70 0.02 113.55 117.09 1zye h SER 55 Ca 0.08 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1zye h SER 55 Cb 0.84 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.77 1zye h SER 55 CO 0.07 0.24 -0.08 0.44 -0.53 0.00 0.00 176.83 176.97 1zye h ASP 56 N 0.50 -0.18 0.00 6.23 3.32 -1.28 -2.85 116.42 122.16 1zye h ASP 56 Ca 0.25 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1zye h ASP 56 Cb 0.19 0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.79 1zye h ASP 56 CO -0.19 -0.13 0.00 0.29 -1.72 0.00 0.00 179.24 177.49 1zye n LYS 57 N -2.59 0.24 -0.26 3.56 4.76 -1.08 -4.02 118.16 118.78 1zye n LYS 57 Ca -0.03 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.38 1zye n LYS 57 Cb 0.09 -1.31 0.03 0.00 -1.84 0.00 0.00 35.03 32.00 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 2.10 0.11 -0.95 7.82 0.00 -0.73 -0.07 119.26 127.53 1zye h ALA 58 Ca 0.00 0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.19 1zye h ALA 58 Cb 0.00 0.80 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 1zye h ALA 58 CO 0.00 -0.61 0.62 0.66 0.00 0.00 0.00 179.25 179.91 1zye h SER 59 N -0.09 0.98 -0.94 0.00 4.64 -1.82 -0.44 113.55 115.87 1zye h SER 59 Ca 0.29 0.01 0.21 0.00 -0.47 0.00 0.00 61.79 61.83 1zye h SER 59 Cb 0.57 -0.20 -0.12 0.00 -0.31 0.00 0.00 62.40 62.34 1zye h SER 59 CO -0.78 0.63 0.50 -0.33 -0.87 0.00 0.00 176.83 175.98 1zye h GLU 60 N 1.11 0.53 -0.23 4.77 5.08 -1.31 0.29 114.58 124.82 1zye h GLU 60 Ca 0.41 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.66 1zye h GLU 60 Cb 0.17 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 1zye h GLU 60 CO -0.16 0.35 -0.17 0.74 -1.00 0.00 0.00 179.01 178.77 1zye h PHE 61 N 0.54 0.61 -0.65 4.33 -1.00 -1.04 -3.14 116.94 116.60 1zye h PHE 61 Ca 0.58 -0.17 0.09 0.00 2.81 0.00 0.00 57.97 61.28 1zye h PHE 61 Cb 1.04 -0.13 -0.07 0.00 3.61 0.00 0.00 35.95 40.39 1zye h PHE 61 CO -0.07 0.83 0.29 0.45 -1.61 0.00 0.00 178.31 178.20 1zye h HIS 62 N 0.22 0.52 -0.74 -0.55 3.86 -0.74 0.63 115.15 118.35 1zye h HIS 62 Ca 0.04 0.03 0.09 0.00 -1.16 0.00 0.00 60.37 59.37 1zye h HIS 62 Cb 0.70 -0.14 -0.07 0.00 1.06 0.00 0.00 27.41 28.96 1zye h HIS 62 CO 0.07 0.18 0.39 -0.44 0.86 0.00 0.00 177.93 178.99 1zye h ASP 63 N 0.51 0.52 -0.26 2.45 3.45 -1.00 0.95 116.42 123.04 1zye h ASP 63 Ca 0.32 0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.83 1zye h ASP 63 Cb 0.35 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 39.08 1zye h ASP 63 CO -0.27 0.30 0.00 1.33 -1.57 0.00 0.00 179.24 179.03 1zye n VAL 64 N -4.83 0.98 -2.85 -1.35 0.24 -0.82 -4.90 118.33 104.79 1zye n VAL 64 Ca 0.12 -0.55 -0.10 0.00 -2.04 0.00 0.00 64.34 61.76 1zye n VAL 64 Cb 0.27 -0.24 0.05 0.00 -1.47 0.00 0.00 33.84 32.45 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 0.31 -2.11 -3.80 -1.34 5.15 0.33 -4.92 115.26 108.88 1zye n ASN 65 Ca 0.11 -0.38 -0.18 0.00 -0.60 0.00 0.00 54.58 53.54 1zye n ASN 65 Cb 0.55 -3.29 -0.16 0.00 -0.53 0.00 0.00 39.78 36.35 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 1.23 3.78 -0.18 0.00 0.41 0.26 -2.96 118.70 121.24 1zye s GLU 67 Ca -0.07 0.28 0.00 0.00 -0.41 0.00 0.00 54.97 54.77 1zye s GLU 67 Cb -0.13 -2.58 0.04 0.00 -1.78 0.00 0.00 34.13 29.68 1zye s GLU 67 CO -0.02 0.22 -0.07 0.08 -0.49 0.00 0.00 175.26 174.98 1zye s VAL 68 N -1.99 1.32 -0.16 2.63 1.01 -1.26 -0.02 120.40 121.93 1zye s VAL 68 Ca 0.48 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.65 1zye s VAL 68 Cb -0.11 -1.48 0.00 0.00 0.00 0.00 0.00 36.38 34.80 1zye s VAL 68 CO 0.25 0.11 -0.17 0.54 0.00 0.00 0.00 175.10 175.83 1zye s VAL 69 N 1.54 2.50 0.43 2.92 0.11 -0.41 -3.31 120.40 124.17 1zye s VAL 69 Ca -0.01 -0.82 -0.11 0.00 -2.93 0.00 0.00 61.98 58.11 1zye s VAL 69 Cb -0.16 -2.05 -0.07 0.00 -1.53 0.00 0.00 36.38 32.58 1zye s VAL 69 CO -0.08 0.52 0.81 0.00 -3.33 0.00 0.00 175.10 173.02 1zye s ALA 70 N 0.92 3.30 -0.01 1.54 0.00 -0.54 -1.85 121.76 125.11 1zye s ALA 70 Ca -0.04 -0.15 -0.16 0.00 0.00 0.00 0.00 51.96 51.62 1zye s ALA 70 Cb -0.15 -2.77 0.03 0.00 0.00 0.00 0.00 23.12 20.22 1zye s ALA 70 CO -0.02 -0.06 0.35 0.54 0.00 0.00 0.00 175.76 176.56 1zye s VAL 71 N -2.43 0.05 0.10 0.00 0.11 0.45 -0.38 120.40 118.30 1zye s VAL 71 Ca 0.52 -0.44 -0.26 0.00 -2.93 0.00 0.00 61.98 58.87 1zye s VAL 71 Cb -0.10 -0.68 0.08 0.00 -1.53 0.00 0.00 36.38 34.14 1zye s VAL 71 CO 0.32 -0.24 0.81 -0.94 -3.33 0.00 0.00 175.10 171.72 1zye s SER 72 N -1.39 -0.37 0.00 3.54 1.04 -1.18 -1.15 113.70 114.19 1zye s SER 72 Ca -0.13 -0.14 0.06 0.00 0.48 0.00 0.00 55.95 56.22 1zye s SER 72 Cb -0.04 0.50 0.36 0.00 0.10 0.00 0.00 66.02 66.94 1zye s SER 72 CO 0.04 -0.84 0.88 1.33 0.98 0.00 0.00 173.24 175.63 1zye n VAL 73 N -0.35 0.00 -1.87 5.02 0.24 -1.26 -1.55 118.33 118.57 1zye n VAL 73 Ca -0.10 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.89 1zye n VAL 73 Cb 0.62 -0.38 0.02 0.00 -1.47 0.00 0.00 33.84 32.63 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 -1.62 5.98 0.60 -1.34 1.01 -1.26 -3.88 116.67 116.17 1zye s ASP 74 Ca 0.09 1.33 -0.16 0.00 0.71 0.00 0.00 52.55 54.53 1zye s ASP 74 Cb 0.04 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.64 1zye s ASP 74 CO 0.07 -1.02 1.07 -0.94 0.21 0.00 0.00 175.17 174.56 1zye s SER 75 N -4.23 5.61 0.15 0.27 1.04 -1.26 -3.27 113.70 112.01 1zye s SER 75 Ca 0.56 1.89 0.20 0.00 0.48 0.00 0.00 55.95 59.08 1zye s SER 75 Cb -0.11 -2.54 0.85 0.00 0.10 0.00 0.00 66.02 64.31 1zye s SER 75 CO 0.53 -1.28 1.63 0.00 0.98 0.00 0.00 173.24 175.10 1zye n HIS 76 N -2.06 0.49 -0.05 5.02 1.44 -1.26 -1.98 115.22 116.81 1zye n HIS 76 Ca 0.09 0.19 -0.14 0.00 -2.01 0.00 0.00 57.72 55.85 1zye n HIS 76 Cb 0.52 -0.80 -0.07 0.00 0.12 0.00 0.00 29.99 29.76 1zye n HIS 76 CO 0.00 0.00 0.00 0.74 -2.81 0.00 0.00 176.34 174.27 1zye h PHE 77 N 0.00 0.53 -0.97 -1.40 0.04 -1.98 -2.54 116.94 110.62 1zye h PHE 77 Ca 0.00 -0.19 0.09 0.00 2.80 0.00 0.00 57.97 60.67 1zye h PHE 77 Cb 0.34 -0.10 -0.07 0.00 2.20 0.00 0.00 35.95 38.32 1zye h PHE 77 CO 0.00 0.88 0.61 0.77 -0.60 0.00 0.00 178.31 179.97 1zye h SER 78 N 0.02 0.94 0.18 2.17 0.02 -1.77 -0.99 113.55 114.11 1zye h SER 78 Ca 0.01 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1zye h SER 78 Cb 0.85 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 63.19 1zye h SER 78 CO 0.06 0.56 -0.24 0.45 -1.14 0.00 0.00 176.83 176.52 1zye h HIS 79 N 1.05 -0.63 0.42 3.45 3.86 -1.40 -1.60 115.15 120.30 1zye h HIS 79 Ca 0.44 0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.65 1zye h HIS 79 Cb 0.29 0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 1zye h HIS 79 CO -0.01 -0.34 -0.30 1.25 0.86 0.00 0.00 177.93 179.38 1zye h LEU 80 N -0.47 -0.79 -1.50 2.43 5.85 -1.21 -0.94 115.31 118.69 1zye h LEU 80 Ca 0.01 0.06 0.39 0.00 0.84 0.00 0.00 57.88 59.18 1zye h LEU 80 Cb 0.46 0.25 -0.11 0.00 0.37 0.00 0.00 40.66 41.63 1zye h LEU 80 CO -0.09 -0.46 0.85 0.00 -0.34 0.00 0.00 178.44 178.39 1zye h ALA 81 N -0.23 2.73 0.25 1.25 0.00 -1.08 0.39 119.26 122.57 1zye h ALA 81 Ca -0.04 0.07 -0.33 0.00 0.00 0.00 0.00 54.91 54.61 1zye h ALA 81 Cb 0.61 0.14 0.04 0.00 0.00 0.00 0.00 17.79 18.58 1zye h ALA 81 CO 0.01 -1.27 -1.45 2.35 0.00 0.00 0.00 179.25 178.89 1zye h TRP 82 N 0.15 0.95 -0.72 0.00 7.01 -0.24 -2.77 115.95 120.33 1zye h TRP 82 Ca 0.75 -0.70 0.11 0.00 2.11 0.00 0.00 58.89 61.16 1zye h TRP 82 Cb 2.36 -0.04 -0.08 0.00 -2.10 0.00 0.00 29.16 29.30 1zye h TRP 82 CO -0.00 1.56 0.32 0.82 -2.79 0.00 0.00 178.44 178.34 1zye h ILE 83 N 0.11 0.76 0.00 2.65 2.04 0.06 -1.61 117.51 121.53 1zye h ILE 83 Ca -0.26 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1zye h ILE 83 Cb 2.14 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 1zye h ILE 83 CO 0.27 0.09 0.00 0.59 0.00 0.00 0.00 178.15 179.10 1zye n ASN 84 N -4.93 0.00 -4.68 1.72 3.02 0.00 -2.11 115.26 108.28 1zye n ASN 84 Ca 0.12 -0.14 -0.41 0.00 -0.03 0.00 0.00 54.58 54.12 1zye n ASN 84 Cb 0.33 -0.25 -0.05 0.00 -0.61 0.00 0.00 39.78 39.21 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 -2.49 4.95 0.47 3.41 2.01 -0.68 -4.94 115.64 118.38 1zye s THR 85 Ca 0.24 1.50 -0.24 0.00 0.31 0.00 0.00 61.69 63.50 1zye s THR 85 Cb 0.16 -4.08 -0.07 0.00 0.01 0.00 0.00 72.50 68.52 1zye s THR 85 CO 0.35 0.11 1.40 -2.84 -0.69 0.00 0.00 174.62 172.94 1zye s PRO 86 N 1.72 3.57 0.26 4.92 0.02 -1.26 -1.84 135.00 142.39 1zye s PRO 86 Ca 0.36 2.35 -0.01 0.00 0.02 0.00 0.00 61.00 63.72 1zye s PRO 86 Cb -0.17 -2.56 0.53 0.00 0.02 0.00 0.00 34.50 32.32 1zye s PRO 86 CO 0.14 -0.88 1.77 0.00 -0.33 0.00 0.00 177.00 177.70 1zye h ARG 87 N 2.13 0.66 -0.79 5.54 3.08 -1.82 -1.95 114.38 121.23 1zye h ARG 87 Ca -0.51 -0.04 0.16 0.00 0.07 0.00 0.00 59.98 59.66 1zye h ARG 87 Cb 1.27 -0.15 -0.15 0.00 0.08 0.00 0.00 29.97 31.02 1zye h ARG 87 CO 0.60 0.44 -0.21 1.17 -1.07 0.00 0.00 179.97 180.90 1zye n LYS 88 N -4.83 -0.08 -1.89 0.04 4.81 -1.26 -1.46 118.16 113.49 1zye n LYS 88 Ca 0.17 1.24 -0.35 0.00 -0.87 0.00 0.00 58.31 58.50 1zye n LYS 88 Cb 0.42 -1.85 0.04 0.00 0.02 0.00 0.00 35.03 33.66 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 -5.28 6.80 0.00 3.14 3.02 -0.77 -4.88 115.26 117.30 1zye n ASN 89 Ca 0.12 -3.80 0.00 0.00 -0.03 0.00 0.00 54.58 50.88 1zye n ASN 89 Cb 0.39 -0.86 0.00 0.00 -0.61 0.00 0.00 39.78 38.70 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 -0.64 0.79 0.00 7.41 0.00 -0.53 -4.89 105.19 107.32 1zye n GLY 90 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 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 -2.03 -0.90 0.12 -0.02 0.00 -1.00 -4.91 105.19 96.43 1zye n GLY 91 Ca 0.00 -1.63 -0.16 0.00 0.00 0.00 0.00 46.02 44.23 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 2.64 0.00 0.99 4.77 -0.77 -4.47 117.00 120.15 1zye n LEU 92 Ca 0.00 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1zye n LEU 92 Cb 0.00 -0.69 0.00 0.00 -2.33 0.00 0.00 43.42 40.40 1zye n LEU 92 CO 0.00 0.86 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1zye n GLY 93 N 2.29 -0.80 3.62 -0.72 0.00 -0.77 -4.63 105.19 104.19 1zye n GLY 93 Ca -0.41 -1.12 -0.49 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.50 1.82 -5.18 1.61 -0.00 -1.26 -4.70 115.22 107.01 1zye n HIS 94 Ca 0.00 0.49 -0.32 0.00 -0.00 0.00 0.00 57.72 57.89 1zye n HIS 94 Cb 0.00 -2.41 -0.16 0.00 -0.00 0.00 0.00 29.99 27.42 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 0.49 2.57 0.00 1.57 0.00 -1.26 -5.01 119.30 117.65 1zye s MET 95 Ca 0.80 -0.86 0.19 0.00 0.00 0.00 0.00 55.69 55.82 1zye s MET 95 Cb -0.82 -2.22 0.26 0.00 0.00 0.00 0.00 34.83 32.05 1zye s MET 95 CO 0.44 0.42 1.20 0.09 0.00 0.00 0.00 175.02 177.17 1zye n ASN 96 N 2.86 2.89 -4.42 1.11 3.02 -1.26 -4.95 115.26 114.50 1zye n ASN 96 Ca -0.17 -1.86 -0.24 0.00 -0.03 0.00 0.00 54.58 52.28 1zye n ASN 96 Cb 0.52 -0.11 -0.11 0.00 -0.61 0.00 0.00 39.78 39.47 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 -1.45 2.24 0.36 2.41 -4.36 -1.26 -4.95 121.20 114.19 1zye s ILE 97 Ca 0.27 -2.19 -0.27 0.00 -0.26 0.00 0.00 60.65 58.20 1zye s ILE 97 Cb 0.17 -2.14 -0.09 0.00 1.25 0.00 0.00 42.46 41.65 1zye s ILE 97 CO 0.25 -0.32 1.25 0.00 0.24 0.00 0.00 174.94 176.36 1zye s ALA 98 N -2.22 3.36 -0.41 2.27 0.00 -1.21 -4.88 121.76 118.66 1zye s ALA 98 Ca 0.24 1.15 -0.05 0.00 0.00 0.00 0.00 51.96 53.30 1zye s ALA 98 Cb -0.06 -3.44 0.10 0.00 0.00 0.00 0.00 23.12 19.72 1zye s ALA 98 CO 0.11 -0.60 0.22 -0.51 0.00 0.00 0.00 175.76 174.98 1zye s LEU 99 N -2.05 5.19 0.02 0.00 1.02 -1.06 -1.47 118.68 120.33 1zye s LEU 99 Ca 0.52 -1.85 -0.24 0.00 0.02 0.00 0.00 54.13 52.59 1zye s LEU 99 Cb -0.36 -1.88 -0.05 0.00 0.02 0.00 0.00 46.19 43.91 1zye s LEU 99 CO 0.47 -0.54 0.71 -0.22 0.02 0.00 0.00 176.35 176.80 1zye s LEU 100 N 1.24 4.43 -0.01 1.79 2.96 0.48 -0.92 118.68 128.65 1zye s LEU 100 Ca 0.06 1.34 -0.22 0.00 -0.22 0.00 0.00 54.13 55.09 1zye s LEU 100 Cb -0.23 -3.13 -0.05 0.00 0.50 0.00 0.00 46.19 43.27 1zye s LEU 100 CO -0.02 0.02 0.65 -0.55 -1.32 0.00 0.00 176.35 175.13 1zye s SER 101 N 0.01 7.02 -0.49 3.68 0.15 -0.18 -3.11 113.70 120.77 1zye s SER 101 Ca 0.36 1.22 0.05 0.00 0.70 0.00 0.00 55.95 58.29 1zye s SER 101 Cb -0.20 -2.39 0.39 0.00 -1.71 0.00 0.00 66.02 62.11 1zye s SER 101 CO 0.21 0.04 1.04 -0.67 1.20 0.00 0.00 173.24 175.05 1zye n ASP 102 N 2.98 4.51 -0.31 5.45 2.03 -0.59 -4.40 116.55 126.21 1zye n ASP 102 Ca -0.05 -3.68 0.17 0.00 0.52 0.00 0.00 54.79 51.76 1zye n ASP 102 Cb 0.51 -0.50 0.43 0.00 -0.72 0.00 0.00 41.12 40.83 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 2.76 0.59 -0.14 -2.67 6.46 -1.68 0.73 115.31 121.36 1zye h LEU 103 Ca 0.22 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 58.06 1zye h LEU 103 Cb 0.75 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.66 1zye h LEU 103 CO 0.83 0.19 -0.07 0.35 -0.62 0.00 0.00 178.44 179.12 1zye n THR 104 N -4.65 0.00 -0.80 1.05 -2.24 -1.26 -4.88 114.28 101.50 1zye n THR 104 Ca 0.23 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 1zye n THR 104 Cb 0.69 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 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 -1.07 -0.20 -0.02 -0.78 5.02 0.25 -4.86 118.16 116.49 1zye n LYS 105 Ca 0.15 0.05 -0.10 0.00 -2.02 0.00 0.00 58.31 56.39 1zye n LYS 105 Cb 0.26 -3.60 0.05 0.00 -0.02 0.00 0.00 35.03 31.72 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 1.30 0.64 0.20 1.97 1.08 -1.90 -1.64 115.11 116.76 1zye h GLN 106 Ca 0.00 -0.38 -0.01 0.00 -1.45 0.00 0.00 58.65 56.81 1zye h GLN 106 Cb 0.10 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1zye h GLN 106 CO 0.00 0.99 -0.10 0.82 -0.95 0.00 0.00 178.83 179.59 1zye h ILE 107 N 0.50 0.89 -0.47 2.54 2.04 -1.89 -1.60 117.51 119.53 1zye h ILE 107 Ca 0.02 -0.79 0.12 0.00 1.00 0.00 0.00 64.86 65.21 1zye h ILE 107 Cb 1.05 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.43 1zye h ILE 107 CO 0.10 0.17 0.33 0.28 0.00 0.00 0.00 178.15 179.03 1zye h SER 108 N -0.68 0.10 0.03 1.72 0.02 -1.92 -1.58 113.55 111.23 1zye h SER 108 Ca -0.03 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1zye h SER 108 Cb 0.48 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.01 1zye h SER 108 CO 0.04 0.06 -0.01 -0.09 -1.14 0.00 0.00 176.83 175.69 1zye h ARG 109 N 0.11 -0.04 -0.01 3.45 2.43 -1.09 -0.97 114.38 118.26 1zye h ARG 109 Ca 0.22 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1zye h ARG 109 Cb 0.74 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1zye h ARG 109 CO -0.02 0.34 -0.15 -0.44 -1.51 0.00 0.00 179.97 178.19 1zye h ASP 110 N -0.42 0.02 -0.13 -3.80 3.32 -0.48 0.04 116.42 114.97 1zye h ASP 110 Ca -0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1zye h ASP 110 Cb 0.39 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1zye h ASP 110 CO 0.01 0.17 0.00 -1.22 -1.72 0.00 0.00 179.24 176.47 1zye n TYR 111 N -4.35 0.16 -2.46 4.55 4.02 -0.67 -4.52 117.16 113.88 1zye n TYR 111 Ca -0.02 -0.08 -0.19 0.00 -0.01 0.00 0.00 57.90 57.59 1zye n TYR 111 Cb 0.22 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.54 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 -0.42 0.36 2.72 0.00 -0.00 -4.87 105.19 104.07 1zye n GLY 112 Ca 0.16 -0.06 0.04 0.00 0.00 0.00 0.00 46.02 46.17 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 -4.09 0.35 -2.76 1.61 0.24 -0.46 -4.98 118.33 108.23 1zye n VAL 113 Ca -0.21 -0.67 -0.43 0.00 -2.04 0.00 0.00 64.34 60.99 1zye n VAL 113 Cb 0.66 0.93 -0.03 0.00 -1.47 0.00 0.00 33.84 33.93 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 -0.77 3.96 -0.51 1.34 2.96 -0.62 -0.48 118.68 124.56 1zye s LEU 114 Ca 0.12 0.63 -0.27 0.00 -0.22 0.00 0.00 54.13 54.39 1zye s LEU 114 Cb 0.07 -3.33 -0.02 0.00 0.50 0.00 0.00 46.19 43.41 1zye s LEU 114 CO 0.10 -0.90 1.85 -0.76 -1.32 0.00 0.00 176.35 175.32 1zye s LEU 115 N 3.59 3.38 0.34 -0.68 1.02 -0.14 -4.88 118.68 121.31 1zye s LEU 115 Ca 0.40 0.70 0.04 0.00 0.02 0.00 0.00 54.13 55.29 1zye s LEU 115 Cb -0.12 -2.88 0.62 0.00 0.02 0.00 0.00 46.19 43.83 1zye s LEU 115 CO 0.19 -2.15 1.88 -0.33 0.02 0.00 0.00 176.35 175.97 1zye h GLU 116 N 14.33 0.52 0.00 1.70 4.39 -1.94 -0.32 114.58 133.26 1zye h GLU 116 Ca -0.28 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.31 1zye h GLU 116 Cb 1.17 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1zye h GLU 116 CO 1.15 0.54 0.00 0.41 -1.16 0.00 0.00 179.01 179.95 1zye n GLY 117 N -0.91 -3.06 0.14 -3.84 0.00 -1.26 -3.30 105.19 92.96 1zye n GLY 117 Ca 0.02 0.42 0.02 0.00 0.00 0.00 0.00 46.02 46.48 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 -0.37 1.61 0.14 -2.00 -3.48 132.00 127.90 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 0.51 0.00 0.41 0.14 0.00 0.00 178.00 179.06 1zye n GLY 119 N 1.21 1.02 3.24 1.56 0.00 -0.14 -5.10 105.19 106.98 1zye n GLY 119 Ca 0.02 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.37 1.41 0.28 0.99 2.34 -1.18 -4.93 118.68 117.23 1zye s LEU 120 Ca 0.00 -1.36 -0.12 0.00 0.06 0.00 0.00 54.13 52.71 1zye s LEU 120 Cb 0.00 0.23 -0.08 0.00 -0.56 0.00 0.00 46.19 45.78 1zye s LEU 120 CO 0.00 -0.78 0.64 0.00 -1.06 0.00 0.00 176.35 175.15 1zye s ALA 121 N -3.99 3.45 0.88 1.48 0.00 -1.26 -0.96 121.76 121.36 1zye s ALA 121 Ca 0.37 -0.13 -0.12 0.00 0.00 0.00 0.00 51.96 52.07 1zye s ALA 121 Cb 0.07 -2.59 0.12 0.00 0.00 0.00 0.00 23.12 20.72 1zye s ALA 121 CO 0.11 0.41 1.14 -0.51 0.00 0.00 0.00 175.76 176.91 1zye s LEU 122 N -2.94 2.15 -1.40 0.00 1.43 0.37 -3.51 118.68 114.78 1zye s LEU 122 Ca 0.50 0.96 -0.12 0.00 -1.03 0.00 0.00 54.13 54.44 1zye s LEU 122 Cb -0.11 -3.34 0.08 0.00 0.03 0.00 0.00 46.19 42.86 1zye s LEU 122 CO 0.20 -2.39 2.13 0.54 0.23 0.00 0.00 176.35 177.06 1zye n ARG 123 N -3.66 3.14 -3.36 1.70 1.74 -1.01 -4.10 116.66 111.11 1zye n ARG 123 Ca 0.07 -2.91 -0.33 0.00 -0.77 0.00 0.00 57.85 53.91 1zye n ARG 123 Cb 0.59 -3.15 -0.06 0.00 -1.02 0.00 0.00 32.46 28.82 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 2.37 2.33 -0.00 -0.13 0.00 -1.22 -1.69 107.32 108.98 1zye s GLY 124 Ca 0.45 -0.19 0.01 0.00 0.00 0.00 0.00 44.72 44.99 1zye s GLY 124 CO -0.06 -0.01 -0.04 -2.27 0.00 0.00 0.00 173.10 170.72 1zye s LEU 125 N -2.64 1.97 -0.04 0.66 0.20 -0.27 0.62 118.68 119.18 1zye s LEU 125 Ca 0.46 -0.07 0.03 0.00 0.69 0.00 0.00 54.13 55.23 1zye s LEU 125 Cb -0.12 -0.22 0.01 0.00 -0.43 0.00 0.00 46.19 45.43 1zye s LEU 125 CO 0.20 0.04 -0.11 -0.36 -0.29 0.00 0.00 176.35 175.84 1zye s PHE 126 N -0.04 1.20 -0.38 5.38 0.08 0.15 -1.59 117.98 122.77 1zye s PHE 126 Ca 0.01 -0.35 -0.13 0.00 0.12 0.00 0.00 56.93 56.58 1zye s PHE 126 Cb -0.02 -0.86 0.01 0.00 -0.57 0.00 0.00 43.02 41.58 1zye s PHE 126 CO -0.00 -0.16 0.26 0.42 -0.10 0.00 0.00 175.22 175.63 1zye s ILE 127 N 0.33 5.03 -0.17 0.64 1.01 -0.03 -1.79 121.20 126.23 1zye s ILE 127 Ca -0.07 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 1zye s ILE 127 Cb -0.11 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.58 1zye s ILE 127 CO 0.02 -0.22 -0.06 -0.63 0.00 0.00 0.00 174.94 174.05 1zye s ILE 128 N 1.65 3.55 0.57 2.92 1.01 -0.29 -0.55 121.20 130.07 1zye s ILE 128 Ca 0.04 -0.47 -0.07 0.00 0.00 0.00 0.00 60.65 60.15 1zye s ILE 128 Cb -0.19 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 1zye s ILE 128 CO 0.09 0.48 0.91 1.51 0.00 0.00 0.00 174.94 177.93 1zye s ASP 129 N 0.70 5.95 0.50 3.58 1.47 -0.39 -0.04 116.67 128.44 1zye s ASP 129 Ca -0.03 1.00 0.04 0.00 1.18 0.00 0.00 52.55 54.74 1zye s ASP 129 Cb -0.15 -2.10 0.20 0.00 -0.34 0.00 0.00 42.92 40.54 1zye s ASP 129 CO 0.02 -0.88 1.00 1.55 0.68 0.00 0.00 175.17 177.54 1zye h PRO 130 N -0.13 0.00 -0.30 2.11 0.13 -1.79 0.93 132.00 132.96 1zye h PRO 130 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1zye h PRO 130 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 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 -2.19 3.24 -0.22 1.44 4.13 -1.26 0.41 115.26 120.80 1zye n ASN 131 Ca -0.00 -1.97 -0.02 0.00 1.68 0.00 0.00 54.58 54.26 1zye n ASN 131 Cb 0.79 -0.19 -0.00 0.00 -1.54 0.00 0.00 39.78 38.84 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 1.45 0.39 3.66 7.41 0.00 0.32 -4.99 105.19 113.43 1zye n GLY 132 Ca 0.18 -0.87 -0.35 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.10 4.82 -0.19 1.61 1.01 -1.22 -1.21 120.40 123.12 1zye s VAL 133 Ca 0.00 -0.03 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 1zye s VAL 133 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1zye s VAL 133 CO 0.00 0.48 1.08 0.27 0.00 0.00 0.00 175.10 176.93 1zye s ILE 134 N 0.18 4.61 -0.03 2.22 -5.25 0.28 -1.26 121.20 121.95 1zye s ILE 134 Ca 0.05 1.93 0.20 0.00 -0.99 0.00 0.00 60.65 61.84 1zye s ILE 134 Cb -0.12 -4.25 -0.30 0.00 2.95 0.00 0.00 42.46 40.74 1zye s ILE 134 CO 0.00 -0.14 0.43 0.29 -1.79 0.00 0.00 174.94 173.74 1zye n LYS 135 N 6.11 0.59 -3.66 0.37 4.76 0.29 -2.52 118.16 124.11 1zye n LYS 135 Ca 0.12 -0.18 -0.15 0.00 -2.87 0.00 0.00 58.31 55.23 1zye n LYS 135 Cb 0.46 -1.47 -0.08 0.00 -1.84 0.00 0.00 35.03 32.11 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 -3.36 -0.45 -0.05 2.13 5.04 -1.21 -4.97 115.29 112.43 1zye s HIS 136 Ca -0.07 0.88 -0.05 0.00 -1.54 0.00 0.00 55.06 54.28 1zye s HIS 136 Cb 0.13 0.23 0.01 0.00 0.04 0.00 0.00 32.58 32.99 1zye s HIS 136 CO 0.82 -0.43 0.14 -0.48 -2.34 0.00 0.00 174.74 172.45 1zye s LEU 137 N -0.80 1.46 0.06 8.88 0.05 -1.26 -0.85 118.68 126.21 1zye s LEU 137 Ca -0.09 0.21 0.09 0.00 0.05 0.00 0.00 54.13 54.39 1zye s LEU 137 Cb -0.03 0.53 -0.03 0.00 -2.05 0.00 0.00 46.19 44.61 1zye s LEU 137 CO 0.05 -0.11 -0.25 -0.44 -0.55 0.00 0.00 176.35 175.05 1zye s SER 138 N -0.18 3.32 -0.05 1.48 0.01 -0.62 -4.97 113.70 112.68 1zye s SER 138 Ca -0.03 -0.58 -0.01 0.00 1.31 0.00 0.00 55.95 56.65 1zye s SER 138 Cb -0.02 -0.34 0.03 0.00 0.21 0.00 0.00 66.02 65.89 1zye s SER 138 CO 0.00 0.25 0.01 -0.69 0.41 0.00 0.00 173.24 173.22 1zye s VAL 139 N -0.87 0.23 0.02 3.43 1.01 -1.26 -1.11 120.40 121.84 1zye s VAL 139 Ca 0.13 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.27 1zye s VAL 139 Cb -0.10 -0.37 -0.04 0.00 0.00 0.00 0.00 36.38 35.88 1zye s VAL 139 CO 0.03 0.20 -0.02 0.20 0.00 0.00 0.00 175.10 175.51 1zye s ASN 140 N 1.53 4.96 0.73 3.32 0.01 -0.68 -4.97 114.94 119.84 1zye s ASN 140 Ca -0.02 -0.08 -0.16 0.00 -0.71 0.00 0.00 52.86 51.89 1zye s ASN 140 Cb -0.13 -1.24 0.02 0.00 0.41 0.00 0.00 41.25 40.31 1zye s ASN 140 CO -0.03 0.26 1.06 -0.67 -1.51 0.00 0.00 177.10 176.22 1zye n ASP 141 N 1.29 0.83 -0.32 -1.22 2.03 -1.26 -2.40 116.55 115.50 1zye n ASP 141 Ca -0.14 0.68 0.20 0.00 0.52 0.00 0.00 54.79 56.05 1zye n ASP 141 Cb 0.52 -1.45 0.41 0.00 -0.72 0.00 0.00 41.12 39.88 1zye n ASP 141 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1zye h LEU 142 N -0.26 0.16 -1.45 -2.67 3.38 -1.96 -2.75 115.31 109.77 1zye h LEU 142 Ca -0.48 0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1zye h LEU 142 Cb 1.33 0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.33 1zye h LEU 142 CO 0.48 -0.23 0.00 -0.81 0.09 0.00 0.00 178.44 177.96 1zye n PRO 143 N -5.21 2.00 -4.29 1.13 -0.04 -1.26 -4.89 135.00 122.43 1zye n PRO 143 Ca 0.28 -1.00 -0.22 0.00 -0.04 0.00 0.00 63.50 62.52 1zye n PRO 143 Cb 0.91 -1.51 -0.16 0.00 -0.04 0.00 0.00 33.50 32.70 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 -1.63 0.75 0.40 0.52 1.01 -1.04 -5.09 120.40 115.32 1zye s VAL 144 Ca 0.18 -0.25 -0.18 0.00 0.00 0.00 0.00 61.98 61.73 1zye s VAL 144 Cb 0.12 -0.74 -0.10 0.00 0.00 0.00 0.00 36.38 35.66 1zye s VAL 144 CO 0.08 0.27 0.87 -0.83 0.00 0.00 0.00 175.10 175.49 1zye s GLY 145 N 0.86 2.32 0.69 4.51 0.00 -1.26 -4.81 107.32 109.63 1zye s GLY 145 Ca -0.12 0.22 -0.11 0.00 0.00 0.00 0.00 44.72 44.72 1zye s GLY 145 CO 0.01 0.47 1.06 0.50 0.00 0.00 0.00 173.10 175.14 1zye s ARG 146 N -3.22 3.01 -0.32 2.90 0.52 -1.26 -5.06 118.95 115.51 1zye s ARG 146 Ca 0.58 0.91 -0.16 0.00 -0.52 0.00 0.00 55.73 56.54 1zye s ARG 146 Cb -0.10 -2.00 -0.02 0.00 0.52 0.00 0.00 34.95 33.36 1zye s ARG 146 CO 0.17 -1.04 0.41 0.45 0.02 0.00 0.00 175.30 175.31 1zye s SER 147 N -3.86 6.24 0.18 0.23 0.15 -1.26 -4.96 113.70 110.41 1zye s SER 147 Ca 0.58 -0.00 -0.14 0.00 0.70 0.00 0.00 55.95 57.09 1zye s SER 147 Cb -0.14 -2.22 0.09 0.00 -1.71 0.00 0.00 66.02 62.04 1zye s SER 147 CO 0.55 -0.32 1.82 0.58 1.20 0.00 0.00 173.24 177.07 1zye h VAL 148 N 5.51 1.08 -0.31 4.45 2.07 -1.93 -2.16 116.25 124.96 1zye h VAL 148 Ca -0.30 -0.22 0.06 0.00 0.82 0.00 0.00 66.70 67.06 1zye h VAL 148 Cb 1.14 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 1zye h VAL 148 CO 0.70 0.12 -0.06 -0.33 0.02 0.00 0.00 177.57 178.02 1zye h GLU 149 N 0.65 0.02 -0.59 1.57 4.39 -1.95 -1.32 114.58 117.34 1zye h GLU 149 Ca 0.20 -0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.91 1zye h GLU 149 Cb -0.02 -0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 1zye h GLU 149 CO -0.07 0.01 0.39 1.49 -1.16 0.00 0.00 179.01 179.67 1zye h GLU 150 N 0.02 0.77 -0.64 2.33 4.57 -1.91 -1.76 114.58 117.96 1zye h GLU 150 Ca 0.15 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.28 1zye h GLU 150 Cb 0.22 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1zye h GLU 150 CO -0.30 0.51 0.38 1.15 -1.18 0.00 0.00 179.01 179.56 1zye h THR 151 N 0.79 1.19 -0.79 0.32 2.02 -0.81 -1.74 112.91 113.89 1zye h THR 151 Ca 0.22 -0.43 0.06 0.00 0.77 0.00 0.00 66.41 67.02 1zye h THR 151 Cb -0.08 0.32 -0.06 0.00 -1.74 0.00 0.00 68.15 66.60 1zye h THR 151 CO -0.06 0.20 0.48 0.25 0.37 0.00 0.00 175.52 176.76 1zye h LEU 152 N 0.86 0.75 -1.44 2.58 5.85 -0.96 -2.03 115.31 120.92 1zye h LEU 152 Ca 0.23 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.98 1zye h LEU 152 Cb -0.01 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1zye h LEU 152 CO -0.04 0.49 0.40 -0.09 -0.34 0.00 0.00 178.44 178.85 1zye h ARG 153 N 0.89 0.73 -0.21 1.25 2.43 -0.50 -2.10 114.38 116.87 1zye h ARG 153 Ca 0.34 -0.04 -0.16 0.00 -0.81 0.00 0.00 59.98 59.31 1zye h ARG 153 Cb 0.15 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1zye h ARG 153 CO -0.17 0.48 -0.50 -0.07 -1.51 0.00 0.00 179.97 178.21 1zye h LEU 154 N 0.76 0.80 0.07 3.80 3.38 -0.90 -0.30 115.31 122.92 1zye h LEU 154 Ca 0.23 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1zye h LEU 154 Cb -0.00 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1zye h LEU 154 CO -0.06 1.22 -0.07 0.58 0.09 0.00 0.00 178.44 180.20 1zye h VAL 155 N 0.42 0.84 -0.53 1.22 2.07 -1.10 -0.83 116.25 118.33 1zye h VAL 155 Ca -0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1zye h VAL 155 Cb 1.11 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 1zye h VAL 155 CO 0.11 0.00 0.23 0.11 0.02 0.00 0.00 177.57 178.04 1zye h LYS 156 N -0.16 0.43 -0.86 1.57 1.57 -1.38 -2.46 116.57 115.28 1zye h LYS 156 Ca 0.00 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.80 1zye h LYS 156 Cb 0.16 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.31 1zye h LYS 156 CO -0.02 0.29 0.54 0.00 -0.57 0.00 0.00 179.45 179.69 1zye h ALA 157 N 1.32 1.15 0.00 3.86 0.00 -0.44 -1.41 119.26 123.74 1zye h ALA 157 Ca 0.25 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1zye h ALA 157 Cb 0.22 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1zye h ALA 157 CO -0.21 0.34 -0.44 0.74 0.00 0.00 0.00 179.25 179.68 1zye h PHE 158 N 1.03 0.00 -0.14 0.00 0.04 -0.72 -2.29 116.94 114.85 1zye h PHE 158 Ca 0.35 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 61.03 1zye h PHE 158 Cb 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.22 1zye h PHE 158 CO -0.03 0.44 -0.29 1.96 -0.60 0.00 0.00 178.31 179.79 1zye h GLN 159 N 0.00 0.45 -0.22 1.51 4.20 -1.04 -2.71 115.11 117.31 1zye h GLN 159 Ca -0.00 -0.29 0.03 0.00 0.06 0.00 0.00 58.65 58.44 1zye h GLN 159 Cb 0.81 0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.58 1zye h GLN 159 CO 0.06 0.90 -0.36 0.35 -0.67 0.00 0.00 178.83 179.11 1zye h PHE 160 N 0.06 -1.08 0.00 2.96 3.04 -1.16 -1.06 116.94 119.70 1zye h PHE 160 Ca 0.00 0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.00 1zye h PHE 160 Cb 0.89 0.50 0.00 0.00 2.56 0.00 0.00 35.95 39.90 1zye h PHE 160 CO 0.10 -0.32 0.00 1.55 -2.02 0.00 0.00 178.31 177.62 1zye n VAL 161 N -4.40 1.18 -0.46 1.41 3.14 -0.87 -0.52 118.33 117.81 1zye n VAL 161 Ca -0.03 0.30 0.09 0.00 -2.96 0.00 0.00 64.34 61.74 1zye n VAL 161 Cb 0.22 -1.18 0.28 0.00 -1.06 0.00 0.00 33.84 32.11 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 -1.39 3.14 0.00 1.45 2.13 -0.43 -5.09 120.64 120.45 1zye n GLU 162 Ca 0.03 -2.60 0.00 0.00 0.66 0.00 0.00 57.16 55.25 1zye n GLU 162 Cb 0.07 -1.62 0.00 0.00 0.27 0.00 0.00 31.44 30.15 1zye n GLU 162 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72