#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i8l s THR 2 N 0.00 0.07 -0.08 1.12 2.01 -1.26 -4.97 115.64 112.53 2i8l s THR 2 Ca 0.00 -0.61 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 2i8l s THR 2 Cb 0.00 -0.45 0.04 0.00 0.01 0.00 0.00 72.50 72.10 2i8l s THR 2 CO 0.00 -0.34 0.18 -0.62 -0.69 0.00 0.00 174.62 173.16 2i8l s ASP 3 N -1.28 -0.02 0.18 3.53 -1.08 -1.26 -0.21 116.67 116.52 2i8l s ASP 3 Ca -0.14 0.39 0.10 0.00 -0.52 0.00 0.00 52.55 52.39 2i8l s ASP 3 Cb -0.07 0.30 -0.04 0.00 -1.46 0.00 0.00 42.92 41.65 2i8l s ASP 3 CO 0.02 -0.17 -0.20 0.68 0.52 0.00 0.00 175.17 176.02 2i8l s VAL 4 N 1.43 2.63 -0.32 1.11 -7.23 -1.05 -0.78 120.40 116.19 2i8l s VAL 4 Ca -0.07 -1.85 0.02 0.00 -1.81 0.00 0.00 61.98 58.27 2i8l s VAL 4 Cb -0.11 -2.26 0.09 0.00 0.56 0.00 0.00 36.38 34.66 2i8l s VAL 4 CO -0.07 -0.07 0.05 -0.22 -0.31 0.00 0.00 175.10 174.47 2i8l s LEU 5 N -2.61 3.74 -0.67 1.32 2.96 -0.43 -1.81 118.68 121.18 2i8l s LEU 5 Ca 0.21 -1.87 -0.21 0.00 -0.22 0.00 0.00 54.13 52.04 2i8l s LEU 5 Cb -0.09 -1.35 0.08 0.00 0.50 0.00 0.00 46.19 45.33 2i8l s LEU 5 CO 0.11 -0.37 0.92 -0.22 -1.32 0.00 0.00 176.35 175.47 2i8l s LEU 6 N 1.17 4.70 0.30 -0.68 2.96 0.25 -0.62 118.68 126.77 2i8l s LEU 6 Ca 0.08 -1.21 -0.28 0.00 -0.22 0.00 0.00 54.13 52.49 2i8l s LEU 6 Cb -0.19 -2.39 -0.09 0.00 0.50 0.00 0.00 46.19 44.02 2i8l s LEU 6 CO -0.13 -1.32 1.08 0.00 -1.32 0.00 0.00 176.35 174.65 2i8l s VAL 8 N -1.25 0.03 0.00 0.00 1.01 -0.43 -0.71 120.40 119.05 2i8l s VAL 8 Ca 0.47 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.16 2i8l s VAL 8 Cb -0.30 -0.16 0.00 0.00 0.00 0.00 0.00 36.38 35.93 2i8l s VAL 8 CO 0.38 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.93 2i8l n GLY 9 N 2.56 2.32 3.35 4.51 0.00 -0.08 -1.96 105.19 115.88 2i8l n GLY 9 Ca -0.16 -1.48 -0.36 0.00 0.00 0.00 0.00 46.02 44.01 2i8l n GLY 9 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2i8l s ASN 10 N 0.00 4.91 0.26 1.61 3.84 -1.16 -2.13 114.94 122.27 2i8l s ASN 10 Ca 0.00 -0.54 0.17 0.00 0.21 0.00 0.00 52.86 52.70 2i8l s ASN 10 Cb 0.00 -1.85 0.92 0.00 -0.55 0.00 0.00 41.25 39.77 2i8l s ASN 10 CO 0.00 -0.12 1.51 -1.20 -2.79 0.00 0.00 177.10 174.51 2i8l n SER 11 N 4.85 0.44 -0.10 -4.21 7.64 -1.26 -1.83 113.62 119.15 2i8l n SER 11 Ca -0.16 0.70 0.02 0.00 1.01 0.00 0.00 58.87 60.44 2i8l n SER 11 Cb 0.49 -0.75 0.03 0.00 -1.01 0.00 0.00 64.21 62.97 2i8l n SER 11 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 2i8l n MET 12 N -2.09 1.25 -1.36 1.43 0.00 -1.26 -4.74 117.12 110.34 2i8l n MET 12 Ca -0.01 -1.31 -0.35 0.00 0.00 0.00 0.00 57.70 56.04 2i8l n MET 12 Cb 0.04 -0.85 0.08 0.00 0.00 0.00 0.00 33.22 32.49 2i8l n MET 12 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 175.97 175.85 2i8l n MET 13 N -0.43 2.72 0.00 3.17 0.00 -0.98 -0.67 117.12 120.92 2i8l n MET 13 Ca 0.03 -3.32 0.00 0.00 0.00 0.00 0.00 57.70 54.41 2i8l n MET 13 Cb 0.48 -2.29 0.00 0.00 0.00 0.00 0.00 33.22 31.41 2i8l n MET 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2i8l n GLY 14 N -0.91 0.68 0.47 -5.12 0.00 -0.69 -2.30 105.19 97.31 2i8l n GLY 14 Ca 0.62 -0.78 0.29 0.00 0.00 0.00 0.00 46.02 46.15 2i8l n GLY 14 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2i8l h ASP 15 N 5.83 0.02 0.02 1.61 1.82 -1.42 -3.21 116.42 121.09 2i8l h ASP 15 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2i8l h ASP 15 Cb 0.00 -0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2i8l h ASP 15 CO 0.00 0.01 0.00 -0.78 -1.61 0.00 0.00 179.24 176.86 2i8l h ASP 16 N 0.02 0.00 0.00 2.28 3.58 -1.79 -2.79 116.42 117.72 2i8l h ASP 16 Ca 0.44 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.89 2i8l h ASP 16 Cb 1.72 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.77 2i8l h ASP 16 CO -0.01 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.96 2i8l n GLY 17 N -1.14 1.10 0.07 -0.78 0.00 -0.76 -2.97 105.19 100.70 2i8l n GLY 17 Ca -0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 2i8l n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i8l h ALA 18 N 1.83 0.10 0.62 4.61 0.00 -1.71 -0.97 119.26 123.75 2i8l h ALA 18 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2i8l h ALA 18 Cb 0.48 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.25 2i8l h ALA 18 CO 0.00 -0.37 -0.30 0.78 0.00 0.00 0.00 179.25 179.37 2i8l h GLY 19 N 0.04 -0.87 -0.29 0.00 0.00 -1.54 -2.40 103.07 98.01 2i8l h GLY 19 Ca 0.03 0.32 0.24 0.00 0.00 0.00 0.00 47.33 47.92 2i8l h GLY 19 CO -0.00 -0.31 0.40 -2.55 0.00 0.00 0.00 176.54 174.07 2i8l h PRO 20 N -0.89 0.35 -0.21 4.80 0.11 -1.68 0.14 132.00 134.63 2i8l h PRO 20 Ca -0.08 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.83 2i8l h PRO 20 Cb 0.66 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.68 2i8l h PRO 20 CO 0.14 0.23 -0.57 1.25 -0.21 0.00 0.00 178.00 178.84 2i8l h LEU 21 N 0.37 0.73 -0.24 2.35 5.85 -1.15 -1.02 115.31 122.20 2i8l h LEU 21 Ca 0.59 -0.40 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 2i8l h LEU 21 Cb 1.17 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 2i8l h LEU 21 CO -0.56 1.15 0.14 0.25 -0.34 0.00 0.00 178.44 179.07 2i8l h LEU 22 N 0.50 0.30 -0.98 2.25 5.85 -0.62 -1.42 115.31 121.18 2i8l h LEU 22 Ca 0.00 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.66 2i8l h LEU 22 Cb 1.14 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 2i8l h LEU 22 CO 0.11 0.28 0.65 0.00 -0.34 0.00 0.00 178.44 179.15 2i8l h ALA 23 N 1.03 1.25 -0.06 1.25 0.00 -0.71 -0.15 119.26 121.86 2i8l h ALA 23 Ca 0.09 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2i8l h ALA 23 Cb 0.05 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 17.44 2i8l h ALA 23 CO -0.01 0.63 0.03 1.49 0.00 0.00 0.00 179.25 181.39 2i8l h GLU 24 N 1.33 0.09 -0.33 0.00 4.57 -0.91 0.86 114.58 120.19 2i8l h GLU 24 Ca 0.36 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.51 2i8l h GLU 24 Cb -0.15 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.41 2i8l h GLU 24 CO -0.08 0.16 0.13 0.87 -1.18 0.00 0.00 179.01 178.91 2i8l h LYS 25 N -0.01 0.49 -0.76 1.92 1.57 -0.95 -0.65 116.57 118.18 2i8l h LYS 25 Ca 0.02 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 2i8l h LYS 25 Cb 0.10 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 2i8l h LYS 25 CO -0.00 0.49 0.28 0.00 -0.57 0.00 0.00 179.45 179.65 2i8l h ALA 27 N 1.15 1.04 -0.29 0.00 0.00 -0.53 -1.93 119.26 118.70 2i8l h ALA 27 Ca 0.25 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 2i8l h ALA 27 Cb 0.25 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2i8l h ALA 27 CO -0.02 0.64 -0.38 0.00 0.00 0.00 0.00 179.25 179.50 2i8l h ALA 28 N 1.18 0.79 -1.26 0.00 0.00 -0.80 -3.42 119.26 115.75 2i8l h ALA 28 Ca 0.23 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 2i8l h ALA 28 Cb 0.30 -0.12 -0.23 0.00 0.00 0.00 0.00 17.79 17.74 2i8l h ALA 28 CO -0.01 0.65 -0.47 0.00 0.00 0.00 0.00 179.25 179.42 2i8l s ALA 29 N -4.31 -1.90 1.14 0.00 0.00 -0.47 -5.10 121.76 111.11 2i8l s ALA 29 Ca -0.08 0.36 -0.18 0.00 0.00 0.00 0.00 51.96 52.05 2i8l s ALA 29 Cb 0.12 -2.45 0.13 0.00 0.00 0.00 0.00 23.12 20.93 2i8l s ALA 29 CO 0.84 -1.98 0.12 -2.30 0.00 0.00 0.00 175.76 172.44 2i8l n PRO 30 N 4.94 -1.81 -4.08 0.00 -0.02 -0.74 -4.26 135.00 129.03 2i8l n PRO 30 Ca 0.07 -0.51 -0.09 0.00 -2.02 0.00 0.00 63.50 60.95 2i8l n PRO 30 Cb 0.53 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 32.16 2i8l n PRO 30 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2i8l s LYS 31 N -3.56 0.58 0.00 -0.52 -0.14 -1.26 -5.00 119.74 109.84 2i8l s LYS 31 Ca 0.57 -1.07 0.00 0.00 -1.36 0.00 0.00 55.97 54.11 2i8l s LYS 31 Cb -0.13 0.07 0.00 0.00 -1.68 0.00 0.00 37.83 36.09 2i8l s LYS 31 CO 0.65 -0.07 0.00 0.41 -0.76 0.00 0.00 175.35 175.59 2i8l n GLY 32 N 0.51 1.82 0.73 -3.33 0.00 -1.19 -2.95 105.19 100.77 2i8l n GLY 32 Ca -0.16 0.42 0.01 0.00 0.00 0.00 0.00 46.02 46.29 2i8l n GLY 32 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2i8l n ASN 33 N 2.73 0.21 -4.71 1.61 4.05 -1.26 -5.05 115.26 112.84 2i8l n ASN 33 Ca 0.00 -1.97 -0.42 0.00 0.45 0.00 0.00 54.58 52.64 2i8l n ASN 33 Cb 0.00 -0.21 -0.03 0.00 1.23 0.00 0.00 39.78 40.77 2i8l n ASN 33 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 177.26 174.47 2i8l s TRP 34 N 0.00 3.14 -0.53 1.20 0.52 -1.15 -4.70 118.94 117.42 2i8l s TRP 34 Ca 0.08 0.93 -0.28 0.00 0.02 0.00 0.00 56.10 56.85 2i8l s TRP 34 Cb 0.09 -3.66 0.02 0.00 -1.15 0.00 0.00 33.47 28.76 2i8l s TRP 34 CO -0.04 -2.34 1.36 0.08 0.02 0.00 0.00 176.95 176.04 2i8l s VAL 35 N 1.47 3.88 0.29 4.03 1.01 0.04 -4.86 120.40 126.27 2i8l s VAL 35 Ca 0.64 0.81 -0.29 0.00 0.00 0.00 0.00 61.98 63.13 2i8l s VAL 35 Cb -0.35 -4.44 -0.10 0.00 0.00 0.00 0.00 36.38 31.48 2i8l s VAL 35 CO 0.29 -1.09 1.45 -0.69 0.00 0.00 0.00 175.10 175.06 2i8l s VAL 36 N 5.63 2.47 0.05 2.92 1.01 -1.26 -1.32 120.40 129.91 2i8l s VAL 36 Ca 0.53 0.42 0.05 0.00 0.00 0.00 0.00 61.98 62.97 2i8l s VAL 36 Cb -0.11 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 2i8l s VAL 36 CO 0.27 0.08 -0.13 -0.63 0.00 0.00 0.00 175.10 174.69 2i8l s ILE 37 N -0.37 1.04 -0.30 2.22 -1.09 0.21 -4.87 121.20 118.05 2i8l s ILE 37 Ca 0.57 -1.14 -0.02 0.00 -2.23 0.00 0.00 60.65 57.83 2i8l s ILE 37 Cb -0.43 -0.99 0.10 0.00 -1.58 0.00 0.00 42.46 39.56 2i8l s ILE 37 CO 0.49 -0.14 0.11 -0.62 -1.23 0.00 0.00 174.94 173.55 2i8l s ASP 38 N -1.45 3.78 0.00 3.58 2.15 -1.26 -1.02 116.67 122.46 2i8l s ASP 38 Ca -0.01 -1.46 0.22 0.00 0.43 0.00 0.00 52.55 51.72 2i8l s ASP 38 Cb -0.09 -0.63 0.99 0.00 -0.30 0.00 0.00 42.92 42.89 2i8l s ASP 38 CO 0.02 -0.42 1.69 0.61 -0.17 0.00 0.00 175.17 176.89 2i8l n GLY 39 N 5.03 -1.15 7.00 2.66 0.00 0.11 -4.97 105.19 113.88 2i8l n GLY 39 Ca -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2i8l n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i8l n GLY 40 N 0.65 2.22 1.04 -0.02 0.00 -1.25 -1.65 105.19 106.18 2i8l n GLY 40 Ca 0.07 -0.34 0.06 0.00 0.00 0.00 0.00 46.02 45.81 2i8l n GLY 40 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2i8l n SER 41 N -0.34 3.00 -3.01 1.61 3.41 -0.90 -0.91 113.62 116.48 2i8l n SER 41 Ca 0.00 -2.26 -0.15 0.00 -0.26 0.00 0.00 58.87 56.20 2i8l n SER 41 Cb 0.00 -0.44 -0.00 0.00 -0.26 0.00 0.00 64.21 63.50 2i8l n SER 41 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2i8l n ALA 42 N 0.57 2.23 0.31 7.33 0.00 -0.66 -4.97 120.51 125.32 2i8l n ALA 42 Ca 0.15 -3.18 0.17 0.00 0.00 0.00 0.00 53.44 50.58 2i8l n ALA 42 Cb 0.57 -0.95 0.71 0.00 0.00 0.00 0.00 19.45 19.79 2i8l n ALA 42 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2i8l h PRO 43 N 2.98 0.00 -0.20 0.00 0.13 -1.72 -2.96 132.00 130.24 2i8l h PRO 43 Ca 0.03 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.14 2i8l h PRO 43 Cb 1.04 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 2i8l h PRO 43 CO 0.47 0.00 0.05 1.05 -0.23 0.00 0.00 178.00 179.34 2i8l h GLU 44 N 0.00 0.27 -0.12 0.86 9.09 -1.94 -0.87 114.58 121.87 2i8l h GLU 44 Ca 0.00 -0.03 -0.02 0.00 0.05 0.00 0.00 59.36 59.36 2i8l h GLU 44 Cb 0.39 -0.05 -0.01 0.00 -1.65 0.00 0.00 28.75 27.43 2i8l h GLU 44 CO 0.00 0.26 0.01 -2.95 0.05 0.00 0.00 179.01 176.37 2i8l h ASN 45 N 0.27 0.15 0.50 3.06 7.08 -1.89 -3.01 115.58 121.74 2i8l h ASN 45 Ca 0.07 -0.01 0.00 0.00 -3.08 0.00 0.00 56.30 53.28 2i8l h ASN 45 Cb 0.10 -0.04 0.00 0.00 -2.08 0.00 0.00 38.32 36.31 2i8l h ASN 45 CO -0.00 0.18 -0.46 0.47 -2.08 0.00 0.00 177.43 175.54 2i8l n ASP 46 N -4.44 0.52 -0.30 6.14 8.00 -0.34 -3.49 116.55 122.64 2i8l n ASP 46 Ca -0.01 -0.27 0.06 0.00 0.71 0.00 0.00 54.79 55.28 2i8l n ASP 46 Cb 0.14 0.21 0.22 0.00 -0.02 0.00 0.00 41.12 41.67 2i8l n ASP 46 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 2i8l h ILE 47 N 0.10 0.79 -0.99 0.53 2.04 -1.47 -0.72 117.51 117.79 2i8l h ILE 47 Ca 0.00 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.67 2i8l h ILE 47 Cb 0.50 0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 36.54 2i8l h ILE 47 CO 0.00 0.13 0.64 0.58 0.00 0.00 0.00 178.15 179.50 2i8l h VAL 48 N 0.70 1.13 -0.20 1.67 2.07 -1.77 -0.06 116.25 119.80 2i8l h VAL 48 Ca 0.46 -0.41 -0.07 0.00 0.82 0.00 0.00 66.70 67.50 2i8l h VAL 48 Cb 0.58 -0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2i8l h VAL 48 CO -0.33 0.22 -0.13 0.00 0.02 0.00 0.00 177.57 177.36 2i8l h ALA 49 N 1.42 0.29 -0.63 1.67 0.00 -1.37 -2.97 119.26 117.67 2i8l h ALA 49 Ca 0.41 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2i8l h ALA 49 Cb 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2i8l h ALA 49 CO -0.14 0.16 0.25 0.82 0.00 0.00 0.00 179.25 180.33 2i8l h ILE 50 N 0.14 1.22 0.00 0.00 2.04 -0.88 -1.42 117.51 118.61 2i8l h ILE 50 Ca 0.04 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.21 2i8l h ILE 50 Cb 0.64 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2i8l h ILE 50 CO 0.04 0.28 0.00 0.03 0.00 0.00 0.00 178.15 178.49 2i8l h ARG 51 N 0.90 0.00 -0.10 2.37 3.08 -0.89 -0.71 114.38 119.04 2i8l h ARG 51 Ca 0.21 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.20 2i8l h ARG 51 Cb 0.18 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 2i8l h ARG 51 CO -0.02 0.00 -0.16 0.93 -1.07 0.00 0.00 179.97 179.65 2i8l h GLU 52 N 0.00 0.29 0.00 0.04 5.08 -1.11 -3.31 114.58 115.58 2i8l h GLU 52 Ca 0.00 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.17 2i8l h GLU 52 Cb 0.19 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 2i8l h GLU 52 CO 0.00 0.75 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.64 2i8l h LEU 53 N -0.14 0.00 -2.87 1.33 3.38 -1.10 -3.47 115.31 112.42 2i8l h LEU 53 Ca 0.01 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.39 2i8l h LEU 53 Cb 0.73 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.39 2i8l h LEU 53 CO 0.04 0.05 -0.98 0.54 0.09 0.00 0.00 178.44 178.19 2i8l n ARG 54 N -3.18 -0.97 -1.30 1.13 1.74 -0.73 -4.85 116.66 108.50 2i8l n ARG 54 Ca 0.00 0.15 -0.35 0.00 -0.77 0.00 0.00 57.85 56.88 2i8l n ARG 54 Cb 0.32 -3.32 0.10 0.00 -1.02 0.00 0.00 32.46 28.54 2i8l n ARG 54 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2i8l n PRO 55 N -4.73 0.45 -0.03 5.56 -0.02 -1.26 -4.85 135.00 130.12 2i8l n PRO 55 Ca -0.22 0.22 -0.14 0.00 -2.02 0.00 0.00 63.50 61.33 2i8l n PRO 55 Cb 0.64 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 2i8l n PRO 55 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2i8l h THR 56 N -0.41 1.29 -4.12 3.45 2.02 -0.92 -3.33 112.91 110.89 2i8l h THR 56 Ca -0.47 -1.88 -0.14 0.00 0.77 0.00 0.00 66.41 64.69 2i8l h THR 56 Cb 1.32 1.84 -0.14 0.00 -1.74 0.00 0.00 68.15 69.43 2i8l h THR 56 CO 0.47 0.60 -0.48 -0.13 0.37 0.00 0.00 175.52 176.35 2i8l s ARG 57 N -3.91 1.01 -0.07 6.66 0.52 -1.19 -1.40 118.95 120.57 2i8l s ARG 57 Ca -0.09 -1.27 -0.08 0.00 -0.52 0.00 0.00 55.73 53.77 2i8l s ARG 57 Cb 0.10 0.31 0.02 0.00 0.52 0.00 0.00 34.95 35.90 2i8l s ARG 57 CO 0.88 -0.33 0.21 -1.17 0.02 0.00 0.00 175.30 174.92 2i8l s LEU 58 N -2.99 1.21 -0.04 2.53 2.96 -0.14 -2.54 118.68 119.66 2i8l s LEU 58 Ca 0.18 0.34 0.04 0.00 -0.22 0.00 0.00 54.13 54.47 2i8l s LEU 58 Cb 0.05 0.76 -0.00 0.00 0.50 0.00 0.00 46.19 47.50 2i8l s LEU 58 CO -0.01 -0.13 -0.14 -0.22 -1.32 0.00 0.00 176.35 174.54 2i8l s LEU 59 N -0.14 1.86 0.04 -0.68 2.96 -0.75 -0.89 118.68 121.08 2i8l s LEU 59 Ca -0.02 -0.29 0.08 0.00 -0.22 0.00 0.00 54.13 53.68 2i8l s LEU 59 Cb -0.02 -0.80 -0.03 0.00 0.50 0.00 0.00 46.19 45.84 2i8l s LEU 59 CO 0.01 0.12 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.28 2i8l s ILE 60 N 0.12 1.92 -0.02 6.68 1.01 -0.22 -0.58 121.20 130.11 2i8l s ILE 60 Ca -0.04 -1.28 -0.00 0.00 0.00 0.00 0.00 60.65 59.33 2i8l s ILE 60 Cb -0.10 -1.65 0.02 0.00 0.01 0.00 0.00 42.46 40.74 2i8l s ILE 60 CO 0.02 0.32 0.03 -0.69 0.00 0.00 0.00 174.94 174.61 2i8l s VAL 61 N -0.78 -0.04 0.34 2.92 1.01 -0.55 -0.94 120.40 122.35 2i8l s VAL 61 Ca 0.10 0.16 -0.17 0.00 0.00 0.00 0.00 61.98 62.07 2i8l s VAL 61 Cb -0.09 -0.07 0.04 0.00 0.00 0.00 0.00 36.38 36.25 2i8l s VAL 61 CO 0.02 0.06 0.73 -0.62 0.00 0.00 0.00 175.10 175.29 2i8l s ASP 62 N 0.78 -0.04 0.82 3.32 2.15 -1.19 -1.32 116.67 121.20 2i8l s ASP 62 Ca -0.06 -0.97 -0.11 0.00 0.43 0.00 0.00 52.55 51.84 2i8l s ASP 62 Cb -0.09 0.78 0.09 0.00 -0.30 0.00 0.00 42.92 43.40 2i8l s ASP 62 CO -0.02 -1.52 1.09 0.00 -0.17 0.00 0.00 175.17 174.55 2i8l s ALA 63 N -3.02 1.97 -0.25 3.66 0.00 -1.26 -3.24 121.76 119.62 2i8l s ALA 63 Ca 0.15 0.06 -0.13 0.00 0.00 0.00 0.00 51.96 52.04 2i8l s ALA 63 Cb -0.05 -3.21 0.08 0.00 0.00 0.00 0.00 23.12 19.94 2i8l s ALA 63 CO 0.10 -1.99 0.59 0.99 0.00 0.00 0.00 175.76 175.46 2i8l s THR 64 N -2.95 -0.16 -0.23 0.00 2.01 0.24 -4.63 115.64 109.91 2i8l s THR 64 Ca 0.62 0.04 -0.29 0.00 0.31 0.00 0.00 61.69 62.36 2i8l s THR 64 Cb -0.17 -0.87 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 2i8l s THR 64 CO 0.56 0.01 1.40 -0.62 -0.69 0.00 0.00 174.62 175.29 2i8l s ASP 65 N 1.78 6.66 0.00 3.53 2.15 -1.26 -3.65 116.67 125.89 2i8l s ASP 65 Ca -0.09 1.51 0.06 0.00 0.43 0.00 0.00 52.55 54.47 2i8l s ASP 65 Cb -0.07 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 40.08 2i8l s ASP 65 CO -0.17 -1.03 0.77 0.23 -0.17 0.00 0.00 175.17 174.79 2i8l n MET 66 N 7.21 0.36 -1.19 4.34 2.81 -1.26 -4.54 117.12 124.85 2i8l n MET 66 Ca 0.16 -1.03 -0.07 0.00 -1.81 0.00 0.00 57.70 54.95 2i8l n MET 66 Cb 0.45 -1.13 -0.03 0.00 -0.71 0.00 0.00 33.22 31.81 2i8l n MET 66 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2i8l n GLY 67 N 0.32 0.69 2.51 3.03 0.00 -1.26 -4.37 105.19 106.10 2i8l n GLY 67 Ca 0.04 -0.05 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 2i8l n GLY 67 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2i8l n LEU 68 N -0.75 0.00 -4.76 0.99 4.77 -1.26 -0.82 117.00 115.16 2i8l n LEU 68 Ca -0.07 -1.15 -0.41 0.00 -0.03 0.00 0.00 56.01 54.36 2i8l n LEU 68 Cb 0.50 -0.54 -0.04 0.00 -2.33 0.00 0.00 43.42 41.01 2i8l n LEU 68 CO 0.10 -0.97 0.85 0.21 -1.33 0.00 0.00 177.39 176.24 2i8l s ASN 69 N -3.90 7.14 0.13 -1.43 3.84 -1.26 -4.66 114.94 114.79 2i8l s ASN 69 Ca 0.46 2.35 -0.34 0.00 0.21 0.00 0.00 52.86 55.54 2i8l s ASN 69 Cb -0.02 -2.63 -0.17 0.00 -0.55 0.00 0.00 41.25 37.88 2i8l s ASN 69 CO 0.31 -0.26 0.99 -2.65 -2.79 0.00 0.00 177.10 172.70 2i8l n PRO 70 N 1.35 0.55 -0.97 0.43 -0.02 -1.26 -1.80 135.00 133.28 2i8l n PRO 70 Ca 0.00 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2i8l n PRO 70 Cb 0.44 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 2i8l n PRO 70 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2i8l n GLY 71 N 1.86 0.68 3.75 -1.23 0.00 -0.73 -4.86 105.19 104.67 2i8l n GLY 71 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2i8l n GLY 71 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2i8l s GLU 72 N -0.16 2.77 -0.01 1.61 0.41 -0.74 -4.59 118.70 117.99 2i8l s GLU 72 Ca 0.00 1.63 0.05 0.00 -0.41 0.00 0.00 54.97 56.24 2i8l s GLU 72 Cb 0.00 -1.92 -0.01 0.00 -1.78 0.00 0.00 34.13 30.41 2i8l s GLU 72 CO 0.00 -1.32 -0.16 0.42 -0.49 0.00 0.00 175.26 173.71 2i8l s ILE 73 N -1.96 1.25 0.01 -1.63 1.01 -1.26 -0.86 121.20 117.75 2i8l s ILE 73 Ca 0.72 -0.68 -0.13 0.00 0.00 0.00 0.00 60.65 60.57 2i8l s ILE 73 Cb -0.26 -1.04 0.02 0.00 0.01 0.00 0.00 42.46 41.19 2i8l s ILE 73 CO 0.38 0.35 0.27 -0.13 0.00 0.00 0.00 174.94 175.81 2i8l s ARG 74 N -0.36 0.68 0.37 2.79 1.81 -0.63 -4.65 118.95 118.96 2i8l s ARG 74 Ca 0.06 -0.35 -0.24 0.00 -1.72 0.00 0.00 55.73 53.47 2i8l s ARG 74 Cb -0.06 0.30 -0.10 0.00 -0.45 0.00 0.00 34.95 34.64 2i8l s ARG 74 CO -0.01 -0.20 0.98 0.42 -0.68 0.00 0.00 175.30 175.82 2i8l s ILE 75 N -1.80 4.09 0.18 1.52 -1.09 0.31 -0.60 121.20 123.80 2i8l s ILE 75 Ca -0.11 1.59 0.02 0.00 -2.23 0.00 0.00 60.65 59.92 2i8l s ILE 75 Cb -0.04 -3.81 -0.05 0.00 -1.58 0.00 0.00 42.46 36.98 2i8l s ILE 75 CO 0.01 -0.00 0.02 -0.63 -1.23 0.00 0.00 174.94 173.11 2i8l s ILE 76 N -1.75 0.62 0.02 2.92 1.01 -0.15 -0.70 121.20 123.17 2i8l s ILE 76 Ca 0.55 -1.98 0.01 0.00 0.00 0.00 0.00 60.65 59.23 2i8l s ILE 76 Cb -0.18 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.10 2i8l s ILE 76 CO 0.23 -0.41 -0.04 -0.62 0.00 0.00 0.00 174.94 174.10 2i8l s ASP 77 N -3.18 0.36 0.55 3.58 -1.08 -1.26 -3.13 116.67 112.51 2i8l s ASP 77 Ca 0.26 -0.34 0.28 0.00 -0.52 0.00 0.00 52.55 52.23 2i8l s ASP 77 Cb 0.06 0.04 1.46 0.00 -1.46 0.00 0.00 42.92 43.03 2i8l s ASP 77 CO 0.05 -0.16 1.94 1.55 0.52 0.00 0.00 175.17 179.07 2i8l h PRO 78 N 5.14 0.00 0.00 4.34 0.13 -1.95 0.72 132.00 140.38 2i8l h PRO 78 Ca -0.30 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 2i8l h PRO 78 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2i8l h PRO 78 CO 0.44 0.00 -0.05 0.22 -0.23 0.00 0.00 178.00 178.39 2i8l h ASP 79 N 0.00 0.00 0.00 1.44 3.58 -1.98 -3.24 116.42 116.22 2i8l h ASP 79 Ca 0.28 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.69 2i8l h ASP 79 Cb 1.22 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 2i8l h ASP 79 CO -0.00 0.05 -1.14 -0.67 -2.88 0.00 0.00 179.24 174.59 2i8l n ASP 80 N -3.23 4.48 -0.33 2.28 2.03 0.05 -4.53 116.55 117.29 2i8l n ASP 80 Ca -0.01 -0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.43 2i8l n ASP 80 Cb 0.24 0.54 0.31 0.00 -0.72 0.00 0.00 41.12 41.50 2i8l n ASP 80 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2i8l h ILE 81 N 0.00 0.65 -0.31 5.18 2.04 -1.12 -0.68 117.51 123.27 2i8l h ILE 81 Ca -0.06 -0.22 0.09 0.00 1.00 0.00 0.00 64.86 65.67 2i8l h ILE 81 Cb 1.13 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 2i8l h ILE 81 CO 0.00 0.12 0.28 0.00 0.00 0.00 0.00 178.15 178.55 2i8l h ALA 82 N 1.65 2.08 0.01 1.87 0.00 -1.79 0.76 119.26 123.84 2i8l h ALA 82 Ca 0.57 -0.01 -0.41 0.00 0.00 0.00 0.00 54.91 55.06 2i8l h ALA 82 Cb 0.93 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.67 2i8l h ALA 82 CO -0.41 -0.44 -2.45 0.39 0.00 0.00 0.00 179.25 176.34 2i8l n GLU 83 N -4.03 0.64 0.20 0.00 1.02 -0.67 -4.54 120.64 113.26 2i8l n GLU 83 Ca 0.05 0.20 0.07 0.00 -0.02 0.00 0.00 57.16 57.45 2i8l n GLU 83 Cb 0.44 -1.53 0.36 0.00 -0.02 0.00 0.00 31.44 30.69 2i8l n GLU 83 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2i8l h MET 84 N -0.32 0.00 0.00 3.49 2.86 -0.51 0.08 114.93 120.53 2i8l h MET 84 Ca -0.60 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.04 2i8l h MET 84 Cb 1.81 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.47 2i8l h MET 84 CO -0.18 0.33 0.00 1.19 1.06 0.00 0.00 176.91 179.31 2i8l n PHE 85 N -3.49 0.00 -0.04 -0.22 3.01 0.20 -2.74 117.46 114.18 2i8l n PHE 85 Ca -0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 2i8l n PHE 85 Cb 0.49 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.96 2i8l n PHE 85 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2i8l n MET 86 N -0.95 1.42 0.25 -1.08 0.00 -0.38 -1.81 117.12 114.57 2i8l n MET 86 Ca 0.22 -0.33 0.08 0.00 0.00 0.00 0.00 57.70 57.67 2i8l n MET 86 Cb 0.10 -0.82 0.61 0.00 0.00 0.00 0.00 33.22 33.11 2i8l n MET 86 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 175.97 177.95 2i8l h MET 87 N 0.00 0.00 -0.48 3.17 -1.53 -0.84 -0.65 114.93 114.59 2i8l h MET 87 Ca 0.00 0.00 0.14 0.00 -3.44 0.00 0.00 59.70 56.40 2i8l h MET 87 Cb 0.02 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.05 2i8l h MET 87 CO 0.00 0.09 0.39 1.79 0.14 0.00 0.00 176.91 179.32 2i8l h THR 88 N 0.00 0.61 0.00 -0.77 1.35 -1.80 -3.46 112.91 108.84 2i8l h THR 88 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2i8l h THR 88 Cb 0.16 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 67.30 2i8l h THR 88 CO 0.01 0.00 0.00 0.41 -0.25 0.00 0.00 175.52 175.69 2i8l n THR 89 N -4.16 0.00 -3.55 6.82 -1.04 -0.25 -4.98 114.28 107.12 2i8l n THR 89 Ca 0.09 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 62.01 2i8l n THR 89 Cb 0.59 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.07 2i8l n THR 89 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2i8l s HIS 90 N 0.00 -0.34 0.00 -1.42 5.65 -1.25 -4.77 115.29 113.16 2i8l s HIS 90 Ca 0.00 0.42 0.00 0.00 0.25 0.00 0.00 55.06 55.73 2i8l s HIS 90 Cb 0.00 0.49 0.00 0.00 -1.18 0.00 0.00 32.58 31.89 2i8l s HIS 90 CO 0.00 -0.40 0.00 -1.71 -0.65 0.00 0.00 174.74 171.98 2i8l n ASN 91 N 0.30 0.00 -3.64 9.88 2.85 -0.75 -4.91 115.26 118.99 2i8l n ASN 91 Ca -0.09 0.00 -0.07 0.00 -0.11 0.00 0.00 54.58 54.31 2i8l n ASN 91 Cb 0.59 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.55 2i8l n ASN 91 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 2i8l s MET 92 N -0.21 0.59 -1.13 1.20 -1.94 -1.26 -5.06 119.30 111.49 2i8l s MET 92 Ca 0.00 0.89 -0.08 0.00 -1.71 0.00 0.00 55.69 54.79 2i8l s MET 92 Cb 0.00 0.19 -0.07 0.00 2.01 0.00 0.00 34.83 36.96 2i8l s MET 92 CO 0.00 -0.10 2.34 -0.35 -0.01 0.00 0.00 175.02 176.90 2i8l n PRO 93 N 3.42 2.53 0.08 2.03 -0.04 -1.26 -4.79 135.00 136.97 2i8l n PRO 93 Ca -0.17 -1.73 0.02 0.00 -0.04 0.00 0.00 63.50 61.58 2i8l n PRO 93 Cb 0.57 -2.61 0.12 0.00 -0.04 0.00 0.00 33.50 31.54 2i8l n PRO 93 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2i8l n LEU 94 N 4.30 0.11 0.03 1.53 4.77 -1.26 -1.96 117.00 124.53 2i8l n LEU 94 Ca 0.55 0.32 0.22 0.00 -0.03 0.00 0.00 56.01 57.06 2i8l n LEU 94 Cb 0.18 -0.26 0.73 0.00 -2.33 0.00 0.00 43.42 41.75 2i8l n LEU 94 CO 0.78 -0.36 1.20 -0.55 -1.33 0.00 0.00 177.39 177.12 2i8l h ASN 95 N 0.00 0.00 -0.19 -1.43 7.08 -1.86 -1.24 115.58 117.94 2i8l h ASN 95 Ca 0.00 0.00 -0.04 0.00 -3.08 0.00 0.00 56.30 53.18 2i8l h ASN 95 Cb 0.77 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.99 2i8l h ASN 95 CO 0.00 0.00 0.00 0.10 -2.08 0.00 0.00 177.43 175.45 2i8l h TYR 96 N 0.00 0.47 -0.14 4.14 -0.00 -1.79 -0.29 116.97 119.36 2i8l h TYR 96 Ca 0.24 -0.04 -0.06 0.00 0.00 0.00 0.00 58.73 58.88 2i8l h TYR 96 Cb 1.22 -0.14 -0.00 0.00 0.00 0.00 0.00 36.73 37.81 2i8l h TYR 96 CO 0.00 0.47 -0.13 1.25 -0.00 0.00 0.00 178.16 179.74 2i8l h LEU 97 N 0.44 0.37 -0.05 0.10 6.46 -1.50 -3.14 115.31 117.99 2i8l h LEU 97 Ca 0.10 -0.47 0.00 0.00 -0.12 0.00 0.00 57.88 57.39 2i8l h LEU 97 Cb 0.29 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.11 2i8l h LEU 97 CO 0.01 0.76 0.03 0.40 -0.62 0.00 0.00 178.44 179.02 2i8l h ILE 98 N -0.02 1.03 0.00 4.05 2.04 -1.43 -2.85 117.51 120.33 2i8l h ILE 98 Ca 0.02 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2i8l h ILE 98 Cb 0.65 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2i8l h ILE 98 CO 0.03 0.03 0.00 -0.67 0.00 0.00 0.00 178.15 177.54 2i8l n ASP 99 N -5.04 0.56 -0.90 1.72 2.03 -0.14 -0.38 116.55 114.39 2i8l n ASP 99 Ca -0.06 0.67 0.08 0.00 0.52 0.00 0.00 54.79 56.00 2i8l n ASP 99 Cb 0.04 -0.78 0.20 0.00 -0.72 0.00 0.00 41.12 39.86 2i8l n ASP 99 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2i8l n GLN 100 N -2.16 2.51 0.00 -0.67 6.02 -1.09 -4.59 117.38 117.40 2i8l n GLN 100 Ca 0.01 -2.16 0.00 0.00 -0.01 0.00 0.00 57.00 54.84 2i8l n GLN 100 Cb 0.17 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.04 2i8l n GLN 100 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2i8l n LEU 101 N 1.01 0.00 0.33 1.08 7.94 -0.50 -4.70 117.00 122.16 2i8l n LEU 101 Ca 0.16 0.00 0.22 0.00 -1.11 0.00 0.00 56.01 55.28 2i8l n LEU 101 Cb 0.50 0.00 1.16 0.00 0.53 0.00 0.00 43.42 45.61 2i8l n LEU 101 CO 0.12 0.00 1.17 0.07 -1.11 0.00 0.00 177.39 177.63 2i8l h LYS 102 N 0.00 0.00 0.00 1.96 2.10 -0.97 -1.75 116.57 117.91 2i8l h LYS 102 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2i8l h LYS 102 Cb 0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2i8l h LYS 102 CO 0.00 0.00 0.00 0.93 -2.00 0.00 0.00 179.45 178.38 2i8l h GLU 103 N 0.00 0.00 0.00 0.07 4.39 -1.81 -3.30 114.58 113.93 2i8l h GLU 103 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2i8l h GLU 103 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 2i8l h GLU 103 CO 0.00 0.00 -0.71 -3.47 -1.16 0.00 0.00 179.01 173.67 2i8l n ASP 104 N -2.57 2.73 -4.76 1.42 2.03 -0.85 -5.06 116.55 109.49 2i8l n ASP 104 Ca -0.00 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.90 2i8l n ASP 104 Cb 0.14 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.50 2i8l n ASP 104 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2i8l s ILE 105 N -1.72 3.27 0.20 5.18 1.01 -0.72 -4.92 121.20 123.49 2i8l s ILE 105 Ca 0.00 1.23 -0.07 0.00 0.00 0.00 0.00 60.65 61.81 2i8l s ILE 105 Cb 0.00 -3.79 0.06 0.00 0.01 0.00 0.00 42.46 38.74 2i8l s ILE 105 CO 0.00 0.28 1.64 1.23 0.00 0.00 0.00 174.94 178.09 2i8l h GLY 106 N 3.97 1.03 -5.60 6.18 0.00 -1.34 -3.43 103.07 103.87 2i8l h GLY 106 Ca -0.47 -0.80 -0.17 0.00 0.00 0.00 0.00 47.33 45.89 2i8l h GLY 106 CO 0.68 0.73 -0.43 1.85 0.00 0.00 0.00 176.54 179.37 2i8l s GLU 107 N -4.86 0.27 -0.09 4.80 2.56 -1.11 -5.01 118.70 115.27 2i8l s GLU 107 Ca -0.11 0.44 0.02 0.00 0.00 0.00 0.00 54.97 55.33 2i8l s GLU 107 Cb 0.13 0.04 0.01 0.00 2.00 0.00 0.00 34.13 36.32 2i8l s GLU 107 CO 0.85 -0.09 -0.15 0.08 -0.56 0.00 0.00 175.26 175.39 2i8l s VAL 108 N 0.60 1.41 0.12 3.70 1.01 -1.26 -0.97 120.40 125.01 2i8l s VAL 108 Ca -0.04 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.38 2i8l s VAL 108 Cb -0.05 -1.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 2i8l s VAL 108 CO -0.03 0.42 -0.13 -0.63 0.00 0.00 0.00 175.10 174.73 2i8l s ILE 109 N 0.81 1.25 0.03 2.22 1.01 -0.07 -4.95 121.20 121.50 2i8l s ILE 109 Ca -0.11 -1.74 0.02 0.00 0.00 0.00 0.00 60.65 58.82 2i8l s ILE 109 Cb -0.16 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.77 2i8l s ILE 109 CO 0.02 -0.48 -0.07 0.12 0.00 0.00 0.00 174.94 174.53 2i8l s PHE 110 N -2.31 0.61 -0.03 3.97 2.19 -1.18 -1.06 117.98 120.16 2i8l s PHE 110 Ca 0.09 -0.41 0.03 0.00 0.33 0.00 0.00 56.93 56.97 2i8l s PHE 110 Cb -0.04 -0.37 0.00 0.00 -1.31 0.00 0.00 43.02 41.30 2i8l s PHE 110 CO 0.02 -0.07 -0.12 -1.17 1.83 0.00 0.00 175.22 175.71 2i8l s LEU 111 N -1.26 1.83 0.26 6.12 0.20 -0.12 -0.98 118.68 124.74 2i8l s LEU 111 Ca -0.08 -0.25 0.11 0.00 0.69 0.00 0.00 54.13 54.60 2i8l s LEU 111 Cb -0.08 -0.72 -0.05 0.00 -0.43 0.00 0.00 46.19 44.91 2i8l s LEU 111 CO 0.00 0.10 -0.16 -0.83 -0.29 0.00 0.00 176.35 175.18 2i8l s GLY 112 N 0.14 1.81 -0.04 7.98 0.00 0.23 -3.19 107.32 114.25 2i8l s GLY 112 Ca -0.04 -1.77 0.01 0.00 0.00 0.00 0.00 44.72 42.92 2i8l s GLY 112 CO 0.01 -1.85 -0.02 -0.42 0.00 0.00 0.00 173.10 170.83 2i8l s ILE 113 N -2.31 0.33 -0.06 0.90 1.01 -1.20 -1.61 121.20 118.26 2i8l s ILE 113 Ca 0.29 -0.00 -0.30 0.00 0.00 0.00 0.00 60.65 60.64 2i8l s ILE 113 Cb -0.06 -0.40 -0.05 0.00 0.01 0.00 0.00 42.46 41.96 2i8l s ILE 113 CO 0.15 0.18 1.67 -1.58 0.00 0.00 0.00 174.94 175.37 2i8l s GLN 114 N 0.97 4.13 1.01 2.79 2.00 -0.04 -0.59 119.66 129.93 2i8l s GLN 114 Ca -0.10 2.17 -0.13 0.00 -2.00 0.00 0.00 55.36 55.30 2i8l s GLN 114 Cb -0.14 -4.00 0.20 0.00 0.80 0.00 0.00 33.01 29.86 2i8l s GLN 114 CO -0.01 -0.90 1.10 -1.25 -0.50 0.00 0.00 175.29 173.72 2i8l s PRO 115 N 4.14 0.32 0.00 1.67 0.04 -1.26 -1.78 135.00 138.14 2i8l s PRO 115 Ca 0.74 0.46 0.00 0.00 0.04 0.00 0.00 61.00 62.24 2i8l s PRO 115 Cb -0.33 -1.73 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2i8l s PRO 115 CO 0.30 -2.79 0.00 -3.47 0.04 0.00 0.00 177.00 171.08 2i8l n ASP 116 N -4.21 0.47 -3.92 6.66 2.03 -1.26 -4.59 116.55 111.73 2i8l n ASP 116 Ca 0.05 0.00 -0.16 0.00 0.52 0.00 0.00 54.79 55.21 2i8l n ASP 116 Cb 0.58 0.02 -0.15 0.00 -0.72 0.00 0.00 41.12 40.85 2i8l n ASP 116 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2i8l s ILE 117 N -1.11 0.33 -0.01 5.18 -5.25 -1.26 -5.10 121.20 113.98 2i8l s ILE 117 Ca 0.00 -0.15 0.00 0.00 -0.99 0.00 0.00 60.65 59.51 2i8l s ILE 117 Cb 0.00 -0.30 0.01 0.00 2.95 0.00 0.00 42.46 45.12 2i8l s ILE 117 CO 0.00 0.11 0.01 -0.69 -1.79 0.00 0.00 174.94 172.58 2i8l s VAL 118 N 0.10 -0.02 0.00 8.37 1.01 -1.26 -1.50 120.40 127.11 2i8l s VAL 118 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2i8l s VAL 118 Cb -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 36.38 36.30 2i8l s VAL 118 CO -0.00 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2i8l n GLY 119 N 3.47 3.43 3.75 4.51 0.00 -0.97 -4.93 105.19 114.45 2i8l n GLY 119 Ca -0.18 -0.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.89 2i8l n GLY 119 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2i8l s PHE 120 N -2.00 2.36 -1.47 1.61 0.08 -1.26 -2.44 117.98 114.85 2i8l s PHE 120 Ca 0.00 1.54 -0.11 0.00 0.12 0.00 0.00 56.93 58.48 2i8l s PHE 120 Cb 0.00 -3.44 0.06 0.00 -0.57 0.00 0.00 43.02 39.07 2i8l s PHE 120 CO 0.00 -2.21 0.86 0.66 -0.10 0.00 0.00 175.22 174.43 2i8l n TYR 121 N -1.88 -2.25 -4.40 0.36 4.01 0.15 -4.92 117.16 108.24 2i8l n TYR 121 Ca 0.13 0.78 -0.27 0.00 -0.16 0.00 0.00 57.90 58.37 2i8l n TYR 121 Cb 0.50 -4.06 -0.13 0.00 -0.31 0.00 0.00 39.34 35.34 2i8l n TYR 121 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2i8l s TYR 122 N -3.21 2.15 0.62 -0.72 2.02 -0.84 -5.00 117.35 112.37 2i8l s TYR 122 Ca 0.54 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.72 2i8l s TYR 122 Cb -0.26 -1.18 -0.03 0.00 -0.40 0.00 0.00 41.96 40.09 2i8l s TYR 122 CO 0.67 0.28 1.03 -1.25 -1.57 0.00 0.00 175.55 174.71 2i8l s PRO 123 N -1.95 3.45 0.21 -1.71 0.04 -1.26 -1.71 135.00 132.08 2i8l s PRO 123 Ca 0.11 0.89 -0.31 0.00 0.04 0.00 0.00 61.00 61.74 2i8l s PRO 123 Cb -0.10 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 32.28 2i8l s PRO 123 CO 0.05 -0.68 1.50 1.41 0.04 0.00 0.00 177.00 179.32 2i8l s MET 124 N -4.81 4.24 0.61 4.56 -2.45 -1.22 -4.15 119.30 116.08 2i8l s MET 124 Ca 0.57 2.33 -0.18 0.00 -1.25 0.00 0.00 55.69 57.16 2i8l s MET 124 Cb -0.12 -3.13 -0.02 0.00 1.25 0.00 0.00 34.83 32.80 2i8l s MET 124 CO 0.48 -0.51 1.19 0.95 1.05 0.00 0.00 175.02 178.17 2i8l s THR 125 N 0.56 2.73 0.16 10.11 -4.23 -1.26 -4.79 115.64 118.91 2i8l s THR 125 Ca 0.64 0.43 -0.16 0.00 -1.18 0.00 0.00 61.69 61.42 2i8l s THR 125 Cb -0.43 -3.11 0.02 0.00 1.34 0.00 0.00 72.50 70.33 2i8l s THR 125 CO 0.37 -0.13 1.77 -0.61 -0.54 0.00 0.00 174.62 175.49 2i8l h GLN 126 N 0.67 0.34 0.00 3.99 -0.00 -1.99 0.01 115.11 118.12 2i8l h GLN 126 Ca -0.50 -0.02 -0.05 0.00 -0.00 0.00 0.00 58.65 58.09 2i8l h GLN 126 Cb 1.29 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 28.68 2i8l h GLN 126 CO 0.54 0.22 -0.22 -1.00 0.00 0.00 0.00 178.83 178.38 2i8l h PRO 127 N 0.35 0.00 0.06 -2.39 0.13 -1.93 -1.18 132.00 127.04 2i8l h PRO 127 Ca 0.16 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 65.02 2i8l h PRO 127 Cb 0.10 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.25 2i8l h PRO 127 CO -0.14 0.22 -1.12 0.82 -0.23 0.00 0.00 178.00 177.55 2i8l h ILE 128 N 0.00 1.32 -0.42 -3.56 5.03 -1.66 -1.18 117.51 117.04 2i8l h ILE 128 Ca -0.00 -2.43 0.04 0.00 -0.12 0.00 0.00 64.86 62.35 2i8l h ILE 128 Cb 0.56 2.55 -0.04 0.00 -3.03 0.00 0.00 36.82 36.87 2i8l h ILE 128 CO 0.03 0.74 0.18 0.11 -0.68 0.00 0.00 178.15 178.52 2i8l h LYS 129 N 0.29 0.35 -0.82 2.37 1.57 -0.63 0.24 116.57 119.94 2i8l h LYS 129 Ca -0.14 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.59 2i8l h LYS 129 Cb 1.78 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.97 2i8l h LYS 129 CO 0.21 0.23 0.42 0.22 -0.57 0.00 0.00 179.45 179.96 2i8l h ASP 130 N 0.36 1.04 -0.01 0.86 3.58 -1.17 -0.10 116.42 120.99 2i8l h ASP 130 Ca 0.19 -0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 2i8l h ASP 130 Cb 0.14 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 40.92 2i8l h ASP 130 CO -0.16 0.86 0.00 0.00 -2.88 0.00 0.00 179.24 177.06 2i8l h ALA 131 N 1.30 0.01 -0.93 -0.78 0.00 -0.65 0.03 119.26 118.24 2i8l h ALA 131 Ca 0.29 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.13 2i8l h ALA 131 Cb 0.07 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2i8l h ALA 131 CO -0.04 -0.40 0.61 0.28 0.00 0.00 0.00 179.25 179.70 2i8l h VAL 132 N -0.16 1.19 0.00 0.00 2.07 -0.68 -0.47 116.25 118.20 2i8l h VAL 132 Ca 0.00 -0.42 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 2i8l h VAL 132 Cb 0.18 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 29.81 2i8l h VAL 132 CO -0.00 0.22 -0.39 -0.08 0.02 0.00 0.00 177.57 177.34 2i8l h GLU 133 N 1.21 0.00 -0.14 1.57 4.81 -0.81 0.59 114.58 121.82 2i8l h GLU 133 Ca 0.36 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.54 2i8l h GLU 133 Cb -0.06 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 2i8l h GLU 133 CO -0.10 0.39 -0.11 1.15 -0.73 0.00 0.00 179.01 179.61 2i8l h THR 134 N 0.00 1.34 -0.39 0.32 2.02 0.04 -1.62 112.91 114.62 2i8l h THR 134 Ca -0.00 -1.22 0.01 0.00 0.77 0.00 0.00 66.41 65.97 2i8l h THR 134 Cb 0.74 1.85 -0.02 0.00 -1.74 0.00 0.00 68.15 68.97 2i8l h THR 134 CO 0.05 0.36 0.24 0.58 0.37 0.00 0.00 175.52 177.12 2i8l h VAL 135 N -0.06 1.06 0.11 3.16 2.07 -0.82 -0.51 116.25 121.27 2i8l h VAL 135 Ca 0.03 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.40 2i8l h VAL 135 Cb 0.61 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 2i8l h VAL 135 CO 0.03 0.09 -0.44 0.22 0.02 0.00 0.00 177.57 177.49 2i8l h TYR 136 N 0.49 -1.24 0.00 1.57 3.20 -0.86 -2.33 116.97 117.81 2i8l h TYR 136 Ca 0.15 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.96 2i8l h TYR 136 Cb -0.02 0.53 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 2i8l h TYR 136 CO -0.06 -0.53 -0.46 -0.56 -1.64 0.00 0.00 178.16 174.90 2i8l h GLN 137 N -0.67 0.00 -0.34 1.82 3.07 -1.13 -2.75 115.11 115.11 2i8l h GLN 137 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.74 2i8l h GLN 137 Cb 0.70 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.24 2i8l h GLN 137 CO -0.26 0.46 0.15 -0.09 0.09 0.00 0.00 178.83 179.18 2i8l h ARG 138 N 0.00 0.47 0.00 0.06 9.65 -0.60 -2.77 114.38 121.19 2i8l h ARG 138 Ca -0.00 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2i8l h ARG 138 Cb 0.82 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.30 2i8l h ARG 138 CO 0.06 0.39 0.09 -0.07 2.80 0.00 0.00 179.97 183.23 2i8l h LEU 139 N 0.47 0.00 -0.04 3.80 3.38 -1.12 0.22 115.31 122.03 2i8l h LEU 139 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2i8l h LEU 139 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2i8l h LEU 139 CO -0.01 0.00 0.00 1.21 0.09 0.00 0.00 178.44 179.73 2i8l n GLU 140 N -2.58 0.26 0.00 1.13 2.13 -1.04 -3.18 120.64 117.36 2i8l n GLU 140 Ca -0.02 0.23 0.00 0.00 0.66 0.00 0.00 57.16 58.03 2i8l n GLU 140 Cb 0.13 -1.82 0.00 0.00 0.27 0.00 0.00 31.44 30.03 2i8l n GLU 140 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2i8l n GLY 141 N 1.23 0.71 3.66 8.31 0.00 -0.24 -4.63 105.19 114.24 2i8l n GLY 141 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 2i8l n GLY 141 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2i8l n TRP 142 N -0.12 2.07 -3.90 1.61 -0.00 0.63 -5.02 117.44 112.71 2i8l n TRP 142 Ca 0.00 0.47 -0.10 0.00 -0.00 0.00 0.00 57.50 57.87 2i8l n TRP 142 Cb 0.09 -2.44 -0.10 0.00 -0.00 0.00 0.00 31.31 28.87 2i8l n TRP 142 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 177.69 175.69 2i8l s GLU 143 N -0.55 0.50 4.44 5.87 2.56 -1.26 -4.92 118.70 125.34 2i8l s GLU 143 Ca 0.67 -0.53 0.00 0.00 0.00 0.00 0.00 54.97 55.12 2i8l s GLU 143 Cb -0.66 0.20 0.00 0.00 2.00 0.00 0.00 34.13 35.67 2i8l s GLU 143 CO 0.51 -0.12 0.00 0.41 -0.56 0.00 0.00 175.26 175.50 2i8l n GLY 144 N 1.26 1.18 0.85 -1.50 0.00 -1.26 -1.16 105.19 104.56 2i8l n GLY 144 Ca -0.22 0.50 0.07 0.00 0.00 0.00 0.00 46.02 46.38 2i8l n GLY 144 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2i8l n ASN 145 N 9.64 3.31 0.00 1.61 6.94 -1.26 -4.97 115.26 130.53 2i8l n ASN 145 Ca 0.00 -2.12 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 2i8l n ASN 145 Cb 0.00 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.09 2i8l n ASN 145 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2i8l n GLY 146 N 0.67 0.46 2.77 4.83 0.00 -0.31 -3.30 105.19 110.31 2i8l n GLY 146 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2i8l n GLY 146 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i8l n GLY 147 N -1.80 0.47 3.76 -0.02 0.00 -1.26 -4.89 105.19 101.44 2i8l n GLY 147 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2i8l n GLY 147 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2i8l s PHE 148 N -2.22 2.46 0.65 1.61 0.08 -1.21 -5.03 117.98 114.32 2i8l s PHE 148 Ca 0.00 1.54 -0.14 0.00 0.12 0.00 0.00 56.93 58.45 2i8l s PHE 148 Cb 0.00 -3.36 -0.01 0.00 -0.57 0.00 0.00 43.02 39.08 2i8l s PHE 148 CO 0.00 -1.99 1.09 0.00 -0.10 0.00 0.00 175.22 174.21 2i8l s ALA 149 N -1.87 2.55 -0.24 5.36 0.00 -1.26 -4.72 121.76 121.58 2i8l s ALA 149 Ca 0.73 0.43 -0.09 0.00 0.00 0.00 0.00 51.96 53.04 2i8l s ALA 149 Cb -0.26 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 2i8l s ALA 149 CO 0.35 -1.17 0.12 -1.14 0.00 0.00 0.00 175.76 173.92 2i8l s GLN 150 N -4.24 3.91 0.15 0.00 -0.44 -1.26 -0.53 119.66 117.25 2i8l s GLN 150 Ca 0.65 -0.36 -0.34 0.00 -2.50 0.00 0.00 55.36 52.81 2i8l s GLN 150 Cb -0.18 -3.42 -0.13 0.00 -1.64 0.00 0.00 33.01 27.63 2i8l s GLN 150 CO 0.42 0.00 1.62 -0.11 0.50 0.00 0.00 175.29 177.73 2i8l n LEU 151 N 4.42 3.26 -2.94 3.68 7.94 0.13 -4.89 117.00 128.59 2i8l n LEU 151 Ca -0.16 1.07 -0.13 0.00 -1.11 0.00 0.00 56.01 55.68 2i8l n LEU 151 Cb 0.52 -1.45 0.01 0.00 0.53 0.00 0.00 43.42 43.03 2i8l n LEU 151 CO 0.34 -0.20 -0.08 0.00 -1.11 0.00 0.00 177.39 176.33 2i8l n ALA 152 N 3.73 2.09 -3.67 1.96 0.00 -1.26 -4.92 120.51 118.43 2i8l n ALA 152 Ca 0.17 -2.96 -0.22 0.00 0.00 0.00 0.00 53.44 50.43 2i8l n ALA 152 Cb 0.30 -0.96 0.03 0.00 0.00 0.00 0.00 19.45 18.82 2i8l n ALA 152 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2i8l n VAL 153 N 0.12 -4.91 -1.57 0.00 0.31 -1.26 -4.98 118.33 106.04 2i8l n VAL 153 Ca 0.16 -0.60 -0.30 0.00 -0.01 0.00 0.00 64.34 63.59 2i8l n VAL 153 Cb 0.73 -4.00 0.20 0.00 -0.91 0.00 0.00 33.84 29.86 2i8l n VAL 153 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2i8l s GLU 154 N -5.89 0.01 0.03 5.55 2.02 -1.26 -5.12 118.70 114.04 2i8l s GLU 154 Ca 0.08 -0.20 -0.08 0.00 0.02 0.00 0.00 54.97 54.79 2i8l s GLU 154 Cb -0.02 -1.75 -0.00 0.00 0.10 0.00 0.00 34.13 32.45 2i8l s GLU 154 CO 0.81 -2.87 0.15 -1.21 0.02 0.00 0.00 175.26 172.17 2i8l s GLU 155 N -5.64 0.60 0.00 1.61 2.02 -1.26 -4.57 118.70 111.45 2i8l s GLU 155 Ca 0.72 -0.59 0.00 0.00 0.02 0.00 0.00 54.97 55.12 2i8l s GLU 155 Cb -0.07 0.25 0.00 0.00 0.10 0.00 0.00 34.13 34.40 2i8l s GLU 155 CO 0.54 -0.16 0.33 -1.91 0.02 0.00 0.00 175.26 174.08