#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 0.53 -0.12 3.17 2.01 -1.26 -4.96 115.64 115.01 2i8l s THR 2 Ca 0.00 -1.26 -0.13 0.00 0.31 0.00 0.00 61.69 60.60 2i8l s THR 2 Cb 0.00 -0.83 0.03 0.00 0.01 0.00 0.00 72.50 71.72 2i8l s THR 2 CO 0.00 -0.51 0.37 -0.62 -0.69 0.00 0.00 174.62 173.17 2i8l s ASP 3 N -1.91 -0.36 0.02 3.53 2.15 -1.26 -0.20 116.67 118.63 2i8l s ASP 3 Ca -0.05 0.65 0.02 0.00 0.43 0.00 0.00 52.55 53.60 2i8l s ASP 3 Cb -0.06 0.69 -0.02 0.00 -0.30 0.00 0.00 42.92 43.23 2i8l s ASP 3 CO -0.01 -0.18 -0.07 -0.69 -0.17 0.00 0.00 175.17 174.05 2i8l s VAL 4 N -0.05 0.51 -0.17 1.11 1.01 -0.82 -0.57 120.40 121.41 2i8l s VAL 4 Ca -0.02 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.24 2i8l s VAL 4 Cb -0.03 -0.51 -0.01 0.00 0.00 0.00 0.00 36.38 35.83 2i8l s VAL 4 CO 0.01 -0.15 -0.11 -0.22 0.00 0.00 0.00 175.10 174.63 2i8l s LEU 5 N -0.93 2.70 -0.48 3.92 2.96 -0.36 -1.57 118.68 124.92 2i8l s LEU 5 Ca -0.04 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.45 2i8l s LEU 5 Cb -0.06 -1.64 0.13 0.00 0.50 0.00 0.00 46.19 45.11 2i8l s LEU 5 CO 0.00 0.07 0.27 -0.22 -1.32 0.00 0.00 176.35 175.15 2i8l s LEU 6 N 0.90 5.12 0.34 -0.68 2.96 0.08 -0.58 118.68 126.82 2i8l s LEU 6 Ca -0.03 -2.38 -0.27 0.00 -0.22 0.00 0.00 54.13 51.23 2i8l s LEU 6 Cb -0.15 -1.80 -0.09 0.00 0.50 0.00 0.00 46.19 44.65 2i8l s LEU 6 CO -0.00 -0.45 1.13 0.00 -1.32 0.00 0.00 176.35 175.71 2i8l s VAL 8 N -1.32 0.03 0.00 0.00 1.01 -0.38 -0.90 120.40 118.84 2i8l s VAL 8 Ca 0.51 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2i8l s VAL 8 Cb -0.31 -0.10 0.00 0.00 0.00 0.00 0.00 36.38 35.97 2i8l s VAL 8 CO 0.39 -0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.96 2i8l n GLY 9 N 2.63 2.41 3.28 4.51 0.00 -0.07 -2.19 105.19 115.76 2i8l n GLY 9 Ca -0.16 -1.63 -0.34 0.00 0.00 0.00 0.00 46.02 43.89 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 4.03 0.24 1.61 3.84 -1.24 -2.02 114.94 121.41 2i8l s ASN 10 Ca 0.00 -0.44 0.16 0.00 0.21 0.00 0.00 52.86 52.79 2i8l s ASN 10 Cb 0.00 -1.67 0.85 0.00 -0.55 0.00 0.00 41.25 39.88 2i8l s ASN 10 CO 0.00 0.01 1.47 -1.20 -2.79 0.00 0.00 177.10 174.58 2i8l n SER 11 N 4.62 0.41 -0.08 -4.21 7.64 -1.26 -1.89 113.62 118.84 2i8l n SER 11 Ca -0.19 0.68 0.01 0.00 1.01 0.00 0.00 58.87 60.38 2i8l n SER 11 Cb 0.51 -0.72 0.02 0.00 -1.01 0.00 0.00 64.21 63.00 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 -2.05 1.16 -0.92 1.43 0.00 -1.26 -4.78 117.12 110.70 2i8l n MET 12 Ca -0.01 -1.17 -0.19 0.00 0.00 0.00 0.00 57.70 56.32 2i8l n MET 12 Cb 0.05 -0.79 0.08 0.00 0.00 0.00 0.00 33.22 32.56 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 -0.35 1.96 0.00 3.17 0.00 -0.79 -0.59 117.12 120.52 2i8l n MET 13 Ca 0.02 -2.04 0.00 0.00 0.00 0.00 0.00 57.70 55.68 2i8l n MET 13 Cb 0.46 -1.80 0.00 0.00 0.00 0.00 0.00 33.22 31.88 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 -0.31 0.45 0.27 -5.12 0.00 -0.65 -1.99 105.19 97.85 2i8l n GLY 14 Ca 0.40 -0.91 0.18 0.00 0.00 0.00 0.00 46.02 45.70 2i8l n GLY 14 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2i8l h ASP 15 N 8.80 0.00 -0.42 1.61 3.32 -0.95 -2.75 116.42 126.04 2i8l h ASP 15 Ca 0.00 0.00 0.12 0.00 0.02 0.00 0.00 57.03 57.17 2i8l h ASP 15 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2i8l h ASP 15 CO 0.00 0.00 0.39 -0.78 -1.72 0.00 0.00 179.24 177.13 2i8l h ASP 16 N 0.00 0.00 0.00 6.45 3.58 -1.75 -2.87 116.42 121.82 2i8l h ASP 16 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2i8l h ASP 16 Cb 0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2i8l h ASP 16 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 2i8l n GLY 17 N -1.52 1.15 0.10 -0.78 0.00 -0.91 -3.61 105.19 99.63 2i8l n GLY 17 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 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 1.92 0.18 0.52 4.61 0.00 -1.72 -1.77 119.26 122.99 2i8l h ALA 18 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 2i8l h ALA 18 Cb 0.54 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2i8l h ALA 18 CO 0.00 -0.15 -0.29 0.78 0.00 0.00 0.00 179.25 179.58 2i8l h GLY 19 N -0.01 -0.80 -0.18 0.00 0.00 -1.58 -1.99 103.07 98.51 2i8l h GLY 19 Ca 0.04 0.32 0.23 0.00 0.00 0.00 0.00 47.33 47.92 2i8l h GLY 19 CO 0.00 -0.29 0.46 -2.55 0.00 0.00 0.00 176.54 174.16 2i8l h PRO 20 N -0.76 0.45 -0.27 4.80 0.11 -1.71 0.18 132.00 134.80 2i8l h PRO 20 Ca -0.06 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 65.85 2i8l h PRO 20 Cb 0.61 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 2i8l h PRO 20 CO 0.08 0.30 -0.50 1.25 -0.21 0.00 0.00 178.00 178.91 2i8l h LEU 21 N 0.46 0.83 -0.30 2.35 5.85 -1.19 -1.76 115.31 121.55 2i8l h LEU 21 Ca 0.59 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2i8l h LEU 21 Cb 1.11 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.89 2i8l h LEU 21 CO -0.51 1.18 0.15 0.25 -0.34 0.00 0.00 178.44 179.18 2i8l h LEU 22 N 0.59 0.38 -0.96 2.25 5.85 -0.45 -2.42 115.31 120.56 2i8l h LEU 22 Ca 0.02 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.68 2i8l h LEU 22 Cb 1.08 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.95 2i8l h LEU 22 CO 0.11 0.38 0.62 0.00 -0.34 0.00 0.00 178.44 179.21 2i8l h ALA 23 N 1.02 1.28 -0.11 1.25 0.00 -0.59 0.06 119.26 122.16 2i8l h ALA 23 Ca 0.10 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2i8l h ALA 23 Cb 0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2i8l h ALA 23 CO -0.01 0.48 0.07 1.49 0.00 0.00 0.00 179.25 181.27 2i8l h GLU 24 N 1.19 0.15 -0.10 0.00 4.57 -1.12 0.77 114.58 120.05 2i8l h GLU 24 Ca 0.39 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.55 2i8l h GLU 24 Cb 0.04 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2i8l h GLU 24 CO -0.13 0.14 0.04 0.87 -1.18 0.00 0.00 179.01 178.74 2i8l h LYS 25 N 0.13 0.14 -0.50 1.92 1.57 -0.93 -1.19 116.57 117.72 2i8l h LYS 25 Ca 0.04 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 2i8l h LYS 25 Cb 0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2i8l h LYS 25 CO -0.01 0.26 0.07 0.00 -0.57 0.00 0.00 179.45 179.20 2i8l h ALA 27 N 1.33 1.10 -0.19 0.00 0.00 -0.62 -1.76 119.26 119.11 2i8l h ALA 27 Ca 0.16 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 2i8l h ALA 27 Cb 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2i8l h ALA 27 CO 0.01 0.58 -0.37 0.00 0.00 0.00 0.00 179.25 179.47 2i8l h ALA 28 N 1.25 1.01 -1.20 0.00 0.00 -0.68 -3.42 119.26 116.21 2i8l h ALA 28 Ca 0.17 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2i8l h ALA 28 Cb 0.40 -0.10 -0.23 0.00 0.00 0.00 0.00 17.79 17.86 2i8l h ALA 28 CO 0.01 0.60 -0.43 0.00 0.00 0.00 0.00 179.25 179.43 2i8l s ALA 29 N -4.27 -2.05 0.96 0.00 0.00 -0.68 -5.11 121.76 110.62 2i8l s ALA 29 Ca -0.06 0.72 -0.12 0.00 0.00 0.00 0.00 51.96 52.50 2i8l s ALA 29 Cb 0.13 -2.43 0.08 0.00 0.00 0.00 0.00 23.12 20.90 2i8l s ALA 29 CO 0.80 -1.85 0.62 -2.30 0.00 0.00 0.00 175.76 173.02 2i8l n PRO 30 N 5.29 -0.52 -4.21 0.00 -0.02 -0.68 -4.27 135.00 130.58 2i8l n PRO 30 Ca 0.05 -0.11 -0.12 0.00 -2.02 0.00 0.00 63.50 61.30 2i8l n PRO 30 Cb 0.53 -2.01 -0.10 0.00 -0.02 0.00 0.00 33.50 31.90 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 -3.95 0.99 1.41 -0.52 -0.14 -1.26 -5.04 119.74 111.23 2i8l s LYS 31 Ca 0.60 -1.44 0.00 0.00 -1.36 0.00 0.00 55.97 53.77 2i8l s LYS 31 Cb -0.21 -0.26 0.00 0.00 -1.68 0.00 0.00 37.83 35.68 2i8l s LYS 31 CO 0.65 -0.07 0.00 0.41 -0.76 0.00 0.00 175.35 175.58 2i8l n GLY 32 N -0.15 2.54 0.03 -3.33 0.00 -1.24 -3.29 105.19 99.75 2i8l n GLY 32 Ca -0.09 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 2.97 0.60 -4.65 1.61 5.15 -1.26 -5.04 115.26 114.65 2i8l n ASN 33 Ca 0.00 -1.37 -0.43 0.00 -0.60 0.00 0.00 54.58 52.18 2i8l n ASN 33 Cb 0.00 -0.02 -0.02 0.00 -0.53 0.00 0.00 39.78 39.21 2i8l n ASN 33 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 2i8l s TRP 34 N -0.34 2.51 -0.11 1.20 0.52 -1.21 -4.43 118.94 117.08 2i8l s TRP 34 Ca 0.01 0.74 -0.29 0.00 0.02 0.00 0.00 56.10 56.58 2i8l s TRP 34 Cb 0.01 -3.77 -0.04 0.00 -1.15 0.00 0.00 33.47 28.51 2i8l s TRP 34 CO 0.00 -2.31 1.64 0.08 0.02 0.00 0.00 176.95 176.37 2i8l s VAL 35 N 4.16 3.64 0.15 4.03 1.01 0.26 -4.65 120.40 129.00 2i8l s VAL 35 Ca 0.62 0.76 -0.30 0.00 0.00 0.00 0.00 61.98 63.05 2i8l s VAL 35 Cb -0.23 -3.54 -0.07 0.00 0.00 0.00 0.00 36.38 32.53 2i8l s VAL 35 CO 0.22 -0.13 1.17 -0.69 0.00 0.00 0.00 175.10 175.67 2i8l s VAL 36 N 4.45 3.76 0.00 2.92 1.01 -1.26 -1.22 120.40 130.07 2i8l s VAL 36 Ca 0.73 1.44 0.03 0.00 0.00 0.00 0.00 61.98 64.18 2i8l s VAL 36 Cb -0.30 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 2i8l s VAL 36 CO 0.29 0.21 -0.10 -0.63 0.00 0.00 0.00 175.10 174.86 2i8l s ILE 37 N 0.14 0.79 -0.27 2.22 1.01 0.26 -4.93 121.20 120.42 2i8l s ILE 37 Ca 0.53 -0.53 0.01 0.00 0.00 0.00 0.00 60.65 60.66 2i8l s ILE 37 Cb -0.31 -0.68 0.08 0.00 0.01 0.00 0.00 42.46 41.55 2i8l s ILE 37 CO 0.34 0.15 -0.00 -0.62 0.00 0.00 0.00 174.94 174.81 2i8l s ASP 38 N -0.43 4.04 0.00 3.58 2.15 -1.26 -0.96 116.67 123.80 2i8l s ASP 38 Ca 0.03 -1.44 0.29 0.00 0.43 0.00 0.00 52.55 51.85 2i8l s ASP 38 Cb -0.05 -1.19 1.64 0.00 -0.30 0.00 0.00 42.92 43.02 2i8l s ASP 38 CO -0.00 -0.30 2.04 0.61 -0.17 0.00 0.00 175.17 177.35 2i8l n GLY 39 N 4.63 -1.01 7.00 2.66 0.00 -0.08 -4.98 105.19 113.41 2i8l n GLY 39 Ca -0.07 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.92 1.52 0.61 -0.02 0.00 -1.26 -2.11 105.19 104.85 2i8l n GLY 40 Ca 0.19 -0.52 0.05 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.08 1.77 -3.05 1.61 3.41 -0.86 -0.90 113.62 113.53 2i8l n SER 41 Ca 0.00 -2.02 -0.18 0.00 -0.26 0.00 0.00 58.87 56.41 2i8l n SER 41 Cb 0.00 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 63.70 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 0.42 2.62 0.38 7.33 0.00 -0.89 -4.91 120.51 125.45 2i8l n ALA 42 Ca 0.11 -3.51 0.11 0.00 0.00 0.00 0.00 53.44 50.15 2i8l n ALA 42 Cb 0.29 -0.90 0.48 0.00 0.00 0.00 0.00 19.45 19.32 2i8l n ALA 42 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2i8l n PRO 43 N 0.14 0.17 -0.01 0.00 -0.04 -1.13 -2.46 135.00 131.68 2i8l n PRO 43 Ca 0.23 0.43 0.13 0.00 -0.04 0.00 0.00 63.50 64.25 2i8l n PRO 43 Cb 0.66 -1.85 0.56 0.00 -0.04 0.00 0.00 33.50 32.83 2i8l n PRO 43 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2i8l h GLU 44 N 0.00 0.25 0.00 0.54 -0.00 -1.93 -0.31 114.58 113.12 2i8l h GLU 44 Ca 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.36 59.33 2i8l h GLU 44 Cb 0.32 -0.06 -0.00 0.00 -0.00 0.00 0.00 28.75 29.01 2i8l h GLU 44 CO 0.00 0.16 -0.06 -2.95 -0.00 0.00 0.00 179.01 176.16 2i8l h ASN 45 N 0.25 0.00 -0.01 3.06 7.08 -1.85 -2.97 115.58 121.15 2i8l h ASN 45 Ca 0.22 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.44 2i8l h ASN 45 Cb 0.54 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.78 2i8l h ASN 45 CO -0.04 0.06 -0.17 0.47 -2.08 0.00 0.00 177.43 175.67 2i8l n ASP 46 N -4.15 2.39 -0.29 6.14 8.00 -0.13 -4.26 116.55 124.24 2i8l n ASP 46 Ca -0.03 -1.72 0.05 0.00 0.71 0.00 0.00 54.79 53.81 2i8l n ASP 46 Cb 0.15 0.16 0.19 0.00 -0.02 0.00 0.00 41.12 41.61 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 3.49 0.83 -0.84 0.53 2.04 -1.44 -0.50 117.51 121.61 2i8l h ILE 47 Ca 0.00 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 2i8l h ILE 47 Cb 0.83 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 2i8l h ILE 47 CO 0.00 0.13 0.50 0.58 0.00 0.00 0.00 178.15 179.36 2i8l h VAL 48 N 0.72 1.24 -0.37 1.67 2.07 -1.82 0.12 116.25 119.89 2i8l h VAL 48 Ca 0.43 -0.54 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 2i8l h VAL 48 Cb 0.49 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2i8l h VAL 48 CO -0.30 0.25 -0.01 0.00 0.02 0.00 0.00 177.57 177.54 2i8l h ALA 49 N 1.27 0.50 -0.15 1.67 0.00 -1.40 -1.32 119.26 119.82 2i8l h ALA 49 Ca 0.30 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2i8l h ALA 49 Cb -0.02 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2i8l h ALA 49 CO -0.05 0.28 0.05 0.82 0.00 0.00 0.00 179.25 180.35 2i8l h ILE 50 N 0.48 0.97 -0.56 0.00 2.04 -1.07 -3.09 117.51 116.27 2i8l h ILE 50 Ca 0.10 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.91 2i8l h ILE 50 Cb 0.48 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 2i8l h ILE 50 CO 0.02 0.02 0.33 0.03 0.00 0.00 0.00 178.15 178.55 2i8l h ARG 51 N 0.13 0.76 -0.29 2.37 3.08 -0.50 -1.24 114.38 118.70 2i8l h ARG 51 Ca 0.07 -0.07 0.08 0.00 0.07 0.00 0.00 59.98 60.13 2i8l h ARG 51 Cb 0.04 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2i8l h ARG 51 CO -0.07 0.55 0.21 0.93 -1.07 0.00 0.00 179.97 180.52 2i8l h GLU 52 N 0.78 0.00 -0.00 0.04 4.39 -1.16 -1.53 114.58 117.10 2i8l h GLU 52 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2i8l h GLU 52 Cb -0.01 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.64 2i8l h GLU 52 CO -0.04 0.00 -0.35 1.28 -1.16 0.00 0.00 179.01 178.74 2i8l n LEU 53 N -4.41 0.37 -3.81 1.33 4.77 -0.47 -4.98 117.00 109.79 2i8l n LEU 53 Ca 0.04 0.13 -0.21 0.00 -0.03 0.00 0.00 56.01 55.94 2i8l n LEU 53 Cb 0.37 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 2i8l n LEU 53 CO 0.35 0.09 -0.08 0.54 -1.33 0.00 0.00 177.39 176.96 2i8l n ARG 54 N -1.47 -0.67 -1.67 3.23 1.74 -0.58 -4.80 116.66 112.45 2i8l n ARG 54 Ca 0.06 -0.20 -0.39 0.00 -0.77 0.00 0.00 57.85 56.55 2i8l n ARG 54 Cb 0.34 -0.64 0.03 0.00 -1.02 0.00 0.00 32.46 31.17 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 -2.70 1.43 0.12 5.56 -0.02 -1.26 -4.82 135.00 133.31 2i8l n PRO 55 Ca -0.06 0.53 -0.02 0.00 -2.02 0.00 0.00 63.50 61.92 2i8l n PRO 55 Cb 0.26 -2.31 0.13 0.00 -0.02 0.00 0.00 33.50 31.57 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 1.30 1.47 -3.54 3.45 2.02 -0.90 -3.29 112.91 113.43 2i8l h THR 56 Ca -0.48 -2.24 -0.13 0.00 0.77 0.00 0.00 66.41 64.33 2i8l h THR 56 Cb 1.33 2.20 -0.19 0.00 -1.74 0.00 0.00 68.15 69.75 2i8l h THR 56 CO 0.56 0.64 -0.46 -0.60 0.37 0.00 0.00 175.52 176.03 2i8l s ARG 57 N -3.53 0.56 -0.05 6.66 3.52 -1.12 -1.79 118.95 123.20 2i8l s ARG 57 Ca -0.01 -0.50 -0.03 0.00 -0.13 0.00 0.00 55.73 55.06 2i8l s ARG 57 Cb 0.12 0.23 0.03 0.00 -1.56 0.00 0.00 34.95 33.77 2i8l s ARG 57 CO 0.77 -0.14 0.13 -1.17 -0.81 0.00 0.00 175.30 174.07 2i8l s LEU 58 N -1.67 1.08 -0.04 -0.88 2.96 -0.12 -1.95 118.68 118.06 2i8l s LEU 58 Ca -0.11 0.26 0.04 0.00 -0.22 0.00 0.00 54.13 54.10 2i8l s LEU 58 Cb -0.05 0.35 -0.00 0.00 0.50 0.00 0.00 46.19 46.99 2i8l s LEU 58 CO -0.00 -0.10 -0.16 -0.22 -1.32 0.00 0.00 176.35 174.54 2i8l s LEU 59 N 0.73 1.90 0.03 -0.68 2.96 -0.61 -1.07 118.68 121.94 2i8l s LEU 59 Ca -0.05 -0.34 0.09 0.00 -0.22 0.00 0.00 54.13 53.60 2i8l s LEU 59 Cb -0.07 -0.93 -0.03 0.00 0.50 0.00 0.00 46.19 45.66 2i8l s LEU 59 CO -0.03 0.14 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.26 2i8l s ILE 60 N 0.06 1.99 -0.04 6.68 1.01 -0.18 -0.75 121.20 129.98 2i8l s ILE 60 Ca -0.04 -1.29 -0.02 0.00 0.00 0.00 0.00 60.65 59.30 2i8l s ILE 60 Cb -0.11 -1.70 0.02 0.00 0.01 0.00 0.00 42.46 40.68 2i8l s ILE 60 CO 0.02 0.36 0.09 -0.69 0.00 0.00 0.00 174.94 174.71 2i8l s VAL 61 N -0.76 -0.02 0.20 2.92 1.01 -0.64 -1.22 120.40 121.88 2i8l s VAL 61 Ca 0.10 0.09 -0.23 0.00 0.00 0.00 0.00 61.98 61.93 2i8l s VAL 61 Cb -0.10 -0.14 0.05 0.00 0.00 0.00 0.00 36.38 36.19 2i8l s VAL 61 CO 0.02 0.04 0.90 -0.62 0.00 0.00 0.00 175.10 175.43 2i8l s ASP 62 N 0.52 -0.18 0.60 3.32 2.15 -1.21 -1.26 116.67 120.62 2i8l s ASP 62 Ca -0.04 -0.50 -0.15 0.00 0.43 0.00 0.00 52.55 52.29 2i8l s ASP 62 Cb -0.06 0.56 -0.03 0.00 -0.30 0.00 0.00 42.92 43.09 2i8l s ASP 62 CO -0.02 -1.05 1.05 0.00 -0.17 0.00 0.00 175.17 174.98 2i8l s ALA 63 N -3.32 2.76 -0.22 3.66 0.00 -1.26 -2.80 121.76 120.58 2i8l s ALA 63 Ca 0.13 0.33 -0.10 0.00 0.00 0.00 0.00 51.96 52.32 2i8l s ALA 63 Cb -0.03 -3.21 0.08 0.00 0.00 0.00 0.00 23.12 19.96 2i8l s ALA 63 CO 0.04 -0.82 0.50 0.99 0.00 0.00 0.00 175.76 176.47 2i8l s THR 64 N -2.55 -0.38 -0.09 0.00 2.01 0.12 -4.70 115.64 110.04 2i8l s THR 64 Ca 0.62 0.09 -0.30 0.00 0.31 0.00 0.00 61.69 62.41 2i8l s THR 64 Cb -0.15 -0.76 -0.03 0.00 0.01 0.00 0.00 72.50 71.56 2i8l s THR 64 CO 0.39 0.04 1.36 -0.62 -0.69 0.00 0.00 174.62 175.10 2i8l s ASP 65 N 2.09 6.88 0.00 3.53 2.15 -1.26 -3.57 116.67 126.50 2i8l s ASP 65 Ca -0.06 1.90 0.00 0.00 0.43 0.00 0.00 52.55 54.82 2i8l s ASP 65 Cb -0.10 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 2i8l s ASP 65 CO -0.15 -0.76 0.55 0.23 -0.17 0.00 0.00 175.17 174.86 2i8l n MET 66 N 6.28 -0.28 -1.83 4.34 2.81 -1.26 -4.72 117.12 122.46 2i8l n MET 66 Ca 0.14 -0.63 -0.17 0.00 -1.81 0.00 0.00 57.70 55.23 2i8l n MET 66 Cb 0.44 -0.96 -0.05 0.00 -0.71 0.00 0.00 33.22 31.94 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 -0.08 0.92 1.74 3.03 0.00 -1.26 -4.84 105.19 104.70 2i8l n GLY 67 Ca 0.00 -0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.18 0.00 -4.76 0.99 4.77 -1.26 -5.01 117.00 109.55 2i8l n LEU 68 Ca -0.19 -1.03 -0.40 0.00 -0.03 0.00 0.00 56.01 54.36 2i8l n LEU 68 Cb 0.60 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 41.42 2i8l n LEU 68 CO 0.26 -0.66 0.80 0.21 -1.33 0.00 0.00 177.39 176.67 2i8l s ASN 69 N -2.71 7.18 0.19 -1.43 2.47 -1.26 -4.99 114.94 114.40 2i8l s ASN 69 Ca 0.28 2.29 -0.31 0.00 0.42 0.00 0.00 52.86 55.55 2i8l s ASN 69 Cb -0.02 -2.63 -0.16 0.00 -1.45 0.00 0.00 41.25 36.99 2i8l s ASN 69 CO 0.18 -0.20 0.85 -2.65 -3.72 0.00 0.00 177.10 171.56 2i8l n PRO 70 N 1.06 0.59 -0.95 0.43 -0.02 -1.26 -1.95 135.00 132.90 2i8l n PRO 70 Ca -0.01 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2i8l n PRO 70 Cb 0.45 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.46 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 1.76 0.77 3.76 -1.23 0.00 -0.47 -4.86 105.19 104.92 2i8l n GLY 71 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 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 3.40 -0.04 1.61 0.41 -0.82 -4.64 118.70 118.46 2i8l s GLU 72 Ca 0.00 1.84 0.05 0.00 -0.41 0.00 0.00 54.97 56.45 2i8l s GLU 72 Cb 0.00 -2.20 -0.01 0.00 -1.78 0.00 0.00 34.13 30.14 2i8l s GLU 72 CO 0.00 -0.87 -0.19 0.42 -0.49 0.00 0.00 175.26 174.13 2i8l s ILE 73 N -1.55 1.60 -0.01 -1.63 1.01 -1.26 -0.91 121.20 118.44 2i8l s ILE 73 Ca 0.70 -0.82 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 2i8l s ILE 73 Cb -0.30 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 40.81 2i8l s ILE 73 CO 0.35 0.45 0.16 -0.13 0.00 0.00 0.00 174.94 175.78 2i8l s ARG 74 N -0.08 0.44 0.31 2.79 1.81 -0.55 -4.49 118.95 119.19 2i8l s ARG 74 Ca -0.02 -0.24 -0.27 0.00 -1.72 0.00 0.00 55.73 53.48 2i8l s ARG 74 Cb -0.12 0.19 -0.09 0.00 -0.45 0.00 0.00 34.95 34.48 2i8l s ARG 74 CO 0.02 -0.10 0.99 0.42 -0.68 0.00 0.00 175.30 175.95 2i8l s ILE 75 N -1.06 3.95 -0.03 1.52 -1.09 -0.06 -0.74 121.20 123.69 2i8l s ILE 75 Ca -0.11 1.73 0.04 0.00 -2.23 0.00 0.00 60.65 60.08 2i8l s ILE 75 Cb -0.06 -4.02 -0.00 0.00 -1.58 0.00 0.00 42.46 36.80 2i8l s ILE 75 CO 0.02 0.24 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.20 2i8l s ILE 76 N -1.43 1.12 0.25 2.92 1.01 -0.84 -0.47 121.20 123.75 2i8l s ILE 76 Ca 0.48 -0.56 -0.28 0.00 0.00 0.00 0.00 60.65 60.30 2i8l s ILE 76 Cb -0.24 -0.97 -0.09 0.00 0.01 0.00 0.00 42.46 41.18 2i8l s ILE 76 CO 0.30 0.33 0.91 -0.62 0.00 0.00 0.00 174.94 175.86 2i8l s ASP 77 N 0.03 7.52 0.45 3.58 -1.08 -1.26 -4.18 116.67 121.73 2i8l s ASP 77 Ca -0.02 1.87 0.26 0.00 -0.52 0.00 0.00 52.55 54.14 2i8l s ASP 77 Cb -0.09 -2.58 1.29 0.00 -1.46 0.00 0.00 42.92 40.08 2i8l s ASP 77 CO 0.01 0.10 1.76 -0.65 0.52 0.00 0.00 175.17 176.91 2i8l h PRO 78 N 3.89 0.22 0.00 4.34 0.11 -1.98 0.01 132.00 138.59 2i8l h PRO 78 Ca -0.46 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2i8l h PRO 78 Cb 1.20 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2i8l h PRO 78 CO 0.67 0.15 -0.20 0.22 -0.21 0.00 0.00 178.00 178.62 2i8l h ASP 79 N 0.23 0.00 0.00 -2.05 3.58 -1.98 -3.13 116.42 113.07 2i8l h ASP 79 Ca 0.62 0.00 -0.32 0.00 0.42 0.00 0.00 57.03 57.76 2i8l h ASP 79 Cb 1.91 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 42.90 2i8l h ASP 79 CO -0.22 0.20 -2.28 -0.67 -2.88 0.00 0.00 179.24 173.39 2i8l n ASP 80 N -3.75 0.27 -0.33 2.28 2.03 -0.13 -4.17 116.55 112.76 2i8l n ASP 80 Ca -0.02 0.00 0.14 0.00 0.52 0.00 0.00 54.79 55.44 2i8l n ASP 80 Cb 0.31 1.06 0.33 0.00 -0.72 0.00 0.00 41.12 42.11 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 0.58 -0.27 5.18 2.04 -1.21 0.07 117.51 123.89 2i8l h ILE 81 Ca -0.47 -0.20 0.08 0.00 1.00 0.00 0.00 64.86 65.27 2i8l h ILE 81 Cb 2.07 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2i8l h ILE 81 CO 0.03 0.10 0.36 0.00 0.00 0.00 0.00 178.15 178.64 2i8l h ALA 82 N 1.69 1.87 0.00 1.87 0.00 -1.71 -1.37 119.26 121.61 2i8l h ALA 82 Ca 0.59 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.36 2i8l h ALA 82 Cb 1.05 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2i8l h ALA 82 CO -0.46 -0.50 -1.47 0.39 0.00 0.00 0.00 179.25 177.21 2i8l n GLU 83 N -3.54 0.93 0.12 0.00 1.02 -0.76 -4.66 120.64 113.76 2i8l n GLU 83 Ca 0.04 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.22 2i8l n GLU 83 Cb 0.50 -1.17 0.31 0.00 -0.02 0.00 0.00 31.44 31.06 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 0.00 0.20 0.25 3.49 2.86 -0.64 -0.41 114.93 120.67 2i8l h MET 84 Ca -0.18 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.38 2i8l h MET 84 Cb 1.32 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.97 2i8l h MET 84 CO -0.02 0.48 -0.12 0.74 1.06 0.00 0.00 176.91 179.05 2i8l h PHE 85 N 0.18 -0.31 -0.01 -0.22 -1.00 -1.51 -3.07 116.94 111.00 2i8l h PHE 85 Ca 0.03 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.80 2i8l h PHE 85 Cb 0.62 0.10 0.00 0.00 3.61 0.00 0.00 35.95 40.28 2i8l h PHE 85 CO 0.01 -0.06 0.00 0.00 -1.61 0.00 0.00 178.31 176.65 2i8l n MET 86 N -5.15 1.04 0.28 1.51 0.00 -0.98 -2.82 117.12 111.01 2i8l n MET 86 Ca -0.09 -0.06 0.13 0.00 0.00 0.00 0.00 57.70 57.67 2i8l n MET 86 Cb 0.21 -1.27 0.83 0.00 0.00 0.00 0.00 33.22 32.99 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 0.12 0.00 0.00 3.17 -1.53 -0.98 0.11 114.93 115.83 2i8l h MET 87 Ca 0.00 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 2i8l h MET 87 Cb 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.08 2i8l h MET 87 CO 0.00 0.01 0.00 0.25 0.14 0.00 0.00 176.91 177.31 2i8l n THR 88 N -4.04 1.21 -1.72 -0.77 -2.24 -1.13 -4.86 114.28 100.73 2i8l n THR 88 Ca -0.03 0.56 -0.20 0.00 -2.27 0.00 0.00 64.05 62.11 2i8l n THR 88 Cb 0.09 -1.53 -0.07 0.00 -2.10 0.00 0.00 70.33 66.72 2i8l n THR 88 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2i8l n THR 89 N -2.04 -0.17 0.13 4.28 -1.04 0.39 -4.76 114.28 111.08 2i8l n THR 89 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2i8l n THR 89 Cb 0.07 -2.08 0.00 0.00 -1.82 0.00 0.00 70.33 66.50 2i8l n THR 89 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2i8l n HIS 90 N -2.72 -2.47 -2.19 -1.42 8.25 -1.26 -5.10 115.22 108.31 2i8l n HIS 90 Ca -0.20 0.52 -0.36 0.00 -0.26 0.00 0.00 57.72 57.42 2i8l n HIS 90 Cb 0.65 1.00 0.01 0.00 1.12 0.00 0.00 29.99 32.78 2i8l n HIS 90 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 2i8l s ASN 91 N -4.57 5.65 0.46 0.41 3.84 -1.26 -4.98 114.94 114.49 2i8l s ASN 91 Ca 0.00 2.26 -0.21 0.00 0.21 0.00 0.00 52.86 55.13 2i8l s ASN 91 Cb 0.00 -2.59 -0.10 0.00 -0.55 0.00 0.00 41.25 38.01 2i8l s ASN 91 CO 0.00 -1.27 0.99 -0.04 -2.79 0.00 0.00 177.10 173.99 2i8l s MET 92 N -3.20 4.02 -0.71 0.43 -1.94 -1.26 -3.52 119.30 113.13 2i8l s MET 92 Ca 0.73 1.24 -0.06 0.00 -1.71 0.00 0.00 55.69 55.89 2i8l s MET 92 Cb -0.27 -2.14 -0.11 0.00 2.01 0.00 0.00 34.83 34.32 2i8l s MET 92 CO 0.30 -0.22 2.48 -0.35 -0.01 0.00 0.00 175.02 177.22 2i8l n PRO 93 N -0.79 2.13 0.00 2.03 -0.04 -1.26 -4.60 135.00 132.47 2i8l n PRO 93 Ca 0.08 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.23 2i8l n PRO 93 Cb 0.53 -2.29 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 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 3.50 0.00 0.16 1.53 4.77 -1.26 -2.75 117.00 122.95 2i8l n LEU 94 Ca 0.45 0.03 0.18 0.00 -0.03 0.00 0.00 56.01 56.64 2i8l n LEU 94 Cb 0.34 -0.03 0.79 0.00 -2.33 0.00 0.00 43.42 42.20 2i8l n LEU 94 CO 0.53 -0.03 1.16 -0.55 -1.33 0.00 0.00 177.39 177.17 2i8l h ASN 95 N 0.00 0.00 0.11 -1.43 7.08 -1.86 -0.47 115.58 119.01 2i8l h ASN 95 Ca 0.00 0.00 -0.02 0.00 -3.08 0.00 0.00 56.30 53.20 2i8l h ASN 95 Cb 0.05 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.29 2i8l h ASN 95 CO 0.00 0.00 -0.10 0.10 -2.08 0.00 0.00 177.43 175.35 2i8l h TYR 96 N 0.00 0.00 -0.03 4.14 -0.00 -1.90 -0.32 116.97 118.86 2i8l h TYR 96 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 58.73 58.75 2i8l h TYR 96 Cb 0.69 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.43 2i8l h TYR 96 CO 0.00 0.10 -0.38 1.25 -0.00 0.00 0.00 178.16 179.13 2i8l h LEU 97 N 0.00 0.39 -0.81 0.10 6.46 -1.38 -3.26 115.31 116.81 2i8l h LEU 97 Ca -0.00 -0.71 0.03 0.00 -0.12 0.00 0.00 57.88 57.08 2i8l h LEU 97 Cb 0.18 -0.12 -0.05 0.00 -0.73 0.00 0.00 40.66 39.94 2i8l h LEU 97 CO 0.01 1.05 0.52 0.40 -0.62 0.00 0.00 178.44 179.79 2i8l h ILE 98 N -0.23 1.12 0.00 4.05 2.04 -1.29 -0.80 117.51 122.40 2i8l h ILE 98 Ca -0.04 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.48 2i8l h ILE 98 Cb 1.08 0.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2i8l h ILE 98 CO 0.08 0.18 -0.00 -0.78 0.00 0.00 0.00 178.15 177.63 2i8l h ASP 99 N 1.00 0.00 0.10 1.72 3.58 -1.16 0.12 116.42 121.78 2i8l h ASP 99 Ca 0.32 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.77 2i8l h ASP 99 Cb 0.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.07 2i8l h ASP 99 CO -0.12 0.00 -0.07 0.00 -2.88 0.00 0.00 179.24 176.18 2i8l n GLN 100 N -3.64 1.26 0.00 0.28 6.02 -0.31 -4.21 117.38 116.77 2i8l n GLN 100 Ca -0.03 -0.63 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 2i8l n GLN 100 Cb 0.08 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.85 2i8l n GLN 100 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2i8l n LEU 101 N -0.32 1.21 0.32 1.08 7.99 -0.37 -4.81 117.00 122.10 2i8l n LEU 101 Ca 0.18 0.00 0.20 0.00 -0.01 0.00 0.00 56.01 56.37 2i8l n LEU 101 Cb 0.31 0.00 1.09 0.00 -0.11 0.00 0.00 43.42 44.71 2i8l n LEU 101 CO 0.20 0.20 1.15 0.07 -1.51 0.00 0.00 177.39 177.50 2i8l h LYS 102 N 0.00 0.00 0.00 3.23 2.10 -1.00 -0.17 116.57 120.74 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 0.82 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.15 2i8l h LYS 102 CO 0.00 0.01 0.00 0.39 -2.00 0.00 0.00 179.45 177.85 2i8l n GLU 103 N -3.33 0.10 0.00 0.07 -0.58 -1.26 -4.19 120.64 111.44 2i8l n GLU 103 Ca -0.03 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 56.99 2i8l n GLU 103 Cb 0.09 -1.66 0.00 0.00 -0.57 0.00 0.00 31.44 29.30 2i8l n GLU 103 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2i8l n ASP 104 N -1.84 0.87 -4.76 1.62 2.03 -0.60 -5.06 116.55 108.82 2i8l n ASP 104 Ca 0.04 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.94 2i8l n ASP 104 Cb 0.24 0.07 -0.03 0.00 -0.72 0.00 0.00 41.12 40.68 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 -1.18 3.04 0.17 5.18 1.01 -0.18 -4.93 121.20 124.31 2i8l s ILE 105 Ca 0.00 1.00 -0.11 0.00 0.00 0.00 0.00 60.65 61.54 2i8l s ILE 105 Cb 0.00 -3.64 0.05 0.00 0.01 0.00 0.00 42.46 38.88 2i8l s ILE 105 CO 0.00 0.22 1.63 1.23 0.00 0.00 0.00 174.94 178.02 2i8l h GLY 106 N 3.92 1.05 -5.55 6.18 0.00 -1.41 -3.44 103.07 103.81 2i8l h GLY 106 Ca -0.47 -0.75 -0.18 0.00 0.00 0.00 0.00 47.33 45.92 2i8l h GLY 106 CO 0.68 0.69 -0.48 1.85 0.00 0.00 0.00 176.54 179.29 2i8l s GLU 107 N -5.07 0.23 -0.06 4.80 2.56 -0.87 -5.00 118.70 115.29 2i8l s GLU 107 Ca -0.12 0.34 0.02 0.00 0.00 0.00 0.00 54.97 55.21 2i8l s GLU 107 Cb 0.13 0.06 0.02 0.00 2.00 0.00 0.00 34.13 36.33 2i8l s GLU 107 CO 0.84 -0.06 -0.10 0.08 -0.56 0.00 0.00 175.26 175.45 2i8l s VAL 108 N 0.39 0.97 0.11 3.70 1.01 -1.26 -0.94 120.40 124.38 2i8l s VAL 108 Ca -0.02 -0.38 0.05 0.00 0.00 0.00 0.00 61.98 61.63 2i8l s VAL 108 Cb -0.04 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2i8l s VAL 108 CO -0.02 0.32 -0.13 -0.63 0.00 0.00 0.00 175.10 174.64 2i8l s ILE 109 N 0.78 1.20 0.02 2.22 1.09 -0.24 -5.00 121.20 121.28 2i8l s ILE 109 Ca -0.13 -1.64 0.03 0.00 -1.10 0.00 0.00 60.65 57.82 2i8l s ILE 109 Cb -0.15 -1.42 -0.02 0.00 -1.06 0.00 0.00 42.46 39.82 2i8l s ILE 109 CO 0.02 -0.42 -0.10 0.12 -0.10 0.00 0.00 174.94 174.46 2i8l s PHE 110 N -2.09 0.85 -0.12 3.97 5.36 -1.26 -1.01 117.98 123.69 2i8l s PHE 110 Ca 0.06 -0.30 0.01 0.00 -0.96 0.00 0.00 56.93 55.75 2i8l s PHE 110 Cb -0.05 -0.52 0.02 0.00 -0.34 0.00 0.00 43.02 42.13 2i8l s PHE 110 CO 0.02 -0.01 -0.13 -1.17 -1.46 0.00 0.00 175.22 172.47 2i8l s LEU 111 N -0.86 1.59 0.19 6.12 0.20 -0.36 -2.00 118.68 123.56 2i8l s LEU 111 Ca -0.01 -0.40 0.07 0.00 0.69 0.00 0.00 54.13 54.48 2i8l s LEU 111 Cb -0.06 -1.03 -0.04 0.00 -0.43 0.00 0.00 46.19 44.62 2i8l s LEU 111 CO 0.00 -0.03 0.04 -0.83 -0.29 0.00 0.00 176.35 175.24 2i8l s GLY 112 N 1.24 1.70 -0.07 7.98 0.00 0.08 -3.29 107.32 114.96 2i8l s GLY 112 Ca -0.02 -1.37 -0.00 0.00 0.00 0.00 0.00 44.72 43.33 2i8l s GLY 112 CO -0.05 -1.39 -0.03 -0.42 0.00 0.00 0.00 173.10 171.21 2i8l s ILE 113 N -1.82 0.56 -0.09 0.90 1.01 -1.12 -1.48 121.20 119.16 2i8l s ILE 113 Ca 0.29 -0.05 -0.29 0.00 0.00 0.00 0.00 60.65 60.59 2i8l s ILE 113 Cb -0.09 -0.63 -0.07 0.00 0.01 0.00 0.00 42.46 41.68 2i8l s ILE 113 CO 0.20 0.26 2.00 -1.58 0.00 0.00 0.00 174.94 175.83 2i8l s GLN 114 N 1.47 3.75 0.88 2.79 2.00 -0.09 -0.70 119.66 129.75 2i8l s GLN 114 Ca -0.02 2.28 -0.13 0.00 -2.00 0.00 0.00 55.36 55.48 2i8l s GLN 114 Cb -0.13 -4.21 0.13 0.00 0.80 0.00 0.00 33.01 29.59 2i8l s GLN 114 CO -0.03 -1.39 1.21 -1.25 -0.50 0.00 0.00 175.29 173.33 2i8l s PRO 115 N 5.13 1.40 0.00 1.67 0.04 -1.26 -1.36 135.00 140.62 2i8l s PRO 115 Ca 0.90 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 61.92 2i8l s PRO 115 Cb -0.37 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2i8l s PRO 115 CO 0.37 -1.96 0.00 -3.47 0.04 0.00 0.00 177.00 171.98 2i8l n ASP 116 N -3.54 1.01 -3.83 6.66 2.03 -1.26 -4.67 116.55 112.95 2i8l n ASP 116 Ca 0.10 0.00 -0.24 0.00 0.52 0.00 0.00 54.79 55.17 2i8l n ASP 116 Cb 0.60 0.11 -0.17 0.00 -0.72 0.00 0.00 41.12 40.94 2i8l n ASP 116 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2i8l s ILE 117 N -1.14 0.65 -0.06 5.18 -1.16 -1.26 -5.08 121.20 118.33 2i8l s ILE 117 Ca 0.00 -0.06 -0.03 0.00 -0.51 0.00 0.00 60.65 60.05 2i8l s ILE 117 Cb 0.00 -0.75 0.03 0.00 0.61 0.00 0.00 42.46 42.35 2i8l s ILE 117 CO 0.00 0.30 0.14 -0.69 -2.81 0.00 0.00 174.94 171.89 2i8l s VAL 118 N 1.82 -0.04 0.00 4.00 1.01 -1.26 -0.47 120.40 125.46 2i8l s VAL 118 Ca 0.04 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.16 2i8l s VAL 118 Cb -0.12 -0.23 0.00 0.00 0.00 0.00 0.00 36.38 36.03 2i8l s VAL 118 CO -0.06 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.70 2i8l n GLY 119 N 3.90 3.85 3.76 4.51 0.00 -0.84 -4.92 105.19 115.45 2i8l n GLY 119 Ca -0.23 -0.84 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 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 2.54 -1.56 1.61 0.08 -1.26 -2.46 117.98 114.93 2i8l s PHE 120 Ca 0.00 1.53 -0.13 0.00 0.12 0.00 0.00 56.93 58.45 2i8l s PHE 120 Cb 0.00 -3.37 0.10 0.00 -0.57 0.00 0.00 43.02 39.17 2i8l s PHE 120 CO 0.00 -1.87 0.88 0.98 -0.10 0.00 0.00 175.22 175.11 2i8l n TYR 121 N -1.46 -2.09 -4.77 0.36 9.36 0.24 -4.92 117.16 113.89 2i8l n TYR 121 Ca 0.12 0.86 -0.32 0.00 3.32 0.00 0.00 57.90 61.89 2i8l n TYR 121 Cb 0.50 -3.71 -0.13 0.00 -0.63 0.00 0.00 39.34 35.37 2i8l n TYR 121 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 2i8l s TYR 122 N -3.36 2.63 0.70 2.98 2.02 -0.52 -4.98 117.35 116.81 2i8l s TYR 122 Ca 0.60 -0.21 -0.11 0.00 -0.37 0.00 0.00 57.07 56.98 2i8l s TYR 122 Cb -0.31 -1.54 0.01 0.00 -0.40 0.00 0.00 41.96 39.72 2i8l s TYR 122 CO 0.86 0.22 1.07 -1.25 -1.57 0.00 0.00 175.55 174.88 2i8l s PRO 123 N -1.13 2.86 0.33 -1.71 0.04 -1.26 -1.63 135.00 132.50 2i8l s PRO 123 Ca 0.13 1.02 -0.27 0.00 0.04 0.00 0.00 61.00 61.92 2i8l s PRO 123 Cb -0.11 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.36 2i8l s PRO 123 CO 0.03 -1.16 1.10 1.41 0.04 0.00 0.00 177.00 178.42 2i8l s MET 124 N -4.92 4.41 0.54 4.56 -2.45 -1.26 -4.25 119.30 115.93 2i8l s MET 124 Ca 0.59 1.72 -0.12 0.00 -1.25 0.00 0.00 55.69 56.63 2i8l s MET 124 Cb -0.15 -2.91 -0.05 0.00 1.25 0.00 0.00 34.83 32.96 2i8l s MET 124 CO 0.53 0.02 0.95 0.95 1.05 0.00 0.00 175.02 178.53 2i8l s THR 125 N -1.35 4.69 0.26 10.11 -4.23 -1.26 -4.88 115.64 118.98 2i8l s THR 125 Ca 0.50 0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 61.87 2i8l s THR 125 Cb -0.29 -3.81 0.24 0.00 1.34 0.00 0.00 72.50 69.99 2i8l s THR 125 CO 0.37 -0.89 1.76 -0.61 -0.54 0.00 0.00 174.62 174.71 2i8l h GLN 126 N 0.33 0.60 0.00 3.99 5.75 -1.98 -1.55 115.11 122.24 2i8l h GLN 126 Ca -0.46 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 57.91 2i8l h GLN 126 Cb 1.19 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.59 2i8l h GLN 126 CO 0.62 0.39 -0.47 -1.00 -2.65 0.00 0.00 178.83 175.72 2i8l h PRO 127 N 0.61 0.00 0.14 -2.39 0.13 -1.94 -0.03 132.00 128.53 2i8l h PRO 127 Ca 0.46 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 65.31 2i8l h PRO 127 Cb 0.66 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.80 2i8l h PRO 127 CO -0.37 0.47 -1.27 0.82 -0.23 0.00 0.00 178.00 177.43 2i8l h ILE 128 N 0.00 1.45 -0.50 -3.56 5.03 -1.76 -0.91 117.51 117.26 2i8l h ILE 128 Ca -0.00 -2.93 0.05 0.00 -0.12 0.00 0.00 64.86 61.85 2i8l h ILE 128 Cb 0.88 2.92 -0.05 0.00 -3.03 0.00 0.00 36.82 37.54 2i8l h ILE 128 CO 0.06 0.86 0.22 0.11 -0.68 0.00 0.00 178.15 178.73 2i8l h LYS 129 N 0.11 0.42 -0.56 2.37 1.57 -1.06 0.61 116.57 120.03 2i8l h LYS 129 Ca -0.16 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.53 2i8l h LYS 129 Cb 1.98 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 34.17 2i8l h LYS 129 CO 0.22 0.28 0.08 0.22 -0.57 0.00 0.00 179.45 179.68 2i8l h ASP 130 N 0.44 0.85 -0.20 0.86 3.58 -0.94 -0.23 116.42 120.77 2i8l h ASP 130 Ca 0.23 -0.18 -0.02 0.00 0.42 0.00 0.00 57.03 57.47 2i8l h ASP 130 Cb 0.18 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.99 2i8l h ASP 130 CO -0.19 0.87 0.06 0.00 -2.88 0.00 0.00 179.24 177.10 2i8l h ALA 131 N 1.24 0.27 -0.84 -0.78 0.00 -0.64 0.05 119.26 118.56 2i8l h ALA 131 Ca 0.18 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2i8l h ALA 131 Cb 0.39 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2i8l h ALA 131 CO 0.01 -0.10 0.38 0.28 0.00 0.00 0.00 179.25 179.82 2i8l h VAL 132 N 0.15 1.26 -0.69 0.00 2.07 -0.62 0.12 116.25 118.55 2i8l h VAL 132 Ca 0.07 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2i8l h VAL 132 Cb 0.25 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.19 2i8l h VAL 132 CO -0.00 0.32 0.42 -0.08 0.02 0.00 0.00 177.57 178.25 2i8l h GLU 133 N 1.20 0.93 -0.11 1.57 4.57 -0.89 0.25 114.58 122.09 2i8l h GLU 133 Ca 0.29 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.39 2i8l h GLU 133 Cb 0.15 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.53 2i8l h GLU 133 CO -0.03 0.65 0.07 1.15 -1.18 0.00 0.00 179.01 179.66 2i8l h THR 134 N 0.93 1.08 -0.40 0.32 2.02 -0.15 -1.15 112.91 115.57 2i8l h THR 134 Ca 0.25 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.21 2i8l h THR 134 Cb -0.05 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 2i8l h THR 134 CO -0.05 0.07 0.25 0.58 0.37 0.00 0.00 175.52 176.75 2i8l h VAL 135 N 0.10 1.11 -0.32 3.16 2.07 -0.77 -0.09 116.25 121.52 2i8l h VAL 135 Ca 0.04 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.39 2i8l h VAL 135 Cb 0.06 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 2i8l h VAL 135 CO -0.01 0.11 -0.05 0.22 0.02 0.00 0.00 177.57 177.86 2i8l h TYR 136 N 0.53 -0.12 0.00 1.57 3.20 -0.71 -0.85 116.97 120.59 2i8l h TYR 136 Ca 0.14 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.97 2i8l h TYR 136 Cb -0.03 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2i8l h TYR 136 CO -0.04 -0.11 -0.33 1.96 -1.64 0.00 0.00 178.16 177.99 2i8l h GLN 137 N 0.03 0.00 0.00 1.82 1.08 -0.86 -2.95 115.11 114.23 2i8l h GLN 137 Ca 0.15 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.29 2i8l h GLN 137 Cb 0.23 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 2i8l h GLN 137 CO -0.31 0.33 -0.29 -0.09 -0.95 0.00 0.00 178.83 177.52 2i8l h ARG 138 N 0.00 0.00 0.00 1.46 9.65 0.32 -3.33 114.38 122.49 2i8l h ARG 138 Ca -0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.87 2i8l h ARG 138 Cb 0.75 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.33 2i8l h ARG 138 CO 0.04 0.29 -0.01 -0.07 2.80 0.00 0.00 179.97 183.03 2i8l h LEU 139 N 0.00 0.00 -0.68 3.80 3.38 -1.11 0.37 115.31 121.08 2i8l h LEU 139 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2i8l h LEU 139 Cb 0.90 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2i8l h LEU 139 CO 0.04 0.01 -0.08 -1.84 0.09 0.00 0.00 178.44 176.65 2i8l n GLU 140 N -3.35 1.27 0.00 1.13 0.28 -1.25 -3.60 120.64 115.12 2i8l n GLU 140 Ca -0.03 -0.68 0.00 0.00 -0.16 0.00 0.00 57.16 56.30 2i8l n GLU 140 Cb 0.10 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.49 2i8l n GLU 140 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2i8l n GLY 141 N 1.22 -1.03 3.77 -1.84 0.00 -0.01 -4.76 105.19 102.53 2i8l n GLY 141 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.04 2.92 -2.13 1.61 -0.00 -0.42 -4.92 117.44 114.48 2i8l n TRP 142 Ca 0.00 0.44 0.01 0.00 -0.00 0.00 0.00 57.50 57.94 2i8l n TRP 142 Cb 0.37 -2.53 0.00 0.00 -0.00 0.00 0.00 31.31 29.15 2i8l n TRP 142 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 2i8l n GLU 143 N 0.63 0.00 0.00 5.87 2.13 -1.26 -4.91 120.64 123.09 2i8l n GLU 143 Ca 0.02 -1.12 0.00 0.00 0.66 0.00 0.00 57.16 56.73 2i8l n GLU 143 Cb 0.38 -0.25 0.00 0.00 0.27 0.00 0.00 31.44 31.85 2i8l n GLU 143 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2i8l n GLY 144 N 0.13 2.49 0.32 8.31 0.00 -1.26 -4.87 105.19 110.31 2i8l n GLY 144 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 0.00 0.00 1.61 6.94 -1.26 -5.01 115.26 117.54 2i8l n ASN 145 Ca 0.00 -1.21 0.00 0.00 -0.02 0.00 0.00 54.58 53.35 2i8l n ASN 145 Cb 0.00 -0.04 0.00 0.00 -2.36 0.00 0.00 39.78 37.38 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 0.00 0.39 2.55 4.83 0.00 -1.26 -2.39 105.19 109.31 2i8l n GLY 146 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.64 0.25 3.69 -0.02 0.00 -1.26 -4.91 105.19 101.30 2i8l n GLY 147 Ca 0.00 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.46 2.17 0.20 1.61 0.08 -1.01 -5.06 117.98 114.52 2i8l s PHE 148 Ca 0.00 1.10 -0.13 0.00 0.12 0.00 0.00 56.93 58.01 2i8l s PHE 148 Cb 0.00 -3.22 -0.07 0.00 -0.57 0.00 0.00 43.02 39.15 2i8l s PHE 148 CO 0.00 -2.72 0.59 0.00 -0.10 0.00 0.00 175.22 172.99 2i8l s ALA 149 N -2.94 3.53 -0.26 5.36 0.00 -1.26 -4.86 121.76 121.31 2i8l s ALA 149 Ca 0.65 -0.12 -0.17 0.00 0.00 0.00 0.00 51.96 52.31 2i8l s ALA 149 Cb -0.18 -2.56 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 2i8l s ALA 149 CO 0.57 0.44 0.48 -1.14 0.00 0.00 0.00 175.76 176.12 2i8l s GLN 150 N -2.35 4.05 0.14 0.00 -0.44 -1.26 -0.88 119.66 118.92 2i8l s GLN 150 Ca 0.43 0.24 -0.31 0.00 -2.50 0.00 0.00 55.36 53.22 2i8l s GLN 150 Cb -0.13 -3.66 -0.11 0.00 -1.64 0.00 0.00 33.01 27.47 2i8l s GLN 150 CO 0.20 -0.34 1.78 -1.17 0.50 0.00 0.00 175.29 176.26 2i8l s LEU 151 N 2.25 4.39 -0.35 3.68 2.96 0.38 -4.90 118.68 127.08 2i8l s LEU 151 Ca 0.20 2.76 0.14 0.00 -0.22 0.00 0.00 54.13 57.01 2i8l s LEU 151 Cb -0.16 -3.58 0.39 0.00 0.50 0.00 0.00 46.19 43.35 2i8l s LEU 151 CO 0.09 -0.98 0.82 0.00 -1.32 0.00 0.00 176.35 174.96 2i8l n ALA 152 N 5.20 2.48 -3.80 5.97 0.00 -1.26 -4.70 120.51 124.39 2i8l n ALA 152 Ca 0.17 -3.27 -0.25 0.00 0.00 0.00 0.00 53.44 50.09 2i8l n ALA 152 Cb 0.38 -0.94 0.01 0.00 0.00 0.00 0.00 19.45 18.90 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 0.15 -4.18 -1.99 0.00 0.31 -1.26 -4.90 118.33 106.46 2i8l n VAL 153 Ca 0.19 -0.60 -0.41 0.00 -0.01 0.00 0.00 64.34 63.51 2i8l n VAL 153 Cb 0.72 -3.43 -0.02 0.00 -0.91 0.00 0.00 33.84 30.20 2i8l n VAL 153 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2i8l s GLU 154 N -6.20 4.26 0.13 5.55 2.12 -1.26 -5.03 118.70 118.26 2i8l s GLU 154 Ca 0.09 2.33 -0.08 0.00 0.36 0.00 0.00 54.97 57.68 2i8l s GLU 154 Cb -0.03 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 31.27 2i8l s GLU 154 CO 0.85 -0.40 0.22 -1.21 -0.54 0.00 0.00 175.26 174.18 2i8l s GLU 155 N -0.84 1.02 0.00 4.30 2.02 -1.26 -4.92 118.70 119.02 2i8l s GLU 155 Ca 0.57 -1.15 0.00 0.00 0.02 0.00 0.00 54.97 54.41 2i8l s GLU 155 Cb -0.42 0.34 0.00 0.00 0.10 0.00 0.00 34.13 34.15 2i8l s GLU 155 CO 0.48 -0.35 0.00 -1.91 0.02 0.00 0.00 175.26 173.50