#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 5.35 0.38 2.03 2.01 -1.26 -4.98 115.64 119.17 2i8l s THR 2 Ca 0.00 -2.95 -0.24 0.00 0.31 0.00 0.00 61.69 58.80 2i8l s THR 2 Cb 0.00 -4.29 -0.09 0.00 0.01 0.00 0.00 72.50 68.12 2i8l s THR 2 CO 0.00 -1.06 1.04 -1.81 -0.69 0.00 0.00 174.62 172.10 2i8l s ASP 3 N 1.49 6.85 0.03 3.53 1.11 -1.26 -0.49 116.67 127.93 2i8l s ASP 3 Ca 0.22 2.02 0.02 0.00 0.18 0.00 0.00 52.55 55.00 2i8l s ASP 3 Cb -0.11 -2.59 -0.02 0.00 1.07 0.00 0.00 42.92 41.27 2i8l s ASP 3 CO -0.08 -0.43 -0.07 -0.69 1.18 0.00 0.00 175.17 175.08 2i8l s VAL 4 N -1.64 0.48 -0.16 -1.27 1.01 -0.68 -0.97 120.40 117.17 2i8l s VAL 4 Ca 0.56 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.62 2i8l s VAL 4 Cb -0.22 -0.54 0.02 0.00 0.00 0.00 0.00 36.38 35.65 2i8l s VAL 4 CO 0.28 -0.31 -0.15 -0.22 0.00 0.00 0.00 175.10 174.70 2i8l s LEU 5 N -1.33 1.89 -0.51 3.92 2.96 -0.32 -1.58 118.68 123.71 2i8l s LEU 5 Ca -0.08 -0.59 -0.06 0.00 -0.22 0.00 0.00 54.13 53.18 2i8l s LEU 5 Cb -0.09 -1.26 0.13 0.00 0.50 0.00 0.00 46.19 45.48 2i8l s LEU 5 CO 0.00 -0.06 0.35 -0.22 -1.32 0.00 0.00 176.35 175.11 2i8l s LEU 6 N 1.42 5.50 0.35 -0.68 2.96 0.23 -0.52 118.68 127.95 2i8l s LEU 6 Ca 0.04 -2.25 -0.27 0.00 -0.22 0.00 0.00 54.13 51.43 2i8l s LEU 6 Cb -0.13 -1.92 -0.09 0.00 0.50 0.00 0.00 46.19 44.54 2i8l s LEU 6 CO -0.11 -0.55 1.16 0.00 -1.32 0.00 0.00 176.35 175.53 2i8l s VAL 8 N -1.32 0.03 0.00 0.00 1.01 -0.19 -0.54 120.40 119.39 2i8l s VAL 8 Ca 0.52 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2i8l s VAL 8 Cb -0.32 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 35.94 2i8l s VAL 8 CO 0.41 -0.15 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2i8l n GLY 9 N 2.60 1.84 3.07 4.51 0.00 -1.26 -2.29 105.19 113.66 2i8l n GLY 9 Ca -0.16 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 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 2.84 0.32 1.61 3.84 -1.16 -1.76 114.94 120.63 2i8l s ASN 10 Ca 0.00 -0.54 0.21 0.00 0.21 0.00 0.00 52.86 52.74 2i8l s ASN 10 Cb 0.00 -1.29 1.15 0.00 -0.55 0.00 0.00 41.25 40.55 2i8l s ASN 10 CO 0.00 -0.02 1.64 -1.20 -2.79 0.00 0.00 177.10 174.73 2i8l n SER 11 N 4.60 0.55 -0.11 -4.21 7.64 -1.26 -2.00 113.62 118.83 2i8l n SER 11 Ca -0.19 0.75 0.02 0.00 1.01 0.00 0.00 58.87 60.47 2i8l n SER 11 Cb 0.50 -0.82 0.03 0.00 -1.01 0.00 0.00 64.21 62.92 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 -2.24 1.28 -1.10 1.43 0.00 -1.26 -4.76 117.12 110.46 2i8l n MET 12 Ca -0.01 -1.40 -0.22 0.00 0.00 0.00 0.00 57.70 56.07 2i8l n MET 12 Cb 0.05 -0.89 0.15 0.00 0.00 0.00 0.00 33.22 32.53 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 -0.49 2.13 0.00 3.17 0.00 -0.85 -0.51 117.12 120.57 2i8l n MET 13 Ca 0.04 -2.68 0.00 0.00 0.00 0.00 0.00 57.70 55.05 2i8l n MET 13 Cb 0.49 -2.05 0.00 0.00 0.00 0.00 0.00 33.22 31.66 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 -0.94 0.30 0.24 -5.12 0.00 -0.67 -1.63 105.19 97.37 2i8l n GLY 14 Ca 0.53 -1.13 0.17 0.00 0.00 0.00 0.00 46.02 45.59 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 6.90 0.00 0.00 1.61 3.32 -1.32 -2.40 116.42 124.52 2i8l h ASP 15 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2i8l h ASP 15 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2i8l h ASP 15 CO 0.00 0.00 0.17 -0.78 -1.72 0.00 0.00 179.24 176.91 2i8l h ASP 16 N 0.00 0.00 0.00 6.45 3.58 -1.77 -2.95 116.42 121.73 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 0.05 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.10 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 -1.15 0.86 0.16 -0.78 0.00 -0.90 -3.00 105.19 100.38 2i8l n GLY 17 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 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 1.58 -0.34 0.46 4.61 0.00 -1.75 -1.48 119.26 122.34 2i8l h ALA 18 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2i8l h ALA 18 Cb 0.29 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2i8l h ALA 18 CO 0.00 -0.64 -0.24 0.78 0.00 0.00 0.00 179.25 179.15 2i8l h GLY 19 N -0.43 -0.68 -0.03 0.00 0.00 -1.60 -2.20 103.07 98.14 2i8l h GLY 19 Ca -0.03 0.26 0.21 0.00 0.00 0.00 0.00 47.33 47.77 2i8l h GLY 19 CO 0.06 -0.25 0.55 -2.55 0.00 0.00 0.00 176.54 174.34 2i8l h PRO 20 N -0.65 0.59 -0.31 4.80 0.11 -1.72 0.18 132.00 135.01 2i8l h PRO 20 Ca -0.06 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.84 2i8l h PRO 20 Cb 0.51 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.48 2i8l h PRO 20 CO 0.09 0.39 -0.48 1.25 -0.21 0.00 0.00 178.00 179.04 2i8l h LEU 21 N 0.61 0.93 -0.29 2.35 5.85 -1.16 -1.45 115.31 122.15 2i8l h LEU 21 Ca 0.59 -0.47 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2i8l h LEU 21 Cb 1.03 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 2i8l h LEU 21 CO -0.44 1.25 0.17 0.25 -0.34 0.00 0.00 178.44 179.33 2i8l h LEU 22 N 0.67 0.36 -0.80 2.25 5.85 -0.58 -1.82 115.31 121.23 2i8l h LEU 22 Ca 0.03 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.72 2i8l h LEU 22 Cb 1.08 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.96 2i8l h LEU 22 CO 0.11 0.32 0.51 0.00 -0.34 0.00 0.00 178.44 179.04 2i8l h ALA 23 N 1.05 1.06 -0.08 1.25 0.00 -0.62 0.04 119.26 121.95 2i8l h ALA 23 Ca 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2i8l h ALA 23 Cb 0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 2i8l h ALA 23 CO -0.02 0.31 0.05 1.49 0.00 0.00 0.00 179.25 181.08 2i8l h GLU 24 N 0.98 0.11 -0.02 0.00 4.81 -1.01 0.52 114.58 119.97 2i8l h GLU 24 Ca 0.33 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2i8l h GLU 24 Cb 0.04 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2i8l h GLU 24 CO -0.12 0.11 0.01 0.87 -0.73 0.00 0.00 179.01 179.14 2i8l h LYS 25 N 0.08 0.02 -0.59 1.92 1.57 -0.89 -0.33 116.57 118.36 2i8l h LYS 25 Ca 0.03 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 2i8l h LYS 25 Cb 0.03 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2i8l h LYS 25 CO -0.01 0.10 0.14 0.00 -0.57 0.00 0.00 179.45 179.11 2i8l h ALA 27 N 1.27 0.89 -0.14 0.00 0.00 -0.65 -2.04 119.26 118.60 2i8l h ALA 27 Ca 0.19 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 2i8l h ALA 27 Cb 0.32 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2i8l h ALA 27 CO -0.00 0.61 -0.38 0.00 0.00 0.00 0.00 179.25 179.47 2i8l h ALA 28 N 1.08 1.09 -1.47 0.00 0.00 -0.61 -3.41 119.26 115.94 2i8l h ALA 28 Ca 0.21 -0.40 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 2i8l h ALA 28 Cb 0.35 -0.10 -0.26 0.00 0.00 0.00 0.00 17.79 17.79 2i8l h ALA 28 CO 0.00 0.58 -0.52 0.00 0.00 0.00 0.00 179.25 179.31 2i8l s ALA 29 N -4.22 -1.52 0.93 0.00 0.00 -0.43 -5.10 121.76 111.42 2i8l s ALA 29 Ca -0.05 0.14 -0.13 0.00 0.00 0.00 0.00 51.96 51.92 2i8l s ALA 29 Cb 0.13 -2.30 0.04 0.00 0.00 0.00 0.00 23.12 21.00 2i8l s ALA 29 CO 0.78 -1.94 0.51 -2.30 0.00 0.00 0.00 175.76 172.81 2i8l n PRO 30 N 4.96 -0.26 -4.15 0.00 -0.02 -0.78 -4.23 135.00 130.52 2i8l n PRO 30 Ca 0.06 -0.03 -0.13 0.00 -2.02 0.00 0.00 63.50 61.38 2i8l n PRO 30 Cb 0.51 -1.92 -0.11 0.00 -0.02 0.00 0.00 33.50 31.96 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 -3.70 0.77 0.28 -0.52 -0.14 -1.26 -5.04 119.74 110.13 2i8l s LYS 31 Ca 0.59 -1.12 0.00 0.00 -1.36 0.00 0.00 55.97 54.08 2i8l s LYS 31 Cb -0.22 -0.38 0.00 0.00 -1.68 0.00 0.00 37.83 35.55 2i8l s LYS 31 CO 0.65 0.04 0.00 0.41 -0.76 0.00 0.00 175.35 175.70 2i8l n GLY 32 N 0.58 2.14 0.21 -3.33 0.00 -1.19 -3.30 105.19 100.31 2i8l n GLY 32 Ca -0.16 0.35 0.01 0.00 0.00 0.00 0.00 46.02 46.21 2i8l n GLY 32 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2i8l n ASN 33 N 2.44 0.31 -4.70 1.61 6.94 -1.26 -5.06 115.26 115.53 2i8l n ASN 33 Ca 0.00 -1.64 -0.42 0.00 -0.02 0.00 0.00 54.58 52.50 2i8l n ASN 33 Cb 0.00 -0.11 -0.03 0.00 -2.36 0.00 0.00 39.78 37.28 2i8l n ASN 33 CO 0.00 0.00 0.00 0.26 -1.03 0.00 0.00 177.26 176.49 2i8l s TRP 34 N -0.27 3.23 -0.12 -2.53 0.52 -1.21 -4.27 118.94 114.28 2i8l s TRP 34 Ca 0.02 1.10 -0.29 0.00 0.02 0.00 0.00 56.10 56.95 2i8l s TRP 34 Cb 0.02 -3.53 -0.03 0.00 -1.15 0.00 0.00 33.47 28.78 2i8l s TRP 34 CO 0.00 -1.78 1.37 0.08 0.02 0.00 0.00 176.95 176.64 2i8l s VAL 35 N 1.55 4.07 0.12 4.03 1.01 -0.14 -4.82 120.40 126.22 2i8l s VAL 35 Ca 0.61 1.31 -0.30 0.00 0.00 0.00 0.00 61.98 63.59 2i8l s VAL 35 Cb -0.31 -3.84 -0.06 0.00 0.00 0.00 0.00 36.38 32.17 2i8l s VAL 35 CO 0.28 -0.11 1.09 -0.69 0.00 0.00 0.00 175.10 175.67 2i8l s VAL 36 N 3.54 4.09 0.04 2.92 1.01 -1.26 -1.18 120.40 129.56 2i8l s VAL 36 Ca 0.60 1.68 0.04 0.00 0.00 0.00 0.00 61.98 64.30 2i8l s VAL 36 Cb -0.25 -4.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 2i8l s VAL 36 CO 0.19 0.23 -0.11 -0.63 0.00 0.00 0.00 175.10 174.79 2i8l s ILE 37 N 0.22 0.82 -0.15 2.22 -1.09 0.32 -4.94 121.20 118.61 2i8l s ILE 37 Ca 0.51 -1.03 -0.02 0.00 -2.23 0.00 0.00 60.65 57.88 2i8l s ILE 37 Cb -0.28 -0.80 0.05 0.00 -1.58 0.00 0.00 42.46 39.85 2i8l s ILE 37 CO 0.32 -0.20 0.02 -0.62 -1.23 0.00 0.00 174.94 173.23 2i8l s ASP 38 N -1.37 2.40 0.34 3.58 2.15 -1.26 -1.17 116.67 121.33 2i8l s ASP 38 Ca -0.04 -0.53 0.26 0.00 0.43 0.00 0.00 52.55 52.67 2i8l s ASP 38 Cb -0.09 -0.55 1.03 0.00 -0.30 0.00 0.00 42.92 43.01 2i8l s ASP 38 CO 0.01 -0.26 1.79 1.23 -0.17 0.00 0.00 175.17 177.77 2i8l h GLY 39 N 8.27 0.00 -5.71 2.66 0.00 -1.17 -3.48 103.07 103.64 2i8l h GLY 39 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 47.33 46.73 2i8l h GLY 39 CO 0.31 0.00 -0.68 0.61 0.00 0.00 0.00 176.54 176.78 2i8l n GLY 40 N 0.23 -0.53 2.80 4.60 0.00 -1.26 -0.89 105.19 110.14 2i8l n GLY 40 Ca 0.02 0.22 -0.09 0.00 0.00 0.00 0.00 46.02 46.17 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 -2.86 -5.70 -2.98 1.61 3.41 -0.72 -4.85 113.62 101.54 2i8l n SER 41 Ca -0.00 0.22 -0.14 0.00 -0.26 0.00 0.00 58.87 58.68 2i8l n SER 41 Cb 0.56 -3.96 -0.00 0.00 -0.26 0.00 0.00 64.21 60.55 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 1.16 2.37 0.20 7.33 0.00 -0.07 -4.98 120.51 126.53 2i8l n ALA 42 Ca -0.09 -3.19 0.05 0.00 0.00 0.00 0.00 53.44 50.22 2i8l n ALA 42 Cb 0.56 -0.94 0.43 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.60 0.00 0.13 -1.84 -2.95 132.00 129.72 2i8l h PRO 43 Ca 0.01 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 2i8l h PRO 43 Cb 1.06 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 2i8l h PRO 43 CO 0.47 0.31 0.36 1.05 -0.23 0.00 0.00 178.00 179.97 2i8l h GLU 44 N 0.00 0.81 0.00 0.86 9.09 -1.94 -0.85 114.58 122.55 2i8l h GLU 44 Ca -0.00 -0.07 0.00 0.00 0.05 0.00 0.00 59.36 59.34 2i8l h GLU 44 Cb 0.59 -0.17 0.00 0.00 -1.65 0.00 0.00 28.75 27.52 2i8l h GLU 44 CO 0.04 0.57 0.00 0.09 0.05 0.00 0.00 179.01 179.76 2i8l n ASN 45 N -4.42 0.46 -0.34 3.06 3.02 -1.11 -2.78 115.26 113.15 2i8l n ASN 45 Ca 0.06 0.67 0.04 0.00 -0.03 0.00 0.00 54.58 55.32 2i8l n ASN 45 Cb 0.07 -0.74 0.03 0.00 -0.61 0.00 0.00 39.78 38.53 2i8l n ASN 45 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2i8l n ASP 46 N -2.07 1.69 -0.31 6.41 2.03 -0.34 -4.51 116.55 119.45 2i8l n ASP 46 Ca 0.00 -1.34 0.20 0.00 0.52 0.00 0.00 54.79 54.17 2i8l n ASP 46 Cb 0.11 0.04 0.47 0.00 -0.72 0.00 0.00 41.12 41.01 2i8l n ASP 46 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2i8l h ILE 47 N 1.67 0.59 -0.94 5.18 2.04 -1.39 -0.07 117.51 124.58 2i8l h ILE 47 Ca 0.00 -0.16 0.08 0.00 1.00 0.00 0.00 64.86 65.78 2i8l h ILE 47 Cb 0.36 0.07 -0.07 0.00 -0.74 0.00 0.00 36.82 36.45 2i8l h ILE 47 CO 0.00 0.09 0.59 0.58 0.00 0.00 0.00 178.15 179.41 2i8l h VAL 48 N 0.47 1.02 -0.44 1.67 2.07 -1.82 0.10 116.25 119.32 2i8l h VAL 48 Ca 0.57 -0.35 -0.10 0.00 0.82 0.00 0.00 66.70 67.64 2i8l h VAL 48 Cb 1.31 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2i8l h VAL 48 CO -0.30 0.19 -0.11 0.00 0.02 0.00 0.00 177.57 177.37 2i8l h ALA 49 N 1.46 0.60 -0.86 1.67 0.00 -1.34 -2.25 119.26 118.54 2i8l h ALA 49 Ca 0.43 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2i8l h ALA 49 Cb 0.26 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2i8l h ALA 49 CO -0.20 0.49 0.45 0.82 0.00 0.00 0.00 179.25 180.81 2i8l h ILE 50 N 0.68 1.26 0.00 0.00 2.04 -1.19 -1.48 117.51 118.81 2i8l h ILE 50 Ca 0.11 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 2i8l h ILE 50 Cb 0.65 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.85 2i8l h ILE 50 CO 0.04 0.30 -0.01 0.03 0.00 0.00 0.00 178.15 178.51 2i8l h ARG 51 N 1.22 0.00 -0.13 2.37 3.08 -0.66 -0.84 114.38 119.41 2i8l h ARG 51 Ca 0.30 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.23 2i8l h ARG 51 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2i8l h ARG 51 CO -0.04 0.01 -0.41 0.93 -1.07 0.00 0.00 179.97 179.38 2i8l h GLU 52 N 0.00 0.51 0.00 0.04 4.39 -0.69 -3.30 114.58 115.53 2i8l h GLU 52 Ca -0.00 -0.37 -0.07 0.00 0.34 0.00 0.00 59.36 59.25 2i8l h GLU 52 Cb 0.32 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2i8l h GLU 52 CO 0.00 0.99 -0.35 -0.07 -1.16 0.00 0.00 179.01 178.43 2i8l h LEU 53 N 0.12 0.00 -3.84 1.33 3.38 -0.93 -3.48 115.31 111.91 2i8l h LEU 53 Ca -0.01 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.42 2i8l h LEU 53 Cb 1.03 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 2i8l h LEU 53 CO 0.09 0.35 -1.02 0.54 0.09 0.00 0.00 178.44 178.48 2i8l n ARG 54 N -3.82 -0.82 -1.57 1.13 1.74 -0.43 -4.80 116.66 108.08 2i8l n ARG 54 Ca -0.01 0.35 -0.44 0.00 -0.77 0.00 0.00 57.85 56.98 2i8l n ARG 54 Cb 0.42 -2.20 -0.01 0.00 -1.02 0.00 0.00 32.46 29.65 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 -3.81 1.23 -0.17 5.56 -0.02 -1.26 -4.91 135.00 131.63 2i8l n PRO 55 Ca -0.20 0.43 -0.10 0.00 -2.02 0.00 0.00 63.50 61.61 2i8l n PRO 55 Cb 0.60 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 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 1.78 1.27 -3.31 3.45 2.02 -1.10 -3.30 112.91 113.71 2i8l h THR 56 Ca -0.40 -1.19 -0.13 0.00 0.77 0.00 0.00 66.41 65.45 2i8l h THR 56 Cb 1.35 1.04 -0.20 0.00 -1.74 0.00 0.00 68.15 68.59 2i8l h THR 56 CO 0.59 0.42 -0.40 -0.13 0.37 0.00 0.00 175.52 176.37 2i8l s ARG 57 N -4.88 0.56 -0.01 6.66 0.52 -1.23 -1.76 118.95 118.80 2i8l s ARG 57 Ca -0.12 -0.32 0.02 0.00 -0.52 0.00 0.00 55.73 54.79 2i8l s ARG 57 Cb 0.12 0.24 0.00 0.00 0.52 0.00 0.00 34.95 35.83 2i8l s ARG 57 CO 0.84 -0.14 -0.06 -1.17 0.02 0.00 0.00 175.30 174.78 2i8l s LEU 58 N -1.37 1.86 -0.05 2.53 2.96 -0.05 -1.69 118.68 122.88 2i8l s LEU 58 Ca -0.14 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.68 2i8l s LEU 58 Cb -0.07 -0.38 -0.00 0.00 0.50 0.00 0.00 46.19 46.25 2i8l s LEU 58 CO 0.03 0.06 -0.17 -0.22 -1.32 0.00 0.00 176.35 174.72 2i8l s LEU 59 N 0.07 1.89 0.01 -0.68 2.96 -0.61 -0.84 118.68 121.48 2i8l s LEU 59 Ca -0.01 -0.37 0.08 0.00 -0.22 0.00 0.00 54.13 53.61 2i8l s LEU 59 Cb -0.05 -1.01 -0.02 0.00 0.50 0.00 0.00 46.19 45.61 2i8l s LEU 59 CO -0.00 0.14 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.30 2i8l s ILE 60 N 0.17 1.90 -0.03 6.68 1.01 0.08 -0.60 121.20 130.41 2i8l s ILE 60 Ca -0.07 -1.16 -0.01 0.00 0.00 0.00 0.00 60.65 59.40 2i8l s ILE 60 Cb -0.13 -1.61 0.02 0.00 0.01 0.00 0.00 42.46 40.76 2i8l s ILE 60 CO 0.03 0.41 0.05 -0.69 0.00 0.00 0.00 174.94 174.74 2i8l s VAL 61 N -0.68 -0.04 0.27 2.92 1.01 -0.69 -1.11 120.40 122.08 2i8l s VAL 61 Ca 0.10 0.13 -0.21 0.00 0.00 0.00 0.00 61.98 62.00 2i8l s VAL 61 Cb -0.09 -0.10 0.03 0.00 0.00 0.00 0.00 36.38 36.22 2i8l s VAL 61 CO 0.01 0.06 0.78 -0.62 0.00 0.00 0.00 175.10 175.32 2i8l s ASP 62 N 0.72 -0.21 0.66 3.32 2.15 -1.19 -1.03 116.67 121.10 2i8l s ASP 62 Ca -0.06 -0.64 -0.14 0.00 0.43 0.00 0.00 52.55 52.14 2i8l s ASP 62 Cb -0.08 0.69 0.00 0.00 -0.30 0.00 0.00 42.92 43.23 2i8l s ASP 62 CO -0.02 -1.30 1.09 0.00 -0.17 0.00 0.00 175.17 174.76 2i8l s ALA 63 N -3.57 2.53 -0.22 3.66 0.00 -1.26 -2.98 121.76 119.92 2i8l s ALA 63 Ca 0.12 0.41 -0.15 0.00 0.00 0.00 0.00 51.96 52.34 2i8l s ALA 63 Cb -0.05 -3.27 0.07 0.00 0.00 0.00 0.00 23.12 19.87 2i8l s ALA 63 CO 0.07 -1.22 0.56 0.99 0.00 0.00 0.00 175.76 176.15 2i8l s THR 64 N -2.54 -0.01 -0.14 0.00 2.01 0.29 -4.68 115.64 110.57 2i8l s THR 64 Ca 0.64 0.03 -0.29 0.00 0.31 0.00 0.00 61.69 62.38 2i8l s THR 64 Cb -0.18 -0.81 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 2i8l s THR 64 CO 0.44 0.01 1.11 -0.62 -0.69 0.00 0.00 174.62 174.87 2i8l s ASP 65 N 1.21 7.10 0.00 3.53 2.15 -1.26 -3.53 116.67 125.87 2i8l s ASP 65 Ca -0.07 1.58 0.00 0.00 0.43 0.00 0.00 52.55 54.48 2i8l s ASP 65 Cb -0.06 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2i8l s ASP 65 CO -0.12 -0.60 0.54 0.23 -0.17 0.00 0.00 175.17 175.05 2i8l n MET 66 N 5.75 -0.37 -1.42 4.34 2.81 -1.26 -4.76 117.12 122.20 2i8l n MET 66 Ca 0.11 -0.61 -0.14 0.00 -1.81 0.00 0.00 57.70 55.25 2i8l n MET 66 Cb 0.47 -0.96 -0.06 0.00 -0.71 0.00 0.00 33.22 31.95 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 -0.07 1.43 2.43 3.03 0.00 -1.26 -5.01 105.19 105.74 2i8l n GLY 67 Ca 0.00 -0.15 -0.16 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.64 0.00 -4.76 0.99 4.77 -1.26 -5.08 117.00 110.03 2i8l n LEU 68 Ca -0.14 -1.16 -0.40 0.00 -0.03 0.00 0.00 56.01 54.28 2i8l n LEU 68 Cb 0.55 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 2i8l n LEU 68 CO 0.22 -0.92 0.75 0.21 -1.33 0.00 0.00 177.39 176.31 2i8l s ASN 69 N -3.75 7.36 0.16 -1.43 3.84 -1.26 -4.99 114.94 114.87 2i8l s ASN 69 Ca 0.44 2.16 -0.33 0.00 0.21 0.00 0.00 52.86 55.34 2i8l s ASN 69 Cb -0.02 -2.62 -0.16 0.00 -0.55 0.00 0.00 41.25 37.90 2i8l s ASN 69 CO 0.30 -0.06 1.04 -2.65 -2.79 0.00 0.00 177.10 172.93 2i8l n PRO 70 N 1.23 0.81 -1.00 0.43 -0.02 -1.26 -1.82 135.00 133.36 2i8l n PRO 70 Ca -0.01 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2i8l n PRO 70 Cb 0.46 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 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 1.89 0.89 3.75 -1.23 0.00 -0.49 -4.84 105.19 105.15 2i8l n GLY 71 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.00 2.79 0.01 1.61 0.41 -0.76 -4.63 118.70 118.12 2i8l s GLU 72 Ca 0.00 1.70 0.05 0.00 -0.41 0.00 0.00 54.97 56.31 2i8l s GLU 72 Cb 0.00 -1.92 -0.02 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 -1.85 1.25 0.04 -1.63 1.01 -1.26 -0.88 121.20 117.88 2i8l s ILE 73 Ca 0.74 -0.80 -0.15 0.00 0.00 0.00 0.00 60.65 60.43 2i8l s ILE 73 Cb -0.27 -1.07 0.03 0.00 0.01 0.00 0.00 42.46 41.15 2i8l s ILE 73 CO 0.37 0.25 0.34 -0.13 0.00 0.00 0.00 174.94 175.77 2i8l s ARG 74 N -0.64 0.83 0.30 2.79 1.81 -0.70 -4.65 118.95 118.68 2i8l s ARG 74 Ca 0.05 -0.41 -0.24 0.00 -1.72 0.00 0.00 55.73 53.41 2i8l s ARG 74 Cb -0.07 0.36 -0.09 0.00 -0.45 0.00 0.00 34.95 34.70 2i8l s ARG 74 CO 0.00 -0.27 0.88 0.42 -0.68 0.00 0.00 175.30 175.66 2i8l s ILE 75 N -2.36 4.32 -0.09 1.52 -1.09 0.01 -0.66 121.20 122.84 2i8l s ILE 75 Ca -0.06 1.66 0.02 0.00 -2.23 0.00 0.00 60.65 60.04 2i8l s ILE 75 Cb -0.01 -3.95 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 2i8l s ILE 75 CO -0.02 0.14 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.04 2i8l s ILE 76 N -1.62 1.47 0.29 2.92 1.01 -0.56 -0.78 121.20 123.94 2i8l s ILE 76 Ca 0.49 -0.66 -0.29 0.00 0.00 0.00 0.00 60.65 60.19 2i8l s ILE 76 Cb -0.18 -1.32 -0.10 0.00 0.01 0.00 0.00 42.46 40.87 2i8l s ILE 76 CO 0.22 0.43 1.14 -0.62 0.00 0.00 0.00 174.94 176.12 2i8l s ASP 77 N 0.73 7.16 0.49 3.58 -1.08 -1.26 -4.05 116.67 122.24 2i8l s ASP 77 Ca -0.12 2.35 0.32 0.00 -0.52 0.00 0.00 52.55 54.58 2i8l s ASP 77 Cb -0.16 -2.63 1.43 0.00 -1.46 0.00 0.00 42.92 40.10 2i8l s ASP 77 CO 0.03 -0.23 1.75 -0.65 0.52 0.00 0.00 175.17 176.60 2i8l h PRO 78 N 3.71 0.12 0.00 4.34 0.11 -1.98 0.89 132.00 139.18 2i8l h PRO 78 Ca -0.47 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 2i8l h PRO 78 Cb 1.21 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2i8l h PRO 78 CO 0.66 0.08 -0.24 0.22 -0.21 0.00 0.00 178.00 178.51 2i8l h ASP 79 N 0.12 0.00 0.00 -2.05 3.58 -2.00 -3.19 116.42 112.89 2i8l h ASP 79 Ca 0.63 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.91 2i8l h ASP 79 Cb 2.21 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 43.23 2i8l h ASP 79 CO -0.14 0.24 -2.10 -0.67 -2.88 0.00 0.00 179.24 173.69 2i8l n ASP 80 N -3.74 0.41 -0.33 2.28 2.03 0.19 -4.12 116.55 113.28 2i8l n ASP 80 Ca -0.01 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.42 2i8l n ASP 80 Cb 0.35 1.43 0.31 0.00 -0.72 0.00 0.00 41.12 42.49 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 0.62 -0.60 5.18 2.04 -1.22 -0.61 117.51 122.92 2i8l h ILE 81 Ca -0.26 -0.21 0.16 0.00 1.00 0.00 0.00 64.86 65.56 2i8l h ILE 81 Cb 1.54 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 2i8l h ILE 81 CO 0.01 0.11 0.42 0.00 0.00 0.00 0.00 178.15 178.70 2i8l h ALA 82 N 1.66 2.47 0.00 1.87 0.00 -1.71 0.08 119.26 123.63 2i8l h ALA 82 Ca 0.56 -0.02 -0.38 0.00 0.00 0.00 0.00 54.91 55.07 2i8l h ALA 82 Cb 0.94 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 2i8l h ALA 82 CO -0.43 -0.64 -2.44 0.39 0.00 0.00 0.00 179.25 176.13 2i8l n GLU 83 N -4.38 0.65 0.15 0.00 1.02 -0.64 -4.29 120.64 113.15 2i8l n GLU 83 Ca 0.11 0.13 0.02 0.00 -0.02 0.00 0.00 57.16 57.40 2i8l n GLU 83 Cb 0.62 -1.51 0.21 0.00 -0.02 0.00 0.00 31.44 30.75 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 0.00 -0.00 3.49 2.86 -0.75 -2.04 114.93 118.49 2i8l h MET 84 Ca -0.57 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.07 2i8l h MET 84 Cb 1.91 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 33.57 2i8l h MET 84 CO -0.08 0.53 -0.00 0.74 1.06 0.00 0.00 176.91 179.16 2i8l h PHE 85 N 0.00 0.01 0.00 -0.22 -1.00 -1.23 -3.14 116.94 111.35 2i8l h PHE 85 Ca -0.01 -0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.77 2i8l h PHE 85 Cb 1.08 -0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.64 2i8l h PHE 85 CO 0.00 0.43 -0.01 0.00 -1.61 0.00 0.00 178.31 177.12 2i8l h MET 86 N -0.42 0.00 -0.08 1.51 -0.00 -1.62 -0.84 114.93 113.47 2i8l h MET 86 Ca 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 59.70 59.72 2i8l h MET 86 Cb 0.43 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.03 2i8l h MET 86 CO 0.00 0.01 0.10 1.98 -0.00 0.00 0.00 176.91 179.00 2i8l h MET 87 N 0.00 0.00 0.00 -0.10 -1.53 -1.32 0.02 114.93 112.00 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 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.22 2i8l h MET 87 CO 0.00 0.00 0.00 0.25 0.14 0.00 0.00 176.91 177.30 2i8l n THR 88 N -3.80 0.78 0.00 -0.77 -2.24 -0.32 -4.79 114.28 103.13 2i8l n THR 88 Ca -0.01 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 2i8l n THR 88 Cb 0.20 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.46 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 -1.35 0.00 -2.10 4.28 -1.04 -0.46 -4.83 114.28 108.77 2i8l n THR 89 Ca 0.05 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.89 2i8l n THR 89 Cb 0.12 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.60 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 0.00 -0.84 -1.13 -1.42 -0.00 -0.13 -4.97 115.22 106.72 2i8l n HIS 90 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.40 2i8l n HIS 90 Cb 0.00 -3.30 0.12 0.00 -0.00 0.00 0.00 29.99 26.81 2i8l n HIS 90 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2i8l s ASN 91 N -2.18 3.78 0.48 0.41 3.84 -1.25 -4.97 114.94 115.05 2i8l s ASN 91 Ca 0.00 2.19 -0.23 0.00 0.21 0.00 0.00 52.86 55.03 2i8l s ASN 91 Cb 0.00 -2.57 -0.07 0.00 -0.55 0.00 0.00 41.25 38.06 2i8l s ASN 91 CO 0.00 -2.53 1.22 -0.04 -2.79 0.00 0.00 177.10 172.96 2i8l s MET 92 N -4.37 3.62 -1.23 0.43 -1.94 -1.26 -3.92 119.30 110.63 2i8l s MET 92 Ca 0.69 1.90 -0.18 0.00 -1.71 0.00 0.00 55.69 56.39 2i8l s MET 92 Cb -0.24 -2.39 -0.01 0.00 2.01 0.00 0.00 34.83 34.20 2i8l s MET 92 CO 0.52 -0.70 2.01 -0.35 -0.01 0.00 0.00 175.02 176.49 2i8l n PRO 93 N -0.59 2.47 0.00 2.03 -0.04 -1.26 -4.51 135.00 133.11 2i8l n PRO 93 Ca 0.08 -2.57 0.00 0.00 -0.04 0.00 0.00 63.50 60.97 2i8l n PRO 93 Cb 0.47 -3.30 0.00 0.00 -0.04 0.00 0.00 33.50 30.63 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 7.91 0.00 0.32 1.53 4.77 -1.26 -2.20 117.00 128.06 2i8l n LEU 94 Ca 0.50 0.20 0.15 0.00 -0.03 0.00 0.00 56.01 56.83 2i8l n LEU 94 Cb 0.42 -0.20 0.82 0.00 -2.33 0.00 0.00 43.42 42.12 2i8l n LEU 94 CO 0.88 -0.20 1.10 -0.55 -1.33 0.00 0.00 177.39 177.28 2i8l h ASN 95 N 0.00 0.00 -0.05 -1.43 7.08 -1.87 -1.18 115.58 118.12 2i8l h ASN 95 Ca 0.00 0.00 0.02 0.00 -3.08 0.00 0.00 56.30 53.24 2i8l h ASN 95 Cb 0.28 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.52 2i8l h ASN 95 CO 0.00 0.00 0.04 0.10 -2.08 0.00 0.00 177.43 175.49 2i8l h TYR 96 N 0.00 0.00 -0.14 4.14 -0.00 -1.84 -0.04 116.97 119.09 2i8l h TYR 96 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 58.73 58.65 2i8l h TYR 96 Cb 0.57 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.30 2i8l h TYR 96 CO 0.00 0.00 -0.22 1.25 -0.00 0.00 0.00 178.16 179.19 2i8l h LEU 97 N 0.00 0.44 -0.72 0.10 6.46 -1.51 -3.21 115.31 116.87 2i8l h LEU 97 Ca 0.03 -0.53 -0.01 0.00 -0.12 0.00 0.00 57.88 57.25 2i8l h LEU 97 Cb 0.11 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 2i8l h LEU 97 CO -0.00 0.88 0.40 0.40 -0.62 0.00 0.00 178.44 179.50 2i8l h ILE 98 N 0.01 1.22 0.00 4.05 2.04 -1.43 -2.27 117.51 121.12 2i8l h ILE 98 Ca 0.01 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.33 2i8l h ILE 98 Cb 0.79 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2i8l h ILE 98 CO 0.05 0.24 -0.01 -0.78 0.00 0.00 0.00 178.15 177.65 2i8l h ASP 99 N 0.99 0.00 -0.01 1.72 3.58 -1.08 0.20 116.42 121.82 2i8l h ASP 99 Ca 0.25 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.70 2i8l h ASP 99 Cb 0.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2i8l h ASP 99 CO -0.04 0.01 0.00 0.00 -2.88 0.00 0.00 179.24 176.33 2i8l n GLN 100 N -3.78 1.39 0.00 0.28 6.02 -0.86 -4.33 117.38 116.11 2i8l n GLN 100 Ca -0.03 -0.57 0.00 0.00 -0.01 0.00 0.00 57.00 56.39 2i8l n GLN 100 Cb 0.09 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.87 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 -0.30 0.08 0.32 1.08 4.77 -0.29 -4.82 117.00 117.84 2i8l n LEU 101 Ca 0.21 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.39 2i8l n LEU 101 Cb 0.25 0.00 1.09 0.00 -2.33 0.00 0.00 43.42 42.43 2i8l n LEU 101 CO 0.17 0.01 1.17 0.07 -1.33 0.00 0.00 177.39 177.48 2i8l h LYS 102 N 0.00 0.00 0.00 3.23 2.10 -0.87 -0.74 116.57 120.29 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 0.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 2i8l h LYS 102 CO 0.00 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 177.84 2i8l n GLU 103 N -3.33 0.13 0.00 0.07 -0.58 -1.26 -4.17 120.64 111.50 2i8l n GLU 103 Ca -0.03 0.33 0.00 0.00 -0.42 0.00 0.00 57.16 57.04 2i8l n GLU 103 Cb 0.11 -1.74 0.00 0.00 -0.57 0.00 0.00 31.44 29.25 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 -1.99 1.25 -4.77 1.62 2.03 -0.61 -5.06 116.55 109.02 2i8l n ASP 104 Ca 0.03 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 54.95 2i8l n ASP 104 Cb 0.24 0.09 -0.01 0.00 -0.72 0.00 0.00 41.12 40.72 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 -1.27 2.93 0.14 5.18 1.01 -0.38 -4.94 121.20 123.88 2i8l s ILE 105 Ca 0.00 0.80 -0.12 0.00 0.00 0.00 0.00 60.65 61.33 2i8l s ILE 105 Cb 0.00 -3.46 0.00 0.00 0.01 0.00 0.00 42.46 39.01 2i8l s ILE 105 CO 0.00 0.09 1.56 1.23 0.00 0.00 0.00 174.94 177.82 2i8l h GLY 106 N 2.63 0.95 -5.01 6.18 0.00 -1.42 -3.45 103.07 102.95 2i8l h GLY 106 Ca -0.49 -0.76 -0.12 0.00 0.00 0.00 0.00 47.33 45.95 2i8l h GLY 106 CO 0.62 0.70 -0.26 1.85 0.00 0.00 0.00 176.54 179.46 2i8l s GLU 107 N -4.84 0.53 -0.07 4.80 2.56 -1.18 -5.00 118.70 115.49 2i8l s GLU 107 Ca -0.12 0.32 0.02 0.00 0.00 0.00 0.00 54.97 55.19 2i8l s GLU 107 Cb 0.11 0.25 0.01 0.00 2.00 0.00 0.00 34.13 36.50 2i8l s GLU 107 CO 0.83 -0.10 -0.13 0.08 -0.56 0.00 0.00 175.26 175.38 2i8l s VAL 108 N -0.28 1.25 0.07 3.70 1.01 -1.26 -0.87 120.40 124.02 2i8l s VAL 108 Ca -0.04 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.45 2i8l s VAL 108 Cb -0.03 -1.13 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 2i8l s VAL 108 CO 0.02 0.38 -0.15 -0.63 0.00 0.00 0.00 175.10 174.72 2i8l s ILE 109 N 0.68 1.17 0.01 2.22 1.01 -0.02 -4.95 121.20 121.32 2i8l s ILE 109 Ca -0.14 -1.25 0.03 0.00 0.00 0.00 0.00 60.65 59.29 2i8l s ILE 109 Cb -0.16 -1.10 -0.01 0.00 0.01 0.00 0.00 42.46 41.19 2i8l s ILE 109 CO 0.04 -0.15 -0.10 0.12 0.00 0.00 0.00 174.94 174.85 2i8l s PHE 110 N -1.15 0.87 -0.11 3.97 5.36 -1.26 -0.74 117.98 124.92 2i8l s PHE 110 Ca -0.00 -0.23 0.03 0.00 -0.96 0.00 0.00 56.93 55.76 2i8l s PHE 110 Cb -0.09 -0.54 0.01 0.00 -0.34 0.00 0.00 43.02 42.05 2i8l s PHE 110 CO 0.02 -0.01 -0.20 -1.17 -1.46 0.00 0.00 175.22 172.40 2i8l s LEU 111 N -0.56 1.95 0.19 6.12 0.20 -0.27 -1.49 118.68 124.82 2i8l s LEU 111 Ca 0.01 -0.50 0.07 0.00 0.69 0.00 0.00 54.13 54.40 2i8l s LEU 111 Cb -0.05 -1.26 -0.04 0.00 -0.43 0.00 0.00 46.19 44.41 2i8l s LEU 111 CO 0.00 0.09 0.06 -0.83 -0.29 0.00 0.00 176.35 175.38 2i8l s GLY 112 N 0.64 1.67 -0.06 7.98 0.00 0.17 -3.18 107.32 114.54 2i8l s GLY 112 Ca -0.13 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.23 2i8l s GLY 112 CO 0.03 -1.40 -0.04 -0.42 0.00 0.00 0.00 173.10 171.28 2i8l s ILE 113 N -1.86 0.57 -0.11 0.90 1.01 -1.16 -1.73 121.20 118.82 2i8l s ILE 113 Ca 0.30 -0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.55 2i8l s ILE 113 Cb -0.09 -0.62 -0.06 0.00 0.01 0.00 0.00 42.46 41.70 2i8l s ILE 113 CO 0.21 0.25 2.04 -1.58 0.00 0.00 0.00 174.94 175.86 2i8l s GLN 114 N 1.17 3.64 0.91 2.79 2.00 -0.05 -0.55 119.66 129.57 2i8l s GLN 114 Ca -0.07 2.24 -0.13 0.00 -2.00 0.00 0.00 55.36 55.40 2i8l s GLN 114 Cb -0.14 -4.24 0.14 0.00 0.80 0.00 0.00 33.01 29.57 2i8l s GLN 114 CO -0.01 -1.52 1.17 -1.25 -0.50 0.00 0.00 175.29 173.18 2i8l s PRO 115 N 5.34 1.15 0.00 1.67 0.04 -1.26 -1.40 135.00 140.54 2i8l s PRO 115 Ca 0.92 0.14 0.00 0.00 0.04 0.00 0.00 61.00 62.10 2i8l s PRO 115 Cb -0.36 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2i8l s PRO 115 CO 0.37 -2.16 0.00 -3.47 0.04 0.00 0.00 177.00 171.78 2i8l n ASP 116 N -3.71 2.51 -3.92 6.66 2.03 -1.26 -4.67 116.55 114.18 2i8l n ASP 116 Ca 0.08 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.22 2i8l n ASP 116 Cb 0.60 0.21 -0.15 0.00 -0.72 0.00 0.00 41.12 41.06 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 -1.52 0.41 -0.03 5.18 -5.25 -1.26 -5.10 121.20 113.63 2i8l s ILE 117 Ca 0.00 -0.15 -0.02 0.00 -0.99 0.00 0.00 60.65 59.49 2i8l s ILE 117 Cb 0.00 -0.39 0.02 0.00 2.95 0.00 0.00 42.46 45.04 2i8l s ILE 117 CO 0.00 0.15 0.07 -0.69 -1.79 0.00 0.00 174.94 172.68 2i8l s VAL 118 N 0.31 -0.03 0.00 8.37 1.01 -1.26 -1.26 120.40 127.54 2i8l s VAL 118 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.04 2i8l s VAL 118 Cb -0.07 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.19 2i8l s VAL 118 CO -0.00 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.74 2i8l n GLY 119 N 3.58 3.62 3.75 4.51 0.00 -0.65 -4.94 105.19 115.06 2i8l n GLY 119 Ca -0.19 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 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 2.35 -1.48 1.61 0.08 -1.26 -2.58 117.98 114.70 2i8l s PHE 120 Ca 0.00 1.56 -0.11 0.00 0.12 0.00 0.00 56.93 58.50 2i8l s PHE 120 Cb 0.00 -3.36 0.06 0.00 -0.57 0.00 0.00 43.02 39.16 2i8l s PHE 120 CO 0.00 -2.15 0.91 0.66 -0.10 0.00 0.00 175.22 174.54 2i8l n TYR 121 N -2.30 -2.29 -4.45 0.36 4.01 0.33 -4.93 117.16 107.90 2i8l n TYR 121 Ca 0.12 0.82 -0.26 0.00 -0.16 0.00 0.00 57.90 58.42 2i8l n TYR 121 Cb 0.51 -4.07 -0.13 0.00 -0.31 0.00 0.00 39.34 35.33 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 -3.24 1.96 0.66 -0.72 2.02 -0.67 -5.00 117.35 112.36 2i8l s TYR 122 Ca 0.58 -0.40 -0.10 0.00 -0.37 0.00 0.00 57.07 56.78 2i8l s TYR 122 Cb -0.28 -1.10 0.00 0.00 -0.40 0.00 0.00 41.96 40.18 2i8l s TYR 122 CO 0.71 0.20 1.03 -1.25 -1.57 0.00 0.00 175.55 174.68 2i8l s PRO 123 N -1.71 2.99 0.27 -1.71 0.04 -1.26 -1.67 135.00 131.95 2i8l s PRO 123 Ca 0.09 0.38 -0.29 0.00 0.04 0.00 0.00 61.00 61.21 2i8l s PRO 123 Cb -0.10 -2.10 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 2i8l s PRO 123 CO 0.04 -0.87 1.17 1.41 0.04 0.00 0.00 177.00 178.79 2i8l s MET 124 N -5.23 4.54 0.62 4.56 -2.45 -1.25 -4.07 119.30 116.03 2i8l s MET 124 Ca 0.56 1.92 -0.12 0.00 -1.25 0.00 0.00 55.69 56.80 2i8l s MET 124 Cb -0.11 -3.17 -0.04 0.00 1.25 0.00 0.00 34.83 32.76 2i8l s MET 124 CO 0.50 0.06 1.03 0.95 1.05 0.00 0.00 175.02 178.61 2i8l s THR 125 N -0.92 4.56 0.24 10.11 -4.23 -1.26 -4.86 115.64 119.28 2i8l s THR 125 Ca 0.47 0.88 -0.05 0.00 -1.18 0.00 0.00 61.69 61.81 2i8l s THR 125 Cb -0.34 -3.77 0.20 0.00 1.34 0.00 0.00 72.50 69.93 2i8l s THR 125 CO 0.43 -1.04 1.75 -0.61 -0.54 0.00 0.00 174.62 174.61 2i8l h GLN 126 N -0.23 0.51 -0.06 3.99 5.75 -1.98 -1.02 115.11 122.06 2i8l h GLN 126 Ca -0.44 -0.03 -0.10 0.00 -0.15 0.00 0.00 58.65 57.93 2i8l h GLN 126 Cb 1.19 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 29.62 2i8l h GLN 126 CO 0.61 0.33 -0.41 -1.00 -2.65 0.00 0.00 178.83 175.71 2i8l h PRO 127 N 0.52 0.12 0.11 -2.39 0.13 -1.94 -0.46 132.00 128.09 2i8l h PRO 127 Ca 0.39 -0.06 -0.27 0.00 -0.87 0.00 0.00 66.00 65.20 2i8l h PRO 127 Cb 0.52 -0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.65 2i8l h PRO 127 CO -0.34 0.52 -1.19 0.82 -0.23 0.00 0.00 178.00 177.58 2i8l h ILE 128 N 0.11 1.47 -0.51 -3.56 5.03 -1.78 -1.49 117.51 116.78 2i8l h ILE 128 Ca 0.01 -2.92 0.06 0.00 -0.12 0.00 0.00 64.86 61.89 2i8l h ILE 128 Cb 0.78 2.84 -0.05 0.00 -3.03 0.00 0.00 36.82 37.35 2i8l h ILE 128 CO 0.06 0.86 0.23 0.11 -0.68 0.00 0.00 178.15 178.72 2i8l h LYS 129 N 0.11 0.43 -0.59 2.37 1.57 -0.95 0.47 116.57 119.98 2i8l h LYS 129 Ca -0.13 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.57 2i8l h LYS 129 Cb 1.89 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 34.08 2i8l h LYS 129 CO 0.20 0.29 0.13 0.22 -0.57 0.00 0.00 179.45 179.72 2i8l h ASP 130 N 0.44 0.87 -0.19 0.86 3.58 -1.00 -0.09 116.42 120.89 2i8l h ASP 130 Ca 0.24 -0.17 -0.02 0.00 0.42 0.00 0.00 57.03 57.50 2i8l h ASP 130 Cb 0.19 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 2i8l h ASP 130 CO -0.20 0.85 0.05 0.00 -2.88 0.00 0.00 179.24 177.06 2i8l h ALA 131 N 1.26 0.25 -0.79 -0.78 0.00 -0.73 -0.36 119.26 118.11 2i8l h ALA 131 Ca 0.19 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2i8l h ALA 131 Cb 0.33 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 2i8l h ALA 131 CO 0.00 -0.10 0.35 0.28 0.00 0.00 0.00 179.25 179.77 2i8l h VAL 132 N 0.12 1.25 -0.67 0.00 2.07 -0.64 -0.23 116.25 118.16 2i8l h VAL 132 Ca 0.06 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.83 2i8l h VAL 132 Cb 0.27 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 2i8l h VAL 132 CO 0.00 0.31 0.43 -0.08 0.02 0.00 0.00 177.57 178.25 2i8l h GLU 133 N 1.13 0.89 -0.23 1.57 4.57 -0.88 0.38 114.58 122.02 2i8l h GLU 133 Ca 0.27 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.38 2i8l h GLU 133 Cb 0.16 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2i8l h GLU 133 CO -0.03 0.60 0.13 1.15 -1.18 0.00 0.00 179.01 179.68 2i8l h THR 134 N 0.91 1.11 -0.40 0.32 2.02 -0.20 -0.97 112.91 115.70 2i8l h THR 134 Ca 0.24 -0.29 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 2i8l h THR 134 Cb -0.08 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2i8l h THR 134 CO -0.05 0.11 0.22 0.58 0.37 0.00 0.00 175.52 176.75 2i8l h VAL 135 N 0.26 1.15 -0.36 3.16 2.07 -0.83 -0.79 116.25 120.90 2i8l h VAL 135 Ca 0.08 -0.37 0.06 0.00 0.82 0.00 0.00 66.70 67.29 2i8l h VAL 135 Cb 0.06 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 2i8l h VAL 135 CO -0.01 0.15 0.01 0.22 0.02 0.00 0.00 177.57 177.96 2i8l h TYR 136 N 0.52 0.00 -0.48 1.57 3.20 -0.65 -1.58 116.97 119.55 2i8l h TYR 136 Ca 0.14 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 2i8l h TYR 136 Cb 0.04 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 2i8l h TYR 136 CO -0.03 -0.06 -0.03 1.96 -1.64 0.00 0.00 178.16 178.37 2i8l h GLN 137 N 0.11 0.82 -0.64 1.82 1.08 -0.90 -3.03 115.11 114.37 2i8l h GLN 137 Ca 0.18 -0.23 0.05 0.00 -1.45 0.00 0.00 58.65 57.19 2i8l h GLN 137 Cb 0.24 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.55 2i8l h GLN 137 CO -0.29 0.84 0.43 -0.09 -0.95 0.00 0.00 178.83 178.77 2i8l h ARG 138 N 0.76 0.67 0.00 1.46 9.65 -0.16 -2.92 114.38 123.83 2i8l h ARG 138 Ca 0.14 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 2i8l h ARG 138 Cb 0.49 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.92 2i8l h ARG 138 CO 0.02 0.44 0.04 -0.07 2.80 0.00 0.00 179.97 183.21 2i8l h LEU 139 N 0.69 0.00 -0.37 3.80 3.38 -1.32 0.14 115.31 121.63 2i8l h LEU 139 Ca 0.27 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2i8l h LEU 139 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2i8l h LEU 139 CO -0.08 0.00 -0.03 -0.08 0.09 0.00 0.00 178.44 178.34 2i8l h GLU 140 N 0.00 0.00 0.00 1.13 4.57 -1.72 -3.14 114.58 115.42 2i8l h GLU 140 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2i8l h GLU 140 Cb 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 2i8l h GLU 140 CO 0.00 0.03 0.00 0.41 -1.18 0.00 0.00 179.01 178.27 2i8l n GLY 141 N 0.83 -0.65 3.63 1.92 0.00 -0.27 -4.59 105.19 106.05 2i8l n GLY 141 Ca 0.03 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.60 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 0.00 1.69 -3.87 1.61 -0.00 0.32 -5.03 117.44 112.16 2i8l n TRP 142 Ca 0.00 0.61 -0.11 0.00 -0.00 0.00 0.00 57.50 58.00 2i8l n TRP 142 Cb 0.40 -2.33 -0.11 0.00 -0.00 0.00 0.00 31.31 29.26 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 -1.24 0.32 5.44 5.87 2.12 -1.26 -4.96 118.70 124.98 2i8l s GLU 143 Ca 0.62 -0.19 0.00 0.00 0.36 0.00 0.00 54.97 55.76 2i8l s GLU 143 Cb -0.68 0.14 0.00 0.00 0.26 0.00 0.00 34.13 33.85 2i8l s GLU 143 CO 0.57 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.64 2i8l n GLY 144 N 2.12 3.62 0.00 -1.50 0.00 -1.26 -1.01 105.19 107.17 2i8l n GLY 144 Ca -0.19 0.18 0.06 0.00 0.00 0.00 0.00 46.02 46.07 2i8l n GLY 144 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2i8l n ASN 145 N 6.37 0.00 -0.28 1.61 5.15 -1.26 -4.84 115.26 122.01 2i8l n ASN 145 Ca 0.00 -1.16 -0.04 0.00 -0.60 0.00 0.00 54.58 52.79 2i8l n ASN 145 Cb 0.00 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.23 2i8l n ASN 145 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2i8l n GLY 146 N 0.40 0.59 3.90 8.20 0.00 -0.18 -2.69 105.19 115.42 2i8l n GLY 146 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.40 0.72 3.78 -0.02 0.00 -1.26 -4.85 105.19 102.16 2i8l n GLY 147 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.96 2.80 0.43 1.61 0.08 -1.09 -5.04 117.98 114.80 2i8l s PHE 148 Ca 0.00 1.54 -0.22 0.00 0.12 0.00 0.00 56.93 58.37 2i8l s PHE 148 Cb 0.00 -3.15 -0.09 0.00 -0.57 0.00 0.00 43.02 39.20 2i8l s PHE 148 CO 0.00 -1.35 1.01 0.00 -0.10 0.00 0.00 175.22 174.79 2i8l s ALA 149 N -2.10 3.02 -0.25 5.36 0.00 -1.26 -4.77 121.76 121.76 2i8l s ALA 149 Ca 0.68 0.58 -0.19 0.00 0.00 0.00 0.00 51.96 53.04 2i8l s ALA 149 Cb -0.20 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 2i8l s ALA 149 CO 0.31 -0.13 0.56 -1.14 0.00 0.00 0.00 175.76 175.36 2i8l s GLN 150 N -2.85 4.10 0.03 0.00 -0.44 -1.26 -0.81 119.66 118.43 2i8l s GLN 150 Ca 0.61 0.42 -0.34 0.00 -2.50 0.00 0.00 55.36 53.55 2i8l s GLN 150 Cb -0.17 -3.64 -0.12 0.00 -1.64 0.00 0.00 33.01 27.44 2i8l s GLN 150 CO 0.21 -0.35 1.77 -0.11 0.50 0.00 0.00 175.29 177.31 2i8l n LEU 151 N 5.50 3.41 0.00 3.68 7.94 0.04 -4.81 117.00 132.77 2i8l n LEU 151 Ca -0.03 1.01 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 2i8l n LEU 151 Cb 0.50 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 43.03 2i8l n LEU 151 CO 0.41 -0.10 0.00 0.00 -1.11 0.00 0.00 177.39 176.59 2i8l n ALA 152 N 5.38 1.35 0.00 1.96 0.00 -1.26 -4.77 120.51 123.18 2i8l n ALA 152 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2i8l n ALA 152 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 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 -1.75 0.00 -2.31 0.00 0.31 -1.26 -5.05 118.33 108.27 2i8l n VAL 153 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.14 2i8l n VAL 153 Cb 0.00 -0.17 -0.02 0.00 -0.91 0.00 0.00 33.84 32.74 2i8l n VAL 153 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2i8l n GLU 154 N -2.29 -1.77 -4.02 5.55 -0.58 -1.26 -4.98 120.64 111.29 2i8l n GLU 154 Ca 0.00 0.93 -0.09 0.00 -0.42 0.00 0.00 57.16 57.59 2i8l n GLU 154 Cb 0.00 -5.55 -0.09 0.00 -0.57 0.00 0.00 31.44 25.24 2i8l n GLU 154 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2i8l s GLU 155 N -4.87 0.88 0.00 3.49 2.02 -1.26 -5.13 118.70 113.83 2i8l s GLU 155 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 54.97 53.78 2i8l s GLU 155 Cb 0.00 0.29 0.00 0.00 0.10 0.00 0.00 34.13 34.52 2i8l s GLU 155 CO 0.00 -0.26 0.00 0.39 0.02 0.00 0.00 175.26 175.41