#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 0.11 0.03 2.03 2.01 -1.26 -4.94 115.64 113.61 2i8l s THR 2 Ca 0.00 -0.90 0.04 0.00 0.31 0.00 0.00 61.69 61.14 2i8l s THR 2 Cb 0.00 -0.85 -0.02 0.00 0.01 0.00 0.00 72.50 71.64 2i8l s THR 2 CO 0.00 -0.50 -0.12 -0.62 -0.69 0.00 0.00 174.62 172.70 2i8l s ASP 3 N -2.00 1.37 0.00 3.53 -1.08 -1.26 -0.37 116.67 116.86 2i8l s ASP 3 Ca -0.06 -0.39 -0.02 0.00 -0.52 0.00 0.00 52.55 51.56 2i8l s ASP 3 Cb -0.02 -0.09 -0.01 0.00 -1.46 0.00 0.00 42.92 41.35 2i8l s ASP 3 CO -0.03 0.02 0.02 -0.69 0.52 0.00 0.00 175.17 175.01 2i8l s VAL 4 N -0.76 0.06 -0.14 1.11 1.01 -0.98 -0.66 120.40 120.05 2i8l s VAL 4 Ca 0.00 -0.49 0.02 0.00 0.00 0.00 0.00 61.98 61.51 2i8l s VAL 4 Cb -0.07 -0.20 0.00 0.00 0.00 0.00 0.00 36.38 36.11 2i8l s VAL 4 CO 0.01 -0.27 -0.19 -0.22 0.00 0.00 0.00 175.10 174.43 2i8l s LEU 5 N -0.82 2.29 -0.39 3.92 2.96 -0.39 -1.55 118.68 124.71 2i8l s LEU 5 Ca -0.09 -0.53 -0.03 0.00 -0.22 0.00 0.00 54.13 53.27 2i8l s LEU 5 Cb -0.06 -1.50 0.10 0.00 0.50 0.00 0.00 46.19 45.24 2i8l s LEU 5 CO -0.00 0.10 0.17 -0.22 -1.32 0.00 0.00 176.35 175.08 2i8l s LEU 6 N 0.72 5.04 0.31 -0.68 2.96 0.10 -0.57 118.68 126.55 2i8l s LEU 6 Ca -0.08 -1.91 -0.27 0.00 -0.22 0.00 0.00 54.13 51.65 2i8l s LEU 6 Cb -0.16 -1.81 -0.09 0.00 0.50 0.00 0.00 46.19 44.63 2i8l s LEU 6 CO 0.01 -0.50 1.03 0.00 -1.32 0.00 0.00 176.35 175.57 2i8l s VAL 8 N -1.39 0.04 0.00 0.00 1.01 -0.48 -0.95 120.40 118.62 2i8l s VAL 8 Ca 0.49 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2i8l s VAL 8 Cb -0.25 -0.08 0.00 0.00 0.00 0.00 0.00 36.38 36.04 2i8l s VAL 8 CO 0.32 -0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.91 2i8l n GLY 9 N 2.70 1.22 3.02 4.51 0.00 -0.11 -2.07 105.19 114.46 2i8l n GLY 9 Ca -0.15 -1.76 -0.29 0.00 0.00 0.00 0.00 46.02 43.82 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 2.51 0.47 1.61 3.84 -1.23 -1.94 114.94 120.20 2i8l s ASN 10 Ca 0.00 -0.44 0.31 0.00 0.21 0.00 0.00 52.86 52.94 2i8l s ASN 10 Cb 0.00 -1.10 1.69 0.00 -0.55 0.00 0.00 41.25 41.29 2i8l s ASN 10 CO 0.00 -0.03 1.95 0.28 -2.79 0.00 0.00 177.10 176.51 2i8l h SER 11 N 7.79 0.00 0.00 -4.21 0.02 -1.89 -2.10 113.55 113.16 2i8l h SER 11 Ca -0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 2i8l h SER 11 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2i8l h SER 11 CO 0.50 0.00 -0.09 1.15 -1.14 0.00 0.00 176.83 177.25 2i8l n MET 12 N -2.60 1.39 -0.82 3.45 0.00 -1.26 -4.62 117.12 112.65 2i8l n MET 12 Ca -0.02 -1.72 -0.09 0.00 0.00 0.00 0.00 57.70 55.87 2i8l n MET 12 Cb 0.06 -1.05 0.20 0.00 0.00 0.00 0.00 33.22 32.43 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 -0.73 2.74 0.00 3.17 0.00 -0.84 -0.78 117.12 120.68 2i8l n MET 13 Ca 0.06 -2.30 0.00 0.00 0.00 0.00 0.00 57.70 55.47 2i8l n MET 13 Cb 0.52 -1.96 0.00 0.00 0.00 0.00 0.00 33.22 31.78 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 -0.25 0.17 0.23 -5.12 0.00 -0.74 -1.47 105.19 98.00 2i8l n GLY 14 Ca 0.35 -1.01 0.16 0.00 0.00 0.00 0.00 46.02 45.51 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 8.39 0.00 -0.46 1.61 3.32 -1.32 -2.75 116.42 125.21 2i8l h ASP 15 Ca 0.00 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.18 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 0.45 -0.78 -1.72 0.00 0.00 179.24 177.19 2i8l h ASP 16 N 0.00 0.00 0.00 6.45 3.58 -1.78 -2.91 116.42 121.76 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 0.07 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.12 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 1.03 0.10 -0.78 0.00 -0.90 -3.52 105.19 99.60 2i8l n GLY 17 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 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 1.81 0.20 0.76 4.61 0.00 -1.72 -2.10 119.26 122.82 2i8l h ALA 18 Ca 0.00 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2i8l h ALA 18 Cb 0.45 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2i8l h ALA 18 CO 0.00 -0.21 -0.40 0.78 0.00 0.00 0.00 179.25 179.42 2i8l h GLY 19 N 0.10 -1.14 -0.12 0.00 0.00 -1.57 -2.42 103.07 97.92 2i8l h GLY 19 Ca 0.05 0.44 0.23 0.00 0.00 0.00 0.00 47.33 48.05 2i8l h GLY 19 CO -0.00 -0.41 0.52 -2.55 0.00 0.00 0.00 176.54 174.10 2i8l h PRO 20 N -1.07 0.52 -0.30 4.80 0.11 -1.71 0.17 132.00 134.52 2i8l h PRO 20 Ca -0.10 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.80 2i8l h PRO 20 Cb 0.84 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.83 2i8l h PRO 20 CO 0.15 0.34 -0.50 1.25 -0.21 0.00 0.00 178.00 179.03 2i8l h LEU 21 N 0.54 0.94 -0.36 2.35 5.85 -1.35 -1.88 115.31 121.39 2i8l h LEU 21 Ca 0.60 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 2i8l h LEU 21 Cb 1.11 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.86 2i8l h LEU 21 CO -0.48 1.27 0.20 0.25 -0.34 0.00 0.00 178.44 179.34 2i8l h LEU 22 N 0.67 0.45 -0.83 2.25 5.85 -0.64 -2.09 115.31 120.96 2i8l h LEU 22 Ca 0.03 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2i8l h LEU 22 Cb 1.10 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.97 2i8l h LEU 22 CO 0.11 0.40 0.54 0.00 -0.34 0.00 0.00 178.44 179.16 2i8l h ALA 23 N 1.06 1.08 -0.05 1.25 0.00 -0.67 0.33 119.26 122.25 2i8l h ALA 23 Ca 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2i8l h ALA 23 Cb 0.06 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2i8l h ALA 23 CO -0.02 0.39 0.03 1.49 0.00 0.00 0.00 179.25 181.14 2i8l h GLU 24 N 1.06 0.07 -0.32 0.00 4.81 -1.08 0.10 114.58 119.22 2i8l h GLU 24 Ca 0.32 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.53 2i8l h GLU 24 Cb -0.03 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2i8l h GLU 24 CO -0.10 0.09 0.15 0.87 -0.73 0.00 0.00 179.01 179.28 2i8l h LYS 25 N 0.03 0.47 -0.23 1.92 1.57 -1.02 -0.85 116.57 118.46 2i8l h LYS 25 Ca 0.02 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 2i8l h LYS 25 Cb 0.04 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2i8l h LYS 25 CO -0.00 0.45 -0.31 0.00 -0.57 0.00 0.00 179.45 179.01 2i8l h ALA 27 N 1.27 0.88 -0.14 0.00 0.00 -0.53 -1.39 119.26 119.36 2i8l h ALA 27 Ca 0.05 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 2i8l h ALA 27 Cb 0.74 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2i8l h ALA 27 CO 0.06 0.67 -0.37 0.00 0.00 0.00 0.00 179.25 179.61 2i8l h ALA 28 N 1.04 1.11 -1.68 0.00 0.00 -0.79 -3.40 119.26 115.54 2i8l h ALA 28 Ca 0.20 -0.39 -0.29 0.00 0.00 0.00 0.00 54.91 54.43 2i8l h ALA 28 Cb 0.47 -0.10 -0.28 0.00 0.00 0.00 0.00 17.79 17.88 2i8l h ALA 28 CO 0.02 0.57 -0.63 0.00 0.00 0.00 0.00 179.25 179.21 2i8l s ALA 29 N -4.24 -0.92 0.64 0.00 0.00 -0.42 -5.10 121.76 111.71 2i8l s ALA 29 Ca -0.05 -0.73 -0.17 0.00 0.00 0.00 0.00 51.96 51.01 2i8l s ALA 29 Cb 0.13 -2.24 -0.05 0.00 0.00 0.00 0.00 23.12 20.97 2i8l s ALA 29 CO 0.78 -2.17 0.79 -2.30 0.00 0.00 0.00 175.76 172.85 2i8l n PRO 30 N 4.16 0.63 -4.39 0.00 -0.02 -0.54 -4.34 135.00 130.50 2i8l n PRO 30 Ca 0.12 0.26 -0.20 0.00 -2.02 0.00 0.00 63.50 61.66 2i8l n PRO 30 Cb 0.49 -2.01 -0.10 0.00 -0.02 0.00 0.00 33.50 31.85 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 -2.71 1.45 0.06 -0.52 -0.14 -1.26 -5.06 119.74 111.55 2i8l s LYS 31 Ca 0.73 -1.71 0.00 0.00 -1.36 0.00 0.00 55.97 53.62 2i8l s LYS 31 Cb -0.40 -1.01 0.00 0.00 -1.68 0.00 0.00 37.83 34.74 2i8l s LYS 31 CO 0.51 0.03 0.00 0.41 -0.76 0.00 0.00 175.35 175.54 2i8l n GLY 32 N -0.50 2.00 0.00 -3.33 0.00 -1.20 -2.91 105.19 99.26 2i8l n GLY 32 Ca -0.06 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 2.94 0.59 -4.67 1.61 2.85 -1.26 -5.07 115.26 112.25 2i8l n ASN 33 Ca 0.00 -1.29 -0.42 0.00 -0.11 0.00 0.00 54.58 52.76 2i8l n ASN 33 Cb 0.00 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 40.99 2i8l n ASN 33 CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 2i8l s TRP 34 N -0.29 2.57 -0.13 1.20 0.52 -1.15 -4.27 118.94 117.39 2i8l s TRP 34 Ca 0.00 0.69 -0.29 0.00 0.02 0.00 0.00 56.10 56.52 2i8l s TRP 34 Cb 0.00 -3.68 -0.03 0.00 -1.15 0.00 0.00 33.47 28.61 2i8l s TRP 34 CO 0.00 -2.61 1.41 0.08 0.02 0.00 0.00 176.95 175.85 2i8l s VAL 35 N 3.34 4.02 0.16 4.03 1.01 0.17 -4.76 120.40 128.35 2i8l s VAL 35 Ca 0.63 1.22 -0.30 0.00 0.00 0.00 0.00 61.98 63.54 2i8l s VAL 35 Cb -0.28 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.22 2i8l s VAL 35 CO 0.23 -0.13 1.08 -0.69 0.00 0.00 0.00 175.10 175.59 2i8l s VAL 36 N 3.78 4.00 0.02 2.92 1.01 -1.26 -1.26 120.40 129.61 2i8l s VAL 36 Ca 0.62 1.69 0.03 0.00 0.00 0.00 0.00 61.98 64.32 2i8l s VAL 36 Cb -0.26 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 2i8l s VAL 36 CO 0.20 0.27 -0.11 -0.63 0.00 0.00 0.00 175.10 174.84 2i8l s ILE 37 N -0.09 0.84 -0.21 2.22 1.01 0.26 -4.93 121.20 120.29 2i8l s ILE 37 Ca 0.50 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 60.37 2i8l s ILE 37 Cb -0.28 -0.76 0.06 0.00 0.01 0.00 0.00 42.46 41.49 2i8l s ILE 37 CO 0.33 0.00 -0.01 -0.62 0.00 0.00 0.00 174.94 174.64 2i8l s ASP 38 N -0.86 3.40 0.00 3.58 2.15 -1.26 -0.90 116.67 122.77 2i8l s ASP 38 Ca 0.00 -1.00 0.31 0.00 0.43 0.00 0.00 52.55 52.29 2i8l s ASP 38 Cb -0.06 -0.91 1.63 0.00 -0.30 0.00 0.00 42.92 43.27 2i8l s ASP 38 CO 0.00 -0.26 2.08 0.61 -0.17 0.00 0.00 175.17 177.43 2i8l n GLY 39 N 4.85 -0.96 7.00 2.66 0.00 -0.13 -4.97 105.19 113.64 2i8l n GLY 39 Ca -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 1.13 1.70 0.63 -0.02 0.00 -1.26 -1.96 105.19 105.42 2i8l n GLY 40 Ca 0.20 -0.50 0.05 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.68 1.82 -3.05 1.61 3.41 -0.82 -0.93 113.62 113.98 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 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 63.69 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 0.44 2.63 0.26 7.33 0.00 -0.83 -4.93 120.51 125.42 2i8l n ALA 42 Ca 0.11 -3.52 0.14 0.00 0.00 0.00 0.00 53.44 50.18 2i8l n ALA 42 Cb 0.30 -0.90 0.62 0.00 0.00 0.00 0.00 19.45 19.46 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 2.99 0.00 -0.54 0.00 0.13 -1.73 -3.23 132.00 129.62 2i8l h PRO 43 Ca 0.07 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.19 2i8l h PRO 43 Cb 0.96 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.06 2i8l h PRO 43 CO 0.54 0.09 0.27 1.05 -0.23 0.00 0.00 178.00 179.73 2i8l h GLU 44 N 0.00 0.75 0.00 0.86 9.09 -1.93 -0.58 114.58 122.78 2i8l h GLU 44 Ca -0.00 -0.09 0.00 0.00 0.05 0.00 0.00 59.36 59.32 2i8l h GLU 44 Cb 0.58 -0.15 0.00 0.00 -1.65 0.00 0.00 28.75 27.53 2i8l h GLU 44 CO 0.01 0.58 0.00 0.09 0.05 0.00 0.00 179.01 179.74 2i8l n ASN 45 N -4.38 0.04 -0.19 3.06 3.02 -1.22 -2.99 115.26 112.60 2i8l n ASN 45 Ca 0.05 0.51 0.02 0.00 -0.03 0.00 0.00 54.58 55.13 2i8l n ASN 45 Cb 0.12 -0.52 0.02 0.00 -0.61 0.00 0.00 39.78 38.79 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 -1.55 1.41 -0.32 6.41 2.03 -0.24 -4.63 116.55 119.67 2i8l n ASP 46 Ca 0.02 -1.21 0.15 0.00 0.52 0.00 0.00 54.79 54.27 2i8l n ASP 46 Cb 0.10 -0.00 0.35 0.00 -0.72 0.00 0.00 41.12 40.85 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 0.93 0.50 -0.80 5.18 2.04 -1.43 -0.39 117.51 123.55 2i8l h ILE 47 Ca 0.00 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 65.77 2i8l h ILE 47 Cb 0.21 -0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 36.20 2i8l h ILE 47 CO 0.00 0.09 0.47 0.58 0.00 0.00 0.00 178.15 179.29 2i8l h VAL 48 N 0.48 0.98 -0.52 1.67 2.07 -1.84 -1.12 116.25 117.97 2i8l h VAL 48 Ca 0.60 -0.29 -0.11 0.00 0.82 0.00 0.00 66.70 67.73 2i8l h VAL 48 Cb 1.15 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2i8l h VAL 48 CO -0.50 0.15 -0.09 0.00 0.02 0.00 0.00 177.57 177.15 2i8l h ALA 49 N 1.41 0.72 -0.19 1.67 0.00 -1.41 -1.88 119.26 119.58 2i8l h ALA 49 Ca 0.36 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2i8l h ALA 49 Cb 0.24 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2i8l h ALA 49 CO -0.20 0.61 0.03 0.82 0.00 0.00 0.00 179.25 180.51 2i8l h ILE 50 N 0.85 0.91 -0.39 0.00 2.04 -1.25 -3.06 117.51 116.61 2i8l h ILE 50 Ca 0.14 -0.04 -0.05 0.00 1.00 0.00 0.00 64.86 65.91 2i8l h ILE 50 Cb 0.65 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 2i8l h ILE 50 CO 0.04 0.02 0.03 0.03 0.00 0.00 0.00 178.15 178.27 2i8l h ARG 51 N 0.11 0.61 -0.22 2.37 3.08 -0.68 -2.40 114.38 117.24 2i8l h ARG 51 Ca 0.08 -0.13 0.06 0.00 0.07 0.00 0.00 59.98 60.07 2i8l h ARG 51 Cb 0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 2i8l h ARG 51 CO -0.11 0.61 0.17 0.93 -1.07 0.00 0.00 179.97 180.50 2i8l h GLU 52 N 0.59 0.00 0.00 0.04 4.39 -1.25 -1.46 114.58 116.89 2i8l h GLU 52 Ca 0.13 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.83 2i8l h GLU 52 Cb 0.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 2i8l h GLU 52 CO 0.01 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.14 2i8l n LEU 53 N -4.29 0.00 -4.17 1.33 4.77 -0.90 -4.93 117.00 108.81 2i8l n LEU 53 Ca 0.02 0.18 -0.36 0.00 -0.03 0.00 0.00 56.01 55.82 2i8l n LEU 53 Cb 0.32 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2i8l n LEU 53 CO 0.33 -0.03 -0.33 0.54 -1.33 0.00 0.00 177.39 176.57 2i8l n ARG 54 N -1.18 -0.97 -1.72 3.23 5.12 -0.55 -4.67 116.66 115.92 2i8l n ARG 54 Ca 0.15 0.13 -0.43 0.00 -1.93 0.00 0.00 57.85 55.77 2i8l n ARG 54 Cb 0.16 -3.34 -0.02 0.00 -1.16 0.00 0.00 32.46 28.10 2i8l n ARG 54 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2i8l n PRO 55 N -4.72 2.47 0.08 5.56 -0.02 -1.26 -4.44 135.00 132.67 2i8l n PRO 55 Ca -0.24 0.88 -0.09 0.00 -2.02 0.00 0.00 63.50 62.02 2i8l n PRO 55 Cb 0.65 -2.62 -0.07 0.00 -0.02 0.00 0.00 33.50 31.44 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 3.24 1.58 -3.94 3.45 2.02 -1.02 -3.33 112.91 114.91 2i8l h THR 56 Ca -0.46 -3.02 -0.13 0.00 0.77 0.00 0.00 66.41 63.57 2i8l h THR 56 Cb 1.24 2.71 -0.18 0.00 -1.74 0.00 0.00 68.15 70.19 2i8l h THR 56 CO 0.78 0.87 -0.59 -0.60 0.37 0.00 0.00 175.52 176.35 2i8l s ARG 57 N -2.91 0.55 0.00 6.66 3.52 -1.14 -1.69 118.95 123.95 2i8l s ARG 57 Ca -0.01 -0.84 0.02 0.00 -0.13 0.00 0.00 55.73 54.76 2i8l s ARG 57 Cb 0.10 0.21 -0.01 0.00 -1.56 0.00 0.00 34.95 33.68 2i8l s ARG 57 CO 0.83 -0.12 -0.05 -1.17 -0.81 0.00 0.00 175.30 173.98 2i8l s LEU 58 N -2.21 2.05 -0.04 -0.88 2.96 0.03 -2.31 118.68 118.29 2i8l s LEU 58 Ca -0.04 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.74 2i8l s LEU 58 Cb -0.00 -0.24 0.00 0.00 0.50 0.00 0.00 46.19 46.45 2i8l s LEU 58 CO -0.05 0.02 -0.11 -0.22 -1.32 0.00 0.00 176.35 174.67 2i8l s LEU 59 N -0.33 1.76 0.05 -0.68 2.96 -0.59 -1.68 118.68 120.17 2i8l s LEU 59 Ca 0.00 -0.23 0.09 0.00 -0.22 0.00 0.00 54.13 53.77 2i8l s LEU 59 Cb -0.03 -0.67 -0.03 0.00 0.50 0.00 0.00 46.19 45.96 2i8l s LEU 59 CO -0.00 0.07 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.22 2i8l s ILE 60 N 0.28 2.02 -0.03 6.68 1.01 -0.25 -0.72 121.20 130.19 2i8l s ILE 60 Ca -0.06 -1.38 -0.01 0.00 0.00 0.00 0.00 60.65 59.20 2i8l s ILE 60 Cb -0.11 -1.74 0.02 0.00 0.01 0.00 0.00 42.46 40.64 2i8l s ILE 60 CO 0.01 0.29 0.06 -0.69 0.00 0.00 0.00 174.94 174.61 2i8l s VAL 61 N -0.84 -0.02 0.22 2.92 1.01 -0.52 -1.13 120.40 122.04 2i8l s VAL 61 Ca 0.11 0.09 -0.23 0.00 0.00 0.00 0.00 61.98 61.95 2i8l s VAL 61 Cb -0.10 -0.11 0.04 0.00 0.00 0.00 0.00 36.38 36.22 2i8l s VAL 61 CO 0.02 0.04 0.84 -0.62 0.00 0.00 0.00 175.10 175.38 2i8l s ASP 62 N 0.50 -0.22 0.65 3.32 2.15 -1.21 -1.38 116.67 120.47 2i8l s ASP 62 Ca -0.04 -0.50 -0.14 0.00 0.43 0.00 0.00 52.55 52.30 2i8l s ASP 62 Cb -0.06 0.61 -0.01 0.00 -0.30 0.00 0.00 42.92 43.17 2i8l s ASP 62 CO -0.02 -1.13 1.08 0.00 -0.17 0.00 0.00 175.17 174.94 2i8l s ALA 63 N -3.61 2.59 -0.22 3.66 0.00 -1.26 -2.80 121.76 120.13 2i8l s ALA 63 Ca 0.11 0.40 -0.09 0.00 0.00 0.00 0.00 51.96 52.38 2i8l s ALA 63 Cb -0.04 -3.26 0.09 0.00 0.00 0.00 0.00 23.12 19.91 2i8l s ALA 63 CO 0.04 -1.12 0.48 0.99 0.00 0.00 0.00 175.76 176.16 2i8l s THR 64 N -2.53 -0.48 -0.08 0.00 2.01 0.13 -4.70 115.64 109.99 2i8l s THR 64 Ca 0.64 0.10 -0.30 0.00 0.31 0.00 0.00 61.69 62.45 2i8l s THR 64 Cb -0.17 -0.74 -0.04 0.00 0.01 0.00 0.00 72.50 71.56 2i8l s THR 64 CO 0.43 0.04 1.38 -0.62 -0.69 0.00 0.00 174.62 175.16 2i8l s ASP 65 N 2.25 6.87 0.00 3.53 2.15 -1.26 -3.62 116.67 126.59 2i8l s ASP 65 Ca -0.05 1.94 0.00 0.00 0.43 0.00 0.00 52.55 54.87 2i8l s ASP 65 Cb -0.10 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 2i8l s ASP 65 CO -0.15 -0.77 0.48 0.23 -0.17 0.00 0.00 175.17 174.79 2i8l n MET 66 N 6.24 -0.51 -1.82 4.34 2.81 -1.26 -4.67 117.12 122.26 2i8l n MET 66 Ca 0.14 -0.52 -0.18 0.00 -1.81 0.00 0.00 57.70 55.33 2i8l n MET 66 Cb 0.44 -0.93 -0.05 0.00 -0.71 0.00 0.00 33.22 31.97 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 -0.04 1.03 1.55 3.03 0.00 -1.26 -5.01 105.19 104.49 2i8l n GLY 67 Ca 0.00 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.28 0.00 -4.76 0.99 4.77 -1.26 -5.09 117.00 109.37 2i8l n LEU 68 Ca -0.20 -0.93 -0.40 0.00 -0.03 0.00 0.00 56.01 54.46 2i8l n LEU 68 Cb 0.62 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 2i8l n LEU 68 CO 0.27 -0.63 0.80 0.21 -1.33 0.00 0.00 177.39 176.71 2i8l s ASN 69 N -2.52 7.18 0.18 -1.43 2.47 -1.26 -4.99 114.94 114.58 2i8l s ASN 69 Ca 0.25 2.28 -0.31 0.00 0.42 0.00 0.00 52.86 55.51 2i8l s ASN 69 Cb -0.02 -2.63 -0.17 0.00 -1.45 0.00 0.00 41.25 36.99 2i8l s ASN 69 CO 0.16 -0.21 0.83 -2.65 -3.72 0.00 0.00 177.10 171.52 2i8l n PRO 70 N 1.04 0.49 -0.94 0.43 -0.02 -1.26 -1.84 135.00 132.90 2i8l n PRO 70 Ca -0.00 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2i8l n PRO 70 Cb 0.45 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 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 1.78 0.59 3.76 -1.23 0.00 -0.54 -4.88 105.19 104.68 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 -0.34 3.10 -0.02 1.61 0.41 -0.77 -4.59 118.70 118.10 2i8l s GLU 72 Ca 0.00 1.65 0.04 0.00 -0.41 0.00 0.00 54.97 56.26 2i8l s GLU 72 Cb 0.00 -1.97 -0.01 0.00 -1.78 0.00 0.00 34.13 30.38 2i8l s GLU 72 CO 0.00 -1.06 -0.15 0.42 -0.49 0.00 0.00 175.26 173.98 2i8l s ILE 73 N -1.81 1.22 -0.02 -1.63 1.01 -1.26 -0.83 121.20 117.88 2i8l s ILE 73 Ca 0.73 -0.64 -0.08 0.00 0.00 0.00 0.00 60.65 60.67 2i8l s ILE 73 Cb -0.26 -1.04 0.01 0.00 0.01 0.00 0.00 42.46 41.19 2i8l s ILE 73 CO 0.32 0.35 0.18 -0.13 0.00 0.00 0.00 174.94 175.66 2i8l s ARG 74 N -0.17 0.44 0.33 2.79 1.81 -0.36 -4.36 118.95 119.44 2i8l s ARG 74 Ca 0.02 -0.18 -0.27 0.00 -1.72 0.00 0.00 55.73 53.58 2i8l s ARG 74 Cb -0.08 0.19 -0.09 0.00 -0.45 0.00 0.00 34.95 34.52 2i8l s ARG 74 CO 0.00 -0.10 1.05 0.42 -0.68 0.00 0.00 175.30 175.99 2i8l s ILE 75 N -0.95 3.71 0.13 1.52 -1.09 -0.25 -0.74 121.20 123.52 2i8l s ILE 75 Ca -0.10 1.51 0.02 0.00 -2.23 0.00 0.00 60.65 59.84 2i8l s ILE 75 Cb -0.06 -3.88 -0.04 0.00 -1.58 0.00 0.00 42.46 36.90 2i8l s ILE 75 CO 0.02 0.20 -0.05 -0.63 -1.23 0.00 0.00 174.94 173.25 2i8l s ILE 76 N -1.42 0.76 0.03 2.92 1.01 -0.75 -1.08 121.20 122.68 2i8l s ILE 76 Ca 0.50 -1.97 0.07 0.00 0.00 0.00 0.00 60.65 59.25 2i8l s ILE 76 Cb -0.26 -1.86 -0.02 0.00 0.01 0.00 0.00 42.46 40.33 2i8l s ILE 76 CO 0.33 -0.72 -0.19 -0.62 0.00 0.00 0.00 174.94 173.74 2i8l s ASP 77 N -3.11 2.29 0.40 3.58 -1.08 -1.26 -3.79 116.67 113.70 2i8l s ASP 77 Ca 0.17 -0.47 0.24 0.00 -0.52 0.00 0.00 52.55 51.96 2i8l s ASP 77 Cb 0.05 -0.20 1.31 0.00 -1.46 0.00 0.00 42.92 42.62 2i8l s ASP 77 CO -0.01 0.15 1.63 -0.65 0.52 0.00 0.00 175.17 176.82 2i8l h PRO 78 N 5.05 0.14 0.00 4.34 0.11 -1.96 0.44 132.00 140.12 2i8l h PRO 78 Ca -0.41 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 2i8l h PRO 78 Cb 1.16 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 2i8l h PRO 78 CO 0.45 0.09 -0.05 0.22 -0.21 0.00 0.00 178.00 178.50 2i8l h ASP 79 N 0.15 0.00 0.00 -2.05 3.58 -1.98 -2.95 116.42 113.17 2i8l h ASP 79 Ca 0.79 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 58.12 2i8l h ASP 79 Cb 2.22 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 43.24 2i8l h ASP 79 CO -0.53 0.05 -1.47 -0.67 -2.88 0.00 0.00 179.24 173.74 2i8l n ASP 80 N -3.34 3.33 -0.34 2.28 2.03 -0.02 -4.45 116.55 116.04 2i8l n ASP 80 Ca -0.02 -0.01 0.16 0.00 0.52 0.00 0.00 54.79 55.44 2i8l n ASP 80 Cb 0.21 0.50 0.36 0.00 -0.72 0.00 0.00 41.12 41.47 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 0.57 -0.09 5.18 2.04 -1.11 -0.14 117.51 123.96 2i8l h ILE 81 Ca -0.19 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.50 2i8l h ILE 81 Cb 1.39 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2i8l h ILE 81 CO 0.00 0.11 0.25 0.00 0.00 0.00 0.00 178.15 178.51 2i8l h ALA 82 N 1.71 1.47 0.00 1.87 0.00 -1.73 -1.46 119.26 121.11 2i8l h ALA 82 Ca 0.62 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.45 2i8l h ALA 82 Cb 1.12 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2i8l h ALA 82 CO -0.46 -0.30 -1.29 0.39 0.00 0.00 0.00 179.25 177.59 2i8l n GLU 83 N -3.22 1.26 0.18 0.00 1.02 -0.75 -4.73 120.64 114.40 2i8l n GLU 83 Ca -0.00 0.02 0.05 0.00 -0.02 0.00 0.00 57.16 57.20 2i8l n GLU 83 Cb 0.34 -1.10 0.32 0.00 -0.02 0.00 0.00 31.44 30.97 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 0.14 3.49 2.86 -0.69 -1.56 114.93 119.18 2i8l h MET 84 Ca -0.11 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 2i8l h MET 84 Cb 1.21 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.87 2i8l h MET 84 CO -0.01 0.40 -0.07 0.74 1.06 0.00 0.00 176.91 179.03 2i8l h PHE 85 N 0.00 -0.18 0.00 -0.22 -1.00 -1.52 -2.95 116.94 111.07 2i8l h PHE 85 Ca -0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2i8l h PHE 85 Cb 0.92 0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.54 2i8l h PHE 85 CO 0.00 0.07 0.00 0.00 -1.61 0.00 0.00 178.31 176.77 2i8l n MET 86 N -5.07 0.79 0.28 1.51 0.00 -0.99 -2.58 117.12 111.06 2i8l n MET 86 Ca -0.09 0.00 0.14 0.00 0.00 0.00 0.00 57.70 57.75 2i8l n MET 86 Cb 0.18 -1.16 0.83 0.00 0.00 0.00 0.00 33.22 33.07 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 0.00 3.17 -1.53 -1.11 0.71 114.93 116.18 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 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.05 2i8l h MET 87 CO 0.00 0.05 0.00 0.25 0.14 0.00 0.00 176.91 177.35 2i8l n THR 88 N -3.80 1.17 -0.83 -0.77 -2.24 -1.06 -4.86 114.28 101.88 2i8l n THR 88 Ca -0.03 0.29 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 2i8l n THR 88 Cb 0.14 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.16 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 -1.34 0.00 0.00 4.28 -1.04 0.24 -4.65 114.28 111.76 2i8l n THR 89 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 2i8l n THR 89 Cb 0.04 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.15 2i8l n THR 89 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2i8l n HIS 90 N -2.18 0.00 -1.95 -1.42 -0.00 -1.26 -5.07 115.22 103.34 2i8l n HIS 90 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.31 2i8l n HIS 90 Cb 0.12 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.10 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 -0.56 6.55 0.52 4.39 3.84 -1.26 -4.94 114.94 123.48 2i8l s ASN 91 Ca 0.00 2.88 -0.22 0.00 0.21 0.00 0.00 52.86 55.73 2i8l s ASN 91 Cb 0.00 -2.66 -0.06 0.00 -0.55 0.00 0.00 41.25 37.98 2i8l s ASN 91 CO 0.00 -0.71 1.27 -0.04 -2.79 0.00 0.00 177.10 174.83 2i8l s MET 92 N -1.95 3.35 -0.99 0.43 -1.94 -1.26 -3.21 119.30 113.72 2i8l s MET 92 Ca 0.51 2.03 -0.12 0.00 -1.71 0.00 0.00 55.69 56.40 2i8l s MET 92 Cb -0.43 -2.28 -0.08 0.00 2.01 0.00 0.00 34.83 34.05 2i8l s MET 92 CO 0.58 -0.96 2.15 -0.35 -0.01 0.00 0.00 175.02 176.44 2i8l n PRO 93 N -0.89 2.15 0.00 2.03 -0.04 -1.26 -4.55 135.00 132.44 2i8l n PRO 93 Ca 0.10 -1.74 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 2i8l n PRO 93 Cb 0.47 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 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 5.24 0.00 -0.03 1.53 4.77 -1.26 -2.57 117.00 124.68 2i8l n LEU 94 Ca 0.50 0.10 0.23 0.00 -0.03 0.00 0.00 56.01 56.82 2i8l n LEU 94 Cb 0.24 -0.10 0.72 0.00 -2.33 0.00 0.00 43.42 41.95 2i8l n LEU 94 CO 0.83 -0.10 1.21 -0.55 -1.33 0.00 0.00 177.39 177.45 2i8l h ASN 95 N 0.00 0.00 -0.93 -1.43 7.08 -1.86 -1.20 115.58 117.24 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 0.11 0.00 -0.05 0.00 -2.08 0.00 0.00 38.32 36.30 2i8l h ASN 95 CO 0.00 0.00 0.62 0.10 -2.08 0.00 0.00 177.43 176.07 2i8l h TYR 96 N 0.00 1.16 -0.23 4.14 -0.00 -1.88 -0.87 116.97 119.28 2i8l h TYR 96 Ca 0.29 0.03 -0.11 0.00 0.00 0.00 0.00 58.73 58.94 2i8l h TYR 96 Cb 1.30 -0.39 -0.00 0.00 0.00 0.00 0.00 36.73 37.64 2i8l h TYR 96 CO 0.00 0.71 -0.27 1.25 -0.00 0.00 0.00 178.16 179.85 2i8l h LEU 97 N 1.23 0.64 -1.10 0.10 6.46 -1.51 -3.10 115.31 118.02 2i8l h LEU 97 Ca 0.35 -0.49 0.01 0.00 -0.12 0.00 0.00 57.88 57.64 2i8l h LEU 97 Cb -0.09 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 39.61 2i8l h LEU 97 CO -0.09 1.00 0.61 0.40 -0.62 0.00 0.00 178.44 179.74 2i8l h ILE 98 N 0.29 1.22 0.00 4.05 2.04 -1.31 -1.21 117.51 122.59 2i8l h ILE 98 Ca 0.03 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.47 2i8l h ILE 98 Cb 0.83 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 2i8l h ILE 98 CO 0.06 0.22 0.00 -0.78 0.00 0.00 0.00 178.15 177.66 2i8l h ASP 99 N 1.23 0.00 0.82 1.72 3.58 -1.09 0.18 116.42 122.86 2i8l h ASP 99 Ca 0.34 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.79 2i8l h ASP 99 Cb -0.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 40.93 2i8l h ASP 99 CO -0.08 0.00 -0.11 0.00 -2.88 0.00 0.00 179.24 176.17 2i8l n GLN 100 N -2.97 0.08 0.00 0.28 1.13 -0.46 -4.35 117.38 111.09 2i8l n GLN 100 Ca -0.01 -0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.03 2i8l n GLN 100 Cb 0.15 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.00 2i8l n GLN 100 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2i8l n LEU 101 N -1.45 0.14 0.27 1.08 4.77 -0.15 -4.71 117.00 116.96 2i8l n LEU 101 Ca 0.08 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.19 2i8l n LEU 101 Cb 0.33 0.00 0.78 0.00 -2.33 0.00 0.00 43.42 42.20 2i8l n LEU 101 CO 0.28 0.02 1.02 0.07 -1.33 0.00 0.00 177.39 177.45 2i8l h LYS 102 N 0.00 0.00 0.00 3.23 2.10 -0.92 0.01 116.57 120.99 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 0.66 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2i8l h LYS 102 CO 0.00 0.09 0.00 0.39 -2.00 0.00 0.00 179.45 177.93 2i8l n GLU 103 N -3.69 0.41 0.00 0.07 -0.58 -1.26 -4.00 120.64 111.59 2i8l n GLU 103 Ca -0.02 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2i8l n GLU 103 Cb 0.20 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 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 -1.28 0.24 -4.00 1.62 2.03 -0.11 -5.07 116.55 109.99 2i8l n ASP 104 Ca 0.13 -0.70 -0.15 0.00 0.52 0.00 0.00 54.79 54.59 2i8l n ASP 104 Cb 0.22 0.14 -0.13 0.00 -0.72 0.00 0.00 41.12 40.62 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 -0.14 0.47 0.19 5.18 1.01 -0.60 -4.71 121.20 122.60 2i8l s ILE 105 Ca 0.00 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.06 2i8l s ILE 105 Cb 0.00 -0.45 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 2i8l s ILE 105 CO 0.00 -0.06 1.54 1.23 0.00 0.00 0.00 174.94 177.65 2i8l h GLY 106 N 5.46 0.78 -6.47 6.18 0.00 -1.43 -3.44 103.07 104.15 2i8l h GLY 106 Ca -0.31 -0.79 -0.24 0.00 0.00 0.00 0.00 47.33 45.99 2i8l h GLY 106 CO 0.47 0.71 -0.57 1.85 0.00 0.00 0.00 176.54 179.00 2i8l s GLU 107 N -4.29 0.11 -0.07 4.80 2.12 -0.99 -5.00 118.70 115.38 2i8l s GLU 107 Ca -0.09 0.55 0.03 0.00 0.36 0.00 0.00 54.97 55.82 2i8l s GLU 107 Cb 0.12 -0.16 0.01 0.00 0.26 0.00 0.00 34.13 34.36 2i8l s GLU 107 CO 0.85 -0.24 -0.13 0.08 -0.54 0.00 0.00 175.26 175.28 2i8l s VAL 108 N 1.82 1.22 0.06 3.70 1.01 -1.26 -0.79 120.40 126.18 2i8l s VAL 108 Ca -0.03 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2i8l s VAL 108 Cb -0.12 -1.10 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 2i8l s VAL 108 CO -0.07 0.37 -0.07 -0.63 0.00 0.00 0.00 175.10 174.70 2i8l s ILE 109 N 0.60 0.57 0.04 2.22 1.01 -0.67 -5.00 121.20 119.96 2i8l s ILE 109 Ca -0.14 -1.43 0.04 0.00 0.00 0.00 0.00 60.65 59.12 2i8l s ILE 109 Cb -0.16 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.26 2i8l s ILE 109 CO 0.04 -0.60 -0.12 0.12 0.00 0.00 0.00 174.94 174.38 2i8l s PHE 110 N -2.33 1.07 -0.12 3.97 5.36 -1.25 -1.10 117.98 123.59 2i8l s PHE 110 Ca -0.01 -0.36 0.01 0.00 -0.96 0.00 0.00 56.93 55.61 2i8l s PHE 110 Cb -0.04 -0.64 0.02 0.00 -0.34 0.00 0.00 43.02 42.03 2i8l s PHE 110 CO -0.02 0.01 -0.12 -1.17 -1.46 0.00 0.00 175.22 172.46 2i8l s LEU 111 N -1.14 1.53 0.19 6.12 0.20 -0.28 -1.80 118.68 123.50 2i8l s LEU 111 Ca -0.00 -0.40 0.06 0.00 0.69 0.00 0.00 54.13 54.48 2i8l s LEU 111 Cb -0.08 -1.02 -0.04 0.00 -0.43 0.00 0.00 46.19 44.63 2i8l s LEU 111 CO 0.01 -0.05 0.10 -0.83 -0.29 0.00 0.00 176.35 175.29 2i8l s GLY 112 N 1.37 1.65 -0.06 7.98 0.00 0.08 -3.32 107.32 115.02 2i8l s GLY 112 Ca 0.01 -1.33 0.00 0.00 0.00 0.00 0.00 44.72 43.40 2i8l s GLY 112 CO -0.07 -1.35 -0.04 -0.42 0.00 0.00 0.00 173.10 171.22 2i8l s ILE 113 N -1.87 0.58 -0.14 0.90 1.01 -1.12 -1.22 121.20 119.34 2i8l s ILE 113 Ca 0.30 -0.09 -0.29 0.00 0.00 0.00 0.00 60.65 60.57 2i8l s ILE 113 Cb -0.09 -0.64 -0.05 0.00 0.01 0.00 0.00 42.46 41.69 2i8l s ILE 113 CO 0.22 0.26 1.89 -1.58 0.00 0.00 0.00 174.94 175.73 2i8l s GLN 114 N 1.28 3.72 0.90 2.79 2.00 -0.01 -0.69 119.66 129.65 2i8l s GLN 114 Ca -0.05 2.07 -0.12 0.00 -2.00 0.00 0.00 55.36 55.25 2i8l s GLN 114 Cb -0.14 -4.17 0.13 0.00 0.80 0.00 0.00 33.01 29.64 2i8l s GLN 114 CO -0.02 -1.41 1.15 -1.25 -0.50 0.00 0.00 175.29 173.26 2i8l s PRO 115 N 5.06 1.25 0.00 1.67 0.04 -1.26 -1.46 135.00 140.31 2i8l s PRO 115 Ca 0.85 0.23 0.00 0.00 0.04 0.00 0.00 61.00 62.11 2i8l s PRO 115 Cb -0.33 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2i8l s PRO 115 CO 0.35 -2.11 0.00 -3.47 0.04 0.00 0.00 177.00 171.81 2i8l n ASP 116 N -3.69 2.24 -3.94 6.66 2.03 -1.26 -4.67 116.55 113.92 2i8l n ASP 116 Ca 0.07 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.21 2i8l n ASP 116 Cb 0.60 0.22 -0.15 0.00 -0.72 0.00 0.00 41.12 41.07 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 -1.45 0.47 -0.03 5.18 -5.25 -1.26 -5.10 121.20 113.76 2i8l s ILE 117 Ca 0.00 -0.20 -0.02 0.00 -0.99 0.00 0.00 60.65 59.44 2i8l s ILE 117 Cb 0.00 -0.44 0.02 0.00 2.95 0.00 0.00 42.46 44.99 2i8l s ILE 117 CO 0.00 0.16 0.08 -0.69 -1.79 0.00 0.00 174.94 172.70 2i8l s VAL 118 N 0.23 -0.02 0.00 8.37 1.01 -1.26 -1.20 120.40 127.54 2i8l s VAL 118 Ca -0.03 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.02 2i8l s VAL 118 Cb -0.07 -0.13 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2i8l s VAL 118 CO -0.00 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.73 2i8l n GLY 119 N 3.40 3.69 3.75 4.51 0.00 -0.54 -4.92 105.19 115.08 2i8l n GLY 119 Ca -0.17 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 2i8l n GLY 119 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2i8l s PHE 120 N -2.00 2.42 -1.55 1.61 5.36 -1.26 -2.34 117.98 120.22 2i8l s PHE 120 Ca 0.00 1.57 -0.04 0.00 -0.96 0.00 0.00 56.93 57.50 2i8l s PHE 120 Cb 0.00 -3.30 0.01 0.00 -0.34 0.00 0.00 43.02 39.39 2i8l s PHE 120 CO 0.00 -2.02 0.45 0.98 -1.46 0.00 0.00 175.22 173.17 2i8l n TYR 121 N -2.38 -1.74 -4.62 10.12 9.36 0.04 -4.92 117.16 123.02 2i8l n TYR 121 Ca 0.12 0.39 -0.26 0.00 3.32 0.00 0.00 57.90 61.46 2i8l n TYR 121 Cb 0.51 -4.14 -0.14 0.00 -0.63 0.00 0.00 39.34 34.94 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 -3.10 1.93 0.70 2.98 2.02 -0.74 -5.01 117.35 116.14 2i8l s TYR 122 Ca 0.24 -0.39 -0.11 0.00 -0.37 0.00 0.00 57.07 56.44 2i8l s TYR 122 Cb -0.11 -1.13 0.02 0.00 -0.40 0.00 0.00 41.96 40.33 2i8l s TYR 122 CO 0.30 0.13 1.09 -1.25 -1.57 0.00 0.00 175.55 174.25 2i8l s PRO 123 N -1.35 2.83 0.21 -1.71 0.04 -1.26 -1.79 135.00 131.97 2i8l s PRO 123 Ca 0.08 0.43 -0.30 0.00 0.04 0.00 0.00 61.00 61.25 2i8l s PRO 123 Cb -0.09 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 2i8l s PRO 123 CO 0.02 -1.04 1.35 1.41 0.04 0.00 0.00 177.00 178.78 2i8l s MET 124 N -5.35 4.36 0.69 4.56 -2.45 -1.25 -4.18 119.30 115.68 2i8l s MET 124 Ca 0.58 2.12 -0.11 0.00 -1.25 0.00 0.00 55.69 57.03 2i8l s MET 124 Cb -0.11 -3.17 0.00 0.00 1.25 0.00 0.00 34.83 32.80 2i8l s MET 124 CO 0.51 -0.30 1.06 0.99 1.05 0.00 0.00 175.02 178.33 2i8l s THR 125 N 0.09 4.02 0.16 10.11 2.01 -1.26 -4.84 115.64 125.92 2i8l s THR 125 Ca 0.57 0.68 -0.16 0.00 0.31 0.00 0.00 61.69 63.09 2i8l s THR 125 Cb -0.38 -3.40 0.02 0.00 0.01 0.00 0.00 72.50 68.75 2i8l s THR 125 CO 0.39 -0.83 1.79 -0.61 -0.69 0.00 0.00 174.62 174.67 2i8l h GLN 126 N -0.63 0.42 0.00 4.92 -0.00 -1.99 -1.67 115.11 116.15 2i8l h GLN 126 Ca -0.44 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.65 58.14 2i8l h GLN 126 Cb 1.21 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 28.59 2i8l h GLN 126 CO 0.57 0.28 -0.21 -1.00 0.00 0.00 0.00 178.83 178.46 2i8l h PRO 127 N 0.43 0.00 0.12 -2.39 0.13 -1.94 -1.03 132.00 127.32 2i8l h PRO 127 Ca 0.16 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 65.01 2i8l h PRO 127 Cb 0.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.17 2i8l h PRO 127 CO -0.10 0.21 -1.28 0.82 -0.23 0.00 0.00 178.00 177.43 2i8l h ILE 128 N 0.00 1.46 -0.46 -3.56 5.03 -1.75 -1.02 117.51 117.20 2i8l h ILE 128 Ca -0.00 -3.04 0.05 0.00 -0.12 0.00 0.00 64.86 61.74 2i8l h ILE 128 Cb 0.51 2.92 -0.04 0.00 -3.03 0.00 0.00 36.82 37.17 2i8l h ILE 128 CO 0.03 0.88 0.21 0.11 -0.68 0.00 0.00 178.15 178.70 2i8l h LYS 129 N 0.07 0.41 -0.65 2.37 1.57 -0.90 0.56 116.57 120.00 2i8l h LYS 129 Ca -0.15 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.57 2i8l h LYS 129 Cb 1.97 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 34.16 2i8l h LYS 129 CO 0.20 0.27 0.24 0.22 -0.57 0.00 0.00 179.45 179.80 2i8l h ASP 130 N 0.42 0.89 -0.21 0.86 3.58 -1.14 -0.21 116.42 120.62 2i8l h ASP 130 Ca 0.21 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.51 2i8l h ASP 130 Cb 0.14 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 2i8l h ASP 130 CO -0.17 0.81 0.08 0.00 -2.88 0.00 0.00 179.24 177.08 2i8l h ALA 131 N 1.32 0.27 -0.80 -0.78 0.00 -0.60 -0.36 119.26 118.30 2i8l h ALA 131 Ca 0.22 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2i8l h ALA 131 Cb 0.22 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2i8l h ALA 131 CO -0.02 -0.13 0.39 0.28 0.00 0.00 0.00 179.25 179.78 2i8l h VAL 132 N 0.17 1.25 -0.30 0.00 2.07 -0.57 -0.00 116.25 118.86 2i8l h VAL 132 Ca 0.07 -0.68 -0.04 0.00 0.82 0.00 0.00 66.70 66.87 2i8l h VAL 132 Cb 0.20 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 2i8l h VAL 132 CO -0.00 0.29 0.02 -0.08 0.02 0.00 0.00 177.57 177.82 2i8l h GLU 133 N 1.14 0.45 -0.24 1.57 4.57 -0.82 0.52 114.58 121.77 2i8l h GLU 133 Ca 0.28 -0.08 -0.12 0.00 -1.18 0.00 0.00 59.36 58.26 2i8l h GLU 133 Cb 0.10 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.61 2i8l h GLU 133 CO -0.04 0.47 -0.30 1.15 -1.18 0.00 0.00 179.01 179.11 2i8l h THR 134 N 0.44 1.32 -0.32 0.32 2.02 0.03 -2.35 112.91 114.37 2i8l h THR 134 Ca 0.10 -1.49 -0.02 0.00 0.77 0.00 0.00 66.41 65.77 2i8l h THR 134 Cb 0.26 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.36 2i8l h THR 134 CO 0.00 0.47 0.12 0.58 0.37 0.00 0.00 175.52 177.06 2i8l h VAL 135 N 0.34 1.19 -0.32 3.16 2.07 -0.68 -0.90 116.25 121.12 2i8l h VAL 135 Ca 0.03 -0.59 0.07 0.00 0.82 0.00 0.00 66.70 67.03 2i8l h VAL 135 Cb 0.88 0.98 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 2i8l h VAL 135 CO 0.07 0.20 -0.14 0.22 0.02 0.00 0.00 177.57 177.95 2i8l h TYR 136 N 0.37 -0.33 -0.14 1.57 3.20 -0.88 -0.39 116.97 120.37 2i8l h TYR 136 Ca 0.11 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.86 2i8l h TYR 136 Cb 0.20 0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 2i8l h TYR 136 CO -0.00 -0.21 -0.56 -0.56 -1.64 0.00 0.00 178.16 175.19 2i8l h GLN 137 N -0.08 0.42 -0.19 1.82 3.07 -1.34 -3.12 115.11 115.69 2i8l h GLN 137 Ca 0.16 -0.27 -0.05 0.00 0.09 0.00 0.00 58.65 58.59 2i8l h GLN 137 Cb 0.33 0.03 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 2i8l h GLN 137 CO -0.38 0.87 -0.10 -0.09 0.09 0.00 0.00 178.83 179.22 2i8l h ARG 138 N 0.32 0.29 0.00 0.06 9.65 -0.21 -2.73 114.38 121.77 2i8l h ARG 138 Ca 0.00 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 2i8l h ARG 138 Cb 1.07 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.61 2i8l h ARG 138 CO 0.10 0.41 0.12 -0.07 2.80 0.00 0.00 179.97 183.32 2i8l h LEU 139 N 0.28 0.00 0.00 3.80 3.38 -1.04 0.21 115.31 121.94 2i8l h LEU 139 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2i8l h LEU 139 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2i8l h LEU 139 CO 0.02 0.00 -0.23 1.21 0.09 0.00 0.00 178.44 179.53 2i8l n GLU 140 N -2.80 0.15 0.00 1.13 2.13 -1.03 -3.23 120.64 117.00 2i8l n GLU 140 Ca -0.02 0.09 0.00 0.00 0.66 0.00 0.00 57.16 57.88 2i8l n GLU 140 Cb 0.17 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 30.24 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 1.40 -1.04 3.65 8.31 0.00 -0.05 -4.64 105.19 112.82 2i8l n GLY 141 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 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 1.32 -3.33 1.61 -0.00 0.54 -4.96 117.44 112.62 2i8l n TRP 142 Ca 0.00 0.47 -0.11 0.00 -0.00 0.00 0.00 57.50 57.86 2i8l n TRP 142 Cb 0.43 -2.23 -0.07 0.00 -0.00 0.00 0.00 31.31 29.44 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 -2.53 0.39 0.00 5.87 2.12 -1.26 -4.93 118.70 118.36 2i8l s GLU 143 Ca 0.70 0.07 0.00 0.00 0.36 0.00 0.00 54.97 56.10 2i8l s GLU 143 Cb -0.46 -0.40 0.00 0.00 0.26 0.00 0.00 34.13 33.53 2i8l s GLU 143 CO 0.51 -1.03 0.00 0.41 -0.54 0.00 0.00 175.26 174.62 2i8l n GLY 144 N 5.34 1.04 0.00 -1.50 0.00 -1.26 -3.50 105.19 105.31 2i8l n GLY 144 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 2.09 0.00 -0.87 1.61 2.85 -1.26 -5.05 115.26 114.63 2i8l n ASN 145 Ca 0.00 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.36 2i8l n ASN 145 Cb 0.00 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 40.97 2i8l n ASN 145 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2i8l n GLY 146 N 0.00 1.18 2.97 8.20 0.00 -1.23 -2.08 105.19 114.23 2i8l n GLY 146 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.69 0.40 3.81 -0.02 0.00 -1.26 -4.96 105.19 102.46 2i8l n GLY 147 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.06 3.02 0.29 1.61 0.08 -0.88 -5.05 117.98 115.00 2i8l s PHE 148 Ca 0.00 1.45 -0.19 0.00 0.12 0.00 0.00 56.93 58.31 2i8l s PHE 148 Cb 0.00 -2.92 -0.09 0.00 -0.57 0.00 0.00 43.02 39.44 2i8l s PHE 148 CO 0.00 -1.31 0.79 0.00 -0.10 0.00 0.00 175.22 174.60 2i8l s ALA 149 N -2.97 3.31 0.05 5.36 0.00 -1.26 -4.82 121.76 121.43 2i8l s ALA 149 Ca 0.59 0.20 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 2i8l s ALA 149 Cb -0.15 -2.89 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 2i8l s ALA 149 CO 0.54 0.28 1.01 -1.14 0.00 0.00 0.00 175.76 176.45 2i8l s GLN 150 N -2.45 4.59 0.47 0.00 -0.44 -1.26 -1.09 119.66 119.46 2i8l s GLN 150 Ca 0.50 1.50 -0.23 0.00 -2.50 0.00 0.00 55.36 54.63 2i8l s GLN 150 Cb -0.14 -3.41 -0.09 0.00 -1.64 0.00 0.00 33.01 27.73 2i8l s GLN 150 CO 0.19 0.01 1.07 -0.11 0.50 0.00 0.00 175.29 176.95 2i8l n LEU 151 N 3.47 3.25 0.00 3.68 7.94 -0.24 -3.49 117.00 131.61 2i8l n LEU 151 Ca 0.05 1.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.95 2i8l n LEU 151 Cb 0.49 -1.40 0.00 0.00 0.53 0.00 0.00 43.42 43.04 2i8l n LEU 151 CO 0.52 -1.36 0.00 0.00 -1.11 0.00 0.00 177.39 175.44 2i8l n ALA 152 N -0.73 0.00 -1.24 1.96 0.00 -1.26 -4.51 120.51 114.73 2i8l n ALA 152 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.27 2i8l n ALA 152 Cb 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.77 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 0.00 3.77 -1.21 0.00 0.31 -1.25 -4.97 118.33 114.97 2i8l n VAL 153 Ca 0.00 -2.27 -0.34 0.00 -0.01 0.00 0.00 64.34 61.72 2i8l n VAL 153 Cb 0.00 -2.25 0.11 0.00 -0.91 0.00 0.00 33.84 30.79 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 2.82 0.32 -1.11 5.55 -0.58 -1.23 -4.47 120.64 121.94 2i8l n GLU 154 Ca 0.61 0.18 0.04 0.00 -0.42 0.00 0.00 57.16 57.57 2i8l n GLU 154 Cb 0.54 -2.34 0.08 0.00 -0.57 0.00 0.00 31.44 29.15 2i8l n GLU 154 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2i8l n GLU 155 N -2.62 0.49 0.00 3.49 1.02 -1.26 -4.99 120.64 116.76 2i8l n GLU 155 Ca 0.13 -2.30 0.00 0.00 -0.02 0.00 0.00 57.16 54.97 2i8l n GLU 155 Cb 0.50 -0.55 0.00 0.00 -0.02 0.00 0.00 31.44 31.38 2i8l n GLU 155 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40