#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxy s LEU 5 N 0.00 3.29 -0.10 1.53 1.43 -0.07 -4.97 118.68 119.78 1gxy s LEU 5 Ca 0.00 -0.10 -0.21 0.00 -1.03 0.00 0.00 54.13 52.79 1gxy s LEU 5 Cb 0.00 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1gxy s LEU 5 CO 0.00 0.28 0.61 -0.04 0.23 0.00 0.00 176.35 177.43 1gxy s MET 6 N -1.48 4.37 0.38 1.70 -1.94 -1.26 -0.93 119.30 120.15 1gxy s MET 6 Ca 0.18 0.68 -0.25 0.00 -1.71 0.00 0.00 55.69 54.59 1gxy s MET 6 Cb -0.11 -3.46 -0.09 0.00 2.01 0.00 0.00 34.83 33.18 1gxy s MET 6 CO 0.09 0.06 1.07 -0.51 -0.01 0.00 0.00 175.02 175.72 1gxy s LEU 7 N 0.87 4.22 0.00 -0.03 1.43 0.06 -4.91 118.68 120.32 1gxy s LEU 7 Ca 0.32 2.12 0.00 0.00 -1.03 0.00 0.00 54.13 55.54 1gxy s LEU 7 Cb -0.16 -4.06 0.00 0.00 0.03 0.00 0.00 46.19 41.99 1gxy s LEU 7 CO 0.14 -0.46 0.00 -0.90 0.23 0.00 0.00 176.35 175.36 1gxy n ASP 8 N 0.17 0.00 -1.60 2.29 5.68 -1.26 -4.56 116.55 117.26 1gxy n ASP 8 Ca 0.04 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.40 1gxy n ASP 8 Cb 0.48 0.00 0.34 0.00 -1.14 0.00 0.00 41.12 40.80 1gxy n ASP 8 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1gxy n THR 9 N 0.00 2.03 -3.92 2.12 -2.24 -1.26 -1.26 114.28 109.75 1gxy n THR 9 Ca 0.00 -1.14 -0.34 0.00 -2.27 0.00 0.00 64.05 60.29 1gxy n THR 9 Cb 0.00 -0.11 0.01 0.00 -2.10 0.00 0.00 70.33 68.13 1gxy n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gxy n ALA 10 N 0.79 -2.38 0.19 6.98 0.00 -1.25 -4.70 120.51 120.14 1gxy n ALA 10 Ca 0.24 -0.36 0.12 0.00 0.00 0.00 0.00 53.44 53.44 1gxy n ALA 10 Cb 0.95 -2.72 0.68 0.00 0.00 0.00 0.00 19.45 18.36 1gxy n ALA 10 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1gxy h PRO 11 N -2.07 0.00 -0.01 0.00 0.13 -1.94 -2.81 132.00 125.30 1gxy h PRO 11 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1gxy h PRO 11 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1gxy h PRO 11 CO 0.55 0.00 -0.18 0.09 -0.23 0.00 0.00 178.00 178.23 1gxy n ASN 12 N -4.41 1.05 -4.75 1.44 3.02 -1.26 -4.93 115.26 105.42 1gxy n ASN 12 Ca 0.01 -0.98 -0.40 0.00 -0.03 0.00 0.00 54.58 53.17 1gxy n ASN 12 Cb 0.25 0.08 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 1gxy n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gxy s ALA 13 N -2.39 3.33 -0.21 5.41 0.00 -1.06 -0.41 121.76 126.43 1gxy s ALA 13 Ca 0.28 0.64 -0.29 0.00 0.00 0.00 0.00 51.96 52.59 1gxy s ALA 13 Cb 0.20 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 20.07 1gxy s ALA 13 CO 0.47 0.15 1.43 0.12 0.00 0.00 0.00 175.76 177.93 1gxy s PHE 14 N -1.03 2.47 -0.11 0.00 5.36 -0.45 -4.85 117.98 119.37 1gxy s PHE 14 Ca 0.42 0.73 0.14 0.00 -0.96 0.00 0.00 56.93 57.26 1gxy s PHE 14 Cb -0.26 -3.83 0.27 0.00 -0.34 0.00 0.00 43.02 38.86 1gxy s PHE 14 CO 0.32 -2.33 1.14 -0.40 -1.46 0.00 0.00 175.22 172.49 1gxy n ASP 15 N 7.56 1.58 -4.57 6.13 5.68 -1.26 -4.68 116.55 126.99 1gxy n ASP 15 Ca 0.16 -2.94 -0.53 0.00 -0.50 0.00 0.00 54.79 50.98 1gxy n ASP 15 Cb 0.45 -0.39 -0.06 0.00 -1.14 0.00 0.00 41.12 39.98 1gxy n ASP 15 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1gxy n ASP 16 N -0.87 1.30 -0.20 -1.12 -0.08 -1.25 -4.79 116.55 109.54 1gxy n ASP 16 Ca 0.12 1.13 0.07 0.00 -1.51 0.00 0.00 54.79 54.60 1gxy n ASP 16 Cb 0.71 -1.14 -0.03 0.00 2.34 0.00 0.00 41.12 43.01 1gxy n ASP 16 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1gxy n GLN 17 N 2.28 2.11 -3.58 -0.67 6.02 -1.26 -5.01 117.38 117.27 1gxy n GLN 17 Ca 0.19 -0.46 -0.23 0.00 -0.01 0.00 0.00 57.00 56.49 1gxy n GLN 17 Cb 0.17 -1.18 0.08 0.00 1.02 0.00 0.00 30.24 30.33 1gxy n GLN 17 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1gxy n TYR 18 N -0.61 -2.63 -2.53 1.08 4.01 -1.26 -4.92 117.16 110.30 1gxy n TYR 18 Ca 0.05 0.98 -0.43 0.00 -0.16 0.00 0.00 57.90 58.34 1gxy n TYR 18 Cb 0.26 -4.95 -0.02 0.00 -0.31 0.00 0.00 39.34 34.32 1gxy n TYR 18 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1gxy s GLU 19 N -6.08 3.63 0.00 -0.72 2.02 -1.26 -3.26 118.70 113.03 1gxy s GLU 19 Ca 0.42 0.59 0.00 0.00 0.02 0.00 0.00 54.97 56.00 1gxy s GLU 19 Cb -0.19 -3.96 0.00 0.00 0.10 0.00 0.00 34.13 30.08 1gxy s GLU 19 CO 0.74 -1.51 0.00 0.41 0.02 0.00 0.00 175.26 174.92 1gxy n GLY 20 N 4.96 0.69 0.51 -1.39 0.00 -1.26 -4.85 105.19 103.85 1gxy n GLY 20 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1gxy n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxy h VAL 22 N 6.98 0.79 -0.74 0.00 2.07 -1.93 0.70 116.25 124.11 1gxy h VAL 22 Ca -0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.53 1gxy h VAL 22 Cb 1.40 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 1gxy h VAL 22 CO 0.00 0.00 0.48 0.78 0.02 0.00 0.00 177.57 178.85 1gxy h ASN 23 N -0.07 0.82 -0.68 0.57 2.35 -1.94 -0.63 115.58 116.00 1gxy h ASN 23 Ca 0.06 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1gxy h ASN 23 Cb 0.17 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.31 1gxy h ASN 23 CO -0.15 0.58 0.34 0.50 -1.65 0.00 0.00 177.43 177.05 1gxy h LYS 24 N 0.97 0.97 -0.39 0.81 1.63 -1.85 -2.64 116.57 116.07 1gxy h LYS 24 Ca 0.28 -0.13 -0.09 0.00 -0.85 0.00 0.00 60.65 59.86 1gxy h LYS 24 Cb -0.06 -0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 31.37 1gxy h LYS 24 CO -0.08 0.75 -0.11 0.52 -3.45 0.00 0.00 179.45 177.08 1gxy h MET 25 N 0.93 0.68 0.00 1.90 2.86 -0.24 -1.49 114.93 119.57 1gxy h MET 25 Ca 0.23 -0.22 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 1gxy h MET 25 Cb 0.10 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 1gxy h MET 25 CO -0.03 0.78 -0.22 0.93 1.06 0.00 0.00 176.91 179.43 1gxy h GLU 26 N 0.62 0.00 0.16 1.72 4.39 -0.86 0.22 114.58 120.84 1gxy h GLU 26 Ca 0.11 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.50 1gxy h GLU 26 Cb 0.55 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.21 1gxy h GLU 26 CO 0.03 0.22 -1.47 1.05 -1.16 0.00 0.00 179.01 177.68 1gxy h GLU 27 N 0.00 0.33 0.00 2.33 4.11 -1.06 -3.38 114.58 116.91 1gxy h GLU 27 Ca -0.00 -0.56 0.00 0.00 0.07 0.00 0.00 59.36 58.87 1gxy h GLU 27 Cb 0.44 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1gxy h GLU 27 CO 0.03 1.23 -1.11 0.36 0.07 0.00 0.00 179.01 179.59 1gxy n LYS 28 N -3.54 0.09 0.17 1.06 2.85 -0.62 -4.44 118.16 113.74 1gxy n LYS 28 Ca -0.15 -0.03 0.05 0.00 -1.05 0.00 0.00 58.31 57.13 1gxy n LYS 28 Cb 1.05 -1.50 0.50 0.00 -0.65 0.00 0.00 35.03 34.43 1gxy n LYS 28 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1gxy h ALA 29 N 2.86 1.73 -0.81 0.58 0.00 -0.73 -1.87 119.26 121.02 1gxy h ALA 29 Ca 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1gxy h ALA 29 Cb 0.57 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1gxy h ALA 29 CO 0.00 0.20 0.38 -1.35 0.00 0.00 0.00 179.25 178.48 1gxy h PRO 30 N 0.14 1.18 -0.44 0.00 0.11 -1.79 0.26 132.00 131.45 1gxy h PRO 30 Ca 0.03 -0.18 -0.13 0.00 0.11 0.00 0.00 66.00 65.84 1gxy h PRO 30 Cb 0.19 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1gxy h PRO 30 CO 0.01 0.91 -0.22 1.25 -0.21 0.00 0.00 178.00 179.75 1gxy h LEU 31 N 1.16 0.95 -1.14 2.35 5.85 -1.75 -2.65 115.31 120.08 1gxy h LEU 31 Ca 0.28 -0.40 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 1gxy h LEU 31 Cb 0.14 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1gxy h LEU 31 CO -0.03 1.14 0.24 -0.07 -0.34 0.00 0.00 178.44 179.38 1gxy h LEU 32 N 0.75 0.77 -0.39 2.25 3.38 -0.82 -1.73 115.31 119.52 1gxy h LEU 32 Ca 0.10 -0.10 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1gxy h LEU 32 Cb 0.79 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1gxy h LEU 32 CO 0.07 0.69 0.04 0.25 0.09 0.00 0.00 178.44 179.57 1gxy h LEU 33 N 0.83 0.65 -1.12 1.67 5.85 -0.35 0.84 115.31 123.68 1gxy h LEU 33 Ca 0.20 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.68 1gxy h LEU 33 Cb 0.16 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1gxy h LEU 33 CO -0.02 0.77 0.60 -0.61 -0.34 0.00 0.00 178.44 178.83 1gxy h GLN 34 N 0.50 1.09 -0.24 1.25 4.15 -1.15 -0.61 115.11 120.10 1gxy h GLN 34 Ca 0.12 -0.07 -0.04 0.00 0.77 0.00 0.00 58.65 59.43 1gxy h GLN 34 Cb 0.41 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.85 1gxy h GLN 34 CO 0.01 0.72 -0.01 1.49 -1.93 0.00 0.00 178.83 179.12 1gxy h GLU 35 N 1.13 0.42 -0.43 1.69 4.81 -0.77 -2.39 114.58 119.04 1gxy h GLU 35 Ca 0.36 -0.14 0.07 0.00 -0.13 0.00 0.00 59.36 59.52 1gxy h GLU 35 Cb 0.04 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.32 1gxy h GLU 35 CO -0.11 0.61 0.08 -0.44 -0.73 0.00 0.00 179.01 178.42 1gxy h ASP 36 N 0.19 -0.01 -0.81 1.04 3.32 0.06 -1.60 116.42 118.61 1gxy h ASP 36 Ca 0.07 0.08 0.09 0.00 0.02 0.00 0.00 57.03 57.28 1gxy h ASP 36 Cb 0.43 0.11 -0.07 0.00 0.22 0.00 0.00 39.33 40.02 1gxy h ASP 36 CO 0.01 0.03 0.46 -0.26 -1.72 0.00 0.00 179.24 177.76 1gxy h PHE 37 N 0.20 0.84 0.00 4.55 0.04 -1.02 0.27 116.94 121.83 1gxy h PHE 37 Ca 0.21 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.99 1gxy h PHE 37 Cb 0.27 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 1gxy h PHE 37 CO -0.22 0.36 -0.08 -0.97 -0.60 0.00 0.00 178.31 176.80 1gxy h ASN 38 N 0.80 0.00 -0.00 2.17 -1.24 -0.77 -2.45 115.58 114.08 1gxy h ASN 38 Ca 0.38 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.39 1gxy h ASN 38 Cb 0.32 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.37 1gxy h ASN 38 CO -0.23 0.08 -0.75 0.23 -1.29 0.00 0.00 177.43 175.47 1gxy n MET 39 N -3.56 1.39 -3.40 6.67 2.81 -0.43 -4.80 117.12 115.81 1gxy n MET 39 Ca -0.02 -0.12 -0.26 0.00 -1.81 0.00 0.00 57.70 55.49 1gxy n MET 39 Cb 0.21 -1.31 -0.10 0.00 -0.71 0.00 0.00 33.22 31.30 1gxy n MET 39 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1gxy s ASN 40 N -2.54 2.00 0.28 7.83 3.84 0.83 -4.99 114.94 122.18 1gxy s ASN 40 Ca 0.08 -2.48 -0.02 0.00 0.21 0.00 0.00 52.86 50.65 1gxy s ASN 40 Cb 0.13 -0.24 0.42 0.00 -0.55 0.00 0.00 41.25 41.01 1gxy s ASN 40 CO 0.67 -0.24 1.91 0.00 -2.79 0.00 0.00 177.10 176.65 1gxy h ALA 41 N 6.38 1.41 -0.77 1.71 0.00 -1.84 -2.08 119.26 124.08 1gxy h ALA 41 Ca 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1gxy h ALA 41 Cb 0.96 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1gxy h ALA 41 CO 0.29 0.47 0.50 0.87 0.00 0.00 0.00 179.25 181.38 1gxy h LYS 42 N 1.17 0.99 -0.69 0.00 1.57 -1.94 -2.24 116.57 115.43 1gxy h LYS 42 Ca 0.40 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 59.06 1gxy h LYS 42 Cb 0.09 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.15 1gxy h LYS 42 CO -0.14 0.65 0.20 1.25 -0.57 0.00 0.00 179.45 180.84 1gxy h LEU 43 N 1.02 1.02 -0.17 2.94 5.85 -1.77 -1.20 115.31 123.00 1gxy h LEU 43 Ca 0.29 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.80 1gxy h LEU 43 Cb -0.09 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.66 1gxy h LEU 43 CO -0.07 0.97 0.08 0.50 -0.34 0.00 0.00 178.44 179.57 1gxy h LYS 44 N 1.02 0.16 -0.47 1.25 3.64 -1.01 0.12 116.57 121.29 1gxy h LYS 44 Ca 0.22 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1gxy h LYS 44 Cb 0.32 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1gxy h LYS 44 CO -0.00 0.11 0.29 0.28 -2.27 0.00 0.00 179.45 177.86 1gxy h VAL 45 N 0.17 1.14 -0.75 2.00 2.07 -1.28 -1.56 116.25 118.04 1gxy h VAL 45 Ca 0.07 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1gxy h VAL 45 Cb 0.03 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 1gxy h VAL 45 CO -0.06 0.14 0.32 0.00 0.02 0.00 0.00 177.57 177.99 1gxy h ALA 46 N 1.15 0.97 -0.71 1.67 0.00 -0.86 -2.09 119.26 119.38 1gxy h ALA 46 Ca 0.17 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1gxy h ALA 46 Cb -0.03 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1gxy h ALA 46 CO -0.03 0.57 0.20 2.35 0.00 0.00 0.00 179.25 182.33 1gxy h TRP 47 N 1.07 1.16 -0.72 0.00 2.91 -0.49 -0.84 115.95 119.04 1gxy h TRP 47 Ca 0.25 -0.12 -0.04 0.00 1.13 0.00 0.00 58.89 60.11 1gxy h TRP 47 Cb 0.18 -0.33 -0.03 0.00 -0.51 0.00 0.00 29.16 28.46 1gxy h TRP 47 CO 0.01 0.93 0.30 0.93 -1.03 0.00 0.00 178.44 179.58 1gxy h GLU 48 N 1.07 1.06 -0.19 2.65 5.08 -0.95 0.11 114.58 123.41 1gxy h GLU 48 Ca 0.23 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1gxy h GLU 48 Cb 0.33 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1gxy h GLU 48 CO -0.00 0.87 0.03 0.93 -1.00 0.00 0.00 179.01 179.83 1gxy h GLU 49 N 1.02 0.32 -0.39 2.33 5.08 -1.05 -2.85 114.58 119.04 1gxy h GLU 49 Ca 0.24 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 1gxy h GLU 49 Cb 0.19 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1gxy h GLU 49 CO -0.02 0.49 0.14 0.00 -1.00 0.00 0.00 179.01 178.62 1gxy h ALA 50 N 0.82 1.53 -0.57 3.43 0.00 -0.91 -2.62 119.26 120.94 1gxy h ALA 50 Ca 0.06 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1gxy h ALA 50 Cb 0.33 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1gxy h ALA 50 CO 0.00 0.36 0.16 -0.22 0.00 0.00 0.00 179.25 179.56 1gxy h LYS 51 N 0.55 0.90 -0.62 0.00 3.64 -0.57 0.37 116.57 120.83 1gxy h LYS 51 Ca 0.13 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1gxy h LYS 51 Cb 0.13 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.80 1gxy h LYS 51 CO -0.01 0.82 0.34 0.87 -2.27 0.00 0.00 179.45 179.20 1gxy h LYS 52 N 0.81 0.86 -0.38 1.90 1.79 -1.26 -0.99 116.57 119.30 1gxy h LYS 52 Ca 0.18 -0.10 -0.02 0.00 -2.18 0.00 0.00 60.65 58.53 1gxy h LYS 52 Cb 0.31 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 30.78 1gxy h LYS 52 CO -0.00 0.66 0.15 -0.09 -1.08 0.00 0.00 179.45 179.08 1gxy h ARG 53 N 0.84 0.58 -0.48 3.15 9.65 -1.16 -2.55 114.38 124.40 1gxy h ARG 53 Ca 0.22 -0.11 0.02 0.00 -1.10 0.00 0.00 59.98 59.01 1gxy h ARG 53 Cb 0.05 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.51 1gxy h ARG 53 CO -0.03 0.56 0.30 2.35 2.80 0.00 0.00 179.97 185.94 1gxy h TRP 54 N 0.47 0.55 -0.15 2.20 2.91 -0.60 -1.62 115.95 119.72 1gxy h TRP 54 Ca 0.13 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 1gxy h TRP 54 Cb 0.20 -0.18 -0.01 0.00 -0.51 0.00 0.00 29.16 28.66 1gxy h TRP 54 CO 0.00 0.33 0.03 -0.91 -1.03 0.00 0.00 178.44 176.86 1gxy h ASN 55 N 0.59 0.18 1.11 2.65 2.35 -1.07 -0.87 115.58 120.52 1gxy h ASN 55 Ca 0.19 -0.01 -0.15 0.00 -0.55 0.00 0.00 56.30 55.78 1gxy h ASN 55 Cb -0.00 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1gxy h ASN 55 CO -0.08 0.20 -0.69 0.78 -1.65 0.00 0.00 177.43 175.99 1gxy h ASN 56 N 0.21 0.00 0.36 5.81 2.35 -0.93 -3.34 115.58 120.03 1gxy h ASN 56 Ca 0.05 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1gxy h ASN 56 Cb 0.09 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.46 1gxy h ASN 56 CO -0.00 0.69 -1.64 2.30 -1.65 0.00 0.00 177.43 177.13 1gxy n ILE 57 N -3.38 0.24 1.30 2.81 -5.35 -0.69 -4.39 119.36 109.90 1gxy n ILE 57 Ca 0.01 -0.52 0.04 0.00 -0.27 0.00 0.00 62.75 62.00 1gxy n ILE 57 Cb 0.77 -0.13 0.12 0.00 -1.74 0.00 0.00 39.64 38.66 1gxy n ILE 57 CO 0.00 0.00 0.00 2.29 -1.76 0.00 0.00 176.55 177.08 1gxy n LYS 58 N -2.42 1.51 0.00 6.28 2.85 -0.38 -4.71 118.16 121.30 1gxy n LYS 58 Ca -0.03 -0.80 0.00 0.00 -1.05 0.00 0.00 58.31 56.44 1gxy n LYS 58 Cb 0.57 -1.18 0.00 0.00 -0.65 0.00 0.00 35.03 33.77 1gxy n LYS 58 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1gxy n PRO 59 N 0.14 0.00 -3.74 -1.58 -0.02 -1.26 -4.04 135.00 124.50 1gxy n PRO 59 Ca 0.08 0.47 -0.28 0.00 -2.02 0.00 0.00 63.50 61.74 1gxy n PRO 59 Cb 0.19 -0.91 -0.12 0.00 -0.02 0.00 0.00 33.50 32.64 1gxy n PRO 59 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1gxy s SER 60 N -2.70 3.70 0.01 2.55 0.15 -1.26 -5.04 113.70 111.11 1gxy s SER 60 Ca 0.00 -3.26 -0.00 0.00 0.70 0.00 0.00 55.95 53.39 1gxy s SER 60 Cb 0.00 -1.21 -0.01 0.00 -1.71 0.00 0.00 66.02 63.09 1gxy s SER 60 CO 0.00 -0.17 -0.02 -0.13 1.20 0.00 0.00 173.24 174.13 1gxy s ARG 61 N -0.51 0.19 -0.05 5.44 1.81 -1.26 -5.15 118.95 119.42 1gxy s ARG 61 Ca 0.24 -0.36 -0.08 0.00 -1.72 0.00 0.00 55.73 53.81 1gxy s ARG 61 Cb -0.10 0.07 -0.05 0.00 -0.45 0.00 0.00 34.95 34.42 1gxy s ARG 61 CO -0.11 -0.03 0.24 0.45 -0.68 0.00 0.00 175.30 175.17 1gxy s SER 62 N -0.87 6.51 0.13 0.23 0.15 -1.26 -5.05 113.70 113.53 1gxy s SER 62 Ca -0.10 0.60 0.04 0.00 0.70 0.00 0.00 55.95 57.19 1gxy s SER 62 Cb -0.06 -2.11 -0.04 0.00 -1.71 0.00 0.00 66.02 62.10 1gxy s SER 62 CO -0.01 0.34 -0.09 -0.31 1.20 0.00 0.00 173.24 174.37 1gxy s TYR 63 N -1.14 1.15 0.80 3.44 1.51 -1.26 -5.14 117.35 116.70 1gxy s TYR 63 Ca 0.21 -0.78 -0.14 0.00 -1.01 0.00 0.00 57.07 55.36 1gxy s TYR 63 Cb -0.13 -0.60 0.05 0.00 -0.11 0.00 0.00 41.96 41.17 1gxy s TYR 63 CO 0.10 0.02 1.03 -2.30 -1.11 0.00 0.00 175.55 173.29 1gxy n PRO 64 N -0.03 0.21 -1.77 -1.71 -0.02 -1.26 -4.87 135.00 125.56 1gxy n PRO 64 Ca -0.12 0.14 -0.42 0.00 -2.02 0.00 0.00 63.50 61.08 1gxy n PRO 64 Cb 0.60 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 1gxy n PRO 64 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1gxy s LYS 65 N -3.80 4.14 0.00 -0.52 1.02 -1.26 -1.69 119.74 117.63 1gxy s LYS 65 Ca 0.71 2.57 0.00 0.00 0.02 0.00 0.00 55.97 59.27 1gxy s LYS 65 Cb -0.30 -3.08 0.00 0.00 -0.52 0.00 0.00 37.83 33.93 1gxy s LYS 65 CO 0.53 -0.72 0.00 0.41 -0.92 0.00 0.00 175.35 174.65 1gxy n GLY 66 N 3.74 3.44 3.67 -3.33 0.00 -1.26 -5.04 105.19 106.41 1gxy n GLY 66 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1gxy n GLY 66 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1gxy s PHE 67 N -2.88 2.38 0.18 1.61 2.19 -0.68 -4.99 117.98 115.79 1gxy s PHE 67 Ca 0.00 0.53 0.01 0.00 0.33 0.00 0.00 56.93 57.79 1gxy s PHE 67 Cb 0.00 -3.76 -0.00 0.00 -1.31 0.00 0.00 43.02 37.95 1gxy s PHE 67 CO 0.00 -3.02 0.02 0.27 1.83 0.00 0.00 175.22 174.32 1gxy n ASN 68 N 6.66 2.05 0.12 6.13 0.23 -1.26 -4.91 115.26 124.27 1gxy n ASN 68 Ca 0.16 -1.86 0.10 0.00 -0.53 0.00 0.00 54.58 52.45 1gxy n ASN 68 Cb 0.43 0.23 0.59 0.00 -2.08 0.00 0.00 39.78 38.95 1gxy n ASN 68 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1gxy h ASP 69 N 0.53 0.14 -0.47 0.53 3.32 -1.99 -2.00 116.42 116.47 1gxy h ASP 69 Ca -0.15 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.82 1gxy h ASP 69 Cb 0.49 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.99 1gxy h ASP 69 CO 0.25 0.09 -0.02 -0.26 -1.72 0.00 0.00 179.24 177.58 1gxy h PHE 70 N 0.16 0.92 -0.11 4.55 0.04 -1.98 -1.02 116.94 119.50 1gxy h PHE 70 Ca 0.11 -0.17 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 1gxy h PHE 70 Cb 0.25 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 1gxy h PHE 70 CO -0.00 0.89 0.01 0.45 -0.60 0.00 0.00 178.31 179.06 1gxy h HIS 71 N 0.69 0.19 -0.50 -0.55 3.86 -1.65 -0.58 115.15 116.61 1gxy h HIS 71 Ca 0.13 -0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 1gxy h HIS 71 Cb 0.54 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.94 1gxy h HIS 71 CO 0.04 0.40 0.19 0.78 0.86 0.00 0.00 177.93 180.21 1gxy h GLY 72 N -0.07 0.81 1.32 2.45 0.00 -1.38 -2.23 103.07 103.97 1gxy h GLY 72 Ca 0.03 -0.45 -0.10 0.00 0.00 0.00 0.00 47.33 46.81 1gxy h GLY 72 CO 0.00 0.42 -0.13 -0.84 0.00 0.00 0.00 176.54 176.00 1gxy h THR 73 N 0.67 1.26 -0.34 4.70 2.02 -1.17 -2.10 112.91 117.96 1gxy h THR 73 Ca 0.17 -1.21 -0.01 0.00 0.77 0.00 0.00 66.41 66.13 1gxy h THR 73 Cb 0.21 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.67 1gxy h THR 73 CO -0.01 0.41 0.16 0.00 0.37 0.00 0.00 175.52 176.45 1gxy h ALA 74 N 1.14 0.44 -0.20 6.16 0.00 -0.88 -0.32 119.26 125.59 1gxy h ALA 74 Ca 0.12 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1gxy h ALA 74 Cb 0.62 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1gxy h ALA 74 CO 0.04 -0.00 0.11 -0.07 0.00 0.00 0.00 179.25 179.33 1gxy h LEU 75 N 0.41 0.18 -0.57 0.00 3.38 -1.27 -1.13 115.31 116.31 1gxy h LEU 75 Ca 0.12 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.13 1gxy h LEU 75 Cb 0.12 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1gxy h LEU 75 CO -0.01 0.14 0.31 0.58 0.09 0.00 0.00 178.44 179.54 1gxy h VAL 76 N 0.24 0.98 -0.81 1.22 2.07 -1.21 -1.99 116.25 116.75 1gxy h VAL 76 Ca 0.08 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.42 1gxy h VAL 76 Cb -0.00 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.06 1gxy h VAL 76 CO -0.04 0.11 0.53 0.00 0.02 0.00 0.00 177.57 178.20 1gxy h ALA 77 N 1.29 1.47 0.00 1.67 0.00 -0.60 -1.75 119.26 121.34 1gxy h ALA 77 Ca 0.25 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1gxy h ALA 77 Cb 0.13 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1gxy h ALA 77 CO -0.16 0.47 -0.16 -0.92 0.00 0.00 0.00 179.25 178.49 1gxy h TYR 78 N 1.04 0.00 -0.03 0.00 3.20 -0.44 0.74 116.97 121.48 1gxy h TYR 78 Ca 0.31 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.18 1gxy h TYR 78 Cb -0.04 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.23 1gxy h TYR 78 CO -0.00 0.16 0.00 0.25 -1.64 0.00 0.00 178.16 176.93 1gxy n THR 79 N -4.16 0.03 -2.91 1.81 -2.24 -0.66 -4.37 114.28 101.78 1gxy n THR 79 Ca -0.02 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1gxy n THR 79 Cb 0.23 -0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 1gxy n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gxy n GLY 80 N 0.91 2.63 0.29 3.38 0.00 0.25 -4.65 105.19 108.00 1gxy n GLY 80 Ca 0.17 -2.11 0.16 0.00 0.00 0.00 0.00 46.02 44.23 1gxy n GLY 80 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1gxy h SER 81 N 0.00 0.00 0.62 1.61 4.64 -1.88 -2.93 113.55 115.61 1gxy h SER 81 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1gxy h SER 81 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1gxy h SER 81 CO 0.00 0.06 0.00 -0.29 -0.87 0.00 0.00 176.83 175.73 1gxy h ILE 82 N 0.00 0.00 -0.82 0.95 6.09 -1.90 -3.26 117.51 118.57 1gxy h ILE 82 Ca -0.00 -0.23 0.10 0.00 -1.37 0.00 0.00 64.86 63.36 1gxy h ILE 82 Cb 0.20 0.98 -0.07 0.00 0.47 0.00 0.00 36.82 38.39 1gxy h ILE 82 CO 0.01 0.00 0.46 0.00 -3.07 0.00 0.00 178.15 175.55 1gxy h ALA 83 N 2.16 1.17 0.13 0.18 0.00 -1.71 -1.01 119.26 120.18 1gxy h ALA 83 Ca 0.00 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1gxy h ALA 83 Cb 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1gxy h ALA 83 CO 0.00 0.07 -0.06 0.28 0.00 0.00 0.00 179.25 179.54 1gxy h VAL 84 N 0.76 0.89 -0.39 0.00 2.07 -1.84 0.14 116.25 117.89 1gxy h VAL 84 Ca 0.40 -0.05 -0.12 0.00 0.82 0.00 0.00 66.70 67.75 1gxy h VAL 84 Cb 0.39 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1gxy h VAL 84 CO -0.26 0.01 -0.26 -0.78 0.02 0.00 0.00 177.57 176.30 1gxy h ASP 85 N -0.19 0.83 -0.21 0.57 1.82 -1.75 -1.94 116.42 115.55 1gxy h ASP 85 Ca -0.02 -0.32 -0.03 0.00 -0.39 0.00 0.00 57.03 56.28 1gxy h ASP 85 Cb 0.15 -0.23 -0.01 0.00 0.68 0.00 0.00 39.33 39.92 1gxy h ASP 85 CO 0.03 1.05 0.02 0.15 -1.61 0.00 0.00 179.24 178.88 1gxy h PHE 86 N 0.69 0.38 -0.65 0.28 3.57 -1.09 -0.85 116.94 119.27 1gxy h PHE 86 Ca 0.09 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1gxy h PHE 86 Cb 0.79 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 1gxy h PHE 86 CO 0.04 0.51 0.39 -0.91 -2.23 0.00 0.00 178.31 176.12 1gxy h ASN 87 N 0.14 0.77 -0.02 0.41 2.35 -0.64 -1.29 115.58 117.31 1gxy h ASN 87 Ca 0.06 -0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1gxy h ASN 87 Cb 0.34 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.52 1gxy h ASN 87 CO 0.01 0.59 0.00 -0.09 -1.65 0.00 0.00 177.43 176.29 1gxy h ARG 88 N 0.89 0.04 -0.79 0.81 2.43 -1.09 -0.70 114.38 115.96 1gxy h ARG 88 Ca 0.24 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.46 1gxy h ARG 88 Cb -0.04 -0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.45 1gxy h ARG 88 CO -0.04 0.29 0.48 0.00 -1.51 0.00 0.00 179.97 179.18 1gxy h ALA 89 N 0.74 1.08 -0.17 2.80 0.00 -0.82 -0.57 119.26 122.33 1gxy h ALA 89 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1gxy h ALA 89 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1gxy h ALA 89 CO 0.00 0.19 -0.01 0.28 0.00 0.00 0.00 179.25 179.71 1gxy h VAL 90 N 0.87 1.27 -0.65 0.00 2.07 -1.14 -2.34 116.25 116.32 1gxy h VAL 90 Ca 0.35 -0.90 0.01 0.00 0.82 0.00 0.00 66.70 66.98 1gxy h VAL 90 Cb 0.18 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 1gxy h VAL 90 CO -0.18 0.27 0.43 -0.09 0.02 0.00 0.00 177.57 178.02 1gxy h ARG 91 N 0.03 0.84 -0.50 1.57 2.43 -0.64 -1.13 114.38 116.98 1gxy h ARG 91 Ca 0.05 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1gxy h ARG 91 Cb 0.41 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1gxy h ARG 91 CO 0.01 0.56 0.03 0.39 -1.51 0.00 0.00 179.97 179.45 1gxy n GLU 92 N -4.44 4.15 0.12 0.20 1.02 -0.27 -3.89 120.64 117.53 1gxy n GLU 92 Ca 0.07 -3.07 -0.13 0.00 -0.02 0.00 0.00 57.16 54.00 1gxy n GLU 92 Cb 0.04 -2.14 -0.06 0.00 -0.02 0.00 0.00 31.44 29.26 1gxy n GLU 92 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1gxy h PHE 93 N 3.15 -0.96 -0.73 -0.32 3.57 -1.12 -0.95 116.94 119.58 1gxy h PHE 93 Ca 0.04 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.62 1gxy h PHE 93 Cb 1.88 0.40 -0.04 0.00 2.79 0.00 0.00 35.95 40.98 1gxy h PHE 93 CO 0.95 -0.46 0.48 -0.22 -2.23 0.00 0.00 178.31 176.84 1gxy h LYS 94 N -0.58 0.77 0.00 1.11 3.64 -1.02 0.11 116.57 120.60 1gxy h LYS 94 Ca 0.03 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.28 1gxy h LYS 94 Cb 0.61 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1gxy h LYS 94 CO -0.20 0.51 -0.37 0.93 -2.27 0.00 0.00 179.45 178.05 1gxy h GLU 95 N 0.79 0.00 -1.68 1.90 5.08 -1.74 -3.38 114.58 115.55 1gxy h GLU 95 Ca 0.31 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 58.22 1gxy h GLU 95 Cb 0.21 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 29.10 1gxy h GLU 95 CO -0.10 0.37 -1.08 -1.71 -1.00 0.00 0.00 179.01 175.49 1gxy n ASN 96 N -3.23 0.29 -0.10 1.42 4.05 -0.39 -4.98 115.26 112.32 1gxy n ASN 96 Ca 0.02 -3.10 -0.00 0.00 0.45 0.00 0.00 54.58 51.94 1gxy n ASN 96 Cb 0.65 -0.22 0.27 0.00 1.23 0.00 0.00 39.78 41.71 1gxy n ASN 96 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1gxy h PRO 97 N 3.05 0.75 0.00 1.20 0.13 -1.01 -2.89 132.00 133.23 1gxy h PRO 97 Ca 0.07 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 1gxy h PRO 97 Cb 0.99 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1gxy h PRO 97 CO 0.44 0.62 0.00 0.41 -0.23 0.00 0.00 178.00 179.24 1gxy n GLY 98 N -1.09 -0.73 0.77 1.56 0.00 -1.26 -2.28 105.19 102.14 1gxy n GLY 98 Ca 0.04 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.09 1gxy n GLY 98 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1gxy n GLN 99 N -1.47 2.19 -3.00 1.61 1.13 -1.09 -4.91 117.38 111.84 1gxy n GLN 99 Ca 0.02 -2.91 -0.44 0.00 -1.94 0.00 0.00 57.00 51.73 1gxy n GLN 99 Cb 0.09 -1.75 -0.02 0.00 0.11 0.00 0.00 30.24 28.66 1gxy n GLN 99 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 1gxy s PHE 100 N -2.98 3.24 -0.83 1.08 5.36 -0.97 -4.89 117.98 117.99 1gxy s PHE 100 Ca 0.40 -1.50 -0.01 0.00 -0.96 0.00 0.00 56.93 54.86 1gxy s PHE 100 Cb 0.35 -4.20 0.35 0.00 -0.34 0.00 0.00 43.02 39.18 1gxy s PHE 100 CO 0.04 -1.40 1.95 0.72 -1.46 0.00 0.00 175.22 175.08 1gxy n HIS 101 N 6.07 3.00 -2.49 10.12 8.25 -1.26 -4.17 115.22 134.74 1gxy n HIS 101 Ca 0.22 -2.39 0.03 0.00 -0.26 0.00 0.00 57.72 55.32 1gxy n HIS 101 Cb 0.49 -1.12 0.02 0.00 1.12 0.00 0.00 29.99 30.50 1gxy n HIS 101 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1gxy n TYR 102 N -0.50 0.06 -0.02 4.41 4.01 -1.26 -4.80 117.16 119.06 1gxy n TYR 102 Ca 0.52 -0.59 -0.09 0.00 -0.16 0.00 0.00 57.90 57.58 1gxy n TYR 102 Cb 0.26 -0.11 -0.03 0.00 -0.31 0.00 0.00 39.34 39.15 1gxy n TYR 102 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1gxy h LYS 103 N 1.04 -0.10 0.10 -0.72 1.57 -1.90 0.48 116.57 117.04 1gxy h LYS 103 Ca -0.24 0.01 -0.28 0.00 -1.87 0.00 0.00 60.65 58.27 1gxy h LYS 103 Cb 1.84 0.02 0.02 0.00 0.08 0.00 0.00 32.23 34.19 1gxy h LYS 103 CO 0.08 -0.07 -1.19 0.00 -0.57 0.00 0.00 179.45 177.71 1gxy h ALA 104 N 1.03 0.11 -0.63 3.86 0.00 -1.87 -3.08 119.26 118.67 1gxy h ALA 104 Ca 0.10 -0.80 0.03 0.00 0.00 0.00 0.00 54.91 54.24 1gxy h ALA 104 Cb 0.26 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1gxy h ALA 104 CO -0.24 0.80 0.39 0.35 0.00 0.00 0.00 179.25 180.55 1gxy h PHE 105 N 0.20 0.72 -0.82 0.00 3.57 -1.89 -0.44 116.94 118.28 1gxy h PHE 105 Ca -0.15 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 1gxy h PHE 105 Cb 1.87 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 40.33 1gxy h PHE 105 CO 0.09 0.41 0.39 1.25 -2.23 0.00 0.00 178.31 178.22 1gxy h HIS 106 N 0.76 1.18 0.16 0.41 2.76 -0.96 -1.18 115.15 118.28 1gxy h HIS 106 Ca 0.25 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.36 1gxy h HIS 106 Cb 0.02 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 28.62 1gxy h HIS 106 CO -0.05 0.85 -0.08 -0.92 -1.30 0.00 0.00 177.93 176.44 1gxy h TYR 107 N 1.16 -0.20 -1.00 5.26 3.20 -1.29 -1.17 116.97 122.93 1gxy h TYR 107 Ca 0.28 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.16 1gxy h TYR 107 Cb 0.12 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 1gxy h TYR 107 CO 0.01 0.05 0.66 1.88 -1.64 0.00 0.00 178.16 179.12 1gxy h TYR 108 N -0.42 1.25 -0.53 -3.82 0.05 -0.97 0.20 116.97 112.73 1gxy h TYR 108 Ca -0.02 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.71 1gxy h TYR 108 Cb 0.33 -0.42 -0.02 0.00 1.01 0.00 0.00 36.73 37.63 1gxy h TYR 108 CO -0.00 0.77 0.01 1.25 -1.05 0.00 0.00 178.16 179.13 1gxy h LEU 109 N 1.33 0.91 -0.09 3.88 5.85 -1.16 0.05 115.31 126.09 1gxy h LEU 109 Ca 0.38 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1gxy h LEU 109 Cb -0.11 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.67 1gxy h LEU 109 CO -0.09 0.99 0.03 0.74 -0.34 0.00 0.00 178.44 179.76 1gxy h THR 110 N 0.80 1.18 -0.57 1.05 2.02 -0.52 -2.16 112.91 114.72 1gxy h THR 110 Ca 0.15 -0.56 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 1gxy h THR 110 Cb 0.52 1.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.29 1gxy h THR 110 CO 0.03 0.16 0.11 -0.09 0.37 0.00 0.00 175.52 176.10 1gxy h ARG 111 N -0.05 0.90 -0.55 6.66 9.65 -0.56 -0.83 114.38 129.60 1gxy h ARG 111 Ca 0.03 -0.21 0.04 0.00 -1.10 0.00 0.00 59.98 58.74 1gxy h ARG 111 Cb 0.23 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.65 1gxy h ARG 111 CO -0.00 0.83 0.32 0.00 2.80 0.00 0.00 179.97 183.91 1gxy h ALA 112 N 1.26 0.72 -0.55 2.80 0.00 -0.85 0.17 119.26 122.80 1gxy h ALA 112 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1gxy h ALA 112 Cb 0.35 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1gxy h ALA 112 CO 0.00 0.01 0.01 1.25 0.00 0.00 0.00 179.25 180.52 1gxy h LEU 113 N 0.61 0.95 -0.81 0.00 6.46 -0.90 -2.62 115.31 119.01 1gxy h LEU 113 Ca 0.23 -0.30 -0.05 0.00 -0.12 0.00 0.00 57.88 57.64 1gxy h LEU 113 Cb 0.08 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.72 1gxy h LEU 113 CO -0.13 1.02 0.29 1.56 -0.62 0.00 0.00 178.44 180.56 1gxy h GLN 114 N 0.85 1.17 0.00 1.25 4.20 -0.55 -2.73 115.11 119.30 1gxy h GLN 114 Ca 0.16 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1gxy h GLN 114 Cb 0.53 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.12 1gxy h GLN 114 CO 0.03 0.96 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.82 1gxy h LEU 115 N 1.13 0.00 0.00 1.46 3.38 -0.46 -2.54 115.31 118.28 1gxy h LEU 115 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1gxy h LEU 115 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1gxy h LEU 115 CO -0.02 0.26 -0.36 0.18 0.09 0.00 0.00 178.44 178.59 1gxy n LEU 116 N -3.87 0.48 -4.68 1.67 4.77 -1.01 -4.79 117.00 109.59 1gxy n LEU 116 Ca -0.02 0.25 -0.46 0.00 -0.03 0.00 0.00 56.01 55.76 1gxy n LEU 116 Cb 0.35 -0.30 -0.04 0.00 -2.33 0.00 0.00 43.42 41.10 1gxy n LEU 116 CO 0.35 0.01 1.44 -1.20 -1.33 0.00 0.00 177.39 176.66 1gxy n SER 117 N -1.77 3.58 0.00 -1.43 7.64 -0.96 -5.04 113.62 115.64 1gxy n SER 117 Ca 0.05 0.99 0.00 0.00 1.01 0.00 0.00 58.87 60.92 1gxy n SER 117 Cb 0.38 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.14 1gxy n SER 117 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1gxy n ASN 118 N 5.88 0.00 0.00 6.43 5.03 -1.26 -5.07 115.26 126.27 1gxy n ASN 118 Ca 0.20 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.65 1gxy n ASN 118 Cb 0.32 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.08 1gxy n ASN 118 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gxy n GLY 119 N 5.00 -0.56 3.73 7.41 0.00 -1.26 -5.03 105.19 114.48 1gxy n GLY 119 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1gxy n GLY 119 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gxy n ASP 120 N -0.01 2.23 -4.50 1.61 10.43 -1.26 -4.98 116.55 120.08 1gxy n ASP 120 Ca 0.00 0.88 -0.26 0.00 2.57 0.00 0.00 54.79 57.97 1gxy n ASP 120 Cb 0.09 -1.56 -0.10 0.00 1.84 0.00 0.00 41.12 41.39 1gxy n ASP 120 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1gxy s HIS 122 N -1.86 1.59 -0.38 0.00 3.76 0.75 -4.97 115.29 114.17 1gxy s HIS 122 Ca 0.24 -0.54 -0.12 0.00 -0.15 0.00 0.00 55.06 54.49 1gxy s HIS 122 Cb -0.08 -0.80 0.03 0.00 1.11 0.00 0.00 32.58 32.84 1gxy s HIS 122 CO 0.13 0.24 0.23 0.45 -0.85 0.00 0.00 174.74 174.94 1gxy s SER 123 N -2.71 5.83 0.29 1.40 0.15 -1.26 -1.63 113.70 115.76 1gxy s SER 123 Ca 0.14 -0.97 0.04 0.00 0.70 0.00 0.00 55.95 55.86 1gxy s SER 123 Cb -0.04 -2.06 -0.06 0.00 -1.71 0.00 0.00 66.02 62.15 1gxy s SER 123 CO 0.05 -0.40 0.04 0.68 1.20 0.00 0.00 173.24 174.80 1gxy s VAL 124 N 1.58 1.11 0.02 4.45 -7.23 0.23 -4.63 120.40 115.93 1gxy s VAL 124 Ca 0.03 -2.02 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 1gxy s VAL 124 Cb -0.19 -2.63 -0.01 0.00 0.56 0.00 0.00 36.38 34.10 1gxy s VAL 124 CO 0.07 -0.11 -0.05 -0.31 -0.31 0.00 0.00 175.10 174.40 1gxy s TYR 125 N -3.36 0.43 -0.06 2.82 2.02 -0.09 -0.27 117.35 118.84 1gxy s TYR 125 Ca 0.34 -0.34 -0.02 0.00 -0.37 0.00 0.00 57.07 56.68 1gxy s TYR 125 Cb 0.07 -0.27 0.04 0.00 -0.40 0.00 0.00 41.96 41.40 1gxy s TYR 125 CO 0.13 -0.08 0.10 0.50 -1.57 0.00 0.00 175.55 174.64 1gxy s ARG 126 N -0.98 -0.02 0.04 -0.62 3.52 -0.31 -0.77 118.95 119.81 1gxy s ARG 126 Ca -0.07 0.42 -0.00 0.00 -0.13 0.00 0.00 55.73 55.95 1gxy s ARG 126 Cb -0.07 -0.36 -0.04 0.00 -1.56 0.00 0.00 34.95 32.93 1gxy s ARG 126 CO -0.00 -0.28 0.18 0.20 -0.81 0.00 0.00 175.30 174.59 1gxy s GLY 127 N 1.98 2.16 0.21 8.12 0.00 -1.18 0.26 107.32 118.87 1gxy s GLY 127 Ca 0.01 -0.84 0.03 0.00 0.00 0.00 0.00 44.72 43.92 1gxy s GLY 127 CO -0.04 -0.79 0.01 -0.51 0.00 0.00 0.00 173.10 171.76 1gxy s THR 128 N -1.43 0.87 -0.10 0.90 -4.23 0.42 -4.47 115.64 107.59 1gxy s THR 128 Ca 0.32 -2.01 0.22 0.00 -1.18 0.00 0.00 61.69 59.04 1gxy s THR 128 Cb -0.13 -2.30 -0.22 0.00 1.34 0.00 0.00 72.50 71.20 1gxy s THR 128 CO 0.24 -0.34 0.68 0.29 -0.54 0.00 0.00 174.62 174.95 1gxy n LYS 129 N -0.36 0.64 -3.70 3.99 4.76 -1.15 -3.03 118.16 119.31 1gxy n LYS 129 Ca -0.05 -0.08 -0.36 0.00 -2.87 0.00 0.00 58.31 54.95 1gxy n LYS 129 Cb 0.64 -1.63 -0.07 0.00 -1.84 0.00 0.00 35.03 32.12 1gxy n LYS 129 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1gxy s THR 130 N -3.46 5.38 0.13 -0.18 2.01 -1.26 -3.69 115.64 114.58 1gxy s THR 130 Ca -0.05 0.33 -0.30 0.00 0.31 0.00 0.00 61.69 61.97 1gxy s THR 130 Cb 0.12 -3.51 -0.06 0.00 0.01 0.00 0.00 72.50 69.06 1gxy s THR 130 CO 0.87 0.47 1.09 -0.60 -0.69 0.00 0.00 174.62 175.76 1gxy s ARG 131 N 0.00 4.58 0.04 4.92 6.06 -1.23 -3.58 118.95 129.74 1gxy s ARG 131 Ca 0.13 1.66 0.07 0.00 -2.50 0.00 0.00 55.73 55.09 1gxy s ARG 131 Cb -0.12 -3.32 -0.03 0.00 0.06 0.00 0.00 34.95 31.53 1gxy s ARG 131 CO 0.02 0.02 -0.18 -0.06 -2.50 0.00 0.00 175.30 172.59 1gxy s PHE 132 N 0.17 2.54 -0.02 5.12 0.40 -1.26 -0.89 117.98 124.04 1gxy s PHE 132 Ca 0.51 -0.26 0.05 0.00 -0.60 0.00 0.00 56.93 56.62 1gxy s PHE 132 Cb -0.28 -1.45 -0.01 0.00 0.51 0.00 0.00 43.02 41.79 1gxy s PHE 132 CO 0.32 0.25 -0.16 -1.01 0.70 0.00 0.00 175.22 175.32 1gxy s HIS 133 N -0.93 1.53 -0.19 0.36 3.76 -0.10 -4.91 115.29 114.82 1gxy s HIS 133 Ca 0.15 -0.35 -0.16 0.00 -0.15 0.00 0.00 55.06 54.55 1gxy s HIS 133 Cb -0.10 -1.01 -0.04 0.00 1.11 0.00 0.00 32.58 32.54 1gxy s HIS 133 CO 0.05 -0.08 0.39 -0.47 -0.85 0.00 0.00 174.74 173.78 1gxy s TYR 134 N -0.20 3.40 -2.00 1.40 5.04 -1.26 -0.76 117.35 122.97 1gxy s TYR 134 Ca 0.02 0.64 0.14 0.00 -2.44 0.00 0.00 57.07 55.43 1gxy s TYR 134 Cb -0.08 -2.50 0.85 0.00 0.35 0.00 0.00 41.96 40.58 1gxy s TYR 134 CO 0.00 0.05 1.36 0.25 -1.34 0.00 0.00 175.55 175.87 1gxy n THR 135 N 4.14 0.00 0.00 4.34 -2.24 -1.26 -4.92 114.28 114.34 1gxy n THR 135 Ca -0.09 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1gxy n THR 135 Cb 0.51 -0.45 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 1gxy n THR 135 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gxy n GLY 136 N 0.36 2.98 3.41 3.38 0.00 -1.26 -5.03 105.19 109.02 1gxy n GLY 136 Ca 0.11 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 1gxy n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gxy s ALA 137 N -0.21 2.45 0.00 4.61 0.00 -1.26 -5.07 121.76 122.27 1gxy s ALA 137 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 50.84 1gxy s ALA 137 Cb 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 23.12 22.41 1gxy s ALA 137 CO 0.00 0.55 0.00 0.41 0.00 0.00 0.00 175.76 176.72 1gxy n GLY 138 N 2.05 1.16 3.94 0.00 0.00 -1.26 -5.03 105.19 106.04 1gxy n GLY 138 Ca -0.16 -2.01 -0.25 0.00 0.00 0.00 0.00 46.02 43.59 1gxy n GLY 138 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gxy s SER 139 N -0.05 4.94 0.03 1.61 0.01 -1.26 -4.83 113.70 114.15 1gxy s SER 139 Ca 0.00 0.38 0.05 0.00 1.31 0.00 0.00 55.95 57.69 1gxy s SER 139 Cb 0.00 -1.09 -0.02 0.00 0.21 0.00 0.00 66.02 65.12 1gxy s SER 139 CO 0.00 -1.49 -0.15 -0.69 0.41 0.00 0.00 173.24 171.32 1gxy s VAL 140 N -3.14 1.22 -0.01 3.43 1.01 -0.59 -4.47 120.40 117.84 1gxy s VAL 140 Ca 0.59 -1.00 -0.09 0.00 0.00 0.00 0.00 61.98 61.49 1gxy s VAL 140 Cb -0.11 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.20 1gxy s VAL 140 CO 0.44 0.07 0.18 -0.60 0.00 0.00 0.00 175.10 175.19 1gxy s ARG 141 N -1.06 0.49 0.01 2.72 3.52 -0.39 -0.68 118.95 123.56 1gxy s ARG 141 Ca 0.03 -0.25 0.21 0.00 -0.13 0.00 0.00 55.73 55.59 1gxy s ARG 141 Cb -0.08 0.21 -0.23 0.00 -1.56 0.00 0.00 34.95 33.29 1gxy s ARG 141 CO 0.01 -0.12 0.58 1.19 -0.81 0.00 0.00 175.30 176.16 1gxy n PHE 142 N 1.64 0.32 0.00 5.12 3.72 -1.26 -3.74 117.46 123.26 1gxy n PHE 142 Ca -0.21 0.10 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1gxy n PHE 142 Cb 0.56 -0.73 0.00 0.00 -0.94 0.00 0.00 39.48 38.37 1gxy n PHE 142 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gxy n GLY 143 N 1.33 1.31 3.84 1.37 0.00 -0.49 -4.84 105.19 107.72 1gxy n GLY 143 Ca -0.08 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 1gxy n GLY 143 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1gxy s GLN 144 N 0.00 2.70 0.65 1.61 -2.07 -1.26 -3.92 119.66 117.37 1gxy s GLN 144 Ca 0.00 0.65 -0.15 0.00 -1.82 0.00 0.00 55.36 54.04 1gxy s GLN 144 Cb 0.00 -1.99 -0.01 0.00 -1.09 0.00 0.00 33.01 29.93 1gxy s GLN 144 CO 0.00 -1.19 1.12 -0.06 -1.32 0.00 0.00 175.29 173.84 1gxy s PHE 145 N -3.21 2.60 0.03 9.60 0.40 -1.26 -3.16 117.98 122.98 1gxy s PHE 145 Ca 0.59 1.55 0.02 0.00 -0.60 0.00 0.00 56.93 58.48 1gxy s PHE 145 Cb -0.13 -3.20 -0.02 0.00 0.51 0.00 0.00 43.02 40.19 1gxy s PHE 145 CO 0.53 -1.72 -0.06 0.95 0.70 0.00 0.00 175.22 175.62 1gxy s THR 146 N -2.26 0.42 0.42 0.64 -4.23 -0.57 -4.90 115.64 105.16 1gxy s THR 146 Ca 0.68 -0.89 0.05 0.00 -1.18 0.00 0.00 61.69 60.35 1gxy s THR 146 Cb -0.21 -0.48 0.01 0.00 1.34 0.00 0.00 72.50 73.15 1gxy s THR 146 CO 0.40 -0.32 0.59 -0.55 -0.54 0.00 0.00 174.62 174.20 1gxy s SER 147 N -1.31 5.72 0.19 3.99 0.15 -1.26 -0.93 113.70 120.25 1gxy s SER 147 Ca -0.09 -0.15 -0.24 0.00 0.70 0.00 0.00 55.95 56.17 1gxy s SER 147 Cb -0.09 -1.03 0.05 0.00 -1.71 0.00 0.00 66.02 63.25 1gxy s SER 147 CO 0.00 -0.71 0.90 -0.94 1.20 0.00 0.00 173.24 173.68 1gxy s SER 148 N -4.28 -0.20 0.07 5.45 1.04 -0.85 -4.82 113.70 110.10 1gxy s SER 148 Ca 0.51 -0.46 0.04 0.00 0.48 0.00 0.00 55.95 56.53 1gxy s SER 148 Cb -0.10 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.54 1gxy s SER 148 CO 0.34 -1.02 -0.13 -0.55 0.98 0.00 0.00 173.24 172.87 1gxy s SER 149 N -2.93 1.53 0.27 7.02 0.15 0.05 -0.67 113.70 119.10 1gxy s SER 149 Ca 0.12 -0.64 0.25 0.00 0.70 0.00 0.00 55.95 56.38 1gxy s SER 149 Cb -0.03 -0.03 0.88 0.00 -1.71 0.00 0.00 66.02 65.14 1gxy s SER 149 CO 0.03 -0.13 1.75 -0.07 1.20 0.00 0.00 173.24 176.03 1gxy h LEU 150 N 4.18 0.00 -8.84 3.45 3.38 -1.51 -0.20 115.31 115.78 1gxy h LEU 150 Ca -0.39 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 56.93 1gxy h LEU 150 Cb 1.19 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.77 1gxy h LEU 150 CO 0.42 0.00 -0.44 -0.55 0.09 0.00 0.00 178.44 177.97 1gxy s SER 151 N -4.63 6.08 0.33 -0.43 0.15 -1.26 -4.87 113.70 109.08 1gxy s SER 151 Ca 0.07 -0.09 0.08 0.00 0.70 0.00 0.00 55.95 56.72 1gxy s SER 151 Cb 0.10 -2.15 0.58 0.00 -1.71 0.00 0.00 66.02 62.85 1gxy s SER 151 CO 0.52 -0.15 1.77 0.50 1.20 0.00 0.00 173.24 177.09 1gxy h LYS 152 N 8.38 0.19 -0.47 5.44 3.64 -1.94 -2.21 116.57 129.60 1gxy h LYS 152 Ca -0.33 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 58.96 1gxy h LYS 152 Cb 1.17 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 1gxy h LYS 152 CO 0.60 0.51 0.24 -0.22 -2.27 0.00 0.00 179.45 178.32 1gxy h LYS 153 N 0.17 0.67 -0.45 1.90 3.64 -1.96 -0.56 116.57 119.98 1gxy h LYS 153 Ca 0.02 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1gxy h LYS 153 Cb 0.68 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1gxy h LYS 153 CO 0.05 0.55 0.22 0.28 -2.27 0.00 0.00 179.45 178.28 1gxy h VAL 154 N 0.62 1.18 -0.49 2.00 2.07 -1.85 -1.40 116.25 118.39 1gxy h VAL 154 Ca 0.16 -0.49 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 1gxy h VAL 154 Cb 0.09 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 1gxy h VAL 154 CO -0.02 0.19 0.10 0.00 0.02 0.00 0.00 177.57 177.86 1gxy h ALA 155 N 1.07 1.27 -0.12 1.67 0.00 -1.11 -2.36 119.26 119.68 1gxy h ALA 155 Ca 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1gxy h ALA 155 Cb 0.10 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1gxy h ALA 155 CO -0.02 0.51 0.00 1.04 0.00 0.00 0.00 179.25 180.78 1gxy n GLN 156 N -4.28 1.78 -2.03 0.00 6.02 -0.24 -3.12 117.38 115.50 1gxy n GLN 156 Ca 0.03 -1.16 -0.35 0.00 -0.01 0.00 0.00 57.00 55.51 1gxy n GLN 156 Cb 0.22 -1.43 0.03 0.00 1.02 0.00 0.00 30.24 30.08 1gxy n GLN 156 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1gxy s SER 157 N -1.73 5.29 0.63 1.08 1.04 -0.54 -4.57 113.70 114.89 1gxy s SER 157 Ca 0.34 2.29 0.30 0.00 0.48 0.00 0.00 55.95 59.37 1gxy s SER 157 Cb 0.19 -2.59 1.64 0.00 0.10 0.00 0.00 66.02 65.36 1gxy s SER 157 CO 0.29 -1.52 1.97 -0.61 0.98 0.00 0.00 173.24 174.35 1gxy h GLN 158 N 0.84 0.00 0.00 4.02 -0.00 -1.89 0.11 115.11 118.19 1gxy h GLN 158 Ca -0.50 0.00 -0.07 0.00 -0.00 0.00 0.00 58.65 58.08 1gxy h GLN 158 Cb 1.28 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.75 1gxy h GLN 158 CO 0.55 0.00 -0.35 1.49 0.00 0.00 0.00 178.83 180.52 1gxy h GLU 159 N 0.00 0.00 0.00 1.69 4.81 -1.90 -3.37 114.58 115.82 1gxy h GLU 159 Ca 0.08 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1gxy h GLU 159 Cb 0.74 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 1gxy h GLU 159 CO -0.00 0.35 -1.11 1.19 -0.73 0.00 0.00 179.01 178.71 1gxy n PHE 160 N -4.11 0.00 -4.20 0.92 3.72 -0.19 -5.04 117.46 108.56 1gxy n PHE 160 Ca -0.02 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.09 1gxy n PHE 160 Cb 0.39 -0.08 -0.09 0.00 -0.94 0.00 0.00 39.48 38.76 1gxy n PHE 160 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1gxy s PHE 161 N -2.04 2.82 -0.03 1.38 2.19 0.20 -2.68 117.98 119.83 1gxy s PHE 161 Ca -0.01 -0.12 -0.09 0.00 0.33 0.00 0.00 56.93 57.03 1gxy s PHE 161 Cb 0.01 -1.44 0.01 0.00 -1.31 0.00 0.00 43.02 40.29 1gxy s PHE 161 CO 0.06 0.47 0.21 0.45 1.83 0.00 0.00 175.22 178.24 1gxy s SER 162 N -2.46 -0.11 0.64 6.13 0.15 -1.19 -4.38 113.70 112.48 1gxy s SER 162 Ca 0.24 0.06 0.37 0.00 0.70 0.00 0.00 55.95 57.33 1gxy s SER 162 Cb -0.11 0.31 2.07 0.00 -1.71 0.00 0.00 66.02 66.59 1gxy s SER 162 CO 0.16 -0.30 2.25 0.44 1.20 0.00 0.00 173.24 176.99 1gxy h ASP 163 N 4.63 0.00 0.60 5.45 3.32 -1.95 0.50 116.42 128.98 1gxy h ASP 163 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1gxy h ASP 163 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1gxy h ASP 163 CO 0.39 0.00 -0.12 1.41 -1.72 0.00 0.00 179.24 179.21 1gxy n HIS 164 N -3.35 0.00 -1.01 4.55 8.25 -1.26 -4.86 115.22 117.53 1gxy n HIS 164 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1gxy n HIS 164 Cb 0.15 -0.30 0.00 0.00 1.12 0.00 0.00 29.99 30.96 1gxy n HIS 164 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1gxy n GLY 165 N 1.38 2.35 3.04 -1.41 0.00 0.18 -3.53 105.19 107.20 1gxy n GLY 165 Ca 0.11 -1.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.12 1gxy n GLY 165 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gxy s THR 166 N 3.09 0.54 -0.23 2.61 2.01 -1.17 -4.61 115.64 117.88 1gxy s THR 166 Ca 0.00 -0.83 -0.03 0.00 0.31 0.00 0.00 61.69 61.15 1gxy s THR 166 Cb 0.00 -0.56 0.01 0.00 0.01 0.00 0.00 72.50 71.96 1gxy s THR 166 CO 0.00 -0.21 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.43 1gxy s LEU 167 N -1.13 2.90 -0.14 4.42 2.96 0.23 -0.43 118.68 127.48 1gxy s LEU 167 Ca -0.06 -0.59 -0.15 0.00 -0.22 0.00 0.00 54.13 53.12 1gxy s LEU 167 Cb -0.08 -1.68 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 1gxy s LEU 167 CO 0.00 -0.06 0.33 -0.36 -1.32 0.00 0.00 176.35 174.95 1gxy s PHE 168 N 1.40 3.49 -0.27 5.38 0.40 0.14 -1.50 117.98 127.02 1gxy s PHE 168 Ca 0.04 0.68 -0.05 0.00 -0.60 0.00 0.00 56.93 57.00 1gxy s PHE 168 Cb -0.15 -2.38 0.01 0.00 0.51 0.00 0.00 43.02 41.02 1gxy s PHE 168 CO -0.05 0.25 0.03 0.42 0.70 0.00 0.00 175.22 176.57 1gxy s ILE 169 N 0.40 3.58 0.02 0.64 1.01 -0.30 -1.17 121.20 125.38 1gxy s ILE 169 Ca 0.19 -0.77 0.06 0.00 0.00 0.00 0.00 60.65 60.13 1gxy s ILE 169 Cb -0.14 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.49 1gxy s ILE 169 CO 0.06 0.15 -0.18 -0.63 0.00 0.00 0.00 174.94 174.33 1gxy s ILE 170 N 1.44 1.46 -0.27 2.92 1.01 0.62 -0.62 121.20 127.77 1gxy s ILE 170 Ca 0.02 -0.97 -0.03 0.00 0.00 0.00 0.00 60.65 59.67 1gxy s ILE 170 Cb -0.17 -1.25 0.02 0.00 0.01 0.00 0.00 42.46 41.08 1gxy s ILE 170 CO -0.00 0.26 -0.01 -0.75 0.00 0.00 0.00 174.94 174.44 1gxy s LYS 171 N -0.83 2.87 0.02 2.79 2.20 -0.65 -0.60 119.74 125.54 1gxy s LYS 171 Ca 0.06 -0.97 0.05 0.00 -0.36 0.00 0.00 55.97 54.75 1gxy s LYS 171 Cb -0.08 -3.13 -0.03 0.00 -1.51 0.00 0.00 37.83 33.08 1gxy s LYS 171 CO 0.01 -0.44 -0.14 -0.08 -0.36 0.00 0.00 175.35 174.34 1gxy s THR 172 N 1.37 3.11 0.00 3.43 -1.32 -0.65 -4.36 115.64 117.23 1gxy s THR 172 Ca 0.00 -1.01 0.00 0.00 -1.21 0.00 0.00 61.69 59.47 1gxy s THR 172 Cb -0.17 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.50 1gxy s THR 172 CO -0.02 0.37 0.35 0.00 -2.21 0.00 0.00 174.62 173.11 1gxy n LEU 174 N -0.24 0.37 -4.76 0.00 4.77 -1.26 -4.63 117.00 111.25 1gxy n LEU 174 Ca 0.00 -0.49 -0.35 0.00 -0.03 0.00 0.00 56.01 55.14 1gxy n LEU 174 Cb 0.01 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1gxy n LEU 174 CO 0.00 0.09 0.80 -0.83 -1.33 0.00 0.00 177.39 176.12 1gxy s GLY 175 N -1.80 2.58 -0.04 -0.72 0.00 -1.26 -4.62 107.32 101.47 1gxy s GLY 175 Ca 0.03 0.86 0.05 0.00 0.00 0.00 0.00 44.72 45.66 1gxy s GLY 175 CO 0.33 1.24 -0.19 0.14 0.00 0.00 0.00 173.10 174.61 1gxy s VAL 176 N -1.80 1.59 -0.30 1.40 1.01 -0.01 -4.91 120.40 117.38 1gxy s VAL 176 Ca 0.74 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 61.61 1gxy s VAL 176 Cb -0.26 -1.35 -0.00 0.00 0.00 0.00 0.00 36.38 34.76 1gxy s VAL 176 CO 0.33 0.45 1.41 -0.47 0.00 0.00 0.00 175.10 176.82 1gxy s TYR 177 N -0.13 2.47 -0.21 5.22 5.04 -1.26 -0.56 117.35 127.91 1gxy s TYR 177 Ca -0.01 0.75 0.14 0.00 -2.44 0.00 0.00 57.07 55.51 1gxy s TYR 177 Cb -0.11 -4.01 0.46 0.00 0.35 0.00 0.00 41.96 38.65 1gxy s TYR 177 CO 0.02 -2.08 1.35 0.44 -1.34 0.00 0.00 175.55 173.94 1gxy n ILE 178 N 6.45 2.29 -0.23 3.14 -5.35 -0.09 -4.72 119.36 120.84 1gxy n ILE 178 Ca 0.16 -2.46 0.18 0.00 -0.27 0.00 0.00 62.75 60.37 1gxy n ILE 178 Cb 0.47 -0.27 0.50 0.00 -1.74 0.00 0.00 39.64 38.59 1gxy n ILE 178 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1gxy h LYS 179 N 1.03 0.41 -0.20 6.28 3.64 -1.91 0.17 116.57 125.99 1gxy h LYS 179 Ca 0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1gxy h LYS 179 Cb 1.37 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1gxy h LYS 179 CO 0.21 0.27 0.00 0.39 -2.27 0.00 0.00 179.45 178.05 1gxy n GLU 180 N -4.51 1.56 -2.61 1.90 -0.58 -1.26 -3.55 120.64 111.59 1gxy n GLU 180 Ca 0.18 -0.86 -0.08 0.00 -0.42 0.00 0.00 57.16 55.98 1gxy n GLU 180 Cb 0.66 -1.26 0.04 0.00 -0.57 0.00 0.00 31.44 30.31 1gxy n GLU 180 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1gxy n PHE 181 N 0.15 1.70 -4.17 -0.32 3.72 0.59 -4.98 117.46 114.15 1gxy n PHE 181 Ca 0.11 -2.30 -0.11 0.00 -0.05 0.00 0.00 57.45 55.11 1gxy n PHE 181 Cb 0.23 -0.27 -0.10 0.00 -0.94 0.00 0.00 39.48 38.40 1gxy n PHE 181 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1gxy s SER 182 N -3.66 0.52 0.32 4.37 0.15 -1.18 -3.07 113.70 111.16 1gxy s SER 182 Ca 0.34 -1.20 0.19 0.00 0.70 0.00 0.00 55.95 55.98 1gxy s SER 182 Cb 0.36 0.25 0.16 0.00 -1.71 0.00 0.00 66.02 65.08 1gxy s SER 182 CO -0.02 -0.69 1.43 -0.26 1.20 0.00 0.00 173.24 174.90 1gxy h PHE 183 N 2.83 0.00 -2.67 3.44 0.04 -1.82 -3.41 116.94 115.34 1gxy h PHE 183 Ca -0.35 0.00 -0.59 0.00 2.80 0.00 0.00 57.97 59.83 1gxy h PHE 183 Cb 1.20 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 38.96 1gxy h PHE 183 CO 0.46 0.25 -0.83 1.03 -0.60 0.00 0.00 178.31 178.62 1gxy s ARG 184 N -3.10 0.76 0.47 1.51 0.52 -1.26 -4.98 118.95 112.87 1gxy s ARG 184 Ca 0.04 -1.56 0.17 0.00 -0.52 0.00 0.00 55.73 53.86 1gxy s ARG 184 Cb 0.07 -1.57 1.16 0.00 0.52 0.00 0.00 34.95 35.13 1gxy s ARG 184 CO 0.72 -1.21 2.02 -1.35 0.02 0.00 0.00 175.30 175.51 1gxy h PRO 185 N 6.84 0.23 -0.01 3.54 0.11 -1.81 -1.30 132.00 139.60 1gxy h PRO 185 Ca 0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1gxy h PRO 185 Cb 0.95 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 1gxy h PRO 185 CO 0.33 0.15 0.12 0.38 -0.21 0.00 0.00 178.00 178.77 1gxy h ASP 186 N 0.23 0.00 1.05 -2.05 2.03 -1.93 -0.86 116.42 114.89 1gxy h ASP 186 Ca 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1gxy h ASP 186 Cb 0.51 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.01 1gxy h ASP 186 CO -0.04 0.00 0.00 1.56 -1.03 0.00 0.00 179.24 179.73 1gxy h GLN 187 N 0.00 0.00 -6.57 4.15 1.08 -1.65 -3.47 115.11 108.64 1gxy h GLN 187 Ca 0.01 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.69 1gxy h GLN 187 Cb 0.25 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.61 1gxy h GLN 187 CO -0.00 0.00 -0.90 0.39 -0.95 0.00 0.00 178.83 177.37 1gxy n GLU 188 N -2.84 -2.88 -2.45 1.46 -0.58 -0.33 -4.54 120.64 108.48 1gxy n GLU 188 Ca 0.01 0.36 -0.40 0.00 -0.42 0.00 0.00 57.16 56.71 1gxy n GLU 188 Cb 0.31 -4.36 -0.04 0.00 -0.57 0.00 0.00 31.44 26.78 1gxy n GLU 188 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1gxy s GLU 189 N -6.66 4.60 -0.17 3.49 2.02 -1.26 -1.51 118.70 119.22 1gxy s GLU 189 Ca 0.02 1.82 0.00 0.00 0.02 0.00 0.00 54.97 56.83 1gxy s GLU 189 Cb -0.01 -3.20 0.03 0.00 0.10 0.00 0.00 34.13 31.05 1gxy s GLU 189 CO 0.90 0.14 -0.11 0.08 0.02 0.00 0.00 175.26 176.30 1gxy s VAL 190 N -0.90 1.47 -0.13 2.63 1.01 0.15 -0.92 120.40 123.71 1gxy s VAL 190 Ca 0.46 -0.75 -0.24 0.00 0.00 0.00 0.00 61.98 61.45 1gxy s VAL 190 Cb -0.32 -1.50 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1gxy s VAL 190 CO 0.40 0.28 0.76 -0.22 0.00 0.00 0.00 175.10 176.32 1gxy s LEU 191 N 1.50 4.22 -0.16 3.92 2.96 0.27 -2.02 118.68 129.37 1gxy s LEU 191 Ca 0.02 1.14 -0.02 0.00 -0.22 0.00 0.00 54.13 55.05 1gxy s LEU 191 Cb -0.15 -3.14 -0.01 0.00 0.50 0.00 0.00 46.19 43.39 1gxy s LEU 191 CO -0.09 -0.28 -0.09 -0.63 -1.32 0.00 0.00 176.35 173.94 1gxy s ILE 192 N 1.63 3.24 0.51 6.68 1.01 -0.10 -0.83 121.20 133.32 1gxy s ILE 192 Ca 0.37 -0.57 -0.21 0.00 0.00 0.00 0.00 60.65 60.24 1gxy s ILE 192 Cb -0.17 -2.41 -0.07 0.00 0.01 0.00 0.00 42.46 39.83 1gxy s ILE 192 CO 0.15 0.49 1.13 -2.16 0.00 0.00 0.00 174.94 174.55 1gxy s PRO 193 N 0.72 3.55 0.00 2.79 0.04 -1.26 -1.52 135.00 139.32 1gxy s PRO 193 Ca -0.04 1.65 0.17 0.00 0.04 0.00 0.00 61.00 62.82 1gxy s PRO 193 Cb -0.15 -2.16 0.84 0.00 0.04 0.00 0.00 34.50 33.07 1gxy s PRO 193 CO 0.02 -0.70 1.54 0.41 0.04 0.00 0.00 177.00 178.31 1gxy n GLY 194 N 0.23 -0.94 0.93 0.56 0.00 -1.19 -2.60 105.19 102.19 1gxy n GLY 194 Ca 0.10 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.15 1gxy n GLY 194 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1gxy n TYR 195 N -1.35 0.47 -2.76 1.61 0.18 -1.26 -1.39 117.16 112.65 1gxy n TYR 195 Ca 0.07 -0.24 -0.41 0.00 1.88 0.00 0.00 57.90 59.20 1gxy n TYR 195 Cb 0.16 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.08 1gxy n TYR 195 CO 0.00 0.00 0.00 -2.00 -2.08 0.00 0.00 176.86 172.78 1gxy s GLU 196 N -1.53 4.65 -0.10 -3.48 2.12 -1.07 -3.34 118.70 115.95 1gxy s GLU 196 Ca 0.36 1.39 0.01 0.00 0.36 0.00 0.00 54.97 57.09 1gxy s GLU 196 Cb 0.20 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 31.18 1gxy s GLU 196 CO 0.28 0.17 -0.13 0.08 -0.54 0.00 0.00 175.26 175.12 1gxy s VAL 197 N 0.18 3.09 -0.28 3.70 1.01 -0.14 -4.45 120.40 123.52 1gxy s VAL 197 Ca 0.47 -0.67 -0.11 0.00 0.00 0.00 0.00 61.98 61.67 1gxy s VAL 197 Cb -0.22 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.84 1gxy s VAL 197 CO 0.29 0.55 0.19 -0.31 0.00 0.00 0.00 175.10 175.81 1gxy s TYR 198 N -0.02 3.22 -0.87 5.22 2.02 0.15 -0.89 117.35 126.18 1gxy s TYR 198 Ca -0.03 0.12 0.24 0.00 -0.37 0.00 0.00 57.07 57.02 1gxy s TYR 198 Cb -0.14 -2.37 0.22 0.00 -0.40 0.00 0.00 41.96 39.27 1gxy s TYR 198 CO 0.04 -0.15 1.20 1.04 -1.57 0.00 0.00 175.55 176.11 1gxy n GLN 199 N 5.02 0.10 -4.00 -0.62 6.02 -0.78 -1.54 117.38 121.59 1gxy n GLN 199 Ca -0.14 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.55 1gxy n GLN 199 Cb 0.52 -1.54 -0.16 0.00 1.02 0.00 0.00 30.24 30.08 1gxy n GLN 199 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1gxy s LYS 200 N -3.07 2.01 -0.07 -1.09 2.20 -0.86 -4.85 119.74 114.02 1gxy s LYS 200 Ca 0.08 -0.93 0.03 0.00 -0.36 0.00 0.00 55.97 54.79 1gxy s LYS 200 Cb 0.16 -2.51 0.01 0.00 -1.51 0.00 0.00 37.83 33.98 1gxy s LYS 200 CO 0.76 -0.47 -0.16 0.08 -0.36 0.00 0.00 175.35 175.21 1gxy s VAL 201 N 1.36 1.40 -0.04 4.02 1.01 -1.26 -0.34 120.40 126.55 1gxy s VAL 201 Ca -0.03 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.31 1gxy s VAL 201 Cb -0.17 -1.25 0.03 0.00 0.00 0.00 0.00 36.38 34.99 1gxy s VAL 201 CO -0.08 0.41 -0.01 -0.60 0.00 0.00 0.00 175.10 174.83 1gxy s ARG 202 N 0.51 0.47 0.17 2.72 3.52 -0.11 -4.98 118.95 121.24 1gxy s ARG 202 Ca -0.14 0.05 -0.28 0.00 -0.13 0.00 0.00 55.73 55.22 1gxy s ARG 202 Cb -0.16 -0.66 -0.08 0.00 -1.56 0.00 0.00 34.95 32.50 1gxy s ARG 202 CO 0.05 -0.16 0.88 0.99 -0.81 0.00 0.00 175.30 176.25 1gxy s THR 203 N 1.21 4.32 -0.04 4.11 2.01 -1.26 -0.33 115.64 125.66 1gxy s THR 203 Ca -0.07 1.93 0.01 0.00 0.31 0.00 0.00 61.69 63.87 1gxy s THR 203 Cb -0.13 -4.25 0.02 0.00 0.01 0.00 0.00 72.50 68.14 1gxy s THR 203 CO -0.02 0.45 -0.04 -1.10 -0.69 0.00 0.00 174.62 173.22 1gxy s GLN 204 N -0.77 0.68 3.56 4.92 -0.21 -0.17 -4.95 119.66 122.72 1gxy s GLN 204 Ca 0.41 -0.08 0.00 0.00 0.02 0.00 0.00 55.36 55.70 1gxy s GLN 204 Cb -0.24 -0.71 0.00 0.00 1.00 0.00 0.00 33.01 33.06 1gxy s GLN 204 CO 0.29 -0.06 0.00 0.41 -2.12 0.00 0.00 175.29 173.81 1gxy n GLY 205 N 3.92 1.01 0.01 3.09 0.00 -1.26 -1.60 105.19 110.35 1gxy n GLY 205 Ca -0.25 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.24 1gxy n GLY 205 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1gxy n TYR 206 N 0.00 0.05 -1.61 1.61 4.11 -1.26 -4.64 117.16 115.43 1gxy n TYR 206 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.90 57.92 1gxy n TYR 206 Cb 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 39.34 39.13 1gxy n TYR 206 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 1gxy n ASN 207 N -1.76 0.00 -4.56 9.48 0.23 -1.24 -5.05 115.26 112.36 1gxy n ASN 207 Ca 0.02 -1.60 -0.31 0.00 -0.53 0.00 0.00 54.58 52.15 1gxy n ASN 207 Cb 0.40 -0.12 -0.11 0.00 -2.08 0.00 0.00 39.78 37.88 1gxy n ASN 207 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1gxy s GLU 208 N 0.00 2.37 -0.06 -3.83 2.02 -0.63 -0.60 118.70 117.97 1gxy s GLU 208 Ca 0.00 -0.84 -0.00 0.00 0.02 0.00 0.00 54.97 54.15 1gxy s GLU 208 Cb 0.00 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.86 1gxy s GLU 208 CO 0.00 0.57 -0.02 0.42 0.02 0.00 0.00 175.26 176.25 1gxy s ILE 209 N -1.02 0.46 -0.29 -1.63 1.01 -0.56 -1.00 121.20 118.17 1gxy s ILE 209 Ca 0.17 -0.01 -0.13 0.00 0.00 0.00 0.00 60.65 60.69 1gxy s ILE 209 Cb -0.11 -0.55 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 1gxy s ILE 209 CO 0.08 0.24 0.27 0.12 0.00 0.00 0.00 174.94 175.65 1gxy s PHE 210 N 1.42 3.23 -0.21 3.97 5.36 0.55 -1.15 117.98 131.14 1gxy s PHE 210 Ca -0.03 0.18 -0.04 0.00 -0.96 0.00 0.00 56.93 56.08 1gxy s PHE 210 Cb -0.13 -2.47 -0.01 0.00 -0.34 0.00 0.00 43.02 40.07 1gxy s PHE 210 CO -0.03 -0.22 -0.05 -0.51 -1.46 0.00 0.00 175.22 172.96 1gxy s LEU 211 N 1.88 2.91 0.00 6.12 1.43 0.21 -0.93 118.68 130.29 1gxy s LEU 211 Ca 0.10 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 52.89 1gxy s LEU 211 Cb -0.16 -1.73 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 1gxy s LEU 211 CO 0.11 0.00 0.23 -0.67 0.23 0.00 0.00 176.35 176.25 1gxy n ASP 212 N 4.63 -0.50 -3.76 2.29 -0.08 0.54 -1.64 116.55 118.03 1gxy n ASP 212 Ca -0.18 -2.79 -0.30 0.00 -1.51 0.00 0.00 54.79 50.01 1gxy n ASP 212 Cb 0.51 1.34 0.03 0.00 2.34 0.00 0.00 41.12 45.34 1gxy n ASP 212 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1gxy n SER 213 N -1.91 -3.91 -4.78 1.67 7.64 -1.26 -2.03 113.62 109.03 1gxy n SER 213 Ca 0.06 -1.02 -0.36 0.00 1.01 0.00 0.00 58.87 58.56 1gxy n SER 213 Cb 0.49 -3.26 -0.02 0.00 -1.01 0.00 0.00 64.21 60.41 1gxy n SER 213 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1gxy s PRO 214 N -6.18 3.85 0.01 1.43 0.04 -1.26 -1.86 135.00 131.02 1gxy s PRO 214 Ca 0.35 1.59 -0.16 0.00 0.04 0.00 0.00 61.00 62.81 1gxy s PRO 214 Cb -0.13 -2.34 0.03 0.00 0.04 0.00 0.00 34.50 32.10 1gxy s PRO 214 CO 0.87 -0.43 0.34 -1.59 0.04 0.00 0.00 177.00 176.23 1gxy s LYS 215 N -2.81 0.76 0.05 4.56 -2.85 -0.07 -4.89 119.74 114.49 1gxy s LYS 215 Ca 0.64 -0.28 -0.22 0.00 -1.00 0.00 0.00 55.97 55.10 1gxy s LYS 215 Cb -0.23 0.33 -0.06 0.00 -2.06 0.00 0.00 37.83 35.81 1gxy s LYS 215 CO 0.28 -0.23 0.67 0.50 0.10 0.00 0.00 175.35 176.68 1gxy s ARG 216 N -1.79 4.39 0.09 1.78 3.52 -1.26 -0.96 118.95 124.72 1gxy s ARG 216 Ca -0.10 0.91 0.05 0.00 -0.13 0.00 0.00 55.73 56.46 1gxy s ARG 216 Cb -0.03 -3.32 -0.03 0.00 -1.56 0.00 0.00 34.95 30.00 1gxy s ARG 216 CO 0.02 0.41 -0.14 0.21 -0.81 0.00 0.00 175.30 174.99 1gxy s LYS 217 N -0.42 0.90 0.55 5.12 2.20 -1.21 -4.95 119.74 121.92 1gxy s LYS 217 Ca 0.34 -1.09 -0.21 0.00 -0.36 0.00 0.00 55.97 54.66 1gxy s LYS 217 Cb -0.20 -0.82 -0.05 0.00 -1.51 0.00 0.00 37.83 35.25 1gxy s LYS 217 CO 0.21 0.17 1.26 0.15 -0.36 0.00 0.00 175.35 176.77 1gxy s LYS 218 N -2.21 3.18 0.52 4.03 1.02 -1.26 -4.89 119.74 120.12 1gxy s LYS 218 Ca 0.03 1.97 -0.02 0.00 0.02 0.00 0.00 55.97 57.97 1gxy s LYS 218 Cb -0.07 -2.14 0.00 0.00 -0.52 0.00 0.00 37.83 35.10 1gxy s LYS 218 CO 0.02 -1.08 0.78 -1.12 -0.92 0.00 0.00 175.35 173.03 1gxy s SER 219 N -1.30 5.69 0.14 2.83 0.01 -1.26 -5.02 113.70 114.80 1gxy s SER 219 Ca 0.73 0.46 -0.03 0.00 1.31 0.00 0.00 55.95 58.42 1gxy s SER 219 Cb -0.34 -1.57 -0.05 0.00 0.21 0.00 0.00 66.02 64.27 1gxy s SER 219 CO 0.39 -0.89 1.34 0.78 0.41 0.00 0.00 173.24 175.28 1gxy h ASN 220 N 0.13 0.48 -3.53 2.44 2.35 -1.92 -3.44 115.58 112.10 1gxy h ASN 220 Ca -0.46 -0.37 -0.67 0.00 -0.55 0.00 0.00 56.30 54.25 1gxy h ASN 220 Cb 1.26 -0.15 -0.16 0.00 0.05 0.00 0.00 38.32 39.32 1gxy h ASN 220 CO 0.58 1.16 -0.68 -0.31 -1.65 0.00 0.00 177.43 176.53 1gxy s TYR 221 N -3.34 2.97 -0.14 1.19 2.02 -1.26 -5.09 117.35 113.71 1gxy s TYR 221 Ca -0.05 0.02 -0.06 0.00 -0.37 0.00 0.00 57.07 56.61 1gxy s TYR 221 Cb 0.09 -1.66 0.06 0.00 -0.40 0.00 0.00 41.96 40.06 1gxy s TYR 221 CO 0.85 0.40 0.29 1.21 -1.57 0.00 0.00 175.55 176.74 1gxy s ASN 222 N -1.31 0.03 -1.59 2.29 2.47 -1.26 -3.93 114.94 111.63 1gxy s ASN 222 Ca 0.17 0.66 -0.15 0.00 0.42 0.00 0.00 52.86 53.95 1gxy s ASN 222 Cb -0.11 0.72 0.11 0.00 -1.45 0.00 0.00 41.25 40.52 1gxy s ASN 222 CO 0.07 -0.22 0.90 0.00 -3.72 0.00 0.00 177.10 174.13 1gxy h LEU 224 N -1.86 0.19 -3.05 0.00 5.85 -2.01 -2.93 115.31 111.50 1gxy h LEU 224 Ca -0.59 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1gxy h LEU 224 Cb 1.38 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.47 1gxy h LEU 224 CO 0.71 0.12 0.00 -1.22 -0.34 0.00 0.00 178.44 177.71 1gxy n TYR 225 N -5.01 1.23 1.94 1.25 4.01 -1.26 -5.27 117.16 114.06 1gxy n TYR 225 Ca 0.08 -0.60 0.16 0.00 -0.16 0.00 0.00 57.90 57.37 1gxy n TYR 225 Cb 0.25 -0.18 0.92 0.00 -0.31 0.00 0.00 39.34 40.03 1gxy n TYR 225 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27