#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 4.16 -0.02 1.53 1.43 -0.29 -4.94 118.68 120.55 1gxy s LEU 5 Ca 0.00 0.25 -0.18 0.00 -1.03 0.00 0.00 54.13 53.17 1gxy s LEU 5 Cb 0.00 -2.47 -0.05 0.00 0.03 0.00 0.00 46.19 43.69 1gxy s LEU 5 CO 0.00 0.26 0.51 -0.04 0.23 0.00 0.00 176.35 177.32 1gxy s MET 6 N -1.88 4.20 0.31 1.70 -1.94 -1.26 -0.48 119.30 119.95 1gxy s MET 6 Ca 0.26 0.58 -0.21 0.00 -1.71 0.00 0.00 55.69 54.61 1gxy s MET 6 Cb -0.12 -3.32 -0.09 0.00 2.01 0.00 0.00 34.83 33.31 1gxy s MET 6 CO 0.17 0.45 0.85 -0.51 -0.01 0.00 0.00 175.02 175.97 1gxy s LEU 7 N -0.38 4.22 0.00 -0.03 1.43 -0.56 -4.91 118.68 118.44 1gxy s LEU 7 Ca 0.28 1.60 0.00 0.00 -1.03 0.00 0.00 54.13 54.98 1gxy s LEU 7 Cb -0.17 -4.01 0.00 0.00 0.03 0.00 0.00 46.19 42.04 1gxy s LEU 7 CO 0.15 -0.12 0.00 -0.90 0.23 0.00 0.00 176.35 175.71 1gxy n ASP 8 N 0.23 0.00 -1.42 2.29 5.68 -1.26 -4.72 116.55 117.34 1gxy n ASP 8 Ca 0.02 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.40 1gxy n ASP 8 Cb 0.52 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.82 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 1.64 -3.77 2.12 -2.24 -1.26 -0.47 114.28 110.31 1gxy n THR 9 Ca 0.00 -1.19 -0.34 0.00 -2.27 0.00 0.00 64.05 60.25 1gxy n THR 9 Cb 0.00 0.21 0.04 0.00 -2.10 0.00 0.00 70.33 68.47 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 1.06 -2.54 0.27 6.98 0.00 -1.24 -4.65 120.51 120.40 1gxy n ALA 10 Ca 0.24 -0.30 0.14 0.00 0.00 0.00 0.00 53.44 53.51 1gxy n ALA 10 Cb 0.80 -3.74 0.79 0.00 0.00 0.00 0.00 19.45 17.30 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 -2.03 0.00 -0.06 0.00 0.13 -1.94 -2.82 132.00 125.28 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 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1gxy h PRO 11 CO 0.50 0.08 0.00 0.09 -0.23 0.00 0.00 178.00 178.44 1gxy n ASN 12 N -3.65 1.70 -4.79 1.44 3.02 -1.26 -4.94 115.26 106.78 1gxy n ASN 12 Ca -0.02 -1.60 -0.38 0.00 -0.03 0.00 0.00 54.58 52.55 1gxy n ASN 12 Cb 0.20 -0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.27 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 -1.94 3.41 -0.15 5.41 0.00 -1.07 -1.05 121.76 126.37 1gxy s ALA 13 Ca 0.36 0.32 -0.29 0.00 0.00 0.00 0.00 51.96 52.35 1gxy s ALA 13 Cb 0.20 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.36 1gxy s ALA 13 CO 0.31 0.29 1.27 0.12 0.00 0.00 0.00 175.76 177.75 1gxy s PHE 14 N -1.33 2.86 -0.08 0.00 5.36 -0.61 -4.87 117.98 119.30 1gxy s PHE 14 Ca 0.40 1.01 0.15 0.00 -0.96 0.00 0.00 56.93 57.53 1gxy s PHE 14 Cb -0.20 -3.51 0.31 0.00 -0.34 0.00 0.00 43.02 39.27 1gxy s PHE 14 CO 0.24 -1.72 1.14 -0.40 -1.46 0.00 0.00 175.22 173.02 1gxy n ASP 15 N 6.44 1.25 -4.61 6.13 5.68 -1.26 -4.64 116.55 125.53 1gxy n ASP 15 Ca 0.14 -2.75 -0.51 0.00 -0.50 0.00 0.00 54.79 51.16 1gxy n ASP 15 Cb 0.45 -0.37 -0.06 0.00 -1.14 0.00 0.00 41.12 40.00 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 -0.45 1.93 -0.30 -1.12 -0.08 -1.26 -4.77 116.55 110.50 1gxy n ASP 16 Ca 0.10 1.11 0.07 0.00 -1.51 0.00 0.00 54.79 54.57 1gxy n ASP 16 Cb 0.82 -1.23 -0.01 0.00 2.34 0.00 0.00 41.12 43.04 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 2.83 1.81 -3.64 -0.67 6.02 -1.26 -5.01 117.38 117.46 1gxy n GLN 17 Ca 0.19 -0.68 -0.21 0.00 -0.01 0.00 0.00 57.00 56.29 1gxy n GLN 17 Cb 0.20 -1.24 0.05 0.00 1.02 0.00 0.00 30.24 30.28 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 -0.30 -2.10 -2.64 1.08 4.01 -1.26 -4.92 117.16 111.04 1gxy n TYR 18 Ca 0.06 0.89 -0.43 0.00 -0.16 0.00 0.00 57.90 58.26 1gxy n TYR 18 Cb 0.31 -4.59 -0.02 0.00 -0.31 0.00 0.00 39.34 34.72 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 -5.89 3.94 0.00 -0.72 2.02 -1.26 -3.52 118.70 113.27 1gxy s GLU 19 Ca 0.11 0.88 0.00 0.00 0.02 0.00 0.00 54.97 55.97 1gxy s GLU 19 Cb -0.05 -3.79 0.00 0.00 0.10 0.00 0.00 34.13 30.38 1gxy s GLU 19 CO 0.79 -1.05 0.00 0.41 0.02 0.00 0.00 175.26 175.42 1gxy n GLY 20 N 4.21 0.80 0.33 -1.39 0.00 -1.26 -4.85 105.19 103.03 1gxy n GLY 20 Ca 0.12 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.19 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 2.87 0.76 -0.80 0.00 2.07 -1.92 0.11 116.25 119.34 1gxy h VAL 22 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1gxy h VAL 22 Cb 1.18 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 1gxy h VAL 22 CO 0.01 0.00 0.45 0.78 0.02 0.00 0.00 177.57 178.83 1gxy h ASN 23 N -0.05 0.99 -0.56 0.57 2.35 -1.95 0.11 115.58 117.03 1gxy h ASN 23 Ca 0.09 -0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1gxy h ASN 23 Cb 0.18 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 1gxy h ASN 23 CO -0.19 0.79 0.31 0.50 -1.65 0.00 0.00 177.43 177.19 1gxy h LYS 24 N 1.11 0.78 -0.37 0.81 1.63 -1.80 -2.89 116.57 115.84 1gxy h LYS 24 Ca 0.28 -0.09 -0.12 0.00 -0.85 0.00 0.00 60.65 59.87 1gxy h LYS 24 Cb 0.01 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.48 1gxy h LYS 24 CO -0.05 0.60 -0.24 0.52 -3.45 0.00 0.00 179.45 176.83 1gxy h MET 25 N 0.76 0.81 0.00 1.90 2.86 -0.24 -2.78 114.93 118.24 1gxy h MET 25 Ca 0.20 -0.38 -0.00 0.00 -2.06 0.00 0.00 59.70 57.46 1gxy h MET 25 Cb 0.04 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1gxy h MET 25 CO -0.03 1.01 -0.00 0.93 1.06 0.00 0.00 176.91 179.88 1gxy h GLU 26 N 0.61 0.00 0.00 1.72 4.39 -0.67 0.29 114.58 120.93 1gxy h GLU 26 Ca 0.07 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.58 1gxy h GLU 26 Cb 0.80 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.42 1gxy h GLU 26 CO 0.07 0.00 -1.67 -0.85 -1.16 0.00 0.00 179.01 175.40 1gxy n GLU 27 N -3.64 0.64 -0.00 2.33 0.28 -1.10 -4.35 120.64 114.79 1gxy n GLU 27 Ca -0.03 0.14 0.11 0.00 -0.16 0.00 0.00 57.16 57.22 1gxy n GLU 27 Cb 0.08 -1.73 -0.14 0.00 1.43 0.00 0.00 31.44 31.09 1gxy n GLU 27 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 1gxy n LYS 28 N -2.81 0.49 -0.19 3.44 2.85 -0.94 -4.50 118.16 116.50 1gxy n LYS 28 Ca -0.14 -0.13 0.05 0.00 -1.05 0.00 0.00 58.31 57.04 1gxy n LYS 28 Cb 0.88 -1.53 0.32 0.00 -0.65 0.00 0.00 35.03 34.05 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 2.24 1.63 -0.71 0.58 0.00 -0.62 -1.88 119.26 120.51 1gxy h ALA 29 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1gxy h ALA 29 Cb 0.88 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1gxy h ALA 29 CO 0.00 0.27 0.44 -1.35 0.00 0.00 0.00 179.25 178.62 1gxy h PRO 30 N 0.83 0.84 -0.45 0.00 0.11 -1.81 0.42 132.00 131.93 1gxy h PRO 30 Ca 0.30 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.24 1gxy h PRO 30 Cb 0.15 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 1gxy h PRO 30 CO -0.09 0.55 -0.19 1.25 -0.21 0.00 0.00 178.00 179.31 1gxy h LEU 31 N 0.86 0.95 -1.15 2.35 5.85 -1.78 -2.42 115.31 119.97 1gxy h LEU 31 Ca 0.28 -0.39 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 1gxy h LEU 31 Cb 0.02 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 1gxy h LEU 31 CO -0.11 1.13 0.08 -0.07 -0.34 0.00 0.00 178.44 179.13 1gxy h LEU 32 N 0.76 0.63 -0.46 2.25 3.38 -0.63 -1.89 115.31 119.35 1gxy h LEU 32 Ca 0.10 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1gxy h LEU 32 Cb 0.76 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1gxy h LEU 32 CO 0.06 0.65 -0.09 0.25 0.09 0.00 0.00 178.44 179.40 1gxy h LEU 33 N 0.65 0.87 -1.17 1.67 5.85 0.02 0.66 115.31 123.86 1gxy h LEU 33 Ca 0.14 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.52 1gxy h LEU 33 Cb 0.29 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1gxy h LEU 33 CO 0.00 1.02 0.56 -0.61 -0.34 0.00 0.00 178.44 179.07 1gxy h GLN 34 N 0.71 1.11 -0.32 1.25 4.15 -1.15 -0.49 115.11 120.37 1gxy h GLN 34 Ca 0.12 -0.07 -0.10 0.00 0.77 0.00 0.00 58.65 59.37 1gxy h GLN 34 Cb 0.63 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 1gxy h GLN 34 CO 0.04 0.73 -0.20 1.49 -1.93 0.00 0.00 178.83 178.96 1gxy h GLU 35 N 1.14 0.71 -0.54 1.69 4.81 -0.84 -2.01 114.58 119.54 1gxy h GLU 35 Ca 0.31 -0.33 0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1gxy h GLU 35 Cb -0.12 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.20 1gxy h GLU 35 CO -0.07 0.94 0.25 -0.44 -0.73 0.00 0.00 179.01 178.96 1gxy h ASP 36 N 0.48 0.34 -0.93 1.04 3.32 -0.12 -1.46 116.42 119.09 1gxy h ASP 36 Ca 0.07 0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.18 1gxy h ASP 36 Cb 0.75 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.23 1gxy h ASP 36 CO 0.06 0.23 0.62 -0.26 -1.72 0.00 0.00 179.24 178.17 1gxy h PHE 37 N 0.49 1.16 0.00 4.55 0.04 -0.94 0.17 116.94 122.40 1gxy h PHE 37 Ca 0.24 0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.04 1gxy h PHE 37 Cb 0.19 -0.39 0.00 0.00 2.20 0.00 0.00 35.95 37.95 1gxy h PHE 37 CO -0.12 0.70 0.00 -0.97 -0.60 0.00 0.00 178.31 177.33 1gxy h ASN 38 N 1.23 0.00 -0.01 2.17 -1.24 -0.53 -2.57 115.58 114.63 1gxy h ASN 38 Ca 0.36 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.37 1gxy h ASN 38 Cb -0.07 0.00 0.00 0.00 0.73 0.00 0.00 38.32 38.98 1gxy h ASN 38 CO -0.09 0.00 -0.31 0.23 -1.29 0.00 0.00 177.43 175.97 1gxy n MET 39 N -2.84 1.91 -3.31 6.67 2.81 -0.56 -4.83 117.12 116.98 1gxy n MET 39 Ca 0.01 -0.67 -0.22 0.00 -1.81 0.00 0.00 57.70 55.02 1gxy n MET 39 Cb 0.26 -1.19 -0.08 0.00 -0.71 0.00 0.00 33.22 31.50 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 -1.71 1.21 0.29 7.83 3.84 0.47 -4.98 114.94 121.89 1gxy s ASN 40 Ca 0.11 -2.35 -0.01 0.00 0.21 0.00 0.00 52.86 50.82 1gxy s ASN 40 Cb 0.11 0.16 0.47 0.00 -0.55 0.00 0.00 41.25 41.43 1gxy s ASN 40 CO 0.36 -0.20 1.94 0.00 -2.79 0.00 0.00 177.10 176.40 1gxy h ALA 41 N 6.15 1.45 -0.82 1.71 0.00 -1.84 -1.89 119.26 124.02 1gxy h ALA 41 Ca 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1gxy h ALA 41 Cb 0.99 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 1gxy h ALA 41 CO 0.26 0.46 0.54 0.87 0.00 0.00 0.00 179.25 181.38 1gxy h LYS 42 N 1.10 1.07 -0.64 0.00 1.57 -1.94 -1.84 116.57 115.89 1gxy h LYS 42 Ca 0.35 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.99 1gxy h LYS 42 Cb 0.03 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.07 1gxy h LYS 42 CO -0.11 0.71 0.11 1.25 -0.57 0.00 0.00 179.45 180.84 1gxy h LEU 43 N 1.11 1.01 -0.54 2.94 5.85 -1.74 -0.66 115.31 123.27 1gxy h LEU 43 Ca 0.30 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1gxy h LEU 43 Cb -0.13 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.61 1gxy h LEU 43 CO -0.06 1.01 0.35 0.50 -0.34 0.00 0.00 178.44 179.90 1gxy h LYS 44 N 0.97 0.71 -0.27 1.25 3.64 -0.81 0.16 116.57 122.22 1gxy h LYS 44 Ca 0.19 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1gxy h LYS 44 Cb 0.43 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1gxy h LYS 44 CO 0.01 0.48 0.03 0.28 -2.27 0.00 0.00 179.45 177.98 1gxy h VAL 45 N 0.73 1.24 -0.58 2.00 2.07 -1.20 -2.26 116.25 118.25 1gxy h VAL 45 Ca 0.20 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.95 1gxy h VAL 45 Cb -0.08 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.90 1gxy h VAL 45 CO -0.04 0.27 0.28 0.00 0.02 0.00 0.00 177.57 178.10 1gxy h ALA 46 N 0.85 0.75 -0.49 1.67 0.00 -0.76 -1.74 119.26 119.55 1gxy h ALA 46 Ca 0.08 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gxy h ALA 46 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1gxy h ALA 46 CO 0.01 -0.08 0.30 2.35 0.00 0.00 0.00 179.25 181.83 1gxy h TRP 47 N 0.53 0.63 -0.97 0.00 2.91 -0.57 -1.43 115.95 117.05 1gxy h TRP 47 Ca 0.27 0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.31 1gxy h TRP 47 Cb 0.21 -0.21 -0.05 0.00 -0.51 0.00 0.00 29.16 28.60 1gxy h TRP 47 CO -0.11 0.43 0.64 0.93 -1.03 0.00 0.00 178.44 179.30 1gxy h GLU 48 N 0.65 1.24 -0.47 2.65 5.08 -0.87 0.17 114.58 123.03 1gxy h GLU 48 Ca 0.18 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.35 1gxy h GLU 48 Cb -0.03 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 28.93 1gxy h GLU 48 CO -0.03 0.82 -0.15 0.93 -1.00 0.00 0.00 179.01 179.58 1gxy h GLU 49 N 1.28 0.93 -0.08 2.33 5.08 -1.02 -2.62 114.58 120.47 1gxy h GLU 49 Ca 0.37 -0.37 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1gxy h GLU 49 Cb -0.09 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1gxy h GLU 49 CO -0.10 1.03 -0.45 0.00 -1.00 0.00 0.00 179.01 178.49 1gxy h ALA 50 N 0.87 1.09 -0.53 3.43 0.00 -0.67 -2.44 119.26 121.01 1gxy h ALA 50 Ca 0.11 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 1gxy h ALA 50 Cb 0.71 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1gxy h ALA 50 CO 0.05 0.61 -0.01 -0.22 0.00 0.00 0.00 179.25 179.69 1gxy h LYS 51 N 0.16 0.90 -0.12 0.00 3.64 -0.52 0.96 116.57 121.59 1gxy h LYS 51 Ca 0.01 -0.26 -0.00 0.00 -1.27 0.00 0.00 60.65 59.12 1gxy h LYS 51 Cb 0.87 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.59 1gxy h LYS 51 CO 0.07 0.90 0.07 0.87 -2.27 0.00 0.00 179.45 179.09 1gxy h LYS 52 N 0.83 0.17 -0.42 1.90 1.79 -1.14 -1.32 116.57 118.38 1gxy h LYS 52 Ca 0.16 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.59 1gxy h LYS 52 Cb 0.50 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 31.10 1gxy h LYS 52 CO 0.02 0.18 0.21 -0.09 -1.08 0.00 0.00 179.45 178.70 1gxy h ARG 53 N 0.11 0.61 -0.73 3.15 9.65 -1.17 -2.70 114.38 123.31 1gxy h ARG 53 Ca 0.04 -0.09 0.04 0.00 -1.10 0.00 0.00 59.98 58.88 1gxy h ARG 53 Cb 0.06 -0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.48 1gxy h ARG 53 CO -0.01 0.52 0.44 2.35 2.80 0.00 0.00 179.97 186.08 1gxy h TRP 54 N 0.54 0.83 -0.03 2.20 2.91 -0.64 -1.62 115.95 120.14 1gxy h TRP 54 Ca 0.15 0.02 -0.05 0.00 1.13 0.00 0.00 58.89 60.14 1gxy h TRP 54 Cb 0.11 -0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 28.49 1gxy h TRP 54 CO -0.01 0.44 -0.20 -0.91 -1.03 0.00 0.00 178.44 176.74 1gxy h ASN 55 N 0.84 0.05 0.49 2.65 2.35 -1.06 -0.65 115.58 120.25 1gxy h ASN 55 Ca 0.31 -0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.87 1gxy h ASN 55 Cb 0.09 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1gxy h ASN 55 CO -0.14 0.25 -0.75 0.78 -1.65 0.00 0.00 177.43 175.93 1gxy h ASN 56 N 0.05 0.25 0.21 5.81 2.35 -0.99 -3.36 115.58 119.90 1gxy h ASN 56 Ca 0.01 -0.18 -0.03 0.00 -0.55 0.00 0.00 56.30 55.56 1gxy h ASN 56 Cb 0.38 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1gxy h ASN 56 CO 0.03 0.91 -1.82 2.30 -1.65 0.00 0.00 177.43 177.20 1gxy n ILE 57 N -3.76 0.23 0.24 2.81 -5.35 -0.88 -4.54 119.36 108.12 1gxy n ILE 57 Ca -0.03 -0.54 0.07 0.00 -0.27 0.00 0.00 62.75 61.99 1gxy n ILE 57 Cb 0.72 -0.11 0.59 0.00 -1.74 0.00 0.00 39.64 39.10 1gxy n ILE 57 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 1gxy h LYS 58 N 0.00 0.00 0.00 6.28 2.10 -1.27 -2.63 116.57 121.05 1gxy h LYS 58 Ca -0.04 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1gxy h LYS 58 Cb 1.09 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.42 1gxy h LYS 58 CO 0.00 0.12 -0.02 -1.35 -2.00 0.00 0.00 179.45 176.20 1gxy h PRO 59 N 0.00 0.00 0.00 0.07 0.11 -1.80 -3.29 132.00 127.10 1gxy h PRO 59 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1gxy h PRO 59 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 1gxy h PRO 59 CO 0.02 0.02 0.00 -1.13 -0.21 0.00 0.00 178.00 176.69 1gxy n SER 60 N -3.29 0.00 -1.69 -2.05 3.41 -0.99 -4.90 113.62 104.10 1gxy n SER 60 Ca -0.02 0.95 0.00 0.00 -0.26 0.00 0.00 58.87 59.54 1gxy n SER 60 Cb 0.13 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 1gxy n SER 60 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1gxy n ARG 61 N -2.24 2.02 -3.76 4.33 5.12 -1.24 -5.16 116.66 115.73 1gxy n ARG 61 Ca 0.00 0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.70 1gxy n ARG 61 Cb 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.26 1gxy n ARG 61 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1gxy s SER 62 N -0.78 4.83 0.13 0.55 1.04 -1.26 -4.99 113.70 113.22 1gxy s SER 62 Ca 0.00 -0.88 0.01 0.00 0.48 0.00 0.00 55.95 55.55 1gxy s SER 62 Cb 0.00 -0.47 -0.04 0.00 0.10 0.00 0.00 66.02 65.60 1gxy s SER 62 CO 0.00 -0.65 0.00 -0.31 0.98 0.00 0.00 173.24 173.26 1gxy s TYR 63 N -2.53 0.97 0.70 5.02 1.51 -1.26 -5.14 117.35 116.61 1gxy s TYR 63 Ca 0.45 -1.07 -0.16 0.00 -1.01 0.00 0.00 57.07 55.28 1gxy s TYR 63 Cb -0.01 -0.56 -0.02 0.00 -0.11 0.00 0.00 41.96 41.26 1gxy s TYR 63 CO 0.26 -0.31 0.79 -2.30 -1.11 0.00 0.00 175.55 172.88 1gxy n PRO 64 N -0.12 0.47 -1.80 -1.71 -0.02 -1.26 -4.86 135.00 125.70 1gxy n PRO 64 Ca -0.08 0.21 -0.42 0.00 -2.02 0.00 0.00 63.50 61.19 1gxy n PRO 64 Cb 0.63 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 32.02 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 -3.01 4.15 0.00 -0.52 3.01 -1.26 -1.69 119.74 120.42 1gxy s LYS 65 Ca 0.71 2.52 0.00 0.00 -1.01 0.00 0.00 55.97 58.19 1gxy s LYS 65 Cb -0.36 -3.09 0.00 0.00 -1.01 0.00 0.00 37.83 33.37 1gxy s LYS 65 CO 0.53 -0.69 0.00 0.41 0.51 0.00 0.00 175.35 176.11 1gxy n GLY 66 N 3.65 1.48 3.66 -3.33 0.00 -1.26 -5.04 105.19 104.35 1gxy n GLY 66 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 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 -2.34 3.01 0.12 1.61 2.19 -0.68 -5.02 117.98 116.86 1gxy s PHE 67 Ca 0.00 1.15 0.00 0.00 0.33 0.00 0.00 56.93 58.41 1gxy s PHE 67 Cb 0.00 -3.44 -0.00 0.00 -1.31 0.00 0.00 43.02 38.27 1gxy s PHE 67 CO 0.00 -1.35 0.02 0.27 1.83 0.00 0.00 175.22 175.98 1gxy n ASN 68 N 6.34 1.78 0.18 6.13 0.23 -1.26 -4.90 115.26 123.76 1gxy n ASN 68 Ca 0.13 -1.56 0.08 0.00 -0.53 0.00 0.00 54.58 52.71 1gxy n ASN 68 Cb 0.45 0.16 0.60 0.00 -2.08 0.00 0.00 39.78 38.91 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 0.35 0.10 -0.51 0.53 3.32 -1.99 -1.63 116.42 116.59 1gxy h ASP 69 Ca -0.10 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.86 1gxy h ASP 69 Cb 0.32 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 1gxy h ASP 69 CO 0.16 0.07 -0.01 -0.26 -1.72 0.00 0.00 179.24 177.47 1gxy h PHE 70 N 0.12 1.04 -0.03 4.55 0.04 -1.98 -0.77 116.94 119.90 1gxy h PHE 70 Ca 0.06 -0.17 -0.01 0.00 2.80 0.00 0.00 57.97 60.64 1gxy h PHE 70 Cb 0.08 -0.27 -0.00 0.00 2.20 0.00 0.00 35.95 37.96 1gxy h PHE 70 CO -0.00 0.93 -0.04 0.45 -0.60 0.00 0.00 178.31 179.06 1gxy h HIS 71 N 0.88 0.10 -0.66 -0.55 3.86 -1.59 -1.21 115.15 115.99 1gxy h HIS 71 Ca 0.16 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 1gxy h HIS 71 Cb 0.53 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.95 1gxy h HIS 71 CO 0.03 0.57 0.37 0.78 0.86 0.00 0.00 177.93 180.55 1gxy h GLY 72 N -0.40 0.98 1.02 2.45 0.00 -1.38 -2.31 103.07 103.43 1gxy h GLY 72 Ca 0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 1gxy h GLY 72 CO 0.01 0.41 0.07 -0.84 0.00 0.00 0.00 176.54 176.19 1gxy h THR 73 N 0.90 1.26 -0.64 4.70 2.02 -1.16 -2.35 112.91 117.64 1gxy h THR 73 Ca 0.23 -1.01 0.01 0.00 0.77 0.00 0.00 66.41 66.41 1gxy h THR 73 Cb 0.02 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 1gxy h THR 73 CO -0.04 0.36 0.42 0.00 0.37 0.00 0.00 175.52 176.64 1gxy h ALA 74 N 0.99 0.81 -0.10 6.16 0.00 -0.97 -0.55 119.26 125.61 1gxy h ALA 74 Ca 0.17 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gxy h ALA 74 Cb 0.44 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1gxy h ALA 74 CO 0.01 0.24 0.05 -0.07 0.00 0.00 0.00 179.25 179.48 1gxy h LEU 75 N 0.86 0.12 -0.37 0.00 3.38 -1.31 -1.44 115.31 116.56 1gxy h LEU 75 Ca 0.23 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.15 1gxy h LEU 75 Cb -0.10 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1gxy h LEU 75 CO -0.05 0.17 0.17 0.58 0.09 0.00 0.00 178.44 179.40 1gxy h VAL 76 N 0.06 0.95 -0.94 1.22 2.07 -1.23 -2.05 116.25 116.33 1gxy h VAL 76 Ca 0.03 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.52 1gxy h VAL 76 Cb 0.08 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 30.35 1gxy h VAL 76 CO -0.01 0.06 0.60 0.00 0.02 0.00 0.00 177.57 178.25 1gxy h ALA 77 N 1.21 1.55 0.00 1.67 0.00 -0.82 -0.44 119.26 122.43 1gxy h ALA 77 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1gxy h ALA 77 Cb 0.10 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1gxy h ALA 77 CO -0.13 0.27 -0.14 -0.92 0.00 0.00 0.00 179.25 178.33 1gxy h TYR 78 N 0.99 0.00 0.00 0.00 3.20 -0.53 -0.76 116.97 119.87 1gxy h TYR 78 Ca 0.43 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.30 1gxy h TYR 78 Cb 0.34 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.61 1gxy h TYR 78 CO -0.00 0.14 0.00 0.25 -1.64 0.00 0.00 178.16 176.91 1gxy n THR 79 N -4.02 0.00 -2.76 1.81 -2.24 -0.18 -4.39 114.28 102.50 1gxy n THR 79 Ca -0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.76 1gxy n THR 79 Cb 0.22 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 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 0.98 2.62 0.29 3.38 0.00 -0.29 -4.67 105.19 107.50 1gxy n GLY 80 Ca 0.23 -2.10 0.18 0.00 0.00 0.00 0.00 46.02 44.34 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 0.58 1.61 4.64 -1.88 -2.96 113.55 115.54 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 0.00 0.00 -0.29 -0.87 0.00 0.00 176.83 175.67 1gxy h ILE 82 N 0.00 0.00 -0.89 0.95 6.09 -1.90 -3.19 117.51 118.57 1gxy h ILE 82 Ca -0.00 -0.21 0.09 0.00 -1.37 0.00 0.00 64.86 63.37 1gxy h ILE 82 Cb 0.40 0.92 -0.07 0.00 0.47 0.00 0.00 36.82 38.54 1gxy h ILE 82 CO 0.00 0.00 0.54 0.00 -3.07 0.00 0.00 178.15 175.62 1gxy h ALA 83 N 2.17 1.28 -0.09 0.18 0.00 -1.72 -1.06 119.26 120.02 1gxy h ALA 83 Ca 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1gxy h ALA 83 Cb 0.29 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1gxy h ALA 83 CO 0.00 0.21 0.05 0.28 0.00 0.00 0.00 179.25 179.79 1gxy h VAL 84 N 0.92 1.05 -0.26 0.00 2.07 -1.82 0.20 116.25 118.41 1gxy h VAL 84 Ca 0.42 -0.14 -0.16 0.00 0.82 0.00 0.00 66.70 67.65 1gxy h VAL 84 Cb 0.33 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1gxy h VAL 84 CO -0.23 0.05 -0.47 -0.78 0.02 0.00 0.00 177.57 176.16 1gxy h ASP 85 N 0.08 0.76 -0.13 0.57 1.82 -1.73 -1.86 116.42 115.93 1gxy h ASP 85 Ca 0.03 -0.37 -0.01 0.00 -0.39 0.00 0.00 57.03 56.28 1gxy h ASP 85 Cb 0.03 -0.22 -0.01 0.00 0.68 0.00 0.00 39.33 39.82 1gxy h ASP 85 CO -0.01 1.11 0.03 0.15 -1.61 0.00 0.00 179.24 178.92 1gxy h PHE 86 N 0.56 0.21 -0.91 0.28 3.57 -1.08 0.18 116.94 119.76 1gxy h PHE 86 Ca 0.03 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.53 1gxy h PHE 86 Cb 1.03 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 1gxy h PHE 86 CO 0.05 0.35 0.60 -0.91 -2.23 0.00 0.00 178.31 176.17 1gxy h ASN 87 N 0.01 1.00 -0.13 0.41 -0.26 -0.55 -1.13 115.58 114.93 1gxy h ASN 87 Ca 0.04 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.75 1gxy h ASN 87 Cb 0.25 -0.24 -0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1gxy h ASN 87 CO -0.00 0.70 0.02 -0.09 -1.06 0.00 0.00 177.43 177.00 1gxy h ARG 88 N 1.17 0.21 -0.86 0.81 2.43 -1.00 -0.87 114.38 116.27 1gxy h ARG 88 Ca 0.35 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.53 1gxy h ARG 88 Cb -0.03 -0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.43 1gxy h ARG 88 CO -0.10 0.39 0.53 0.00 -1.51 0.00 0.00 179.97 179.28 1gxy h ALA 89 N 0.81 1.18 -0.09 2.80 0.00 -0.54 -0.66 119.26 122.75 1gxy h ALA 89 Ca 0.04 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1gxy h ALA 89 Cb 0.28 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1gxy h ALA 89 CO 0.00 0.26 -0.06 0.28 0.00 0.00 0.00 179.25 179.73 1gxy h VAL 90 N 0.95 1.34 -0.78 0.00 2.07 -1.09 -2.47 116.25 116.27 1gxy h VAL 90 Ca 0.38 -1.13 0.08 0.00 0.82 0.00 0.00 66.70 66.85 1gxy h VAL 90 Cb 0.19 1.89 -0.07 0.00 -1.52 0.00 0.00 31.29 31.79 1gxy h VAL 90 CO -0.18 0.32 0.44 -0.09 0.02 0.00 0.00 177.57 178.08 1gxy h ARG 91 N -0.18 0.74 -0.63 1.57 2.43 -0.68 -1.52 114.38 116.11 1gxy h ARG 91 Ca 0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1gxy h ARG 91 Cb 0.53 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1gxy h ARG 91 CO 0.02 0.49 0.00 0.39 -1.51 0.00 0.00 179.97 179.36 1gxy n GLU 92 N -4.76 4.38 0.09 0.20 1.02 -0.30 -3.73 120.64 117.55 1gxy n GLU 92 Ca 0.12 -2.80 -0.15 0.00 -0.02 0.00 0.00 57.16 54.31 1gxy n GLU 92 Cb 0.25 -2.15 -0.08 0.00 -0.02 0.00 0.00 31.44 29.44 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 3.62 -1.28 -0.53 -0.32 3.57 -1.00 -2.55 116.94 118.44 1gxy h PHE 93 Ca 0.00 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.62 1gxy h PHE 93 Cb 1.77 0.55 -0.03 0.00 2.79 0.00 0.00 35.95 41.03 1gxy h PHE 93 CO 0.95 -0.53 0.36 -0.22 -2.23 0.00 0.00 178.31 176.64 1gxy h LYS 94 N -0.65 0.38 -0.06 1.11 3.64 -1.38 -0.33 116.57 119.27 1gxy h LYS 94 Ca 0.02 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1gxy h LYS 94 Cb 0.69 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.42 1gxy h LYS 94 CO -0.28 0.25 -0.28 0.93 -2.27 0.00 0.00 179.45 177.79 1gxy h GLU 95 N 0.39 0.11 -0.48 1.90 5.08 -1.70 -3.38 114.58 116.50 1gxy h GLU 95 Ca 0.24 -0.04 -0.22 0.00 -1.00 0.00 0.00 59.36 58.34 1gxy h GLU 95 Cb 0.44 -0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.52 1gxy h GLU 95 CO -0.06 0.40 -0.53 0.27 -1.00 0.00 0.00 179.01 178.09 1gxy n ASN 96 N -4.16 -2.92 0.32 1.42 2.04 -0.65 -5.01 115.26 106.30 1gxy n ASN 96 Ca -0.02 -3.13 0.19 0.00 -0.44 0.00 0.00 54.58 51.19 1gxy n ASN 96 Cb 0.36 1.65 1.08 0.00 -2.53 0.00 0.00 39.78 40.34 1gxy n ASN 96 CO 0.00 0.00 0.00 1.55 -0.44 0.00 0.00 177.26 178.37 1gxy h PRO 97 N 4.38 0.00 0.00 -0.53 0.13 -1.29 -2.34 132.00 132.34 1gxy h PRO 97 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1gxy h PRO 97 Cb 1.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1gxy h PRO 97 CO 0.23 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.41 1gxy n GLY 98 N -1.13 -1.19 1.18 1.56 0.00 -1.26 -2.69 105.19 101.66 1gxy n GLY 98 Ca -0.03 0.12 0.02 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.26 2.71 -3.14 1.61 1.13 -0.88 -4.89 117.38 111.66 1gxy n GLN 99 Ca 0.01 -2.99 -0.46 0.00 -1.94 0.00 0.00 57.00 51.63 1gxy n GLN 99 Cb 0.19 -1.91 -0.02 0.00 0.11 0.00 0.00 30.24 28.61 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 -2.99 3.46 -0.92 1.08 5.36 -1.09 -4.90 117.98 117.97 1gxy s PHE 100 Ca 0.45 -1.70 -0.02 0.00 -0.96 0.00 0.00 56.93 54.71 1gxy s PHE 100 Cb 0.38 -4.03 0.34 0.00 -0.34 0.00 0.00 43.02 39.36 1gxy s PHE 100 CO 0.07 -1.22 1.95 0.72 -1.46 0.00 0.00 175.22 175.28 1gxy n HIS 101 N 5.19 2.90 -2.38 10.12 8.25 -1.26 -4.09 115.22 133.95 1gxy n HIS 101 Ca 0.18 -2.42 0.02 0.00 -0.26 0.00 0.00 57.72 55.24 1gxy n HIS 101 Cb 0.48 -1.19 0.00 0.00 1.12 0.00 0.00 29.99 30.40 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 -0.35 0.00 -0.03 4.41 4.01 -1.26 -4.80 117.16 119.15 1gxy n TYR 102 Ca 0.51 -0.48 -0.08 0.00 -0.16 0.00 0.00 57.90 57.69 1gxy n TYR 102 Cb 0.24 -0.01 -0.02 0.00 -0.31 0.00 0.00 39.34 39.24 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 0.75 -0.16 0.14 -0.72 1.57 -1.89 0.06 116.57 116.33 1gxy h LYS 103 Ca -0.29 0.01 -0.28 0.00 -1.87 0.00 0.00 60.65 58.22 1gxy h LYS 103 Cb 1.77 0.04 0.01 0.00 0.08 0.00 0.00 32.23 34.13 1gxy h LYS 103 CO 0.02 -0.10 -1.29 0.00 -0.57 0.00 0.00 179.45 177.50 1gxy h ALA 104 N 0.95 0.07 -0.45 3.86 0.00 -1.88 -3.16 119.26 118.65 1gxy h ALA 104 Ca 0.11 -0.90 0.03 0.00 0.00 0.00 0.00 54.91 54.15 1gxy h ALA 104 Cb 0.33 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1gxy h ALA 104 CO -0.28 0.95 0.24 0.35 0.00 0.00 0.00 179.25 180.51 1gxy h PHE 105 N 0.08 0.45 -0.77 0.00 3.57 -1.88 0.13 116.94 118.53 1gxy h PHE 105 Ca -0.16 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.37 1gxy h PHE 105 Cb 2.00 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 40.56 1gxy h PHE 105 CO 0.07 0.24 0.50 1.25 -2.23 0.00 0.00 178.31 178.15 1gxy h HIS 106 N 0.49 0.97 0.02 0.41 2.76 -1.07 -1.32 115.15 117.41 1gxy h HIS 106 Ca 0.19 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.38 1gxy h HIS 106 Cb 0.07 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.70 1gxy h HIS 106 CO -0.09 0.62 -0.01 -0.92 -1.30 0.00 0.00 177.93 176.23 1gxy h TYR 107 N 1.04 -0.02 -0.73 5.26 3.20 -1.33 -1.18 116.97 123.21 1gxy h TYR 107 Ca 0.28 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.13 1gxy h TYR 107 Cb -0.11 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.14 1gxy h TYR 107 CO -0.02 0.13 0.37 1.88 -1.64 0.00 0.00 178.16 178.88 1gxy h TYR 108 N -0.18 1.01 -0.38 -3.82 0.05 -0.76 0.18 116.97 113.08 1gxy h TYR 108 Ca -0.00 -0.03 -0.10 0.00 0.05 0.00 0.00 58.73 58.65 1gxy h TYR 108 Cb 0.17 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.58 1gxy h TYR 108 CO -0.03 0.72 -0.16 1.25 -1.05 0.00 0.00 178.16 178.90 1gxy h LEU 109 N 1.02 0.79 -0.27 3.88 5.85 -1.17 0.68 115.31 126.10 1gxy h LEU 109 Ca 0.25 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 1gxy h LEU 109 Cb 0.07 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1gxy h LEU 109 CO -0.04 1.01 0.11 0.74 -0.34 0.00 0.00 178.44 179.92 1gxy h THR 110 N 0.57 1.17 -0.59 1.05 2.02 -0.82 -1.88 112.91 114.42 1gxy h THR 110 Ca 0.09 -0.50 -0.05 0.00 0.77 0.00 0.00 66.41 66.72 1gxy h THR 110 Cb 0.70 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 1gxy h THR 110 CO 0.05 0.17 0.16 -0.09 0.37 0.00 0.00 175.52 176.18 1gxy h ARG 111 N 0.29 0.90 -0.31 6.66 9.65 -0.54 -1.02 114.38 130.01 1gxy h ARG 111 Ca 0.09 -0.18 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1gxy h ARG 111 Cb 0.16 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.59 1gxy h ARG 111 CO -0.01 0.79 0.20 0.00 2.80 0.00 0.00 179.97 183.76 1gxy h ALA 112 N 1.31 0.39 -0.56 2.80 0.00 -0.59 -0.86 119.26 121.75 1gxy h ALA 112 Ca 0.19 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1gxy h ALA 112 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1gxy h ALA 112 CO -0.00 -0.15 0.18 1.25 0.00 0.00 0.00 179.25 180.53 1gxy h LEU 113 N 0.42 0.80 -0.71 0.00 6.46 -0.91 -2.28 115.31 119.10 1gxy h LEU 113 Ca 0.11 -0.20 -0.02 0.00 -0.12 0.00 0.00 57.88 57.65 1gxy h LEU 113 Cb -0.04 -0.21 -0.03 0.00 -0.73 0.00 0.00 40.66 39.64 1gxy h LEU 113 CO -0.03 0.79 0.36 1.56 -0.62 0.00 0.00 178.44 180.50 1gxy h GLN 114 N 0.78 1.00 0.00 1.25 4.20 -0.94 -2.30 115.11 119.10 1gxy h GLN 114 Ca 0.18 -0.13 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1gxy h GLN 114 Cb 0.27 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1gxy h GLN 114 CO -0.01 0.77 -0.34 -0.07 -0.67 0.00 0.00 178.83 178.52 1gxy h LEU 115 N 0.98 0.00 -1.96 1.46 3.38 -1.02 -1.70 115.31 116.45 1gxy h LEU 115 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1gxy h LEU 115 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1gxy h LEU 115 CO -0.03 0.34 0.00 0.18 0.09 0.00 0.00 178.44 179.01 1gxy n LEU 116 N -4.11 2.84 -4.74 1.67 4.77 -0.87 -4.80 117.00 111.76 1gxy n LEU 116 Ca -0.02 -1.44 -0.39 0.00 -0.03 0.00 0.00 56.01 54.14 1gxy n LEU 116 Cb 0.38 -0.52 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 1gxy n LEU 116 CO 0.38 0.42 0.28 -0.44 -1.33 0.00 0.00 177.39 176.70 1gxy s SER 117 N -0.46 6.88 0.00 -1.43 0.01 -0.64 -4.95 113.70 113.10 1gxy s SER 117 Ca 0.24 1.05 0.00 0.00 1.31 0.00 0.00 55.95 58.54 1gxy s SER 117 Cb 0.17 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 64.05 1gxy s SER 117 CO 0.08 0.01 0.00 0.59 0.41 0.00 0.00 173.24 174.34 1gxy n ASN 118 N 3.31 0.43 -0.29 2.44 4.13 -1.26 -5.09 115.26 118.93 1gxy n ASN 118 Ca -0.06 0.00 0.03 0.00 1.68 0.00 0.00 54.58 56.24 1gxy n ASN 118 Cb 0.51 0.00 0.08 0.00 -1.54 0.00 0.00 39.78 38.83 1gxy n ASN 118 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1gxy n GLY 119 N 2.15 3.09 3.78 7.41 0.00 -1.26 -5.05 105.19 115.32 1gxy n GLY 119 Ca 0.00 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 1gxy n GLY 119 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gxy s ASP 120 N -1.17 5.42 0.23 1.61 -0.00 -1.26 -5.04 116.67 116.46 1gxy s ASP 120 Ca 0.13 1.98 0.11 0.00 -0.00 0.00 0.00 52.55 54.77 1gxy s ASP 120 Cb 0.08 -2.55 -0.05 0.00 -0.00 0.00 0.00 42.92 40.40 1gxy s ASP 120 CO 0.07 -1.42 -0.15 0.00 -0.00 0.00 0.00 175.17 173.67 1gxy s HIS 122 N -2.05 1.38 -0.38 0.00 3.76 0.11 -4.98 115.29 113.12 1gxy s HIS 122 Ca 0.27 -0.51 -0.13 0.00 -0.15 0.00 0.00 55.06 54.54 1gxy s HIS 122 Cb -0.07 -0.74 0.02 0.00 1.11 0.00 0.00 32.58 32.90 1gxy s HIS 122 CO 0.15 0.12 0.24 0.45 -0.85 0.00 0.00 174.74 174.85 1gxy s SER 123 N -2.18 5.90 0.34 1.40 0.15 -1.26 -1.45 113.70 116.59 1gxy s SER 123 Ca 0.05 -0.86 0.03 0.00 0.70 0.00 0.00 55.95 55.88 1gxy s SER 123 Cb -0.07 -2.09 -0.04 0.00 -1.71 0.00 0.00 66.02 62.11 1gxy s SER 123 CO 0.03 -0.38 0.12 0.68 1.20 0.00 0.00 173.24 174.89 1gxy s VAL 124 N 1.62 0.65 0.02 4.45 -7.23 0.05 -4.65 120.40 115.31 1gxy s VAL 124 Ca 0.04 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.21 1gxy s VAL 124 Cb -0.19 -2.54 -0.02 0.00 0.56 0.00 0.00 36.38 34.19 1gxy s VAL 124 CO 0.08 0.00 -0.02 -0.31 -0.31 0.00 0.00 175.10 174.54 1gxy s TYR 125 N -3.42 0.20 -0.07 2.82 2.02 -0.12 -0.89 117.35 117.89 1gxy s TYR 125 Ca 0.32 -0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 56.58 1gxy s TYR 125 Cb 0.05 -0.15 0.04 0.00 -0.40 0.00 0.00 41.96 41.51 1gxy s TYR 125 CO 0.16 -0.15 0.14 0.50 -1.57 0.00 0.00 175.55 174.62 1gxy s ARG 126 N -1.17 0.02 -0.00 -0.62 3.52 -0.59 -0.61 118.95 119.51 1gxy s ARG 126 Ca -0.13 0.51 -0.03 0.00 -0.13 0.00 0.00 55.73 55.95 1gxy s ARG 126 Cb -0.08 -0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 32.96 1gxy s ARG 126 CO -0.01 -0.30 0.20 0.20 -0.81 0.00 0.00 175.30 174.58 1gxy s GLY 127 N 2.15 2.19 0.11 8.12 0.00 -1.17 -0.10 107.32 118.61 1gxy s GLY 127 Ca 0.02 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 44.03 1gxy s GLY 127 CO -0.05 -0.64 -0.10 -0.51 0.00 0.00 0.00 173.10 171.80 1gxy s THR 128 N -1.34 1.01 -0.25 0.90 -4.23 0.25 -4.47 115.64 107.51 1gxy s THR 128 Ca 0.28 -1.71 0.21 0.00 -1.18 0.00 0.00 61.69 59.30 1gxy s THR 128 Cb -0.13 -1.45 0.04 0.00 1.34 0.00 0.00 72.50 72.30 1gxy s THR 128 CO 0.19 -0.57 1.13 0.11 -0.54 0.00 0.00 174.62 174.94 1gxy h LYS 129 N 3.45 0.00 -6.00 3.99 1.79 -1.73 -2.56 116.57 115.50 1gxy h LYS 129 Ca -0.37 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 57.50 1gxy h LYS 129 Cb 1.19 0.00 -0.06 0.00 -1.58 0.00 0.00 32.23 31.78 1gxy h LYS 129 CO 0.54 0.07 -0.15 0.99 -1.08 0.00 0.00 179.45 179.83 1gxy s THR 130 N -3.25 4.99 -0.07 -0.16 2.01 -1.26 -3.75 115.64 114.16 1gxy s THR 130 Ca 0.01 0.96 -0.28 0.00 0.31 0.00 0.00 61.69 62.69 1gxy s THR 130 Cb 0.08 -3.78 -0.02 0.00 0.01 0.00 0.00 72.50 68.79 1gxy s THR 130 CO 0.77 0.52 0.92 -0.60 -0.69 0.00 0.00 174.62 175.53 1gxy s ARG 131 N -0.70 4.46 0.02 4.92 6.06 -1.25 -3.32 118.95 129.13 1gxy s ARG 131 Ca 0.25 1.26 0.03 0.00 -2.50 0.00 0.00 55.73 54.77 1gxy s ARG 131 Cb -0.17 -3.50 -0.04 0.00 0.06 0.00 0.00 34.95 31.31 1gxy s ARG 131 CO 0.14 -0.14 -0.02 -0.06 -2.50 0.00 0.00 175.30 172.71 1gxy s PHE 132 N 1.42 3.00 -0.05 5.12 0.40 -1.26 -1.14 117.98 125.46 1gxy s PHE 132 Ca 0.46 0.02 0.05 0.00 -0.60 0.00 0.00 56.93 56.87 1gxy s PHE 132 Cb -0.19 -1.62 -0.01 0.00 0.51 0.00 0.00 43.02 41.71 1gxy s PHE 132 CO 0.21 0.44 -0.22 -1.01 0.70 0.00 0.00 175.22 175.34 1gxy s HIS 133 N -1.10 2.13 -0.11 0.36 3.76 0.37 -4.90 115.29 115.79 1gxy s HIS 133 Ca 0.20 -0.63 -0.13 0.00 -0.15 0.00 0.00 55.06 54.35 1gxy s HIS 133 Cb -0.11 -1.41 -0.05 0.00 1.11 0.00 0.00 32.58 32.12 1gxy s HIS 133 CO 0.11 -0.20 0.29 -0.47 -0.85 0.00 0.00 174.74 173.62 1gxy s TYR 134 N -0.06 3.56 -0.94 1.40 5.04 -1.26 -1.50 117.35 123.58 1gxy s TYR 134 Ca -0.04 0.68 0.13 0.00 -2.44 0.00 0.00 57.07 55.39 1gxy s TYR 134 Cb -0.13 -2.24 0.54 0.00 0.35 0.00 0.00 41.96 40.48 1gxy s TYR 134 CO 0.03 0.45 1.40 0.25 -1.34 0.00 0.00 175.55 176.34 1gxy n THR 135 N 2.78 1.18 -0.02 4.34 -2.24 -1.26 -4.86 114.28 114.21 1gxy n THR 135 Ca -0.14 0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1gxy n THR 135 Cb 0.53 -1.12 0.00 0.00 -2.10 0.00 0.00 70.33 67.63 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 -0.32 0.38 3.49 3.38 0.00 -1.26 -5.05 105.19 105.83 1gxy n GLY 136 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.04 -1.74 0.00 4.61 0.00 -1.26 -5.06 121.76 116.26 1gxy s ALA 137 Ca 0.00 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1gxy s ALA 137 Cb 0.00 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.36 1gxy s ALA 137 CO 0.00 -0.52 0.00 0.41 0.00 0.00 0.00 175.76 175.65 1gxy n GLY 138 N 0.37 0.71 3.90 0.00 0.00 -1.26 -5.03 105.19 103.88 1gxy n GLY 138 Ca -0.16 -1.82 -0.29 0.00 0.00 0.00 0.00 46.02 43.75 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 -1.20 5.37 0.01 1.61 0.01 -1.26 -4.65 113.70 113.58 1gxy s SER 139 Ca 0.00 0.93 0.03 0.00 1.31 0.00 0.00 55.95 58.22 1gxy s SER 139 Cb 0.00 -1.75 -0.01 0.00 0.21 0.00 0.00 66.02 64.47 1gxy s SER 139 CO 0.00 -1.32 -0.10 -0.69 0.41 0.00 0.00 173.24 171.54 1gxy s VAL 140 N -3.26 0.74 -0.01 3.43 1.01 -0.57 -4.56 120.40 117.19 1gxy s VAL 140 Ca 0.57 -0.61 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 1gxy s VAL 140 Cb -0.11 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.61 1gxy s VAL 140 CO 0.49 0.06 0.15 -0.60 0.00 0.00 0.00 175.10 175.20 1gxy s ARG 141 N -0.61 0.44 -0.11 2.72 3.52 0.38 -0.83 118.95 124.47 1gxy s ARG 141 Ca 0.01 -0.29 0.19 0.00 -0.13 0.00 0.00 55.73 55.51 1gxy s ARG 141 Cb -0.05 0.19 -0.27 0.00 -1.56 0.00 0.00 34.95 33.25 1gxy s ARG 141 CO 0.00 -0.10 0.30 1.19 -0.81 0.00 0.00 175.30 175.88 1gxy n PHE 142 N 1.71 0.12 0.00 5.12 3.72 -1.26 -3.62 117.46 123.25 1gxy n PHE 142 Ca -0.21 0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1gxy n PHE 142 Cb 0.56 -0.84 0.00 0.00 -0.94 0.00 0.00 39.48 38.26 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 1.54 1.59 3.83 1.37 0.00 -0.80 -4.80 105.19 107.92 1gxy n GLY 143 Ca -0.20 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.45 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 3.18 0.71 1.61 -2.07 -1.26 -3.91 119.66 117.92 1gxy s GLN 144 Ca 0.00 0.93 -0.14 0.00 -1.82 0.00 0.00 55.36 54.33 1gxy s GLN 144 Cb 0.00 -2.02 0.03 0.00 -1.09 0.00 0.00 33.01 29.92 1gxy s GLN 144 CO 0.00 -0.91 1.13 -0.06 -1.32 0.00 0.00 175.29 174.14 1gxy s PHE 145 N -3.00 2.40 0.04 9.60 0.40 -1.26 -3.39 117.98 122.78 1gxy s PHE 145 Ca 0.58 1.58 0.02 0.00 -0.60 0.00 0.00 56.93 58.51 1gxy s PHE 145 Cb -0.13 -3.24 -0.03 0.00 0.51 0.00 0.00 43.02 40.13 1gxy s PHE 145 CO 0.52 -2.01 -0.07 0.95 0.70 0.00 0.00 175.22 175.31 1gxy s THR 146 N -2.35 0.51 0.44 0.64 -4.23 -0.51 -4.90 115.64 105.24 1gxy s THR 146 Ca 0.68 -1.15 0.08 0.00 -1.18 0.00 0.00 61.69 60.12 1gxy s THR 146 Cb -0.22 -0.68 0.02 0.00 1.34 0.00 0.00 72.50 72.96 1gxy s THR 146 CO 0.45 -0.45 0.60 -0.55 -0.54 0.00 0.00 174.62 174.14 1gxy s SER 147 N -1.71 5.58 0.15 3.99 0.15 -1.26 -0.94 113.70 119.65 1gxy s SER 147 Ca -0.08 -0.43 -0.25 0.00 0.70 0.00 0.00 55.95 55.88 1gxy s SER 147 Cb -0.08 -0.58 0.06 0.00 -1.71 0.00 0.00 66.02 63.71 1gxy s SER 147 CO -0.00 -0.84 0.93 -0.94 1.20 0.00 0.00 173.24 173.59 1gxy s SER 148 N -4.38 -0.21 0.06 5.45 1.04 -0.88 -4.83 113.70 109.95 1gxy s SER 148 Ca 0.56 -0.37 0.05 0.00 0.48 0.00 0.00 55.95 56.66 1gxy s SER 148 Cb -0.10 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 1gxy s SER 148 CO 0.34 -0.91 -0.13 -0.55 0.98 0.00 0.00 173.24 172.97 1gxy s SER 149 N -2.89 1.54 0.53 7.02 0.15 0.22 -0.99 113.70 119.28 1gxy s SER 149 Ca 0.11 -0.55 0.32 0.00 0.70 0.00 0.00 55.95 56.53 1gxy s SER 149 Cb -0.02 -0.06 1.23 0.00 -1.71 0.00 0.00 66.02 65.47 1gxy s SER 149 CO 0.01 -0.06 1.94 -0.07 1.20 0.00 0.00 173.24 176.26 1gxy h LEU 150 N 4.54 0.00 -8.94 3.45 3.38 -1.43 -0.28 115.31 116.03 1gxy h LEU 150 Ca -0.39 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 56.95 1gxy h LEU 150 Cb 1.19 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.79 1gxy h LEU 150 CO 0.41 0.02 -0.24 -0.55 0.09 0.00 0.00 178.44 178.18 1gxy s SER 151 N -5.79 6.25 0.37 -0.43 0.15 -1.26 -4.83 113.70 108.16 1gxy s SER 151 Ca 0.02 0.29 0.13 0.00 0.70 0.00 0.00 55.95 57.09 1gxy s SER 151 Cb 0.09 -2.21 0.72 0.00 -1.71 0.00 0.00 66.02 62.91 1gxy s SER 151 CO 0.56 -0.18 1.82 0.50 1.20 0.00 0.00 173.24 177.14 1gxy h LYS 152 N 8.17 0.00 -0.46 5.44 3.64 -1.94 -2.30 116.57 129.12 1gxy h LYS 152 Ca -0.32 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.99 1gxy h LYS 152 Cb 1.16 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1gxy h LYS 152 CO 0.64 0.38 0.01 -0.22 -2.27 0.00 0.00 179.45 177.99 1gxy h LYS 153 N 0.00 0.81 -0.30 1.90 3.64 -1.96 -1.56 116.57 119.09 1gxy h LYS 153 Ca -0.00 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.12 1gxy h LYS 153 Cb 0.68 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1gxy h LYS 153 CO 0.05 0.86 0.17 0.28 -2.27 0.00 0.00 179.45 178.53 1gxy h VAL 154 N 0.66 1.13 -0.21 2.00 2.07 -1.87 -1.92 116.25 118.11 1gxy h VAL 154 Ca 0.13 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1gxy h VAL 154 Cb 0.48 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1gxy h VAL 154 CO 0.02 0.13 0.11 0.00 0.02 0.00 0.00 177.57 177.85 1gxy h ALA 155 N 1.04 1.79 -0.61 1.67 0.00 -1.23 -2.10 119.26 119.82 1gxy h ALA 155 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1gxy h ALA 155 Cb 0.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1gxy h ALA 155 CO -0.02 0.18 0.00 1.04 0.00 0.00 0.00 179.25 180.45 1gxy n GLN 156 N -4.47 2.47 -1.78 0.00 6.02 -0.60 -3.06 117.38 115.95 1gxy n GLN 156 Ca 0.00 -2.28 -0.33 0.00 -0.01 0.00 0.00 57.00 54.38 1gxy n GLN 156 Cb 0.10 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 29.91 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 -1.06 5.17 0.61 1.08 1.04 -0.75 -4.61 113.70 115.18 1gxy s SER 157 Ca 0.42 1.98 0.29 0.00 0.48 0.00 0.00 55.95 59.13 1gxy s SER 157 Cb 0.22 -2.55 1.56 0.00 0.10 0.00 0.00 66.02 65.36 1gxy s SER 157 CO 0.29 -1.59 1.95 1.56 0.98 0.00 0.00 173.24 176.43 1gxy h GLN 158 N 0.06 0.00 -0.65 4.02 4.20 -1.89 -0.64 115.11 120.21 1gxy h GLN 158 Ca -0.47 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.19 1gxy h GLN 158 Cb 1.24 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.00 1gxy h GLN 158 CO 0.54 0.00 0.19 1.49 -0.67 0.00 0.00 178.83 180.38 1gxy h GLU 159 N 0.00 1.00 0.00 1.46 4.81 -1.91 -3.36 114.58 116.58 1gxy h GLU 159 Ca 0.12 -0.21 -0.14 0.00 -0.13 0.00 0.00 59.36 59.00 1gxy h GLU 159 Cb 0.88 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.09 1gxy h GLU 159 CO -0.00 0.87 -1.59 1.19 -0.73 0.00 0.00 179.01 178.75 1gxy n PHE 160 N -4.26 0.00 -4.40 0.92 3.72 -0.51 -4.99 117.46 107.95 1gxy n PHE 160 Ca 0.05 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.18 1gxy n PHE 160 Cb 0.23 -0.41 -0.12 0.00 -0.94 0.00 0.00 39.48 38.24 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 -2.26 2.36 -0.01 1.38 2.19 -0.36 -2.10 117.98 119.17 1gxy s PHE 161 Ca -0.04 -0.34 -0.11 0.00 0.33 0.00 0.00 56.93 56.77 1gxy s PHE 161 Cb 0.03 -1.19 0.01 0.00 -1.31 0.00 0.00 43.02 40.57 1gxy s PHE 161 CO 0.37 0.47 0.22 0.45 1.83 0.00 0.00 175.22 178.56 1gxy s SER 162 N -2.58 -0.09 0.60 6.13 0.15 -1.25 -4.47 113.70 112.19 1gxy s SER 162 Ca 0.20 -0.03 0.32 0.00 0.70 0.00 0.00 55.95 57.15 1gxy s SER 162 Cb -0.08 0.27 1.89 0.00 -1.71 0.00 0.00 66.02 66.39 1gxy s SER 162 CO 0.10 -0.38 2.25 0.44 1.20 0.00 0.00 173.24 176.85 1gxy h ASP 163 N 4.21 0.00 0.28 5.45 3.32 -1.95 0.30 116.42 128.02 1gxy h ASP 163 Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 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 0.40 0.02 -0.05 1.41 -1.72 0.00 0.00 179.24 179.30 1gxy n HIS 164 N -3.66 0.00 -0.76 4.55 8.25 -1.26 -4.82 115.22 117.52 1gxy n HIS 164 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1gxy n HIS 164 Cb 0.10 -0.14 0.00 0.00 1.12 0.00 0.00 29.99 31.07 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 1.20 2.22 2.99 -1.41 0.00 0.10 -3.83 105.19 106.46 1gxy n GLY 165 Ca 0.17 -1.84 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 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 3.51 0.35 -0.20 2.61 2.01 -0.96 -4.61 115.64 118.36 1gxy s THR 166 Ca 0.00 -0.63 -0.03 0.00 0.31 0.00 0.00 61.69 61.35 1gxy s THR 166 Cb 0.00 -0.38 -0.01 0.00 0.01 0.00 0.00 72.50 72.12 1gxy s THR 166 CO 0.00 -0.19 -0.07 -0.22 -0.69 0.00 0.00 174.62 173.45 1gxy s LEU 167 N -0.87 2.81 -0.19 4.42 2.96 0.26 -0.58 118.68 127.49 1gxy s LEU 167 Ca -0.06 -0.39 -0.13 0.00 -0.22 0.00 0.00 54.13 53.33 1gxy s LEU 167 Cb -0.06 -1.69 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 1gxy s LEU 167 CO -0.00 0.02 0.28 -0.36 -1.32 0.00 0.00 176.35 174.98 1gxy s PHE 168 N 1.20 3.40 -0.31 5.38 0.40 0.86 -1.49 117.98 127.43 1gxy s PHE 168 Ca 0.02 0.50 -0.06 0.00 -0.60 0.00 0.00 56.93 56.79 1gxy s PHE 168 Cb -0.14 -2.37 0.02 0.00 0.51 0.00 0.00 43.02 41.04 1gxy s PHE 168 CO -0.02 0.13 0.08 0.42 0.70 0.00 0.00 175.22 176.53 1gxy s ILE 169 N 0.83 3.83 -0.03 0.64 1.01 -0.20 -1.53 121.20 125.75 1gxy s ILE 169 Ca 0.15 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 59.98 1gxy s ILE 169 Cb -0.13 -3.05 -0.01 0.00 0.01 0.00 0.00 42.46 39.27 1gxy s ILE 169 CO 0.05 -0.01 -0.23 -0.63 0.00 0.00 0.00 174.94 174.12 1gxy s ILE 170 N 1.45 1.80 -0.30 2.92 1.01 -0.07 -0.73 121.20 127.28 1gxy s ILE 170 Ca 0.01 -0.96 -0.07 0.00 0.00 0.00 0.00 60.65 59.63 1gxy s ILE 170 Cb -0.18 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 40.80 1gxy s ILE 170 CO 0.02 0.51 0.08 -0.75 0.00 0.00 0.00 174.94 174.79 1gxy s LYS 171 N -0.41 3.05 0.01 2.79 2.20 -0.43 -0.77 119.74 126.17 1gxy s LYS 171 Ca 0.05 -0.89 0.04 0.00 -0.36 0.00 0.00 55.97 54.82 1gxy s LYS 171 Cb -0.10 -3.36 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 1gxy s LYS 171 CO 0.00 -0.46 -0.11 -0.08 -0.36 0.00 0.00 175.35 174.35 1gxy s THR 172 N 1.48 3.32 0.00 3.43 -1.32 -0.53 -4.36 115.64 117.67 1gxy s THR 172 Ca 0.02 -0.89 0.00 0.00 -1.21 0.00 0.00 61.69 59.61 1gxy s THR 172 Cb -0.17 -2.42 0.00 0.00 -1.51 0.00 0.00 72.50 68.40 1gxy s THR 172 CO 0.02 0.40 0.30 0.00 -2.21 0.00 0.00 174.62 173.13 1gxy n LEU 174 N -0.28 0.66 -4.77 0.00 4.77 -1.26 -4.69 117.00 111.42 1gxy n LEU 174 Ca 0.00 -0.63 -0.34 0.00 -0.03 0.00 0.00 56.01 55.01 1gxy n LEU 174 Cb 0.02 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.13 1gxy n LEU 174 CO 0.00 0.14 0.76 -0.83 -1.33 0.00 0.00 177.39 176.14 1gxy s GLY 175 N -1.40 2.41 -0.05 -0.72 0.00 -1.26 -4.60 107.32 101.69 1gxy s GLY 175 Ca 0.04 0.70 0.05 0.00 0.00 0.00 0.00 44.72 45.51 1gxy s GLY 175 CO 0.24 1.05 -0.21 0.14 0.00 0.00 0.00 173.10 174.32 1gxy s VAL 176 N -2.04 1.74 -0.20 1.40 1.01 0.16 -4.91 120.40 117.56 1gxy s VAL 176 Ca 0.70 -0.89 -0.29 0.00 0.00 0.00 0.00 61.98 61.50 1gxy s VAL 176 Cb -0.22 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 1gxy s VAL 176 CO 0.34 0.49 1.41 -0.47 0.00 0.00 0.00 175.10 176.88 1gxy s TYR 177 N -0.01 2.50 -0.21 5.22 5.04 -1.26 -0.61 117.35 128.01 1gxy s TYR 177 Ca -0.05 0.74 0.13 0.00 -2.44 0.00 0.00 57.07 55.45 1gxy s TYR 177 Cb -0.13 -3.78 0.41 0.00 0.35 0.00 0.00 41.96 38.81 1gxy s TYR 177 CO 0.03 -2.32 1.26 0.44 -1.34 0.00 0.00 175.55 173.63 1gxy n ILE 178 N 5.85 2.21 -0.14 3.14 -5.35 0.07 -4.72 119.36 120.43 1gxy n ILE 178 Ca 0.16 -2.86 0.18 0.00 -0.27 0.00 0.00 62.75 59.95 1gxy n ILE 178 Cb 0.45 -0.26 0.57 0.00 -1.74 0.00 0.00 39.64 38.66 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 0.83 0.28 -0.26 6.28 3.64 -1.89 0.03 116.57 125.47 1gxy h LYS 179 Ca 0.04 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1gxy h LYS 179 Cb 1.15 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 1gxy h LYS 179 CO 0.09 0.18 0.00 0.39 -2.27 0.00 0.00 179.45 177.84 1gxy n GLU 180 N -4.44 1.66 -2.65 1.90 -0.58 -1.26 -3.80 120.64 111.46 1gxy n GLU 180 Ca 0.14 -1.02 -0.10 0.00 -0.42 0.00 0.00 57.16 55.77 1gxy n GLU 180 Cb 0.61 -1.26 0.03 0.00 -0.57 0.00 0.00 31.44 30.25 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 0.30 1.47 -4.00 -0.32 3.72 -0.01 -4.96 117.46 113.67 1gxy n PHE 181 Ca 0.11 -2.70 -0.08 0.00 -0.05 0.00 0.00 57.45 54.73 1gxy n PHE 181 Cb 0.26 -0.32 -0.09 0.00 -0.94 0.00 0.00 39.48 38.38 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 -3.29 0.33 0.40 4.37 0.15 -1.22 -3.00 113.70 111.43 1gxy s SER 182 Ca 0.30 -0.79 0.21 0.00 0.70 0.00 0.00 55.95 56.37 1gxy s SER 182 Cb 0.43 0.23 0.66 0.00 -1.71 0.00 0.00 66.02 65.63 1gxy s SER 182 CO 0.00 -0.59 1.71 -0.26 1.20 0.00 0.00 173.24 175.30 1gxy h PHE 183 N 3.26 0.00 -2.67 3.44 0.04 -1.83 -3.39 116.94 115.78 1gxy h PHE 183 Ca -0.34 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 59.84 1gxy h PHE 183 Cb 1.17 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 38.92 1gxy h PHE 183 CO 0.52 0.29 -0.83 1.03 -0.60 0.00 0.00 178.31 178.72 1gxy s ARG 184 N -3.45 1.08 0.35 1.51 0.52 -1.26 -4.99 118.95 112.71 1gxy s ARG 184 Ca 0.02 -2.00 0.11 0.00 -0.52 0.00 0.00 55.73 53.33 1gxy s ARG 184 Cb 0.09 -1.85 0.87 0.00 0.52 0.00 0.00 34.95 34.58 1gxy s ARG 184 CO 0.67 -1.27 1.81 -1.35 0.02 0.00 0.00 175.30 175.18 1gxy h PRO 185 N 6.29 0.61 0.00 3.54 0.11 -1.77 -1.31 132.00 139.46 1gxy h PRO 185 Ca 0.12 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1gxy h PRO 185 Cb 0.91 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1gxy h PRO 185 CO 0.41 0.40 0.13 0.38 -0.21 0.00 0.00 178.00 179.11 1gxy h ASP 186 N 0.63 0.00 0.87 -2.05 2.03 -1.94 -1.28 116.42 114.68 1gxy h ASP 186 Ca 0.54 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.84 1gxy h ASP 186 Cb 1.02 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.52 1gxy h ASP 186 CO -0.30 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.91 1gxy n GLN 187 N -2.81 0.10 -3.95 4.15 1.13 -0.50 -4.91 117.38 110.60 1gxy n GLN 187 Ca -0.02 0.23 -0.28 0.00 -1.94 0.00 0.00 57.00 54.99 1gxy n GLN 187 Cb 0.18 -1.66 -0.02 0.00 0.11 0.00 0.00 30.24 28.86 1gxy n GLN 187 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1gxy n GLU 188 N -1.84 -2.63 -2.49 -1.09 -0.58 -0.48 -4.52 120.64 107.01 1gxy n GLU 188 Ca 0.04 0.37 -0.40 0.00 -0.42 0.00 0.00 57.16 56.75 1gxy n GLU 188 Cb 0.28 -4.28 -0.04 0.00 -0.57 0.00 0.00 31.44 26.82 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 -6.59 4.63 -0.16 3.49 2.02 -1.26 -1.32 118.70 119.52 1gxy s GLU 189 Ca 0.10 1.78 0.00 0.00 0.02 0.00 0.00 54.97 56.87 1gxy s GLU 189 Cb -0.04 -3.21 0.03 0.00 0.10 0.00 0.00 34.13 31.01 1gxy s GLU 189 CO 0.90 0.19 -0.12 0.08 0.02 0.00 0.00 175.26 176.32 1gxy s VAL 190 N -0.95 1.51 -0.09 2.63 1.01 -0.16 -0.75 120.40 123.60 1gxy s VAL 190 Ca 0.46 -0.69 -0.24 0.00 0.00 0.00 0.00 61.98 61.50 1gxy s VAL 190 Cb -0.31 -1.48 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1gxy s VAL 190 CO 0.39 0.35 0.74 -0.22 0.00 0.00 0.00 175.10 176.37 1gxy s LEU 191 N 1.50 4.28 -0.14 3.92 2.96 0.22 -2.07 118.68 129.34 1gxy s LEU 191 Ca 0.03 1.19 0.00 0.00 -0.22 0.00 0.00 54.13 55.14 1gxy s LEU 191 Cb -0.14 -3.13 -0.01 0.00 0.50 0.00 0.00 46.19 43.41 1gxy s LEU 191 CO -0.10 -0.19 -0.15 -0.63 -1.32 0.00 0.00 176.35 173.97 1gxy s ILE 192 N 1.14 2.80 0.60 6.68 1.01 -0.12 -0.66 121.20 132.66 1gxy s ILE 192 Ca 0.38 -0.74 -0.17 0.00 0.00 0.00 0.00 60.65 60.13 1gxy s ILE 192 Cb -0.18 -2.17 -0.03 0.00 0.01 0.00 0.00 42.46 40.09 1gxy s ILE 192 CO 0.17 0.52 1.10 -2.16 0.00 0.00 0.00 174.94 174.57 1gxy s PRO 193 N 0.59 3.10 0.00 2.79 0.04 -1.26 -1.43 135.00 138.84 1gxy s PRO 193 Ca -0.09 1.42 0.18 0.00 0.04 0.00 0.00 61.00 62.55 1gxy s PRO 193 Cb -0.16 -1.99 0.76 0.00 0.04 0.00 0.00 34.50 33.16 1gxy s PRO 193 CO 0.03 -1.01 1.57 0.41 0.04 0.00 0.00 177.00 178.04 1gxy n GLY 194 N -0.40 -1.11 0.82 0.56 0.00 -1.22 -2.79 105.19 101.06 1gxy n GLY 194 Ca 0.10 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.16 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 -1.50 0.43 -2.87 1.61 0.18 -1.26 -1.90 117.16 111.86 1gxy n TYR 195 Ca 0.04 -0.22 -0.41 0.00 1.88 0.00 0.00 57.90 59.20 1gxy n TYR 195 Cb 0.21 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.13 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 -1.57 4.54 -0.09 -3.48 2.12 -1.12 -2.86 118.70 116.25 1gxy s GLU 196 Ca 0.34 1.20 0.03 0.00 0.36 0.00 0.00 54.97 56.89 1gxy s GLU 196 Cb 0.18 -3.42 -0.02 0.00 0.26 0.00 0.00 34.13 31.14 1gxy s GLU 196 CO 0.26 0.11 -0.17 0.08 -0.54 0.00 0.00 175.26 175.00 1gxy s VAL 197 N 0.52 2.80 -0.30 3.70 1.01 -0.04 -4.48 120.40 123.60 1gxy s VAL 197 Ca 0.44 -0.78 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 1gxy s VAL 197 Cb -0.20 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1gxy s VAL 197 CO 0.25 0.56 0.25 -0.31 0.00 0.00 0.00 175.10 175.84 1gxy s TYR 198 N -0.09 3.22 -0.74 5.22 2.02 -0.01 -0.97 117.35 126.01 1gxy s TYR 198 Ca -0.03 0.09 0.24 0.00 -0.37 0.00 0.00 57.07 57.00 1gxy s TYR 198 Cb -0.14 -2.46 0.29 0.00 -0.40 0.00 0.00 41.96 39.25 1gxy s TYR 198 CO 0.04 -0.24 1.25 1.04 -1.57 0.00 0.00 175.55 176.07 1gxy n GLN 199 N 5.14 0.20 -3.97 -0.62 6.02 -0.70 -1.51 117.38 121.95 1gxy n GLN 199 Ca -0.12 0.03 -0.31 0.00 -0.01 0.00 0.00 57.00 56.59 1gxy n GLN 199 Cb 0.51 -1.60 -0.15 0.00 1.02 0.00 0.00 30.24 30.02 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 -3.13 1.73 -0.03 -1.09 2.20 -0.74 -4.73 119.74 113.95 1gxy s LYS 200 Ca 0.07 -1.19 0.05 0.00 -0.36 0.00 0.00 55.97 54.54 1gxy s LYS 200 Cb 0.15 -2.71 -0.01 0.00 -1.51 0.00 0.00 37.83 33.75 1gxy s LYS 200 CO 0.74 -0.65 -0.19 0.08 -0.36 0.00 0.00 175.35 174.98 1gxy s VAL 201 N 1.27 1.52 -0.05 4.02 1.01 -1.26 0.01 120.40 126.92 1gxy s VAL 201 Ca -0.04 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 1gxy s VAL 201 Cb -0.19 -1.28 0.03 0.00 0.00 0.00 0.00 36.38 34.94 1gxy s VAL 201 CO -0.07 0.43 0.11 -0.60 0.00 0.00 0.00 175.10 174.97 1gxy s ARG 202 N -0.21 0.07 0.05 2.72 3.52 -0.34 -4.88 118.95 119.87 1gxy s ARG 202 Ca 0.02 0.27 -0.24 0.00 -0.13 0.00 0.00 55.73 55.64 1gxy s ARG 202 Cb -0.10 -0.13 -0.06 0.00 -1.56 0.00 0.00 34.95 33.11 1gxy s ARG 202 CO 0.01 -0.12 0.75 0.99 -0.81 0.00 0.00 175.30 176.11 1gxy s THR 203 N 0.84 4.73 -0.05 4.11 2.01 -1.26 -0.38 115.64 125.63 1gxy s THR 203 Ca -0.07 1.59 0.02 0.00 0.31 0.00 0.00 61.69 63.54 1gxy s THR 203 Cb -0.09 -4.09 0.02 0.00 0.01 0.00 0.00 72.50 68.34 1gxy s THR 203 CO -0.04 0.38 -0.09 -1.58 -0.69 0.00 0.00 174.62 172.60 1gxy s GLN 204 N -0.15 1.35 4.72 4.92 0.74 -0.28 -4.96 119.66 126.00 1gxy s GLN 204 Ca 0.37 -0.30 0.00 0.00 0.05 0.00 0.00 55.36 55.48 1gxy s GLN 204 Cb -0.20 -1.17 0.00 0.00 1.10 0.00 0.00 33.01 32.73 1gxy s GLN 204 CO 0.22 0.00 0.00 0.41 -0.55 0.00 0.00 175.29 175.38 1gxy n GLY 205 N 3.83 1.69 0.05 2.59 0.00 -1.26 -2.27 105.19 109.83 1gxy n GLY 205 Ca -0.23 -0.55 0.05 0.00 0.00 0.00 0.00 46.02 45.28 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 6.09 0.00 -2.07 1.61 4.11 -1.26 -4.72 117.16 120.92 1gxy n TYR 206 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1gxy n TYR 206 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.34 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 -1.04 0.13 -4.29 9.48 0.23 -1.25 -5.03 115.26 113.49 1gxy n ASN 207 Ca 0.02 -1.91 -0.30 0.00 -0.53 0.00 0.00 54.58 51.86 1gxy n ASN 207 Cb 0.17 -0.19 -0.16 0.00 -2.08 0.00 0.00 39.78 37.52 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 2.06 -0.05 -3.83 2.02 -0.96 -0.57 118.70 117.37 1gxy s GLU 208 Ca 0.05 -0.90 0.01 0.00 0.02 0.00 0.00 54.97 54.15 1gxy s GLU 208 Cb 0.06 -1.97 0.02 0.00 0.10 0.00 0.00 34.13 32.34 1gxy s GLU 208 CO -0.02 0.53 -0.04 0.42 0.02 0.00 0.00 175.26 176.17 1gxy s ILE 209 N -0.56 0.50 -0.21 -1.63 1.01 -0.56 -1.13 121.20 118.63 1gxy s ILE 209 Ca 0.09 -0.09 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 1gxy s ILE 209 Cb -0.10 -0.54 -0.05 0.00 0.01 0.00 0.00 42.46 41.78 1gxy s ILE 209 CO -0.01 0.22 0.12 -0.36 0.00 0.00 0.00 174.94 174.91 1gxy s PHE 210 N 1.02 3.33 -0.22 3.97 0.40 0.48 -1.03 117.98 125.93 1gxy s PHE 210 Ca -0.10 0.21 -0.01 0.00 -0.60 0.00 0.00 56.93 56.43 1gxy s PHE 210 Cb -0.14 -2.17 0.02 0.00 0.51 0.00 0.00 43.02 41.24 1gxy s PHE 210 CO -0.01 0.17 -0.11 -0.51 0.70 0.00 0.00 175.22 175.47 1gxy s LEU 211 N 0.58 2.73 0.00 -0.37 1.43 0.09 -1.20 118.68 121.94 1gxy s LEU 211 Ca 0.06 -0.70 0.06 0.00 -1.03 0.00 0.00 54.13 52.52 1gxy s LEU 211 Cb -0.12 -1.61 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 1gxy s LEU 211 CO 0.00 -0.06 0.22 -0.67 0.23 0.00 0.00 176.35 176.07 1gxy n ASP 212 N 4.67 -0.29 -3.79 2.29 -0.08 0.10 -1.31 116.55 118.14 1gxy n ASP 212 Ca -0.18 -2.83 -0.31 0.00 -1.51 0.00 0.00 54.79 49.96 1gxy n ASP 212 Cb 0.49 1.31 0.02 0.00 2.34 0.00 0.00 41.12 45.28 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 -1.85 -3.67 -4.78 1.67 7.64 -1.26 -1.79 113.62 109.57 1gxy n SER 213 Ca 0.05 -1.03 -0.34 0.00 1.01 0.00 0.00 58.87 58.56 1gxy n SER 213 Cb 0.51 -3.18 0.01 0.00 -1.01 0.00 0.00 64.21 60.53 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 -6.25 3.26 0.01 1.43 0.04 -1.26 -1.72 135.00 130.51 1gxy s PRO 214 Ca 0.33 1.41 -0.24 0.00 0.04 0.00 0.00 61.00 62.54 1gxy s PRO 214 Cb -0.12 -2.01 0.05 0.00 0.04 0.00 0.00 34.50 32.46 1gxy s PRO 214 CO 0.88 -0.88 0.54 -1.59 0.04 0.00 0.00 177.00 175.98 1gxy s LYS 215 N -3.70 0.99 0.22 4.56 -2.85 -0.15 -4.90 119.74 113.92 1gxy s LYS 215 Ca 0.68 -0.09 -0.29 0.00 -1.00 0.00 0.00 55.97 55.27 1gxy s LYS 215 Cb -0.20 0.46 -0.09 0.00 -2.06 0.00 0.00 37.83 35.94 1gxy s LYS 215 CO 0.32 -0.34 0.91 0.50 0.10 0.00 0.00 175.35 176.84 1gxy s ARG 216 N -1.93 4.79 -0.01 1.78 3.52 -1.26 -0.86 118.95 124.98 1gxy s ARG 216 Ca -0.08 1.42 0.01 0.00 -0.13 0.00 0.00 55.73 56.95 1gxy s ARG 216 Cb -0.01 -3.28 0.00 0.00 -1.56 0.00 0.00 34.95 30.10 1gxy s ARG 216 CO 0.02 0.52 -0.03 0.21 -0.81 0.00 0.00 175.30 175.21 1gxy s LYS 217 N -1.12 0.36 0.26 5.12 2.20 -1.13 -4.92 119.74 120.50 1gxy s LYS 217 Ca 0.40 -0.11 -0.30 0.00 -0.36 0.00 0.00 55.97 55.60 1gxy s LYS 217 Cb -0.25 -0.37 -0.14 0.00 -1.51 0.00 0.00 37.83 35.55 1gxy s LYS 217 CO 0.31 0.05 1.23 1.17 -0.36 0.00 0.00 175.35 177.74 1gxy n LYS 218 N 3.21 1.70 -2.16 4.03 4.81 -1.26 -4.89 118.16 123.60 1gxy n LYS 218 Ca -0.16 0.60 -0.28 0.00 -0.87 0.00 0.00 58.31 57.60 1gxy n LYS 218 Cb 0.57 -2.13 0.04 0.00 0.02 0.00 0.00 35.03 33.53 1gxy n LYS 218 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1gxy s SER 219 N -0.12 5.47 0.12 3.14 0.01 -1.26 -5.00 113.70 116.06 1gxy s SER 219 Ca 0.64 0.88 -0.01 0.00 1.31 0.00 0.00 55.95 58.77 1gxy s SER 219 Cb -0.69 -1.77 -0.13 0.00 0.21 0.00 0.00 66.02 63.65 1gxy s SER 219 CO 0.56 -1.23 1.28 0.78 0.41 0.00 0.00 173.24 175.04 1gxy h ASN 220 N -0.42 0.35 -3.57 2.44 2.35 -1.92 -3.44 115.58 111.37 1gxy h ASN 220 Ca -0.45 -0.32 -0.67 0.00 -0.55 0.00 0.00 56.30 54.31 1gxy h ASN 220 Cb 1.26 -0.11 -0.17 0.00 0.05 0.00 0.00 38.32 39.35 1gxy h ASN 220 CO 0.62 1.17 -0.70 -0.31 -1.65 0.00 0.00 177.43 176.56 1gxy s TYR 221 N -3.01 2.91 -0.15 1.19 2.02 -1.26 -5.08 117.35 113.97 1gxy s TYR 221 Ca -0.04 -0.03 -0.06 0.00 -0.37 0.00 0.00 57.07 56.57 1gxy s TYR 221 Cb 0.09 -1.61 0.07 0.00 -0.40 0.00 0.00 41.96 40.10 1gxy s TYR 221 CO 0.85 0.39 0.33 1.21 -1.57 0.00 0.00 175.55 176.76 1gxy s ASN 222 N -1.48 -0.11 -1.51 2.29 2.47 -1.26 -4.00 114.94 111.35 1gxy s ASN 222 Ca 0.18 0.74 -0.13 0.00 0.42 0.00 0.00 52.86 54.07 1gxy s ASN 222 Cb -0.11 0.81 0.09 0.00 -1.45 0.00 0.00 41.25 40.59 1gxy s ASN 222 CO 0.08 -0.21 0.84 0.00 -3.72 0.00 0.00 177.10 174.09 1gxy h LEU 224 N -1.76 0.53 -3.49 0.00 5.85 -2.01 -2.73 115.31 111.70 1gxy h LEU 224 Ca -0.55 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.21 1gxy h LEU 224 Cb 1.36 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1gxy h LEU 224 CO 0.65 0.33 0.00 -1.22 -0.34 0.00 0.00 178.44 177.86 1gxy n TYR 225 N -4.81 1.77 2.00 1.25 4.01 -1.26 -5.27 117.16 114.86 1gxy n TYR 225 Ca 0.09 -0.77 0.16 0.00 -0.16 0.00 0.00 57.90 57.22 1gxy n TYR 225 Cb 0.21 -0.46 0.95 0.00 -0.31 0.00 0.00 39.34 39.73 1gxy n TYR 225 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27