#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hqs n ALA 2 N 0.00 0.00 -0.06 3.04 0.00 -1.26 -4.82 120.51 117.41 1hqs n ALA 2 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1hqs n ALA 2 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1hqs n ALA 2 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1hqs h GLN 3 N 0.00 0.33 -6.65 0.00 4.20 -2.06 -3.44 115.11 107.49 1hqs h GLN 3 Ca 0.00 -0.09 -0.51 0.00 0.06 0.00 0.00 58.65 58.11 1hqs h GLN 3 Cb 0.00 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.73 1hqs h GLN 3 CO 0.00 0.50 0.02 0.20 -0.67 0.00 0.00 178.83 178.88 1hqs s GLY 4 N -2.99 2.17 0.26 3.46 0.00 -1.26 -4.94 107.32 104.02 1hqs s GLY 4 Ca -0.14 -0.17 0.11 0.00 0.00 0.00 0.00 44.72 44.52 1hqs s GLY 4 CO 0.72 0.00 -0.18 -0.54 0.00 0.00 0.00 173.10 173.10 1hqs s GLU 5 N -3.21 1.58 0.09 2.90 0.41 -0.10 -4.89 118.70 115.48 1hqs s GLU 5 Ca 0.50 -1.72 -0.26 0.00 -0.41 0.00 0.00 54.97 53.09 1hqs s GLU 5 Cb -0.11 -1.57 -0.06 0.00 -1.78 0.00 0.00 34.13 30.61 1hqs s GLU 5 CO 0.23 0.28 0.79 -1.59 -0.49 0.00 0.00 175.26 174.49 1hqs s LYS 6 N -3.55 4.55 0.44 1.61 0.00 -1.26 -1.75 119.74 119.77 1hqs s LYS 6 Ca 0.28 1.14 -0.23 0.00 0.00 0.00 0.00 55.97 57.16 1hqs s LYS 6 Cb -0.04 -3.33 -0.08 0.00 0.00 0.00 0.00 37.83 34.38 1hqs s LYS 6 CO 0.13 0.36 1.11 0.42 0.00 0.00 0.00 175.35 177.37 1hqs s ILE 7 N -0.39 3.38 0.22 3.79 1.01 -1.26 -4.72 121.20 123.24 1hqs s ILE 7 Ca 0.39 1.03 0.05 0.00 0.00 0.00 0.00 60.65 62.12 1hqs s ILE 7 Cb -0.22 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.68 1hqs s ILE 7 CO 0.25 -0.01 -0.04 0.42 0.00 0.00 0.00 174.94 175.55 1hqs s THR 8 N -1.61 1.24 0.10 2.92 -4.23 -0.83 -4.77 115.64 108.45 1hqs s THR 8 Ca 0.61 -2.07 0.09 0.00 -1.18 0.00 0.00 61.69 59.14 1hqs s THR 8 Cb -0.25 -2.25 -0.03 0.00 1.34 0.00 0.00 72.50 71.30 1hqs s THR 8 CO 0.31 -0.42 -0.22 0.54 -0.54 0.00 0.00 174.62 174.29 1hqs s VAL 9 N -3.28 1.81 -0.24 2.29 0.11 -1.26 0.13 120.40 119.96 1hqs s VAL 9 Ca 0.26 -1.52 -0.00 0.00 -2.93 0.00 0.00 61.98 57.79 1hqs s VAL 9 Cb 0.04 -1.62 0.06 0.00 -1.53 0.00 0.00 36.38 33.33 1hqs s VAL 9 CO 0.08 0.02 -0.02 -0.55 -3.33 0.00 0.00 175.10 171.30 1hqs s SER 10 N -1.79 3.68 -1.66 3.54 0.15 -0.02 -4.82 113.70 112.79 1hqs s SER 10 Ca 0.08 -1.17 -0.12 0.00 0.70 0.00 0.00 55.95 55.44 1hqs s SER 10 Cb -0.10 -1.04 0.11 0.00 -1.71 0.00 0.00 66.02 63.29 1hqs s SER 10 CO 0.04 -0.27 0.52 0.59 1.20 0.00 0.00 173.24 175.32 1hqs n ASN 11 N 4.76 -1.54 0.00 5.45 3.02 -1.26 -0.52 115.26 125.17 1hqs n ASN 11 Ca -0.10 -1.12 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 1hqs n ASN 11 Cb 0.44 -2.32 0.00 0.00 -0.61 0.00 0.00 39.78 37.29 1hqs n ASN 11 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hqs n GLY 12 N -1.67 3.19 3.74 7.41 0.00 -1.26 -5.05 105.19 111.55 1hqs n GLY 12 Ca -0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.59 1hqs n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hqs s VAL 13 N -2.36 5.33 0.09 1.61 1.01 0.32 -4.43 120.40 121.97 1hqs s VAL 13 Ca 0.00 0.45 -0.31 0.00 0.00 0.00 0.00 61.98 62.12 1hqs s VAL 13 Cb 0.00 -3.58 -0.07 0.00 0.00 0.00 0.00 36.38 32.73 1hqs s VAL 13 CO 0.00 0.42 1.30 -0.76 0.00 0.00 0.00 175.10 176.06 1hqs s LEU 14 N 0.34 4.37 -0.48 3.92 1.43 -1.26 -0.84 118.68 126.15 1hqs s LEU 14 Ca 0.14 2.18 -0.10 0.00 -1.03 0.00 0.00 54.13 55.33 1hqs s LEU 14 Cb -0.13 -3.58 0.12 0.00 0.03 0.00 0.00 46.19 42.63 1hqs s LEU 14 CO 0.03 -0.57 0.37 0.21 0.23 0.00 0.00 176.35 176.62 1hqs s ASN 15 N 1.07 5.79 -0.34 2.29 3.84 0.12 -4.95 114.94 122.76 1hqs s ASN 15 Ca 0.62 -1.89 -0.14 0.00 0.21 0.00 0.00 52.86 51.66 1hqs s ASN 15 Cb -0.33 -2.05 -0.01 0.00 -0.55 0.00 0.00 41.25 38.31 1hqs s ASN 15 CO 0.30 -0.72 0.28 -0.69 -2.79 0.00 0.00 177.10 173.48 1hqs s VAL 16 N 1.40 5.25 0.89 -5.21 1.01 -1.26 -1.97 120.40 120.50 1hqs s VAL 16 Ca 0.05 -0.15 -0.11 0.00 0.00 0.00 0.00 61.98 61.78 1hqs s VAL 16 Cb -0.27 -3.76 0.13 0.00 0.00 0.00 0.00 36.38 32.48 1hqs s VAL 16 CO -0.00 -0.05 1.10 -2.16 0.00 0.00 0.00 175.10 173.99 1hqs s PRO 17 N 1.82 1.30 0.00 2.72 0.04 -1.26 -4.92 135.00 134.70 1hqs s PRO 17 Ca 0.08 1.16 0.25 0.00 0.04 0.00 0.00 61.00 62.53 1hqs s PRO 17 Cb -0.17 -1.79 1.23 0.00 0.04 0.00 0.00 34.50 33.81 1hqs s PRO 17 CO 0.11 -2.31 1.84 0.09 0.04 0.00 0.00 177.00 176.76 1hqs n ASN 18 N -3.97 0.00 -3.21 6.66 3.02 -1.26 -3.71 115.26 112.79 1hqs n ASN 18 Ca 0.09 0.03 -0.24 0.00 -0.03 0.00 0.00 54.58 54.42 1hqs n ASN 18 Cb 0.53 -0.32 -0.07 0.00 -0.61 0.00 0.00 39.78 39.32 1hqs n ASN 18 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1hqs n ASN 19 N -1.32 0.74 -4.79 6.41 4.13 -1.25 -1.22 115.26 117.95 1hqs n ASN 19 Ca 0.11 -2.83 -0.35 0.00 1.68 0.00 0.00 54.58 53.18 1hqs n ASN 19 Cb 0.22 -0.64 -0.05 0.00 -1.54 0.00 0.00 39.78 37.77 1hqs n ASN 19 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1hqs s PRO 20 N -1.50 4.20 -0.26 3.52 0.04 -1.21 -0.92 135.00 138.86 1hqs s PRO 20 Ca 0.36 1.38 -0.17 0.00 0.04 0.00 0.00 61.00 62.61 1hqs s PRO 20 Cb 0.19 -2.45 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 1hqs s PRO 20 CO -0.10 -0.08 0.46 0.42 0.04 0.00 0.00 177.00 177.74 1hqs s ILE 21 N -1.80 5.11 -0.30 0.56 1.01 -0.71 -1.34 121.20 123.73 1hqs s ILE 21 Ca 0.59 0.75 0.01 0.00 0.00 0.00 0.00 60.65 62.00 1hqs s ILE 21 Cb -0.18 -3.77 0.07 0.00 0.01 0.00 0.00 42.46 38.59 1hqs s ILE 21 CO 0.23 0.12 -0.01 -0.63 0.00 0.00 0.00 174.94 174.64 1hqs s ILE 22 N 2.20 2.59 0.59 2.92 -1.09 0.09 -4.77 121.20 123.73 1hqs s ILE 22 Ca 0.19 -1.71 -0.19 0.00 -2.23 0.00 0.00 60.65 56.71 1hqs s ILE 22 Cb -0.16 -2.60 -0.04 0.00 -1.58 0.00 0.00 42.46 38.09 1hqs s ILE 22 CO 0.09 -0.22 1.22 -2.84 -1.23 0.00 0.00 174.94 171.97 1hqs s PRO 23 N 1.13 2.98 -0.02 2.79 0.02 -1.25 -1.51 135.00 139.14 1hqs s PRO 23 Ca -0.03 1.88 -0.11 0.00 0.02 0.00 0.00 61.00 62.76 1hqs s PRO 23 Cb -0.20 -1.96 0.01 0.00 0.02 0.00 0.00 34.50 32.37 1hqs s PRO 23 CO -0.04 -1.21 0.22 -0.59 -0.33 0.00 0.00 177.00 175.05 1hqs s PHE 24 N -1.55 -0.09 -0.20 6.54 -0.12 -0.15 -2.17 117.98 120.24 1hqs s PHE 24 Ca 0.77 0.14 -0.02 0.00 -0.05 0.00 0.00 56.93 57.77 1hqs s PHE 24 Cb -0.32 0.03 -0.00 0.00 -0.63 0.00 0.00 43.02 42.10 1hqs s PHE 24 CO 0.35 -0.31 -0.10 0.42 -0.05 0.00 0.00 175.22 175.53 1hqs s ILE 25 N -1.15 2.99 0.17 -4.49 1.01 -0.78 -0.88 121.20 118.06 1hqs s ILE 25 Ca -0.12 -0.63 -0.15 0.00 0.00 0.00 0.00 60.65 59.75 1hqs s ILE 25 Cb -0.06 -2.32 0.05 0.00 0.01 0.00 0.00 42.46 40.14 1hqs s ILE 25 CO 0.02 0.47 1.82 -0.08 0.00 0.00 0.00 174.94 177.17 1hqs h GLU 26 N 7.89 0.61 0.00 2.79 4.81 -1.88 -0.18 114.58 128.61 1hqs h GLU 26 Ca -0.41 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1hqs h GLU 26 Cb 1.16 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1hqs h GLU 26 CO 0.61 0.40 0.00 0.41 -0.73 0.00 0.00 179.01 179.70 1hqs n GLY 27 N -1.23 0.42 3.92 1.92 0.00 -1.26 -3.75 105.19 105.20 1hqs n GLY 27 Ca 0.02 -1.82 -0.27 0.00 0.00 0.00 0.00 46.02 43.95 1hqs n GLY 27 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hqs s ASP 28 N -1.48 4.73 1.50 1.61 -0.00 0.16 -4.33 116.67 118.87 1hqs s ASP 28 Ca 0.00 0.62 0.00 0.00 -0.00 0.00 0.00 52.55 53.17 1hqs s ASP 28 Cb 0.00 -1.23 0.00 0.00 -0.00 0.00 0.00 42.92 41.69 1hqs s ASP 28 CO 0.00 -1.70 0.00 0.61 -0.00 0.00 0.00 175.17 174.08 1hqs n GLY 29 N -3.08 3.09 0.18 0.21 0.00 -1.26 -1.17 105.19 103.17 1hqs n GLY 29 Ca 0.08 0.28 0.10 0.00 0.00 0.00 0.00 46.02 46.48 1hqs n GLY 29 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hqs n THR 30 N 0.00 0.06 -0.14 2.61 -2.24 -1.26 -4.33 114.28 108.98 1hqs n THR 30 Ca 0.00 -0.11 -0.04 0.00 -2.27 0.00 0.00 64.05 61.63 1hqs n THR 30 Cb 0.00 -0.08 0.02 0.00 -2.10 0.00 0.00 70.33 68.18 1hqs n THR 30 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1hqs h GLY 31 N 5.26 0.27 1.24 3.38 0.00 -1.36 -2.39 103.07 109.47 1hqs h GLY 31 Ca 0.00 0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.52 1hqs h GLY 31 CO 0.00 -0.18 0.47 -2.55 0.00 0.00 0.00 176.54 174.28 1hqs h PRO 32 N -0.03 0.89 -0.25 4.80 0.11 -1.75 -1.26 132.00 134.51 1hqs h PRO 32 Ca 0.21 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 66.20 1hqs h PRO 32 Cb 0.35 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 1hqs h PRO 32 CO -0.47 0.59 -0.11 -0.44 -0.21 0.00 0.00 178.00 177.36 1hqs h ASP 33 N 0.92 0.53 -0.37 -2.05 3.45 -1.77 -2.77 116.42 114.35 1hqs h ASP 33 Ca 0.27 -0.41 -0.02 0.00 0.43 0.00 0.00 57.03 57.31 1hqs h ASP 33 Cb -0.03 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 1hqs h ASP 33 CO -0.07 0.82 0.16 0.40 -1.57 0.00 0.00 179.24 178.98 1hqs h ILE 34 N 0.24 1.18 -0.40 0.35 2.04 -1.24 -3.08 117.51 116.60 1hqs h ILE 34 Ca 0.06 -0.54 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1hqs h ILE 34 Cb 0.62 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1hqs h ILE 34 CO 0.04 0.20 0.22 -0.25 0.00 0.00 0.00 178.15 178.35 1hqs h TRP 35 N 0.46 0.52 -0.58 1.37 2.91 -1.24 0.14 115.95 119.53 1hqs h TRP 35 Ca 0.13 0.00 -0.10 0.00 1.13 0.00 0.00 58.89 60.05 1hqs h TRP 35 Cb 0.16 -0.17 -0.02 0.00 -0.51 0.00 0.00 29.16 28.61 1hqs h TRP 35 CO -0.01 0.37 -0.03 -0.97 -1.03 0.00 0.00 178.44 176.77 1hqs h ASN 36 N 0.55 1.03 0.10 2.65 -0.73 -1.40 -2.31 115.58 115.47 1hqs h ASN 36 Ca 0.14 -0.30 -0.17 0.00 1.87 0.00 0.00 56.30 57.84 1hqs h ASN 36 Cb 0.01 -0.28 0.01 0.00 0.27 0.00 0.00 38.32 38.33 1hqs h ASN 36 CO -0.02 1.09 -0.78 0.00 -0.37 0.00 0.00 177.43 177.35 1hqs h ALA 37 N 1.00 -0.01 -0.19 1.57 0.00 -1.45 -3.32 119.26 116.87 1hqs h ALA 37 Ca 0.16 -0.75 0.04 0.00 0.00 0.00 0.00 54.91 54.36 1hqs h ALA 37 Cb 0.59 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1hqs h ALA 37 CO 0.04 0.40 -0.07 0.00 0.00 0.00 0.00 179.25 179.61 1hqs h ALA 38 N 0.01 0.09 -0.68 0.00 0.00 -0.78 -2.26 119.26 115.64 1hqs h ALA 38 Ca -0.15 0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.91 1hqs h ALA 38 Cb 1.51 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 1hqs h ALA 38 CO 0.08 -0.50 0.35 0.66 0.00 0.00 0.00 179.25 179.84 1hqs h SER 39 N -0.04 0.48 -0.28 0.00 4.64 -1.59 -1.69 113.55 115.07 1hqs h SER 39 Ca 0.10 0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.36 1hqs h SER 39 Cb 0.19 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1hqs h SER 39 CO -0.22 0.29 -0.20 0.11 -0.87 0.00 0.00 176.83 175.94 1hqs h LYS 40 N 0.62 0.75 -0.31 4.77 1.57 -1.57 -1.00 116.57 121.40 1hqs h LYS 40 Ca 0.32 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1hqs h LYS 40 Cb 0.29 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.55 1hqs h LYS 40 CO -0.23 0.89 0.07 0.28 -0.57 0.00 0.00 179.45 179.89 1hqs h VAL 41 N 0.66 1.22 -0.56 0.50 2.07 -1.04 -0.08 116.25 119.01 1hqs h VAL 41 Ca 0.10 -0.73 -0.05 0.00 0.82 0.00 0.00 66.70 66.84 1hqs h VAL 41 Cb 0.69 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1hqs h VAL 41 CO 0.05 0.24 0.16 -0.07 0.02 0.00 0.00 177.57 177.97 1hqs h LEU 42 N 0.33 0.84 -0.52 2.57 3.38 -1.21 -1.41 115.31 119.28 1hqs h LEU 42 Ca 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1hqs h LEU 42 Cb 0.29 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1hqs h LEU 42 CO 0.00 0.84 0.30 -0.33 0.09 0.00 0.00 178.44 179.33 1hqs h GLU 43 N 0.80 0.72 -0.81 1.13 5.08 -1.07 -1.72 114.58 118.70 1hqs h GLU 43 Ca 0.18 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1hqs h GLU 43 Cb 0.31 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1hqs h GLU 43 CO -0.00 0.55 0.54 0.00 -1.00 0.00 0.00 179.01 179.09 1hqs h ALA 44 N 1.13 1.03 -0.50 3.43 0.00 -0.73 -0.41 119.26 123.22 1hqs h ALA 44 Ca 0.19 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1hqs h ALA 44 Cb 0.03 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1hqs h ALA 44 CO -0.03 0.44 -0.11 0.00 0.00 0.00 0.00 179.25 179.55 1hqs h ALA 45 N 1.30 0.87 -0.42 0.00 0.00 -0.88 0.13 119.26 120.26 1hqs h ALA 45 Ca 0.30 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1hqs h ALA 45 Cb -0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 1hqs h ALA 45 CO -0.07 0.64 0.07 0.28 0.00 0.00 0.00 179.25 180.17 1hqs h VAL 46 N 0.82 1.24 -0.17 0.00 2.07 -0.91 0.51 116.25 119.81 1hqs h VAL 46 Ca 0.13 -0.89 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1hqs h VAL 46 Cb 0.64 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1hqs h VAL 46 CO 0.04 0.31 -0.04 -0.08 0.02 0.00 0.00 177.57 177.82 1hqs h GLU 47 N 0.56 0.32 -0.23 1.57 4.81 -0.87 -2.02 114.58 118.72 1hqs h GLU 47 Ca 0.13 -0.12 -0.12 0.00 -0.13 0.00 0.00 59.36 59.12 1hqs h GLU 47 Cb 0.38 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1hqs h GLU 47 CO 0.01 0.59 -0.35 0.87 -0.73 0.00 0.00 179.01 179.39 1hqs h LYS 48 N 0.03 0.50 -0.11 1.92 1.57 -0.71 -1.95 116.57 117.82 1hqs h LYS 48 Ca 0.04 -0.23 -0.14 0.00 -1.87 0.00 0.00 60.65 58.45 1hqs h LYS 48 Cb 0.47 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.77 1hqs h LYS 48 CO 0.02 0.78 -0.48 0.00 -0.57 0.00 0.00 179.45 179.20 1hqs h ALA 49 N 1.20 0.21 -0.37 3.86 0.00 -0.85 -3.35 119.26 119.95 1hqs h ALA 49 Ca 0.05 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1hqs h ALA 49 Cb 0.82 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1hqs h ALA 49 CO 0.07 0.38 0.00 0.66 0.00 0.00 0.00 179.25 180.35 1hqs n TYR 50 N -4.24 1.04 -3.37 0.00 4.01 -0.77 -4.97 117.16 108.86 1hqs n TYR 50 Ca -0.08 -0.74 -0.23 0.00 -0.16 0.00 0.00 57.90 56.69 1hqs n TYR 50 Cb 0.59 -0.26 -0.01 0.00 -0.31 0.00 0.00 39.34 39.35 1hqs n TYR 50 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1hqs n LYS 51 N 0.07 -3.33 -0.03 -0.72 4.76 -0.74 -0.90 118.16 117.28 1hqs n LYS 51 Ca 0.21 0.46 0.00 0.00 -2.87 0.00 0.00 58.31 56.11 1hqs n LYS 51 Cb 0.83 -5.17 0.00 0.00 -1.84 0.00 0.00 35.03 28.85 1hqs n LYS 51 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hqs n GLY 52 N -1.16 1.13 0.23 0.72 0.00 -1.20 -4.91 105.19 100.01 1hqs n GLY 52 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.07 1hqs n GLY 52 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1hqs h GLU 53 N 3.30 0.00 -6.44 1.61 4.81 -1.36 -3.43 114.58 113.07 1hqs h GLU 53 Ca 0.00 0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.60 1hqs h GLU 53 Cb 0.00 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.22 1hqs h GLU 53 CO 0.00 0.14 -0.79 0.15 -0.73 0.00 0.00 179.01 177.78 1hqs s LYS 54 N -4.69 1.61 -0.21 1.92 1.02 -1.26 -4.82 119.74 113.32 1hqs s LYS 54 Ca -0.04 -1.62 -0.20 0.00 0.02 0.00 0.00 55.97 54.13 1hqs s LYS 54 Cb 0.16 -1.83 0.05 0.00 -0.52 0.00 0.00 37.83 35.70 1hqs s LYS 54 CO 0.68 0.37 0.57 0.21 -0.92 0.00 0.00 175.35 176.26 1hqs s LYS 55 N -3.04 0.67 -0.14 1.68 2.20 -0.36 -4.62 119.74 116.13 1hqs s LYS 55 Ca 0.25 0.77 -0.06 0.00 -0.36 0.00 0.00 55.97 56.57 1hqs s LYS 55 Cb -0.07 0.33 -0.04 0.00 -1.51 0.00 0.00 37.83 36.54 1hqs s LYS 55 CO 0.12 -0.08 0.07 0.42 -0.36 0.00 0.00 175.35 175.51 1hqs s ILE 56 N 0.25 4.85 -0.36 5.43 1.01 -1.26 -3.36 121.20 127.76 1hqs s ILE 56 Ca -0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.56 1hqs s ILE 56 Cb -0.04 -3.13 0.06 0.00 0.01 0.00 0.00 42.46 39.37 1hqs s ILE 56 CO 0.01 0.54 0.14 -0.89 0.00 0.00 0.00 174.94 174.75 1hqs s THR 57 N -0.36 3.69 0.21 2.92 2.01 -0.45 -5.00 115.64 118.67 1hqs s THR 57 Ca 0.09 -1.39 -0.30 0.00 0.31 0.00 0.00 61.69 60.40 1hqs s THR 57 Cb -0.12 -3.21 -0.08 0.00 0.01 0.00 0.00 72.50 69.10 1hqs s THR 57 CO 0.02 -0.34 0.94 0.26 -0.69 0.00 0.00 174.62 174.81 1hqs s TRP 58 N 1.34 3.95 -0.23 4.92 0.52 -1.26 -0.73 118.94 127.45 1hqs s TRP 58 Ca 0.01 1.89 0.01 0.00 0.02 0.00 0.00 56.10 58.02 1hqs s TRP 58 Cb -0.21 -2.99 0.06 0.00 -1.15 0.00 0.00 33.47 29.18 1hqs s TRP 58 CO 0.01 0.41 -0.07 0.21 0.02 0.00 0.00 176.95 177.53 1hqs s LYS 59 N -0.93 1.75 0.15 4.98 2.20 -0.57 -4.88 119.74 122.45 1hqs s LYS 59 Ca 0.42 -0.99 -0.30 0.00 -0.36 0.00 0.00 55.97 54.74 1hqs s LYS 59 Cb -0.25 -2.58 -0.07 0.00 -1.51 0.00 0.00 37.83 33.42 1hqs s LYS 59 CO 0.31 -0.56 1.15 -2.00 -0.36 0.00 0.00 175.35 173.89 1hqs s GLU 60 N 1.37 4.52 0.20 4.03 2.12 -1.26 -0.98 118.70 128.70 1hqs s GLU 60 Ca -0.05 1.77 0.08 0.00 0.36 0.00 0.00 54.97 57.13 1hqs s GLU 60 Cb -0.18 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.88 1hqs s GLU 60 CO -0.06 -0.06 -0.16 0.14 -0.54 0.00 0.00 175.26 174.58 1hqs s VAL 61 N 0.14 1.78 -0.01 3.70 -7.23 -0.06 -4.86 120.40 113.86 1hqs s VAL 61 Ca 0.53 -2.13 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 1hqs s VAL 61 Cb -0.30 -1.99 -0.03 0.00 0.56 0.00 0.00 36.38 34.61 1hqs s VAL 61 CO 0.34 -0.51 -0.03 -0.31 -0.31 0.00 0.00 175.10 174.28 1hqs s TYR 62 N -2.69 2.99 -0.02 2.82 2.02 -1.26 -4.28 117.35 116.93 1hqs s TYR 62 Ca 0.21 0.03 -0.27 0.00 -0.37 0.00 0.00 57.07 56.67 1hqs s TYR 62 Cb -0.02 -1.65 0.06 0.00 -0.40 0.00 0.00 41.96 39.94 1hqs s TYR 62 CO 0.07 0.42 0.59 0.00 -1.57 0.00 0.00 175.55 175.06 1hqs s ALA 63 N -1.02 -1.53 0.00 3.71 0.00 -1.26 -4.48 121.76 117.17 1hqs s ALA 63 Ca 0.18 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.15 1hqs s ALA 63 Cb -0.11 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1hqs s ALA 63 CO 0.08 -0.39 0.00 0.41 0.00 0.00 0.00 175.76 175.86 1hqs n GLY 64 N 0.85 -0.54 0.30 0.00 0.00 0.55 -3.98 105.19 102.36 1hqs n GLY 64 Ca -0.19 -1.13 0.05 0.00 0.00 0.00 0.00 46.02 44.75 1hqs n GLY 64 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1hqs h GLU 65 N 0.00 0.60 -0.84 1.61 4.57 -1.95 -0.18 114.58 118.40 1hqs h GLU 65 Ca 0.00 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 1hqs h GLU 65 Cb 0.00 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.42 1hqs h GLU 65 CO 0.00 0.40 0.43 -0.22 -1.18 0.00 0.00 179.01 178.44 1hqs h LYS 66 N 0.62 1.19 -0.31 1.92 3.64 -1.96 0.68 116.57 122.35 1hqs h LYS 66 Ca 0.43 -0.16 -0.14 0.00 -1.27 0.00 0.00 60.65 59.51 1hqs h LYS 66 Cb 0.57 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 1hqs h LYS 66 CO -0.34 0.90 -0.35 0.00 -2.27 0.00 0.00 179.45 177.39 1hqs h ALA 67 N 1.23 0.46 -0.41 5.00 0.00 -1.46 -2.63 119.26 121.46 1hqs h ALA 67 Ca 0.29 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1hqs h ALA 67 Cb 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1hqs h ALA 67 CO -0.04 0.52 0.20 -0.92 0.00 0.00 0.00 179.25 179.01 1hqs h TYR 68 N 0.54 0.59 -0.38 0.00 3.20 -0.69 0.17 116.97 120.40 1hqs h TYR 68 Ca 0.04 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.93 1hqs h TYR 68 Cb 0.93 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.98 1hqs h TYR 68 CO 0.07 0.48 0.12 -0.91 -1.64 0.00 0.00 178.16 176.29 1hqs h ASN 69 N 0.52 0.12 -0.05 -2.11 2.35 -0.84 0.11 115.58 115.68 1hqs h ASN 69 Ca 0.14 0.05 -0.18 0.00 -0.55 0.00 0.00 56.30 55.76 1hqs h ASN 69 Cb 0.11 0.04 0.01 0.00 0.05 0.00 0.00 38.32 38.53 1hqs h ASN 69 CO -0.02 0.10 -0.68 0.11 -1.65 0.00 0.00 177.43 175.30 1hqs h LYS 70 N 0.27 0.54 0.00 0.81 1.57 -1.27 -3.41 116.57 115.09 1hqs h LYS 70 Ca 0.18 -0.52 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 1hqs h LYS 70 Cb 0.17 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1hqs h LYS 70 CO -0.19 1.15 -0.37 0.25 -0.57 0.00 0.00 179.45 179.72 1hqs n THR 71 N -4.12 0.00 -1.02 -0.16 -2.24 0.58 -5.00 114.28 102.32 1hqs n THR 71 Ca -0.09 -0.35 -0.01 0.00 -2.27 0.00 0.00 64.05 61.33 1hqs n THR 71 Cb 0.70 0.87 -0.00 0.00 -2.10 0.00 0.00 70.33 69.80 1hqs n THR 71 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hqs n GLY 72 N 1.35 0.47 2.95 3.38 0.00 0.37 -5.00 105.19 108.72 1hqs n GLY 72 Ca 0.00 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 1hqs n GLY 72 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hqs s GLU 73 N -1.04 0.87 0.23 1.61 2.02 -1.26 -4.95 118.70 116.20 1hqs s GLU 73 Ca 0.00 -0.22 0.01 0.00 0.02 0.00 0.00 54.97 54.78 1hqs s GLU 73 Cb 0.00 -0.83 0.25 0.00 0.10 0.00 0.00 34.13 33.65 1hqs s GLU 73 CO 0.00 0.04 1.59 -1.49 0.02 0.00 0.00 175.26 175.42 1hqs h TRP 74 N 6.66 0.54 -2.51 1.61 4.06 -1.86 -2.73 115.95 121.73 1hqs h TRP 74 Ca -0.35 -0.17 -0.58 0.00 2.06 0.00 0.00 58.89 59.85 1hqs h TRP 74 Cb 1.17 -0.11 -0.39 0.00 -1.00 0.00 0.00 29.16 28.83 1hqs h TRP 74 CO 0.46 0.83 -0.89 -1.17 -3.56 0.00 0.00 178.44 174.11 1hqs s LEU 75 N -8.34 1.10 0.52 -4.49 2.96 -1.26 -0.33 118.68 108.84 1hqs s LEU 75 Ca -0.06 -2.47 -0.22 0.00 -0.22 0.00 0.00 54.13 51.16 1hqs s LEU 75 Cb 0.12 -0.40 -0.07 0.00 0.50 0.00 0.00 46.19 46.34 1hqs s LEU 75 CO 0.81 -0.26 1.15 -2.65 -1.32 0.00 0.00 176.35 174.08 1hqs n PRO 76 N 3.65 1.39 -0.07 0.98 -0.02 -1.26 -4.88 135.00 134.79 1hqs n PRO 76 Ca 0.18 0.51 0.02 0.00 -2.02 0.00 0.00 63.50 62.19 1hqs n PRO 76 Cb 0.41 -2.31 0.34 0.00 -0.02 0.00 0.00 33.50 31.92 1hqs n PRO 76 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hqs h ALA 77 N 1.22 1.57 -0.56 3.55 0.00 -1.98 -1.97 119.26 121.08 1hqs h ALA 77 Ca -0.48 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.41 1hqs h ALA 77 Cb 1.33 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1hqs h ALA 77 CO 0.55 0.37 0.37 1.49 0.00 0.00 0.00 179.25 182.04 1hqs h GLU 78 N 0.70 0.59 -0.32 0.00 4.57 -1.98 0.16 114.58 118.31 1hqs h GLU 78 Ca 0.19 -0.04 -0.06 0.00 -1.18 0.00 0.00 59.36 58.27 1hqs h GLU 78 Cb -0.02 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 1hqs h GLU 78 CO -0.03 0.39 -0.05 1.15 -1.18 0.00 0.00 179.01 179.29 1hqs h THR 79 N 0.61 1.27 -0.39 0.32 2.02 -1.66 0.23 112.91 115.31 1hqs h THR 79 Ca 0.23 -1.06 -0.02 0.00 0.77 0.00 0.00 66.41 66.33 1hqs h THR 79 Cb 0.17 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 1hqs h THR 79 CO -0.06 0.34 0.16 -0.07 0.37 0.00 0.00 175.52 176.26 1hqs h LEU 80 N 0.37 0.54 -0.31 2.58 3.38 -1.20 -1.69 115.31 118.99 1hqs h LEU 80 Ca 0.08 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1hqs h LEU 80 Cb 0.52 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1hqs h LEU 80 CO 0.03 0.56 0.19 0.44 0.09 0.00 0.00 178.44 179.75 1hqs h ASP 81 N 0.49 0.33 -0.55 -0.43 3.32 -0.58 0.18 116.42 119.18 1hqs h ASP 81 Ca 0.13 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.13 1hqs h ASP 81 Cb 0.19 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1hqs h ASP 81 CO -0.01 0.24 0.15 0.58 -1.72 0.00 0.00 179.24 178.48 1hqs h VAL 82 N 0.40 1.24 -0.51 -1.35 2.07 -0.86 0.31 116.25 117.54 1hqs h VAL 82 Ca 0.12 -0.85 -0.07 0.00 0.82 0.00 0.00 66.70 66.71 1hqs h VAL 82 Cb -0.03 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1hqs h VAL 82 CO -0.04 0.31 0.04 0.40 0.02 0.00 0.00 177.57 178.30 1hqs h ILE 83 N 0.78 1.26 -0.82 4.57 2.04 -1.08 -0.72 117.51 123.54 1hqs h ILE 83 Ca 0.18 -1.03 -0.02 0.00 1.00 0.00 0.00 64.86 64.99 1hqs h ILE 83 Cb 0.32 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 1hqs h ILE 83 CO -0.00 0.37 0.43 -0.09 0.00 0.00 0.00 178.15 178.85 1hqs h ARG 84 N 0.76 1.16 0.05 2.37 2.43 -0.33 -1.25 114.38 119.56 1hqs h ARG 84 Ca 0.15 -0.15 -0.28 0.00 -0.81 0.00 0.00 59.98 58.90 1hqs h ARG 84 Cb 0.47 -0.22 0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1hqs h ARG 84 CO 0.02 0.86 -1.12 1.49 -1.51 0.00 0.00 179.97 179.72 1hqs h GLU 85 N 1.16 0.68 -0.01 0.20 4.81 -0.81 -3.33 114.58 117.27 1hqs h GLU 85 Ca 0.29 -0.79 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1hqs h GLU 85 Cb 0.06 0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1hqs h GLU 85 CO -0.04 1.35 -0.15 0.66 -0.73 0.00 0.00 179.01 180.09 1hqs n TYR 86 N -3.84 0.00 0.00 0.92 4.01 -0.29 -4.80 117.16 113.17 1hqs n TYR 86 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 1hqs n TYR 86 Cb 0.92 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.80 1hqs n TYR 86 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1hqs n PHE 87 N -0.81 0.00 -5.12 -0.72 3.01 -0.48 -4.43 117.46 108.91 1hqs n PHE 87 Ca 0.14 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.31 1hqs n PHE 87 Cb 0.30 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.61 1hqs n PHE 87 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 1hqs s ILE 88 N 0.00 1.81 0.14 4.37 -4.36 -1.26 -1.35 121.20 120.54 1hqs s ILE 88 Ca 0.00 -0.95 0.00 0.00 -0.26 0.00 0.00 60.65 59.44 1hqs s ILE 88 Cb 0.00 -1.52 -0.04 0.00 1.25 0.00 0.00 42.46 42.15 1hqs s ILE 88 CO 0.00 0.51 0.02 0.00 0.24 0.00 0.00 174.94 175.71 1hqs s ALA 89 N -0.32 1.00 -0.01 2.27 0.00 -0.56 -3.88 121.76 120.26 1hqs s ALA 89 Ca 0.03 -1.48 0.04 0.00 0.00 0.00 0.00 51.96 50.54 1hqs s ALA 89 Cb -0.11 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.67 1hqs s ALA 89 CO 0.01 -0.41 -0.12 -1.50 0.00 0.00 0.00 175.76 173.74 1hqs s ILE 90 N -3.88 0.98 0.03 0.00 2.07 -0.92 -0.66 121.20 118.81 1hqs s ILE 90 Ca 0.22 -0.52 -0.00 0.00 -1.41 0.00 0.00 60.65 58.94 1hqs s ILE 90 Cb 0.07 -0.83 -0.02 0.00 0.13 0.00 0.00 42.46 41.81 1hqs s ILE 90 CO 0.01 0.28 -0.03 -1.59 -1.91 0.00 0.00 174.94 171.70 1hqs s LYS 91 N -0.22 0.36 0.52 3.50 -2.85 0.27 -1.87 119.74 119.44 1hqs s LYS 91 Ca 0.03 -0.72 -0.04 0.00 -1.00 0.00 0.00 55.97 54.24 1hqs s LYS 91 Cb -0.06 0.12 0.11 0.00 -2.06 0.00 0.00 37.83 35.95 1hqs s LYS 91 CO -0.00 -0.06 0.70 0.41 0.10 0.00 0.00 175.35 176.50 1hqs n GLY 92 N 1.34 -0.18 3.80 0.59 0.00 -0.08 -4.11 105.19 106.55 1hqs n GLY 92 Ca -0.22 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.58 1hqs n GLY 92 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1hqs s PRO 93 N -4.37 4.06 -0.09 1.61 0.04 -1.26 -4.61 135.00 130.37 1hqs s PRO 93 Ca 0.43 1.32 0.02 0.00 0.04 0.00 0.00 61.00 62.81 1hqs s PRO 93 Cb -0.02 -2.26 0.01 0.00 0.04 0.00 0.00 34.50 32.28 1hqs s PRO 93 CO 0.29 -0.20 -0.13 -0.51 0.04 0.00 0.00 177.00 176.49 1hqs s LEU 94 N -3.12 1.63 0.13 -3.56 1.43 -1.26 0.40 118.68 114.34 1hqs s LEU 94 Ca 0.63 -0.36 -0.30 0.00 -1.03 0.00 0.00 54.13 53.06 1hqs s LEU 94 Cb -0.15 -0.96 -0.07 0.00 0.03 0.00 0.00 46.19 45.04 1hqs s LEU 94 CO 0.20 0.01 1.08 -0.89 0.23 0.00 0.00 176.35 176.98 1hqs s THR 95 N 0.92 4.10 -0.16 5.49 2.01 -1.26 -4.81 115.64 121.93 1hqs s THR 95 Ca -0.09 1.72 -0.01 0.00 0.31 0.00 0.00 61.69 63.62 1hqs s THR 95 Cb -0.15 -4.10 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 1hqs s THR 95 CO 0.00 0.25 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.17 1hqs s THR 96 N 0.13 2.98 0.54 -0.82 2.01 -1.26 -4.84 115.64 114.37 1hqs s THR 96 Ca 0.51 -0.66 -0.21 0.00 0.31 0.00 0.00 61.69 61.64 1hqs s THR 96 Cb -0.27 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 69.90 1hqs s THR 96 CO 0.32 0.50 1.21 -2.84 -0.69 0.00 0.00 174.62 173.13 1hqs s PRO 97 N 0.79 3.29 -0.15 4.92 0.02 -1.26 -5.01 135.00 137.60 1hqs s PRO 97 Ca -0.04 1.86 -0.13 0.00 0.02 0.00 0.00 61.00 62.71 1hqs s PRO 97 Cb -0.15 -2.15 -0.05 0.00 0.02 0.00 0.00 34.50 32.17 1hqs s PRO 97 CO 0.01 -0.96 0.26 0.08 -0.33 0.00 0.00 177.00 176.07 1hqs s VAL 98 N -1.54 5.32 0.00 3.83 1.01 -1.26 -4.45 120.40 123.30 1hqs s VAL 98 Ca 0.71 0.49 0.00 0.00 0.00 0.00 0.00 61.98 63.18 1hqs s VAL 98 Cb -0.31 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.48 1hqs s VAL 98 CO 0.36 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.49 1hqs n GLY 99 N 3.20 2.59 0.00 4.51 0.00 -1.26 -4.88 105.19 109.36 1hqs n GLY 99 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1hqs n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqs n GLY 100 N -2.00 0.70 7.00 -0.02 0.00 -1.26 -5.16 105.19 104.44 1hqs n GLY 100 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1hqs n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqs n GLY 101 N 0.00 -1.52 3.79 -0.02 0.00 -1.26 -4.52 105.19 101.66 1hqs n GLY 101 Ca 0.00 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.38 1hqs n GLY 101 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1hqs s ILE 102 N 0.00 3.54 0.49 -0.61 -4.36 -1.26 -4.99 121.20 114.01 1hqs s ILE 102 Ca 0.00 0.83 -0.20 0.00 -0.26 0.00 0.00 60.65 61.01 1hqs s ILE 102 Cb 0.00 -3.32 -0.08 0.00 1.25 0.00 0.00 42.46 40.31 1hqs s ILE 102 CO 0.00 -0.34 1.06 -0.13 0.24 0.00 0.00 174.94 175.77 1hqs s ARG 103 N -3.71 3.76 -0.15 0.37 1.81 -1.26 -4.34 118.95 115.43 1hqs s ARG 103 Ca 0.67 1.42 -0.40 0.00 -1.72 0.00 0.00 55.73 55.70 1hqs s ARG 103 Cb -0.19 -2.12 -0.18 0.00 -0.45 0.00 0.00 34.95 32.02 1hqs s ARG 103 CO 0.32 -0.48 1.46 0.45 -0.68 0.00 0.00 175.30 176.37 1hqs n SER 104 N -0.94 1.49 0.12 0.23 2.88 -1.26 -4.85 113.62 111.29 1hqs n SER 104 Ca 0.09 1.12 -0.01 0.00 -1.33 0.00 0.00 58.87 58.75 1hqs n SER 104 Cb 0.52 -1.07 0.06 0.00 -0.75 0.00 0.00 64.21 62.97 1hqs n SER 104 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1hqs h LEU 105 N 5.18 0.00 -0.56 2.46 3.38 -1.90 -0.52 115.31 123.36 1hqs h LEU 105 Ca -0.47 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.39 1hqs h LEU 105 Cb 1.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 1hqs h LEU 105 CO 0.85 0.68 -0.07 0.78 0.09 0.00 0.00 178.44 180.76 1hqs h ASN 106 N 0.00 1.04 -0.01 -0.43 2.35 -1.89 -1.62 115.58 115.02 1hqs h ASN 106 Ca -0.01 -0.34 -0.22 0.00 -0.55 0.00 0.00 56.30 55.19 1hqs h ASN 106 Cb 1.38 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 39.48 1hqs h ASN 106 CO 0.09 1.13 -0.80 0.58 -1.65 0.00 0.00 177.43 176.78 1hqs h VAL 107 N 0.93 1.31 -0.67 2.81 2.07 -1.91 -2.82 116.25 117.96 1hqs h VAL 107 Ca 0.15 -2.06 0.04 0.00 0.82 0.00 0.00 66.70 65.65 1hqs h VAL 107 Cb 0.64 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 32.42 1hqs h VAL 107 CO 0.04 0.64 0.40 0.00 0.02 0.00 0.00 177.57 178.67 1hqs h ALA 108 N 0.65 0.88 -0.32 1.67 0.00 -0.91 -0.01 119.26 121.23 1hqs h ALA 108 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1hqs h ALA 108 Cb 1.41 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 1hqs h ALA 108 CO 0.16 0.13 0.21 -0.07 0.00 0.00 0.00 179.25 179.67 1hqs h LEU 109 N 0.77 0.37 -0.55 0.00 3.38 -1.27 0.14 115.31 118.15 1hqs h LEU 109 Ca 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1hqs h LEU 109 Cb 0.09 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1hqs h LEU 109 CO -0.14 0.28 0.36 0.03 0.09 0.00 0.00 178.44 179.07 1hqs h ARG 110 N 0.43 0.73 0.01 1.13 3.08 -1.15 -2.62 114.38 115.98 1hqs h ARG 110 Ca 0.12 -0.05 -0.21 0.00 0.07 0.00 0.00 59.98 59.91 1hqs h ARG 110 Cb -0.04 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 29.85 1hqs h ARG 110 CO -0.02 0.49 -0.92 1.96 -1.07 0.00 0.00 179.97 180.40 1hqs h GLN 111 N 0.75 0.30 -0.25 0.04 4.20 -0.83 0.01 115.11 119.33 1hqs h GLN 111 Ca 0.20 -0.33 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 1hqs h GLN 111 Cb -0.08 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1hqs h GLN 111 CO -0.04 1.04 0.06 0.93 -0.67 0.00 0.00 178.83 180.14 1hqs h GLU 112 N 0.16 0.40 -0.01 1.46 4.39 -0.63 -3.08 114.58 117.28 1hqs h GLU 112 Ca -0.06 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1hqs h GLU 112 Cb 1.56 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.16 1hqs h GLU 112 CO 0.15 0.50 -0.26 1.28 -1.16 0.00 0.00 179.01 179.53 1hqs n LEU 113 N -4.72 1.01 -3.13 1.33 4.77 -1.00 -4.98 117.00 110.28 1hqs n LEU 113 Ca -0.03 -0.25 -0.17 0.00 -0.03 0.00 0.00 56.01 55.52 1hqs n LEU 113 Cb 0.18 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.22 1hqs n LEU 113 CO 0.36 0.19 0.14 -0.67 -1.33 0.00 0.00 177.39 176.09 1hqs n ASP 114 N -0.66 -3.52 -4.21 -1.43 2.03 -0.55 -4.91 116.55 103.29 1hqs n ASP 114 Ca 0.12 -0.51 -0.43 0.00 0.52 0.00 0.00 54.79 54.49 1hqs n ASP 114 Cb 0.35 -4.47 0.00 0.00 -0.72 0.00 0.00 41.12 36.28 1hqs n ASP 114 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1hqs n LEU 115 N -3.98 5.79 0.17 -2.67 4.77 -0.12 -4.54 117.00 116.42 1hqs n LEU 115 Ca -0.15 -4.21 0.12 0.00 -0.03 0.00 0.00 56.01 51.75 1hqs n LEU 115 Cb 0.61 -1.66 0.60 0.00 -2.33 0.00 0.00 43.42 40.65 1hqs n LEU 115 CO 0.54 0.72 0.86 2.19 -1.33 0.00 0.00 177.39 180.38 1hqs h PHE 116 N 6.77 0.00 -3.47 -1.77 -5.15 -1.82 -3.39 116.94 108.10 1hqs h PHE 116 Ca 0.45 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.22 1hqs h PHE 116 Cb 0.77 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.94 1hqs h PHE 116 CO 1.34 0.00 0.00 0.28 -2.00 0.00 0.00 178.31 177.93 1hqs n VAL 117 N -2.33 0.00 -3.33 0.88 0.31 -0.70 -0.56 118.33 112.61 1hqs n VAL 117 Ca -0.01 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.35 1hqs n VAL 117 Cb 0.10 -0.33 -0.04 0.00 -0.91 0.00 0.00 33.84 32.65 1hqs n VAL 117 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1hqs s LEU 119 N 0.00 -0.34 -0.36 7.52 2.96 0.91 -0.33 118.68 129.04 1hqs s LEU 119 Ca 0.00 0.47 0.02 0.00 -0.22 0.00 0.00 54.13 54.40 1hqs s LEU 119 Cb 0.00 1.39 0.11 0.00 0.50 0.00 0.00 46.19 48.19 1hqs s LEU 119 CO 0.00 -0.07 0.13 -0.13 -1.32 0.00 0.00 176.35 174.96 1hqs s ARG 120 N 2.19 1.15 0.25 1.98 1.81 -0.34 -1.47 118.95 124.52 1hqs s ARG 120 Ca -0.02 -1.63 -0.29 0.00 -1.72 0.00 0.00 55.73 52.07 1hqs s ARG 120 Cb -0.04 -2.51 -0.09 0.00 -0.45 0.00 0.00 34.95 31.86 1hqs s ARG 120 CO -0.17 -1.02 0.95 -1.25 -0.68 0.00 0.00 175.30 173.13 1hqs s PRO 121 N 0.98 4.81 -0.24 3.54 0.04 -1.26 -0.86 135.00 142.02 1hqs s PRO 121 Ca 0.12 1.49 -0.02 0.00 0.04 0.00 0.00 61.00 62.63 1hqs s PRO 121 Cb -0.20 -3.21 0.07 0.00 0.04 0.00 0.00 34.50 31.21 1hqs s PRO 121 CO -0.13 0.47 0.04 0.08 0.04 0.00 0.00 177.00 177.50 1hqs s VAL 122 N -1.24 0.79 0.07 -0.36 1.01 0.78 -4.70 120.40 116.74 1hqs s VAL 122 Ca 0.43 -0.91 -0.04 0.00 0.00 0.00 0.00 61.98 61.45 1hqs s VAL 122 Cb -0.25 -1.34 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 1hqs s VAL 122 CO 0.31 -0.33 0.06 0.00 0.00 0.00 0.00 175.10 175.14 1hqs s ARG 123 N 1.71 0.71 -0.11 2.72 1.70 -1.26 -0.75 118.95 123.68 1hqs s ARG 123 Ca 0.01 -1.12 -0.15 0.00 -0.47 0.00 0.00 55.73 54.00 1hqs s ARG 123 Cb -0.17 0.26 -0.05 0.00 -0.57 0.00 0.00 34.95 34.42 1hqs s ARG 123 CO -0.13 -0.18 0.37 -0.47 -1.08 0.00 0.00 175.30 173.81 1hqs s TYR 124 N -3.90 3.54 -0.27 5.89 5.04 -1.24 -4.93 117.35 121.47 1hqs s TYR 124 Ca 0.07 0.76 -0.11 0.00 -2.44 0.00 0.00 57.07 55.35 1hqs s TYR 124 Cb 0.07 -2.38 -0.05 0.00 0.35 0.00 0.00 41.96 39.95 1hqs s TYR 124 CO -0.10 0.32 0.18 -0.06 -1.34 0.00 0.00 175.55 174.55 1hqs s PHE 125 N 0.14 3.24 0.14 4.97 0.08 -1.26 -5.01 117.98 120.28 1hqs s PHE 125 Ca 0.21 0.14 -0.35 0.00 0.12 0.00 0.00 56.93 57.05 1hqs s PHE 125 Cb -0.14 -2.35 -0.16 0.00 -0.57 0.00 0.00 43.02 39.80 1hqs s PHE 125 CO 0.08 -0.11 1.32 2.41 -0.10 0.00 0.00 175.22 178.81 1hqs n THR 126 N 4.88 0.38 0.00 0.64 -1.04 -1.26 -1.58 114.28 116.30 1hqs n THR 126 Ca -0.14 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 1hqs n THR 126 Cb 0.52 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 1hqs n THR 126 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1hqs n GLY 127 N 2.43 3.11 3.71 3.41 0.00 -1.26 -3.84 105.19 112.75 1hqs n GLY 127 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1hqs n GLY 127 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hqs s VAL 128 N -2.92 3.08 0.10 1.61 1.01 -0.62 -4.95 120.40 117.70 1hqs s VAL 128 Ca 0.00 0.71 -0.31 0.00 0.00 0.00 0.00 61.98 62.38 1hqs s VAL 128 Cb 0.00 -3.45 -0.08 0.00 0.00 0.00 0.00 36.38 32.85 1hqs s VAL 128 CO 0.00 0.04 1.44 -2.16 0.00 0.00 0.00 175.10 174.41 1hqs s PRO 129 N 1.57 4.29 0.05 2.72 0.04 -1.26 -4.93 135.00 137.48 1hqs s PRO 129 Ca 0.68 2.11 0.05 0.00 0.04 0.00 0.00 61.00 63.89 1hqs s PRO 129 Cb -0.39 -3.32 -0.02 0.00 0.04 0.00 0.00 34.50 30.80 1hqs s PRO 129 CO 0.30 -0.51 -0.15 0.45 0.04 0.00 0.00 177.00 177.13 1hqs s SER 130 N 1.36 1.83 0.20 6.66 0.15 -1.26 -4.37 113.70 118.26 1hqs s SER 130 Ca 0.66 -0.51 0.26 0.00 0.70 0.00 0.00 55.95 57.05 1hqs s SER 130 Cb -0.37 -0.11 0.86 0.00 -1.71 0.00 0.00 66.02 64.70 1hqs s SER 130 CO 0.30 0.03 1.77 -0.81 1.20 0.00 0.00 173.24 175.73 1hqs n PRO 131 N 1.70 0.23 -4.01 5.44 -0.04 -1.26 -4.85 135.00 132.21 1hqs n PRO 131 Ca -0.19 0.23 -0.21 0.00 -0.04 0.00 0.00 63.50 63.29 1hqs n PRO 131 Cb 0.54 -1.79 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 1hqs n PRO 131 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1hqs s VAL 132 N -3.13 4.89 0.11 0.52 -7.23 -1.26 -5.05 120.40 109.26 1hqs s VAL 132 Ca 0.10 -1.16 -0.14 0.00 -1.81 0.00 0.00 61.98 58.97 1hqs s VAL 132 Cb 0.12 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.35 1hqs s VAL 132 CO 0.56 -0.33 1.48 0.11 -0.31 0.00 0.00 175.10 176.61 1hqs h LYS 133 N 1.29 0.72 -2.16 4.82 1.57 -1.98 -3.38 116.57 117.45 1hqs h LYS 133 Ca -0.50 -0.31 -0.58 0.00 -1.87 0.00 0.00 60.65 57.38 1hqs h LYS 133 Cb 1.23 -0.02 -0.41 0.00 0.08 0.00 0.00 32.23 33.11 1hqs h LYS 133 CO 0.61 0.92 -0.73 0.54 -0.57 0.00 0.00 179.45 180.22 1hqs n ARG 134 N -4.33 2.25 0.33 3.15 1.74 -1.26 -4.89 116.66 113.65 1hqs n ARG 134 Ca -0.02 -4.38 0.22 0.00 -0.77 0.00 0.00 57.85 52.90 1hqs n ARG 134 Cb 0.40 -2.03 1.11 0.00 -1.02 0.00 0.00 32.46 30.91 1hqs n ARG 134 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1hqs h PRO 135 N 3.85 0.00 0.00 5.56 0.13 -1.86 -1.99 132.00 137.69 1hqs h PRO 135 Ca 0.16 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.28 1hqs h PRO 135 Cb 0.69 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 1hqs h PRO 135 CO 0.75 0.00 -0.05 1.05 -0.23 0.00 0.00 178.00 179.52 1hqs h GLU 136 N 0.00 0.00 0.00 0.86 9.09 -1.94 -2.10 114.58 120.49 1hqs h GLU 136 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1hqs h GLU 136 Cb 0.11 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.21 1hqs h GLU 136 CO 0.00 0.05 0.00 -0.25 0.05 0.00 0.00 179.01 178.86 1hqs n ASP 137 N -3.26 0.01 -4.49 3.06 8.00 -0.75 -4.69 116.55 114.43 1hqs n ASP 137 Ca -0.01 0.50 -0.43 0.00 0.71 0.00 0.00 54.79 55.56 1hqs n ASP 137 Cb 0.24 -0.50 -0.09 0.00 -0.02 0.00 0.00 41.12 40.75 1hqs n ASP 137 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1hqs s THR 138 N -3.00 5.07 -0.31 -3.53 2.01 -0.79 -3.43 115.64 111.65 1hqs s THR 138 Ca 0.12 -0.25 0.00 0.00 0.31 0.00 0.00 61.69 61.87 1hqs s THR 138 Cb 0.16 -4.04 0.14 0.00 0.01 0.00 0.00 72.50 68.77 1hqs s THR 138 CO 0.44 -0.41 0.31 -0.62 -0.69 0.00 0.00 174.62 173.66 1hqs s ASP 139 N 1.82 1.59 0.18 3.53 3.68 -1.25 -3.72 116.67 122.51 1hqs s ASP 139 Ca 0.13 -1.01 0.00 0.00 2.13 0.00 0.00 52.55 53.81 1hqs s ASP 139 Cb -0.17 0.49 -0.04 0.00 -1.45 0.00 0.00 42.92 41.75 1hqs s ASP 139 CO 0.14 -0.35 0.05 -0.04 0.13 0.00 0.00 175.17 175.10 1hqs s MET 140 N 2.09 1.11 -0.16 4.34 -1.94 0.08 -4.56 119.30 120.26 1hqs s MET 140 Ca 0.12 -1.56 -0.02 0.00 -1.71 0.00 0.00 55.69 52.52 1hqs s MET 140 Cb -0.14 -0.02 0.05 0.00 2.01 0.00 0.00 34.83 36.72 1hqs s MET 140 CO -0.25 -0.24 0.02 0.08 -0.01 0.00 0.00 175.02 174.62 1hqs s VAL 141 N -3.87 0.53 -0.19 -6.03 1.01 -0.23 -0.16 120.40 111.46 1hqs s VAL 141 Ca 0.29 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.70 1hqs s VAL 141 Cb 0.07 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 1hqs s VAL 141 CO 0.06 -0.05 0.52 -0.63 0.00 0.00 0.00 175.10 174.99 1hqs s ILE 142 N 1.87 5.12 -0.44 2.22 -1.09 -0.04 -1.12 121.20 127.72 1hqs s ILE 142 Ca 0.01 0.96 -0.09 0.00 -2.23 0.00 0.00 60.65 59.30 1hqs s ILE 142 Cb -0.16 -3.84 0.10 0.00 -1.58 0.00 0.00 42.46 36.98 1hqs s ILE 142 CO -0.07 0.20 0.30 -0.36 -1.23 0.00 0.00 174.94 173.78 1hqs s PHE 143 N 1.48 3.39 -0.26 3.97 0.08 0.25 -1.20 117.98 125.69 1hqs s PHE 143 Ca 0.24 -1.75 -0.10 0.00 0.12 0.00 0.00 56.93 55.45 1hqs s PHE 143 Cb -0.15 -3.24 -0.05 0.00 -0.57 0.00 0.00 43.02 39.00 1hqs s PHE 143 CO 0.10 -0.93 0.16 0.50 -0.10 0.00 0.00 175.22 174.95 1hqs s ARG 144 N 1.38 3.96 0.23 0.44 3.52 -1.26 -1.04 118.95 126.17 1hqs s ARG 144 Ca 0.05 -0.32 -0.32 0.00 -0.13 0.00 0.00 55.73 55.01 1hqs s ARG 144 Cb -0.25 -3.56 -0.12 0.00 -1.56 0.00 0.00 34.95 29.46 1hqs s ARG 144 CO 0.00 -0.08 1.61 -1.91 -0.81 0.00 0.00 175.30 174.12 1hqs n GLU 145 N 4.70 2.53 -0.06 5.12 0.00 -0.25 -4.44 120.64 128.25 1hqs n GLU 145 Ca -0.15 0.91 0.02 0.00 0.00 0.00 0.00 57.16 57.94 1hqs n GLU 145 Cb 0.52 -2.70 0.05 0.00 0.00 0.00 0.00 31.44 29.31 1hqs n GLU 145 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 1hqs n ASN 146 N 3.05 2.29 0.00 4.31 5.15 0.28 -2.91 115.26 127.43 1hqs n ASN 146 Ca 0.13 -2.06 0.00 0.00 -0.60 0.00 0.00 54.58 52.05 1hqs n ASN 146 Cb 0.34 -0.09 0.00 0.00 -0.53 0.00 0.00 39.78 39.50 1hqs n ASN 146 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1hqs n THR 147 N -0.27 0.00 -1.57 -0.44 -2.24 -1.26 -4.63 114.28 103.87 1hqs n THR 147 Ca 0.04 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1hqs n THR 147 Cb 0.32 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 1hqs n THR 147 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1hqs n GLU 148 N -0.39 1.48 0.00 -0.78 0.28 -1.26 -4.79 120.64 115.18 1hqs n GLU 148 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1hqs n GLU 148 Cb 0.03 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.90 1hqs n GLU 148 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1hqs n ASP 149 N 0.00 -1.85 0.05 -1.84 4.64 0.78 -3.63 116.55 114.70 1hqs n ASP 149 Ca 0.00 0.00 0.04 0.00 -1.38 0.00 0.00 54.79 53.45 1hqs n ASP 149 Cb 0.00 0.00 0.21 0.00 -1.04 0.00 0.00 41.12 40.29 1hqs n ASP 149 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1hqs n ILE 150 N -0.51 1.58 0.68 5.18 0.13 -1.26 -1.72 119.36 123.44 1hqs n ILE 150 Ca 0.00 0.51 0.09 0.00 -1.10 0.00 0.00 62.75 62.25 1hqs n ILE 150 Cb 0.00 -1.47 0.41 0.00 -0.84 0.00 0.00 39.64 37.73 1hqs n ILE 150 CO 0.00 0.00 0.00 -1.22 2.80 0.00 0.00 176.55 178.13 1hqs n TYR 151 N -1.72 0.00 0.21 9.51 4.02 -1.24 -3.12 117.16 124.82 1hqs n TYR 151 Ca 0.00 0.00 0.17 0.00 -0.01 0.00 0.00 57.90 58.07 1hqs n TYR 151 Cb 0.04 -0.46 0.84 0.00 -0.02 0.00 0.00 39.34 39.74 1hqs n TYR 151 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1hqs h ALA 152 N 2.68 1.77 -0.66 -0.72 0.00 -1.48 -3.46 119.26 117.39 1hqs h ALA 152 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1hqs h ALA 152 Cb 0.29 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1hqs h ALA 152 CO 0.00 -0.29 -0.02 0.41 0.00 0.00 0.00 179.25 179.35 1hqs n GLY 153 N -1.39 0.66 3.29 0.00 0.00 -1.18 -5.03 105.19 101.54 1hqs n GLY 153 Ca 0.01 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 1hqs n GLY 153 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hqs s ILE 154 N -2.56 4.78 0.07 -0.61 1.01 -1.26 -5.03 121.20 117.59 1hqs s ILE 154 Ca 0.01 -1.50 -0.27 0.00 0.00 0.00 0.00 60.65 58.90 1hqs s ILE 154 Cb -0.00 -4.03 0.07 0.00 0.01 0.00 0.00 42.46 38.51 1hqs s ILE 154 CO 0.01 -0.74 0.64 -1.83 0.00 0.00 0.00 174.94 173.02 1hqs s GLU 155 N 1.51 1.18 -0.02 2.79 -1.05 -1.26 -0.59 118.70 121.27 1hqs s GLU 155 Ca 0.04 -0.15 0.01 0.00 -0.15 0.00 0.00 54.97 54.73 1hqs s GLU 155 Cb -0.27 0.55 0.01 0.00 -0.44 0.00 0.00 34.13 33.97 1hqs s GLU 155 CO 0.02 -0.46 -0.05 0.71 0.95 0.00 0.00 175.26 176.44 1hqs s TYR 156 N -2.61 0.52 0.42 4.83 1.51 -0.27 -4.99 117.35 116.77 1hqs s TYR 156 Ca -0.04 -0.10 -0.15 0.00 -1.01 0.00 0.00 57.07 55.76 1hqs s TYR 156 Cb -0.01 -0.40 -0.08 0.00 -0.11 0.00 0.00 41.96 41.36 1hqs s TYR 156 CO -0.03 -0.06 0.86 0.00 -1.11 0.00 0.00 175.55 175.21 1hqs s ALA 157 N 0.22 3.20 0.34 3.71 0.00 -1.26 -0.90 121.76 127.08 1hqs s ALA 157 Ca -0.02 0.07 -0.28 0.00 0.00 0.00 0.00 51.96 51.73 1hqs s ALA 157 Cb -0.06 -2.92 -0.12 0.00 0.00 0.00 0.00 23.12 20.02 1hqs s ALA 157 CO -0.00 0.03 1.32 1.17 0.00 0.00 0.00 175.76 178.27 1hqs n LYS 158 N -1.05 2.18 -0.03 0.00 4.81 -1.26 -1.65 118.16 121.17 1hqs n LYS 158 Ca 0.05 0.77 0.00 0.00 -0.87 0.00 0.00 58.31 58.25 1hqs n LYS 158 Cb 0.54 -2.37 0.00 0.00 0.02 0.00 0.00 35.03 33.22 1hqs n LYS 158 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1hqs n GLY 159 N 0.80 2.13 3.86 3.14 0.00 -1.26 -5.02 105.19 108.83 1hqs n GLY 159 Ca 0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 1hqs n GLY 159 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hqs s SER 160 N -3.44 6.55 0.27 1.61 1.04 -0.66 -4.96 113.70 114.12 1hqs s SER 160 Ca 0.00 1.42 0.01 0.00 0.48 0.00 0.00 55.95 57.86 1hqs s SER 160 Cb 0.00 -2.45 0.38 0.00 0.10 0.00 0.00 66.02 64.06 1hqs s SER 160 CO 0.00 -0.56 1.72 -0.08 0.98 0.00 0.00 173.24 175.30 1hqs h GLU 161 N 0.90 0.54 -0.06 4.02 4.81 -1.96 -2.86 114.58 119.98 1hqs h GLU 161 Ca -0.47 -0.20 -0.00 0.00 -0.13 0.00 0.00 59.36 58.56 1hqs h GLU 161 Cb 1.19 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.53 1hqs h GLU 161 CO 0.62 0.73 0.02 0.93 -0.73 0.00 0.00 179.01 180.58 1hqs h GLU 162 N 0.49 0.08 -0.20 1.92 3.07 -1.92 -1.72 114.58 116.30 1hqs h GLU 162 Ca 0.07 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 58.88 1hqs h GLU 162 Cb 0.65 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.53 1hqs h GLU 162 CO 0.05 0.21 -0.05 -0.24 -1.40 0.00 0.00 179.01 177.57 1hqs h VAL 163 N -0.06 1.16 -0.06 3.13 3.04 -1.78 -0.96 116.25 120.72 1hqs h VAL 163 Ca 0.02 -0.65 -0.01 0.00 -1.01 0.00 0.00 66.70 65.06 1hqs h VAL 163 Cb 0.15 1.07 -0.00 0.00 -2.01 0.00 0.00 31.29 30.50 1hqs h VAL 163 CO -0.00 0.21 0.01 -0.61 -1.01 0.00 0.00 177.57 176.17 1hqs h GLN 164 N 0.29 0.10 -0.67 4.17 -0.00 -1.27 0.17 115.11 117.90 1hqs h GLN 164 Ca 0.06 -0.03 0.03 0.00 -0.00 0.00 0.00 58.65 58.72 1hqs h GLN 164 Cb 0.28 -0.01 -0.04 0.00 0.00 0.00 0.00 27.48 27.71 1hqs h GLN 164 CO 0.01 0.31 0.41 0.87 0.00 0.00 0.00 178.83 180.43 1hqs h LYS 165 N -0.12 0.77 -0.09 1.69 1.57 -0.89 -0.30 116.57 119.20 1hqs h LYS 165 Ca 0.02 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1hqs h LYS 165 Cb 0.25 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 1hqs h LYS 165 CO 0.00 0.51 0.02 1.25 -0.57 0.00 0.00 179.45 180.66 1hqs h LEU 166 N 0.79 0.14 -0.56 2.94 5.85 -1.01 -0.84 115.31 122.62 1hqs h LEU 166 Ca 0.27 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1hqs h LEU 166 Cb 0.04 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1hqs h LEU 166 CO -0.12 0.35 0.29 0.40 -0.34 0.00 0.00 178.44 179.03 1hqs h ILE 167 N -0.09 1.19 -0.58 4.05 2.04 -0.77 -0.90 117.51 122.45 1hqs h ILE 167 Ca 0.03 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1hqs h ILE 167 Cb 0.27 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1hqs h ILE 167 CO 0.00 0.21 0.30 0.28 0.00 0.00 0.00 178.15 178.94 1hqs h SER 168 N 0.75 0.75 0.05 1.72 0.02 -0.98 -0.53 113.55 115.33 1hqs h SER 168 Ca 0.20 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1hqs h SER 168 Cb 0.07 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1hqs h SER 168 CO -0.03 0.65 -0.05 0.15 -1.14 0.00 0.00 176.83 176.40 1hqs h PHE 169 N 0.79 -0.14 -0.14 3.45 3.57 -0.78 0.41 116.94 124.10 1hqs h PHE 169 Ca 0.20 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.73 1hqs h PHE 169 Cb 0.08 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 1hqs h PHE 169 CO -0.01 -0.09 -0.03 -0.07 -2.23 0.00 0.00 178.31 175.89 1hqs h LEU 170 N -0.12 -0.11 -0.27 0.59 3.38 -0.94 0.20 115.31 118.04 1hqs h LEU 170 Ca 0.01 0.04 -0.16 0.00 0.09 0.00 0.00 57.88 57.85 1hqs h LEU 170 Cb 0.12 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1hqs h LEU 170 CO -0.02 -0.04 -0.47 1.56 0.09 0.00 0.00 178.44 179.57 1hqs h GLN 171 N 0.01 0.80 0.15 1.13 4.20 -0.95 -0.62 115.11 119.83 1hqs h GLN 171 Ca 0.07 -0.49 -0.34 0.00 0.06 0.00 0.00 58.65 57.94 1hqs h GLN 171 Cb 0.10 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 1hqs h GLN 171 CO -0.13 1.12 -1.76 -0.91 -0.67 0.00 0.00 178.83 176.48 1hqs h ASN 172 N 0.56 0.49 0.14 1.46 2.35 -0.15 -3.11 115.58 117.32 1hqs h ASN 172 Ca 0.02 -0.81 -0.35 0.00 -0.55 0.00 0.00 56.30 54.61 1hqs h ASN 172 Cb 1.07 -0.16 -0.06 0.00 0.05 0.00 0.00 38.32 39.22 1hqs h ASN 172 CO 0.11 1.69 -2.20 -0.62 -1.65 0.00 0.00 177.43 174.76 1hqs n GLU 173 N -3.51 0.67 -0.15 0.81 1.02 0.69 -4.40 120.64 115.77 1hqs n GLU 173 Ca -0.24 0.11 0.07 0.00 -0.02 0.00 0.00 57.16 57.08 1hqs n GLU 173 Cb 1.06 -1.60 0.15 0.00 -0.02 0.00 0.00 31.44 31.02 1hqs n GLU 173 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1hqs n LEU 174 N -2.93 2.83 -3.41 -4.62 4.77 -0.94 -5.00 117.00 107.70 1hqs n LEU 174 Ca -0.30 -1.65 -0.25 0.00 -0.03 0.00 0.00 56.01 53.78 1hqs n LEU 174 Cb 1.10 -0.19 0.02 0.00 -2.33 0.00 0.00 43.42 42.02 1hqs n LEU 174 CO 0.42 0.66 0.02 0.59 -1.33 0.00 0.00 177.39 177.74 1hqs n ASN 175 N 0.79 -4.77 -4.71 -1.43 3.02 -0.72 -4.92 115.26 102.52 1hqs n ASN 175 Ca 0.12 -0.46 -0.42 0.00 -0.03 0.00 0.00 54.58 53.79 1hqs n ASN 175 Cb 0.43 -3.87 -0.03 0.00 -0.61 0.00 0.00 39.78 35.70 1hqs n ASN 175 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1hqs s VAL 176 N -3.10 3.89 -0.02 2.41 1.01 -0.32 -4.89 120.40 119.38 1hqs s VAL 176 Ca 0.45 1.37 0.03 0.00 0.00 0.00 0.00 61.98 63.83 1hqs s VAL 176 Cb -0.22 -3.88 0.05 0.00 0.00 0.00 0.00 36.38 32.33 1hqs s VAL 176 CO 0.55 0.11 0.87 -0.46 0.00 0.00 0.00 175.10 176.18 1hqs n ASN 177 N 3.86 1.16 -0.84 3.32 0.23 -1.26 -4.33 115.26 117.40 1hqs n ASN 177 Ca 0.09 -1.89 0.12 0.00 -0.53 0.00 0.00 54.58 52.37 1hqs n ASN 177 Cb 0.46 -0.11 0.25 0.00 -2.08 0.00 0.00 39.78 38.30 1hqs n ASN 177 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1hqs n LYS 178 N -0.44 2.15 -2.63 -3.83 5.02 -1.26 -4.83 118.16 112.33 1hqs n LYS 178 Ca 0.03 -1.68 -0.43 0.00 -2.02 0.00 0.00 58.31 54.20 1hqs n LYS 178 Cb 0.46 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 33.98 1hqs n LYS 178 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1hqs s ILE 179 N -1.88 4.32 0.16 -0.18 1.01 -1.26 -4.92 121.20 118.45 1hqs s ILE 179 Ca 0.33 1.35 -0.14 0.00 0.00 0.00 0.00 60.65 62.19 1hqs s ILE 179 Cb 0.21 -4.53 0.05 0.00 0.01 0.00 0.00 42.46 38.19 1hqs s ILE 179 CO 0.31 -0.83 1.74 -0.09 0.00 0.00 0.00 174.94 176.07 1hqs h ARG 180 N 8.86 0.75 -2.36 2.79 9.65 -2.02 -3.36 114.38 128.69 1hqs h ARG 180 Ca -0.22 -0.11 -0.59 0.00 -1.10 0.00 0.00 59.98 57.95 1hqs h ARG 180 Cb 1.06 -0.13 -0.40 0.00 -1.39 0.00 0.00 29.97 29.11 1hqs h ARG 180 CO 1.09 0.63 -0.84 1.19 2.80 0.00 0.00 179.97 184.84 1hqs n PHE 181 N -4.58 1.22 0.23 2.20 3.72 -1.26 -4.98 117.46 114.01 1hqs n PHE 181 Ca 0.02 -3.80 0.14 0.00 -0.05 0.00 0.00 57.45 53.77 1hqs n PHE 181 Cb 0.12 -0.30 0.80 0.00 -0.94 0.00 0.00 39.48 39.16 1hqs n PHE 181 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1hqs h PRO 182 N 4.74 0.00 0.00 -1.08 0.13 -1.97 -2.61 132.00 131.20 1hqs h PRO 182 Ca 0.17 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1hqs h PRO 182 Cb 0.81 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.94 1hqs h PRO 182 CO 0.58 0.00 -0.01 0.93 -0.23 0.00 0.00 178.00 179.27 1hqs h GLU 183 N 0.00 0.00 0.00 0.86 4.39 -1.96 -3.33 114.58 114.54 1hqs h GLU 183 Ca 0.05 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 1hqs h GLU 183 Cb 0.25 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 1hqs h GLU 183 CO -0.00 0.01 -0.35 0.25 -1.16 0.00 0.00 179.01 177.76 1hqs n THR 184 N -3.10 0.95 -3.99 1.13 -2.24 -1.00 -4.82 114.28 101.21 1hqs n THR 184 Ca 0.02 -1.29 -0.31 0.00 -2.27 0.00 0.00 64.05 60.20 1hqs n THR 184 Cb 0.43 0.19 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 1hqs n THR 184 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hqs s SER 185 N -2.04 5.94 0.16 3.42 1.04 -1.10 -4.86 113.70 116.25 1hqs s SER 185 Ca 0.19 0.14 0.03 0.00 0.48 0.00 0.00 55.95 56.79 1hqs s SER 185 Cb 0.18 -1.72 -0.03 0.00 0.10 0.00 0.00 66.02 64.54 1hqs s SER 185 CO -0.01 0.18 0.30 -0.83 0.98 0.00 0.00 173.24 173.86 1hqs s GLY 186 N -2.38 1.63 -0.05 7.32 0.00 -1.26 -3.98 107.32 108.61 1hqs s GLY 186 Ca 0.31 -1.06 0.02 0.00 0.00 0.00 0.00 44.72 43.99 1hqs s GLY 186 CO 0.24 -1.06 -0.08 -0.42 0.00 0.00 0.00 173.10 171.77 1hqs s ILE 187 N -1.78 0.80 0.07 0.90 -1.09 -0.08 -4.94 121.20 115.09 1hqs s ILE 187 Ca 0.34 -0.30 0.06 0.00 -2.23 0.00 0.00 60.65 58.52 1hqs s ILE 187 Cb -0.11 -0.76 -0.04 0.00 -1.58 0.00 0.00 42.46 39.98 1hqs s ILE 187 CO 0.29 0.27 -0.08 -0.83 -1.23 0.00 0.00 174.94 173.36 1hqs s GLY 188 N 0.66 1.80 -0.13 6.18 0.00 -1.26 -1.11 107.32 113.45 1hqs s GLY 188 Ca -0.11 -1.16 -0.01 0.00 0.00 0.00 0.00 44.72 43.44 1hqs s GLY 188 CO 0.02 -1.10 -0.08 -0.42 0.00 0.00 0.00 173.10 171.51 1hqs s ILE 189 N -1.16 3.49 -0.34 0.90 -1.09 0.25 -4.98 121.20 118.26 1hqs s ILE 189 Ca 0.21 -0.51 0.03 0.00 -2.23 0.00 0.00 60.65 58.14 1hqs s ILE 189 Cb -0.11 -2.49 0.09 0.00 -1.58 0.00 0.00 42.46 38.38 1hqs s ILE 189 CO 0.13 0.52 0.05 -0.75 -1.23 0.00 0.00 174.94 173.66 1hqs s LYS 190 N 0.18 1.69 -0.17 2.79 2.20 -1.26 -4.53 119.74 120.64 1hqs s LYS 190 Ca -0.05 -1.78 -0.10 0.00 -0.36 0.00 0.00 55.97 53.69 1hqs s LYS 190 Cb -0.14 -3.22 -0.05 0.00 -1.51 0.00 0.00 37.83 32.91 1hqs s LYS 190 CO 0.04 -0.90 0.16 -2.14 -0.36 0.00 0.00 175.35 172.15 1hqs s PRO 191 N 0.97 3.96 -0.04 4.03 0.02 -1.26 -4.91 135.00 137.77 1hqs s PRO 191 Ca 0.07 -0.14 -0.01 0.00 0.02 0.00 0.00 61.00 60.95 1hqs s PRO 191 Cb -0.20 -3.34 0.03 0.00 0.02 0.00 0.00 34.50 31.01 1hqs s PRO 191 CO -0.07 0.45 0.02 0.08 -0.33 0.00 0.00 177.00 177.15 1hqs s VAL 192 N -0.09 0.15 0.35 3.83 1.01 -1.26 -0.16 120.40 124.23 1hqs s VAL 192 Ca 0.11 0.18 0.09 0.00 0.00 0.00 0.00 61.98 62.37 1hqs s VAL 192 Cb -0.12 -0.30 -0.07 0.00 0.00 0.00 0.00 36.38 35.89 1hqs s VAL 192 CO 0.01 0.18 -0.07 -0.94 0.00 0.00 0.00 175.10 174.28 1hqs s SER 193 N 1.55 3.72 0.11 3.32 1.04 -1.26 -4.88 113.70 117.30 1hqs s SER 193 Ca -0.02 -1.23 -0.13 0.00 0.48 0.00 0.00 55.95 55.04 1hqs s SER 193 Cb -0.13 -0.35 -0.08 0.00 0.10 0.00 0.00 66.02 65.56 1hqs s SER 193 CO -0.03 -0.26 1.43 -0.08 0.98 0.00 0.00 173.24 175.28 1hqs h GLU 194 N 1.98 0.78 -0.28 4.02 4.81 -1.98 -1.07 114.58 122.84 1hqs h GLU 194 Ca -0.42 -0.43 -0.03 0.00 -0.13 0.00 0.00 59.36 58.35 1hqs h GLU 194 Cb 1.25 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 1hqs h GLU 194 CO 0.72 1.05 0.07 0.93 -0.73 0.00 0.00 179.01 181.06 1hqs h GLU 195 N 0.55 0.45 -0.36 1.92 5.08 -1.99 -0.54 114.58 119.69 1hqs h GLU 195 Ca 0.05 -0.11 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1hqs h GLU 195 Cb 0.93 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 1hqs h GLU 195 CO 0.08 0.53 0.09 0.78 -1.00 0.00 0.00 179.01 179.49 1hqs h GLY 196 N 0.29 0.62 0.94 -3.84 0.00 -1.97 -2.65 103.07 96.46 1hqs h GLY 196 Ca 0.09 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1hqs h GLY 196 CO 0.00 0.36 0.12 -0.84 0.00 0.00 0.00 176.54 176.19 1hqs h THR 197 N 0.43 1.13 -0.18 4.70 2.02 -1.12 -2.90 112.91 116.99 1hqs h THR 197 Ca 0.11 -0.36 0.04 0.00 0.77 0.00 0.00 66.41 66.97 1hqs h THR 197 Cb 0.30 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 67.61 1hqs h THR 197 CO 0.00 0.13 -0.05 0.28 0.37 0.00 0.00 175.52 176.24 1hqs h SER 198 N 0.27 -0.19 -0.07 4.18 0.02 -1.03 0.35 113.55 117.07 1hqs h SER 198 Ca 0.08 0.06 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1hqs h SER 198 Cb 0.09 0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 1hqs h SER 198 CO -0.01 -0.07 -0.12 0.08 -1.14 0.00 0.00 176.83 175.57 1hqs h ARG 199 N -0.02 0.38 0.03 3.45 0.11 -1.50 0.06 114.38 116.90 1hqs h ARG 199 Ca 0.09 -0.10 -0.00 0.00 0.10 0.00 0.00 59.98 60.07 1hqs h ARG 199 Cb 0.15 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.18 1hqs h ARG 199 CO -0.19 0.50 -0.02 1.25 0.10 0.00 0.00 179.97 181.62 1hqs h LEU 200 N 0.36 -0.04 -1.00 0.08 7.12 -1.23 -2.46 115.31 118.15 1hqs h LEU 200 Ca 0.07 -0.42 -0.05 0.00 0.13 0.00 0.00 57.88 57.61 1hqs h LEU 200 Cb 0.43 0.01 -0.02 0.00 -0.53 0.00 0.00 40.66 40.54 1hqs h LEU 200 CO 0.02 0.40 0.12 0.58 -0.13 0.00 0.00 178.44 179.44 1hqs h VAL 201 N -0.49 1.23 -0.56 1.05 2.07 -0.76 -1.52 116.25 117.28 1hqs h VAL 201 Ca -0.00 -0.85 0.02 0.00 0.82 0.00 0.00 66.70 66.68 1hqs h VAL 201 Cb 0.45 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1hqs h VAL 201 CO 0.01 0.31 0.35 -0.09 0.02 0.00 0.00 177.57 178.17 1hqs h ARG 202 N 0.81 0.68 -0.67 1.57 2.43 -0.98 -0.47 114.38 117.75 1hqs h ARG 202 Ca 0.18 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1hqs h ARG 202 Cb 0.32 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 1hqs h ARG 202 CO 0.00 0.45 0.14 0.00 -1.51 0.00 0.00 179.97 179.05 1hqs h ALA 203 N 1.23 0.88 -0.35 2.80 0.00 -0.93 -0.62 119.26 122.27 1hqs h ALA 203 Ca 0.22 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1hqs h ALA 203 Cb -0.02 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1hqs h ALA 203 CO -0.07 0.62 0.16 0.00 0.00 0.00 0.00 179.25 179.96 1hqs h ALA 204 N 1.06 0.45 -0.40 0.00 0.00 -0.69 -1.47 119.26 118.21 1hqs h ALA 204 Ca 0.21 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1hqs h ALA 204 Cb 0.40 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1hqs h ALA 204 CO 0.01 0.02 0.04 0.82 0.00 0.00 0.00 179.25 180.14 1hqs h ILE 205 N 0.43 1.25 -0.84 0.00 2.04 -0.92 -1.28 117.51 118.18 1hqs h ILE 205 Ca 0.12 -0.91 0.06 0.00 1.00 0.00 0.00 64.86 65.13 1hqs h ILE 205 Cb 0.13 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.22 1hqs h ILE 205 CO -0.01 0.31 0.51 0.44 0.00 0.00 0.00 178.15 179.40 1hqs h ASP 206 N 0.51 0.80 -0.38 1.72 3.32 -1.04 -0.24 116.42 121.11 1hqs h ASP 206 Ca 0.12 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 1hqs h ASP 206 Cb 0.40 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1hqs h ASP 206 CO 0.01 0.51 0.11 0.22 -1.72 0.00 0.00 179.24 178.37 1hqs h TYR 207 N 0.93 0.62 -0.50 4.55 3.20 -1.07 0.13 116.97 124.83 1hqs h TYR 207 Ca 0.37 -0.07 0.03 0.00 3.14 0.00 0.00 58.73 62.20 1hqs h TYR 207 Cb 0.19 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.24 1hqs h TYR 207 CO -0.04 0.59 0.28 0.00 -1.64 0.00 0.00 178.16 177.35 1hqs h ALA 208 N 0.95 0.64 0.28 1.82 0.00 -0.24 0.15 119.26 122.86 1hqs h ALA 208 Ca 0.12 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1hqs h ALA 208 Cb 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1hqs h ALA 208 CO -0.00 -0.04 -0.14 0.82 0.00 0.00 0.00 179.25 179.89 1hqs h ILE 209 N 0.55 0.76 -0.94 0.00 2.04 -0.94 0.39 117.51 119.38 1hqs h ILE 209 Ca 0.21 -0.42 0.11 0.00 1.00 0.00 0.00 64.86 65.76 1hqs h ILE 209 Cb 0.06 0.99 -0.08 0.00 -0.74 0.00 0.00 36.82 37.05 1hqs h ILE 209 CO -0.11 0.09 0.57 -0.08 0.00 0.00 0.00 178.15 178.62 1hqs h GLU 210 N -0.60 0.91 -0.67 2.37 4.81 -0.50 -2.39 114.58 118.50 1hqs h GLU 210 Ca -0.04 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1hqs h GLU 210 Cb 0.43 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1hqs h GLU 210 CO 0.06 0.60 0.00 0.72 -0.73 0.00 0.00 179.01 179.66 1hqs n HIS 211 N -4.66 1.05 -3.37 0.92 8.25 0.49 -4.97 115.22 112.94 1hqs n HIS 211 Ca 0.17 -0.53 -0.24 0.00 -0.26 0.00 0.00 57.72 56.86 1hqs n HIS 211 Cb 0.31 -0.07 0.06 0.00 1.12 0.00 0.00 29.99 31.41 1hqs n HIS 211 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hqs n GLY 212 N 1.39 -0.53 3.82 -1.41 0.00 -0.07 -4.98 105.19 103.40 1hqs n GLY 212 Ca 0.24 0.20 -0.34 0.00 0.00 0.00 0.00 46.02 46.12 1hqs n GLY 212 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1hqs s ARG 213 N -6.07 4.26 0.43 1.61 1.81 -0.09 -5.00 118.95 115.89 1hqs s ARG 213 Ca 0.47 1.06 0.23 0.00 -1.72 0.00 0.00 55.73 55.77 1hqs s ARG 213 Cb -0.21 -2.38 0.39 0.00 -0.45 0.00 0.00 34.95 32.30 1hqs s ARG 213 CO 0.58 0.09 1.62 0.87 -0.68 0.00 0.00 175.30 177.78 1hqs h LYS 214 N 2.30 0.00 -2.81 3.54 1.79 -1.94 -3.44 116.57 116.01 1hqs h LYS 214 Ca -0.48 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.02 1hqs h LYS 214 Cb 1.18 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 31.72 1hqs h LYS 214 CO 0.63 0.07 0.29 -1.54 -1.08 0.00 0.00 179.45 177.82 1hqs s SER 215 N -6.20 -0.45 -0.14 0.86 1.04 -1.26 -2.32 113.70 105.22 1hqs s SER 215 Ca 0.06 -0.12 -0.00 0.00 0.48 0.00 0.00 55.95 56.36 1hqs s SER 215 Cb 0.06 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.78 1hqs s SER 215 CO 0.67 -0.96 -0.09 -0.69 0.98 0.00 0.00 173.24 173.16 1hqs s VAL 216 N -3.62 1.23 -0.26 5.02 1.01 0.04 -1.84 120.40 121.98 1hqs s VAL 216 Ca 0.04 -0.53 -0.08 0.00 0.00 0.00 0.00 61.98 61.41 1hqs s VAL 216 Cb -0.02 -1.27 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1hqs s VAL 216 CO -0.08 0.30 0.09 -0.89 0.00 0.00 0.00 175.10 174.52 1hqs s THR 217 N 1.61 4.38 -0.30 3.92 2.01 0.09 -1.42 115.64 125.93 1hqs s THR 217 Ca 0.03 -0.23 -0.27 0.00 0.31 0.00 0.00 61.69 61.52 1hqs s THR 217 Cb -0.14 -3.09 0.01 0.00 0.01 0.00 0.00 72.50 69.29 1hqs s THR 217 CO -0.09 0.27 0.98 -0.76 -0.69 0.00 0.00 174.62 174.34 1hqs s LEU 218 N 1.61 4.01 -0.19 4.42 1.43 0.14 -1.04 118.68 129.06 1hqs s LEU 218 Ca 0.06 1.00 -0.08 0.00 -1.03 0.00 0.00 54.13 54.08 1hqs s LEU 218 Cb -0.16 -3.40 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 1hqs s LEU 218 CO 0.04 -0.76 0.08 -0.69 0.23 0.00 0.00 176.35 175.25 1hqs s VAL 219 N 3.36 4.91 0.25 -1.59 1.01 -0.49 -1.16 120.40 126.70 1hqs s VAL 219 Ca 0.41 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 62.21 1hqs s VAL 219 Cb -0.13 -3.23 0.03 0.00 0.00 0.00 0.00 36.38 33.04 1hqs s VAL 219 CO 0.13 0.45 0.65 -1.38 0.00 0.00 0.00 175.10 174.94 1hqs s HIS 220 N 0.45 -0.16 -0.46 5.22 -0.00 -0.83 -4.34 115.29 115.16 1hqs s HIS 220 Ca 0.04 -0.24 0.07 0.00 -0.00 0.00 0.00 55.06 54.94 1hqs s HIS 220 Cb -0.12 0.58 0.40 0.00 -0.00 0.00 0.00 32.58 33.44 1hqs s HIS 220 CO 0.00 -1.11 1.02 1.17 -0.00 0.00 0.00 174.74 175.83 1hqs n LYS 221 N -0.42 2.94 0.01 -0.38 3.00 -1.26 0.12 118.16 122.17 1hqs n LYS 221 Ca -0.06 -4.38 0.07 0.00 -0.00 0.00 0.00 58.31 53.94 1hqs n LYS 221 Cb 0.61 -2.09 0.33 0.00 0.00 0.00 0.00 35.03 33.88 1hqs n LYS 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1hqs n GLY 222 N -0.32 -1.03 0.18 3.14 0.00 -1.26 -2.05 105.19 103.85 1hqs n GLY 222 Ca 0.32 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.43 1hqs n GLY 222 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1hqs h ASN 223 N 0.00 0.00 0.00 1.61 -1.07 -1.95 -3.28 115.58 110.89 1hqs h ASN 223 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 56.30 56.18 1hqs h ASN 223 Cb 0.26 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.48 1hqs h ASN 223 CO 0.00 0.00 -1.68 -0.38 0.07 0.00 0.00 177.43 175.44 1hqs n ILE 224 N -2.73 0.68 -3.55 6.14 2.08 -1.09 -4.78 119.36 116.10 1hqs n ILE 224 Ca 0.04 -0.23 -0.39 0.00 0.56 0.00 0.00 62.75 62.73 1hqs n ILE 224 Cb 0.44 -1.15 -0.05 0.00 -0.75 0.00 0.00 39.64 38.13 1hqs n ILE 224 CO 0.00 0.00 0.00 -0.04 0.56 0.00 0.00 176.55 177.07 1hqs s MET 225 N -2.23 3.55 0.20 0.38 -1.94 -0.87 -4.92 119.30 113.46 1hqs s MET 225 Ca -0.16 -3.26 -0.08 0.00 -1.71 0.00 0.00 55.69 50.47 1hqs s MET 225 Cb 0.05 -4.13 0.13 0.00 2.01 0.00 0.00 34.83 32.89 1hqs s MET 225 CO 0.25 -1.26 1.72 0.87 -0.01 0.00 0.00 175.02 176.60 1hqs h LYS 226 N 6.20 1.14 -0.01 2.03 1.57 -1.83 0.34 116.57 126.00 1hqs h LYS 226 Ca 0.16 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1hqs h LYS 226 Cb 0.83 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1hqs h LYS 226 CO 0.90 1.00 -0.18 1.19 -0.57 0.00 0.00 179.45 181.79 1hqs n PHE 227 N -4.23 0.00 0.00 -1.35 0.99 -1.26 -1.86 117.46 109.75 1hqs n PHE 227 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.50 1hqs n PHE 227 Cb 0.26 -0.07 0.00 0.00 -1.00 0.00 0.00 39.48 38.67 1hqs n PHE 227 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 1hqs n THR 228 N -0.24 0.00 -0.01 4.37 -2.24 -1.22 -4.48 114.28 110.46 1hqs n THR 228 Ca 0.14 0.02 -0.06 0.00 -2.27 0.00 0.00 64.05 61.87 1hqs n THR 228 Cb 0.37 -0.87 0.12 0.00 -2.10 0.00 0.00 70.33 67.86 1hqs n THR 228 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1hqs h GLU 229 N 0.00 0.57 -0.48 -0.78 5.08 -1.65 0.14 114.58 117.46 1hqs h GLU 229 Ca 0.00 -0.26 -0.12 0.00 -1.00 0.00 0.00 59.36 57.97 1hqs h GLU 229 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1hqs h GLU 229 CO 0.00 0.84 -0.18 0.78 -1.00 0.00 0.00 179.01 179.45 1hqs h GLY 230 N 1.04 1.05 1.27 -3.84 0.00 -0.89 -2.26 103.07 99.45 1hqs h GLY 230 Ca 0.05 -0.91 -0.07 0.00 0.00 0.00 0.00 47.33 46.39 1hqs h GLY 230 CO 0.07 0.83 0.03 0.00 0.00 0.00 0.00 176.54 177.47 1hqs h ALA 231 N 0.87 1.05 -0.41 3.60 0.00 -1.13 -2.10 119.26 121.15 1hqs h ALA 231 Ca 0.11 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.77 1hqs h ALA 231 Cb 0.75 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1hqs h ALA 231 CO 0.06 0.60 0.25 0.35 0.00 0.00 0.00 179.25 180.51 1hqs h PHE 232 N 0.83 0.47 -0.27 0.00 3.04 -0.74 0.18 116.94 120.45 1hqs h PHE 232 Ca 0.16 0.01 0.02 0.00 3.98 0.00 0.00 57.97 62.15 1hqs h PHE 232 Cb 0.45 -0.15 -0.03 0.00 2.56 0.00 0.00 35.95 38.78 1hqs h PHE 232 CO 0.03 0.28 0.11 -0.22 -2.02 0.00 0.00 178.31 176.48 1hqs h LYS 233 N 0.50 0.23 -0.24 1.11 3.64 -1.08 -0.11 116.57 120.62 1hqs h LYS 233 Ca 0.16 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 1hqs h LYS 233 Cb -0.01 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1hqs h LYS 233 CO -0.06 0.15 -0.00 -0.91 -2.27 0.00 0.00 179.45 176.36 1hqs h ASN 234 N 0.24 0.42 -0.49 4.20 2.35 -0.99 -1.64 115.58 119.68 1hqs h ASN 234 Ca 0.12 -0.31 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1hqs h ASN 234 Cb 0.07 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1hqs h ASN 234 CO -0.11 0.63 0.28 -0.50 -1.65 0.00 0.00 177.43 176.08 1hqs h TRP 235 N 0.20 0.68 -0.32 1.19 6.55 -0.55 0.31 115.95 124.01 1hqs h TRP 235 Ca 0.07 -0.01 -0.07 0.00 0.95 0.00 0.00 58.89 59.83 1hqs h TRP 235 Cb 0.41 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.48 1hqs h TRP 235 CO 0.04 0.48 -0.08 0.78 -1.05 0.00 0.00 178.44 178.61 1hqs h GLY 236 N 0.78 0.67 1.03 1.49 0.00 -0.76 -0.95 103.07 105.33 1hqs h GLY 236 Ca 0.18 -0.55 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 1hqs h GLY 236 CO -0.03 0.50 0.04 -0.97 0.00 0.00 0.00 176.54 176.08 1hqs h TYR 237 N 0.40 1.02 -0.17 5.60 0.05 -0.90 -2.23 116.97 120.74 1hqs h TYR 237 Ca 0.08 -0.16 -0.00 0.00 0.05 0.00 0.00 58.73 58.70 1hqs h TYR 237 Cb 0.57 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 1hqs h TYR 237 CO 0.05 0.92 0.09 0.93 -1.05 0.00 0.00 178.16 179.10 1hqs h GLU 238 N 0.83 0.23 -0.56 4.88 5.08 -0.89 -2.23 114.58 121.93 1hqs h GLU 238 Ca 0.16 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1hqs h GLU 238 Cb 0.48 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1hqs h GLU 238 CO 0.02 0.24 0.34 1.25 -1.00 0.00 0.00 179.01 179.86 1hqs h LEU 239 N 0.16 0.66 -0.15 1.33 6.46 -1.13 -0.54 115.31 122.09 1hqs h LEU 239 Ca 0.06 -0.05 0.04 0.00 -0.12 0.00 0.00 57.88 57.81 1hqs h LEU 239 Cb 0.07 -0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 39.79 1hqs h LEU 239 CO -0.01 0.52 -0.13 0.00 -0.62 0.00 0.00 178.44 178.20 1hqs h ALA 240 N 1.17 -0.01 -0.34 1.25 0.00 -1.23 -0.31 119.26 119.79 1hqs h ALA 240 Ca 0.20 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 1hqs h ALA 240 Cb -0.02 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1hqs h ALA 240 CO -0.04 -0.57 -0.42 0.93 0.00 0.00 0.00 179.25 179.15 1hqs h GLU 241 N -0.14 0.84 -0.22 0.00 5.08 -1.25 -0.81 114.58 118.08 1hqs h GLU 241 Ca 0.10 -0.46 -0.10 0.00 -1.00 0.00 0.00 59.36 57.90 1hqs h GLU 241 Cb 0.29 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1hqs h GLU 241 CO -0.24 1.10 -0.26 -0.22 -1.00 0.00 0.00 179.01 178.39 1hqs h LYS 242 N 0.68 0.57 0.00 2.33 3.64 -0.90 -2.75 116.57 120.14 1hqs h LYS 242 Ca 0.05 -0.31 -0.06 0.00 -1.27 0.00 0.00 60.65 59.05 1hqs h LYS 242 Cb 1.00 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1hqs h LYS 242 CO 0.10 0.91 -1.85 0.39 -2.27 0.00 0.00 179.45 176.73 1hqs n GLU 243 N -4.36 0.65 -0.90 1.90 1.02 -0.14 -4.52 120.64 114.29 1hqs n GLU 243 Ca -0.05 -0.09 0.05 0.00 -0.02 0.00 0.00 57.16 57.05 1hqs n GLU 243 Cb 0.45 -1.59 0.11 0.00 -0.02 0.00 0.00 31.44 30.38 1hqs n GLU 243 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1hqs n TYR 244 N -2.44 0.00 -0.39 -0.32 4.02 -0.32 -4.93 117.16 112.78 1hqs n TYR 244 Ca -0.08 -0.94 -0.07 0.00 -0.01 0.00 0.00 57.90 56.80 1hqs n TYR 244 Cb 0.67 -0.19 -0.04 0.00 -0.02 0.00 0.00 39.34 39.76 1hqs n TYR 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1hqs n GLY 245 N -0.42 -2.29 0.28 2.72 0.00 -1.04 -0.89 105.19 103.55 1hqs n GLY 245 Ca 0.12 1.11 0.17 0.00 0.00 0.00 0.00 46.02 47.42 1hqs n GLY 245 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1hqs h ASP 246 N 0.00 0.00 0.25 1.61 2.03 -1.91 -3.16 116.42 115.24 1hqs h ASP 246 Ca 0.22 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.52 1hqs h ASP 246 Cb 0.46 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.96 1hqs h ASP 246 CO -0.92 0.05 -0.75 0.29 -1.03 0.00 0.00 179.24 176.88 1hqs n LYS 247 N -3.23 0.01 -4.35 4.15 5.02 -0.07 -4.96 118.16 114.73 1hqs n LYS 247 Ca -0.01 -0.01 -0.18 0.00 -2.02 0.00 0.00 58.31 56.10 1hqs n LYS 247 Cb 0.25 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.66 1hqs n LYS 247 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1hqs s VAL 248 N -2.99 0.79 -0.08 -0.18 -7.23 -0.94 -1.30 120.40 108.46 1hqs s VAL 248 Ca 0.10 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.23 1hqs s VAL 248 Cb 0.17 -2.63 0.04 0.00 0.56 0.00 0.00 36.38 34.52 1hqs s VAL 248 CO 0.78 -0.05 0.07 0.12 -0.31 0.00 0.00 175.10 175.71 1hqs s PHE 249 N -3.59 0.11 0.27 2.82 5.36 -0.46 -4.81 117.98 117.68 1hqs s PHE 249 Ca 0.36 0.09 0.06 0.00 -0.96 0.00 0.00 56.93 56.48 1hqs s PHE 249 Cb 0.08 -0.55 -0.03 0.00 -0.34 0.00 0.00 43.02 42.18 1hqs s PHE 249 CO 0.13 -0.29 0.30 0.95 -1.46 0.00 0.00 175.22 174.85 1hqs s THR 250 N 2.16 4.55 0.30 0.12 -4.23 -1.26 -1.34 115.64 115.93 1hqs s THR 250 Ca 0.04 -1.21 0.18 0.00 -1.18 0.00 0.00 61.69 59.51 1hqs s THR 250 Cb -0.13 -3.53 0.14 0.00 1.34 0.00 0.00 72.50 70.32 1hqs s THR 250 CO -0.05 -0.30 1.83 -0.50 -0.54 0.00 0.00 174.62 175.06 1hqs h TRP 251 N 1.28 0.00 -0.76 3.99 4.06 -1.37 -1.21 115.95 121.93 1hqs h TRP 251 Ca -0.49 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.41 1hqs h TRP 251 Cb 1.24 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.37 1hqs h TRP 251 CO 0.50 0.34 0.26 0.00 -3.56 0.00 0.00 178.44 175.97 1hqs h ALA 252 N 1.66 1.01 -0.46 1.49 0.00 -1.95 -0.20 119.26 120.82 1hqs h ALA 252 Ca -0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1hqs h ALA 252 Cb 0.71 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1hqs h ALA 252 CO 0.04 0.67 0.10 0.37 0.00 0.00 0.00 179.25 180.43 1hqs h GLN 253 N 1.12 0.74 -0.17 0.00 4.15 -1.81 -1.63 115.11 117.52 1hqs h GLN 253 Ca 0.25 -0.19 0.03 0.00 0.77 0.00 0.00 58.65 59.51 1hqs h GLN 253 Cb 0.28 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 27.85 1hqs h GLN 253 CO -0.01 0.75 -0.04 -0.92 -1.93 0.00 0.00 178.83 176.68 1hqs h TYR 254 N 0.61 -0.08 -0.78 3.99 3.20 -0.57 -1.79 116.97 121.56 1hqs h TYR 254 Ca 0.14 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 1hqs h TYR 254 Cb 0.35 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.64 1hqs h TYR 254 CO 0.02 -0.06 0.35 -0.44 -1.64 0.00 0.00 178.16 176.38 1hqs h ASP 255 N 0.01 1.03 -0.35 -2.11 3.45 -0.87 -1.86 116.42 115.72 1hqs h ASP 255 Ca 0.08 -0.14 -0.07 0.00 0.43 0.00 0.00 57.03 57.33 1hqs h ASP 255 Cb 0.12 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.60 1hqs h ASP 255 CO -0.17 0.89 -0.03 0.03 -1.57 0.00 0.00 179.24 178.40 1hqs h ARG 256 N 1.11 0.73 -0.49 3.56 3.08 -0.95 -1.16 114.38 120.27 1hqs h ARG 256 Ca 0.26 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 60.02 1hqs h ARG 256 Cb 0.15 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1hqs h ARG 256 CO -0.03 0.77 -0.07 0.82 -1.07 0.00 0.00 179.97 180.39 1hqs h ILE 257 N 0.68 1.27 -0.00 2.04 2.04 -1.04 -2.09 117.51 120.41 1hqs h ILE 257 Ca 0.13 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.81 1hqs h ILE 257 Cb 0.46 1.04 -0.00 0.00 -0.74 0.00 0.00 36.82 37.58 1hqs h ILE 257 CO 0.02 0.41 -0.02 0.00 0.00 0.00 0.00 178.15 178.57 1hqs h ALA 258 N 0.91 -0.01 -0.58 1.87 0.00 -0.94 0.67 119.26 121.18 1hqs h ALA 258 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.14 1hqs h ALA 258 Cb 0.61 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1hqs h ALA 258 CO 0.04 -0.51 0.18 0.93 0.00 0.00 0.00 179.25 179.89 1hqs h GLU 259 N -0.03 0.34 0.18 0.00 5.08 -1.16 0.33 114.58 119.32 1hqs h GLU 259 Ca 0.01 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.09 1hqs h GLU 259 Cb 0.04 -0.08 0.03 0.00 0.50 0.00 0.00 28.75 29.24 1hqs h GLU 259 CO -0.02 0.22 -1.14 0.93 -1.00 0.00 0.00 179.01 178.00 1hqs h GLU 260 N 0.35 0.38 0.00 2.33 5.08 -1.17 -3.42 114.58 118.12 1hqs h GLU 260 Ca 0.29 -0.66 0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1hqs h GLU 260 Cb 0.38 0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1hqs h GLU 260 CO -0.32 1.31 0.00 1.04 -1.00 0.00 0.00 179.01 180.04 1hqs n GLN 261 N -3.95 0.34 0.00 2.33 6.02 0.23 -5.09 117.38 117.27 1hqs n GLN 261 Ca -0.16 -0.65 0.00 0.00 -0.01 0.00 0.00 57.00 56.17 1hqs n GLN 261 Cb 0.94 -0.84 0.00 0.00 1.02 0.00 0.00 30.24 31.36 1hqs n GLN 261 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1hqs n GLY 262 N -0.13 0.97 0.21 1.08 0.00 0.12 -4.29 105.19 103.15 1hqs n GLY 262 Ca 0.00 -1.86 0.05 0.00 0.00 0.00 0.00 46.02 44.21 1hqs n GLY 262 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1hqs h LYS 263 N 0.00 0.00 -0.10 1.61 3.64 -1.87 -2.59 116.57 117.26 1hqs h LYS 263 Ca 0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 1hqs h LYS 263 Cb 0.00 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1hqs h LYS 263 CO 0.00 0.26 -0.67 -0.44 -2.27 0.00 0.00 179.45 176.33 1hqs h ASP 264 N 0.00 0.77 -0.83 4.20 3.32 -1.96 -0.71 116.42 121.21 1hqs h ASP 264 Ca -0.00 -0.66 -0.03 0.00 0.02 0.00 0.00 57.03 56.37 1hqs h ASP 264 Cb 0.48 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 1hqs h ASP 264 CO 0.03 1.30 0.42 0.00 -1.72 0.00 0.00 179.24 179.28 1hqs h ALA 265 N 0.48 1.17 -0.27 3.45 0.00 -1.71 -0.19 119.26 122.18 1hqs h ALA 265 Ca -0.05 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1hqs h ALA 265 Cb 1.31 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1hqs h ALA 265 CO 0.14 0.64 -0.40 0.00 0.00 0.00 0.00 179.25 179.63 1hqs h ALA 266 N 1.28 0.80 -0.15 0.00 0.00 -1.42 -1.72 119.26 118.05 1hqs h ALA 266 Ca 0.29 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1hqs h ALA 266 Cb 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1hqs h ALA 266 CO -0.04 0.65 -0.45 -0.91 0.00 0.00 0.00 179.25 178.50 1hqs h ASN 267 N 0.53 0.39 -0.23 0.00 2.35 -0.49 -2.45 115.58 115.68 1hqs h ASN 267 Ca 0.05 -0.18 -0.12 0.00 -0.55 0.00 0.00 56.30 55.49 1hqs h ASN 267 Cb 0.92 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 39.18 1hqs h ASN 267 CO 0.08 0.79 -0.34 0.50 -1.65 0.00 0.00 177.43 176.81 1hqs h LYS 268 N 0.29 0.64 -0.75 0.81 3.64 -0.92 -2.84 116.57 117.44 1hqs h LYS 268 Ca 0.02 -0.38 -0.03 0.00 -1.27 0.00 0.00 60.65 58.99 1hqs h LYS 268 Cb 0.92 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 1hqs h LYS 268 CO 0.08 0.99 0.37 0.00 -2.27 0.00 0.00 179.45 178.62 1hqs h ALA 269 N 0.64 0.97 -0.42 5.00 0.00 -1.23 -2.05 119.26 122.18 1hqs h ALA 269 Ca 0.02 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1hqs h ALA 269 Cb 0.93 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 1hqs h ALA 269 CO 0.08 0.53 0.02 0.37 0.00 0.00 0.00 179.25 180.25 1hqs h GLN 270 N 1.06 0.72 -0.61 0.00 4.15 -1.45 -1.89 115.11 117.08 1hqs h GLN 270 Ca 0.26 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 59.45 1hqs h GLN 270 Cb 0.11 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.70 1hqs h GLN 270 CO -0.03 0.79 0.36 0.66 -1.93 0.00 0.00 178.83 178.68 1hqs h SER 271 N 0.56 0.74 -0.23 -0.69 4.64 -1.34 -0.26 113.55 116.98 1hqs h SER 271 Ca 0.12 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.35 1hqs h SER 271 Cb 0.45 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 1hqs h SER 271 CO 0.02 0.59 0.09 -0.33 -0.87 0.00 0.00 176.83 176.33 1hqs h GLU 272 N 0.83 0.41 -0.11 4.77 5.08 -1.25 0.26 114.58 124.58 1hqs h GLU 272 Ca 0.22 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.33 1hqs h GLU 272 Cb -0.01 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 1hqs h GLU 272 CO -0.04 0.37 -0.72 0.00 -1.00 0.00 0.00 179.01 177.62 1hqs h ALA 273 N 1.69 0.54 0.72 3.43 0.00 -0.70 -1.16 119.26 123.77 1hqs h ALA 273 Ca 0.10 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1hqs h ALA 273 Cb 0.14 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.88 1hqs h ALA 273 CO -0.01 0.74 -0.35 0.93 0.00 0.00 0.00 179.25 180.57 1hqs h GLU 274 N 0.35 -0.93 -0.82 0.00 4.39 -0.19 -0.87 114.58 116.51 1hqs h GLU 274 Ca -0.03 0.06 0.19 0.00 0.34 0.00 0.00 59.36 59.92 1hqs h GLU 274 Cb 1.31 0.21 -0.12 0.00 -0.10 0.00 0.00 28.75 30.06 1hqs h GLU 274 CO 0.13 -0.60 0.29 0.00 -1.16 0.00 0.00 179.01 177.68 1hqs h ALA 275 N -0.91 1.20 0.00 3.43 0.00 -0.96 0.12 119.26 122.13 1hqs h ALA 275 Ca -0.10 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1hqs h ALA 275 Cb 0.76 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1hqs h ALA 275 CO 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.09 1hqs n ALA 276 N -2.58 2.33 -1.11 0.00 0.00 -0.44 -4.88 120.51 113.83 1hqs n ALA 276 Ca 0.18 -0.11 -0.04 0.00 0.00 0.00 0.00 53.44 53.47 1hqs n ALA 276 Cb 0.55 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.69 1hqs n ALA 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hqs n GLY 277 N 0.40 0.68 3.76 0.00 0.00 0.42 -5.02 105.19 105.43 1hqs n GLY 277 Ca 0.13 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 1hqs n GLY 277 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hqs s LYS 278 N -2.10 4.51 -0.01 1.61 1.02 -0.35 -5.00 119.74 119.42 1hqs s LYS 278 Ca 0.00 1.73 -0.30 0.00 0.02 0.00 0.00 55.97 57.42 1hqs s LYS 278 Cb 0.00 -3.02 -0.03 0.00 -0.52 0.00 0.00 37.83 34.26 1hqs s LYS 278 CO 0.00 0.12 0.99 0.42 -0.92 0.00 0.00 175.35 175.96 1hqs s ILE 279 N -1.29 4.85 -0.11 2.17 1.01 -0.42 -4.69 121.20 122.72 1hqs s ILE 279 Ca 0.48 2.05 -0.28 0.00 0.00 0.00 0.00 60.65 62.90 1hqs s ILE 279 Cb -0.29 -4.32 -0.01 0.00 0.01 0.00 0.00 42.46 37.85 1hqs s ILE 279 CO 0.37 0.14 0.95 -0.63 0.00 0.00 0.00 174.94 175.78 1hqs s ILE 280 N 1.14 4.82 -0.31 2.92 -1.09 -0.98 -1.35 121.20 126.35 1hqs s ILE 280 Ca 0.52 1.93 -0.08 0.00 -2.23 0.00 0.00 60.65 60.78 1hqs s ILE 280 Cb -0.21 -4.26 0.00 0.00 -1.58 0.00 0.00 42.46 36.41 1hqs s ILE 280 CO 0.27 0.03 0.11 -0.63 -1.23 0.00 0.00 174.94 173.49 1hqs s ILE 281 N 1.93 4.24 0.21 2.92 -1.09 -0.45 -0.78 121.20 128.17 1hqs s ILE 281 Ca 0.46 -0.60 0.02 0.00 -2.23 0.00 0.00 60.65 58.29 1hqs s ILE 281 Cb -0.18 -3.19 -0.01 0.00 -1.58 0.00 0.00 42.46 37.50 1hqs s ILE 281 CO 0.17 0.05 0.07 2.29 -1.23 0.00 0.00 174.94 176.30 1hqs n LYS 282 N 4.92 0.78 -3.81 2.79 2.85 -0.51 -0.84 118.16 124.34 1hqs n LYS 282 Ca -0.14 -1.74 -0.11 0.00 -1.05 0.00 0.00 58.31 55.26 1hqs n LYS 282 Cb 0.48 0.93 -0.08 0.00 -0.65 0.00 0.00 35.03 35.72 1hqs n LYS 282 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1hqs s ASP 283 N -2.27 -0.04 -0.04 -5.58 -4.77 -1.26 -0.68 116.67 102.03 1hqs s ASP 283 Ca 0.10 -0.28 -0.02 0.00 -3.30 0.00 0.00 52.55 49.06 1hqs s ASP 283 Cb 0.00 0.31 0.03 0.00 -1.09 0.00 0.00 42.92 42.18 1hqs s ASP 283 CO 0.07 -0.57 0.09 -0.55 0.70 0.00 0.00 175.17 174.91 1hqs s SER 284 N -2.03 -0.03 0.21 2.11 0.15 -0.30 -4.88 113.70 108.93 1hqs s SER 284 Ca -0.06 0.17 -0.30 0.00 0.70 0.00 0.00 55.95 56.46 1hqs s SER 284 Cb -0.01 0.08 -0.09 0.00 -1.71 0.00 0.00 66.02 64.28 1hqs s SER 284 CO -0.03 -0.12 1.38 -0.63 1.20 0.00 0.00 173.24 175.04 1hqs s ILE 285 N 0.92 2.95 0.24 6.45 -1.09 -1.25 -1.97 121.20 127.44 1hqs s ILE 285 Ca -0.07 0.78 -0.06 0.00 -2.23 0.00 0.00 60.65 59.06 1hqs s ILE 285 Cb -0.10 -3.50 0.23 0.00 -1.58 0.00 0.00 42.46 37.51 1hqs s ILE 285 CO -0.04 0.11 1.68 0.00 -1.23 0.00 0.00 174.94 175.47 1hqs h ALA 286 N 5.36 0.88 -0.45 9.38 0.00 -0.66 0.14 119.26 133.91 1hqs h ALA 286 Ca -0.45 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 1hqs h ALA 286 Cb 1.21 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 1hqs h ALA 286 CO 0.78 -0.35 -0.09 0.38 0.00 0.00 0.00 179.25 179.97 1hqs h ASP 287 N 0.23 0.77 -0.46 0.00 3.04 -1.91 -2.16 116.42 115.93 1hqs h ASP 287 Ca 0.40 -0.22 -0.14 0.00 -3.24 0.00 0.00 57.03 53.83 1hqs h ASP 287 Cb 0.68 -0.21 -0.01 0.00 -1.04 0.00 0.00 39.33 38.75 1hqs h ASP 287 CO -0.52 0.89 -0.26 0.40 -2.04 0.00 0.00 179.24 177.71 1hqs h ILE 288 N 0.72 1.27 -0.87 4.15 1.08 -1.70 -2.98 117.51 119.18 1hqs h ILE 288 Ca 0.13 -1.42 0.02 0.00 -0.39 0.00 0.00 64.86 63.19 1hqs h ILE 288 Cb 0.56 1.18 -0.05 0.00 -3.07 0.00 0.00 36.82 35.44 1hqs h ILE 288 CO 0.03 0.49 0.57 0.15 -0.69 0.00 0.00 178.15 178.70 1hqs h PHE 289 N 0.84 1.07 0.00 1.37 3.57 -0.50 -0.15 116.94 123.14 1hqs h PHE 289 Ca 0.10 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1hqs h PHE 289 Cb 0.84 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 1hqs h PHE 289 CO 0.06 0.64 -0.02 -0.07 -2.23 0.00 0.00 178.31 176.69 1hqs h LEU 290 N 1.13 0.00 0.10 0.59 3.38 -1.24 -0.88 115.31 118.39 1hqs h LEU 290 Ca 0.33 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.04 1hqs h LEU 290 Cb -0.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1hqs h LEU 290 CO -0.09 0.02 -1.36 1.56 0.09 0.00 0.00 178.44 178.65 1hqs h GLN 291 N 0.00 0.22 0.00 1.13 4.20 -1.12 -3.39 115.11 116.15 1hqs h GLN 291 Ca -0.00 -0.37 -0.04 0.00 0.06 0.00 0.00 58.65 58.31 1hqs h GLN 291 Cb 0.05 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1hqs h GLN 291 CO 0.00 1.18 -0.17 1.96 -0.67 0.00 0.00 178.83 181.13 1hqs h GLN 292 N -0.37 0.00 0.00 1.46 4.20 -0.34 -1.11 115.11 118.94 1hqs h GLN 292 Ca -0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1hqs h GLN 292 Cb 1.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.48 1hqs h GLN 292 CO 0.04 0.17 0.00 -0.84 -0.67 0.00 0.00 178.83 177.53 1hqs h ILE 293 N 0.00 0.00 0.04 2.54 3.07 -1.38 0.63 117.51 122.42 1hqs h ILE 293 Ca -0.00 -0.29 -0.37 0.00 1.55 0.00 0.00 64.86 65.74 1hqs h ILE 293 Cb 0.34 1.08 -0.05 0.00 -0.27 0.00 0.00 36.82 37.92 1hqs h ILE 293 CO 0.02 0.00 -2.15 0.18 -1.05 0.00 0.00 178.15 175.16 1hqs n LEU 294 N -2.41 2.50 0.06 0.16 4.77 -0.50 -3.96 117.00 117.63 1hqs n LEU 294 Ca 0.02 0.15 -0.10 0.00 -0.03 0.00 0.00 56.01 56.05 1hqs n LEU 294 Cb 0.25 -0.97 -0.13 0.00 -2.33 0.00 0.00 43.42 40.24 1hqs n LEU 294 CO 0.21 0.74 -0.02 0.71 -1.33 0.00 0.00 177.39 177.71 1hqs h THR 295 N -0.33 1.53 -0.75 -5.08 1.35 -1.27 -3.42 112.91 104.94 1hqs h THR 295 Ca -0.52 -3.21 -0.33 0.00 -0.55 0.00 0.00 66.41 61.80 1hqs h THR 295 Cb 1.79 2.82 -0.26 0.00 -1.73 0.00 0.00 68.15 70.77 1hqs h THR 295 CO -0.12 0.89 -0.75 -2.11 -0.25 0.00 0.00 175.52 173.19 1hqs n ARG 296 N -3.37 1.04 0.31 4.72 1.85 0.19 -4.99 116.66 116.42 1hqs n ARG 296 Ca -0.05 -2.52 0.19 0.00 -1.00 0.00 0.00 57.85 54.47 1hqs n ARG 296 Cb 0.98 -1.15 1.02 0.00 -1.05 0.00 0.00 32.46 32.26 1hqs n ARG 296 CO 0.00 0.00 0.00 -1.00 -0.01 0.00 0.00 177.63 176.62 1hqs h PRO 297 N 2.87 0.00 0.00 2.89 0.13 -1.63 -2.44 132.00 133.83 1hqs h PRO 297 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1hqs h PRO 297 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1hqs h PRO 297 CO 0.26 0.02 0.00 0.27 -0.23 0.00 0.00 178.00 178.32 1hqs n ASN 298 N -3.41 0.00 -0.28 1.44 6.94 -1.22 -1.93 115.26 116.80 1hqs n ASN 298 Ca -0.03 0.48 0.15 0.00 -0.02 0.00 0.00 54.58 55.16 1hqs n ASN 298 Cb 0.11 -0.49 0.66 0.00 -2.36 0.00 0.00 39.78 37.71 1hqs n ASN 298 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1hqs n GLU 299 N -1.49 1.31 -4.83 -3.83 1.02 -0.92 -4.85 120.64 107.05 1hqs n GLU 299 Ca 0.03 -0.55 -0.28 0.00 -0.02 0.00 0.00 57.16 56.33 1hqs n GLU 299 Cb 0.12 -1.49 -0.15 0.00 -0.02 0.00 0.00 31.44 29.90 1hqs n GLU 299 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1hqs s PHE 300 N -2.07 2.03 0.00 -0.32 0.08 -0.81 -5.03 117.98 111.85 1hqs s PHE 300 Ca 0.40 -0.39 0.00 0.00 0.12 0.00 0.00 56.93 57.06 1hqs s PHE 300 Cb 0.21 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.43 1hqs s PHE 300 CO 0.37 0.08 0.00 -0.25 -0.10 0.00 0.00 175.22 175.32 1hqs n ASP 301 N 1.96 0.00 -4.82 1.36 9.92 -1.26 -4.70 116.55 119.02 1hqs n ASP 301 Ca -0.17 0.00 -0.38 0.00 -0.53 0.00 0.00 54.79 53.72 1hqs n ASP 301 Cb 0.53 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.94 1hqs n ASP 301 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1hqs s VAL 302 N 0.00 5.15 -0.07 2.53 1.01 -0.77 -1.06 120.40 127.19 1hqs s VAL 302 Ca 0.00 0.72 0.04 0.00 0.00 0.00 0.00 61.98 62.74 1hqs s VAL 302 Cb 0.00 -3.67 0.00 0.00 0.00 0.00 0.00 36.38 32.72 1hqs s VAL 302 CO 0.00 0.54 -0.18 -0.69 0.00 0.00 0.00 175.10 174.76 1hqs s VAL 303 N -0.73 1.59 -0.16 2.92 1.01 -0.27 -0.73 120.40 124.03 1hqs s VAL 303 Ca 0.22 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.44 1hqs s VAL 303 Cb -0.15 -1.38 0.01 0.00 0.00 0.00 0.00 36.38 34.85 1hqs s VAL 303 CO 0.11 0.45 -0.19 0.00 0.00 0.00 0.00 175.10 175.47 1hqs s ALA 304 N 0.28 2.36 0.33 5.51 0.00 -0.20 0.84 121.76 130.87 1hqs s ALA 304 Ca -0.11 -1.11 -0.06 0.00 0.00 0.00 0.00 51.96 50.67 1hqs s ALA 304 Cb -0.15 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 21.85 1hqs s ALA 304 CO 0.05 -0.12 0.51 -0.08 0.00 0.00 0.00 175.76 176.12 1hqs s THR 305 N 0.95 0.00 0.88 0.00 -1.32 -0.21 -1.39 115.64 114.55 1hqs s THR 305 Ca -0.03 -1.49 -0.14 0.00 -1.21 0.00 0.00 61.69 58.82 1hqs s THR 305 Cb -0.15 -2.59 0.13 0.00 -1.51 0.00 0.00 72.50 68.39 1hqs s THR 305 CO -0.04 0.00 1.24 -0.04 -2.21 0.00 0.00 174.62 173.57 1hqs s MET 306 N -3.16 1.34 0.09 7.08 -1.94 -1.26 -1.09 119.30 120.36 1hqs s MET 306 Ca 0.27 -0.11 -0.34 0.00 -1.71 0.00 0.00 55.69 53.80 1hqs s MET 306 Cb -0.01 -1.90 -0.15 0.00 2.01 0.00 0.00 34.83 34.78 1hqs s MET 306 CO 0.17 -1.99 1.57 -0.97 -0.01 0.00 0.00 175.02 173.79 1hqs h ASN 307 N -1.34 -1.35 0.15 3.03 -0.73 -1.81 0.14 115.58 113.67 1hqs h ASN 307 Ca -0.45 0.12 -0.01 0.00 1.87 0.00 0.00 56.30 57.83 1hqs h ASN 307 Cb 1.29 0.46 0.00 0.00 0.27 0.00 0.00 38.32 40.34 1hqs h ASN 307 CO 0.54 -0.60 -0.07 0.25 -0.37 0.00 0.00 177.43 177.17 1hqs h LEU 308 N -0.88 -0.17 -0.90 0.34 6.46 -1.90 -1.83 115.31 116.42 1hqs h LEU 308 Ca -0.03 -0.18 0.09 0.00 -0.12 0.00 0.00 57.88 57.64 1hqs h LEU 308 Cb 0.80 0.04 -0.07 0.00 -0.73 0.00 0.00 40.66 40.71 1hqs h LEU 308 CO -0.13 0.08 0.55 0.78 -0.62 0.00 0.00 178.44 179.10 1hqs h ASN 309 N -0.43 0.83 -0.90 1.25 2.35 -1.96 -1.14 115.58 115.59 1hqs h ASN 309 Ca -0.02 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1hqs h ASN 309 Cb 0.34 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.53 1hqs h ASN 309 CO 0.03 0.49 0.59 1.23 -1.65 0.00 0.00 177.43 178.12 1hqs h GLY 310 N 0.95 1.28 0.99 2.83 0.00 -0.56 0.10 103.07 108.65 1hqs h GLY 310 Ca 0.42 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1hqs h GLY 310 CO -0.22 0.48 -0.22 -1.80 0.00 0.00 0.00 176.54 174.78 1hqs h ASP 311 N 1.23 -0.54 -0.18 0.19 -0.00 -0.36 -1.22 116.42 115.54 1hqs h ASP 311 Ca 0.33 0.02 -0.00 0.00 -0.00 0.00 0.00 57.03 57.38 1hqs h ASP 311 Cb -0.12 0.14 -0.01 0.00 -0.00 0.00 0.00 39.33 39.34 1hqs h ASP 311 CO -0.07 -0.37 0.10 1.88 -0.00 0.00 0.00 179.24 180.77 1hqs h TYR 312 N -0.61 0.24 -0.56 0.28 -1.99 -1.08 -2.79 116.97 110.46 1hqs h TYR 312 Ca -0.06 -0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.66 1hqs h TYR 312 Cb 0.48 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 39.10 1hqs h TYR 312 CO -0.05 0.23 0.34 0.82 -0.00 0.00 0.00 178.16 179.50 1hqs h ILE 313 N 0.18 1.16 -0.75 -2.88 2.04 -0.80 -1.54 117.51 114.94 1hqs h ILE 313 Ca 0.06 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1hqs h ILE 313 Cb 0.07 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 1hqs h ILE 313 CO -0.01 0.16 0.46 0.28 0.00 0.00 0.00 178.15 179.04 1hqs h SER 314 N 0.75 0.89 -0.22 1.72 0.02 -1.18 -1.33 113.55 114.20 1hqs h SER 314 Ca 0.20 -0.05 -0.18 0.00 -0.84 0.00 0.00 61.79 60.92 1hqs h SER 314 Cb -0.03 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.28 1hqs h SER 314 CO -0.04 0.68 -0.52 0.44 -1.14 0.00 0.00 176.83 176.25 1hqs h ASP 315 N 1.02 0.89 -0.78 3.07 3.45 -1.31 -0.13 116.42 122.62 1hqs h ASP 315 Ca 0.27 -0.46 -0.04 0.00 0.43 0.00 0.00 57.03 57.23 1hqs h ASP 315 Cb -0.06 -0.25 -0.04 0.00 -0.56 0.00 0.00 39.33 38.43 1hqs h ASP 315 CO -0.05 1.24 0.34 0.00 -1.57 0.00 0.00 179.24 179.20 1hqs h ALA 316 N 0.78 1.11 -0.11 3.45 0.00 -1.08 -1.88 119.26 121.54 1hqs h ALA 316 Ca 0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1hqs h ALA 316 Cb 1.11 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1hqs h ALA 316 CO 0.11 0.65 -0.13 -0.07 0.00 0.00 0.00 179.25 179.81 1hqs h LEU 317 N 1.13 0.31 -1.15 0.00 3.38 -1.15 -3.16 115.31 114.67 1hqs h LEU 317 Ca 0.27 -0.50 0.14 0.00 0.09 0.00 0.00 57.88 57.88 1hqs h LEU 317 Cb 0.17 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.76 1hqs h LEU 317 CO -0.03 0.74 0.60 0.00 0.09 0.00 0.00 178.44 179.84 1hqs h ALA 318 N 0.58 1.70 0.00 1.53 0.00 -0.78 0.94 119.26 123.23 1hqs h ALA 318 Ca 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1hqs h ALA 318 Cb 0.66 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1hqs h ALA 318 CO 0.03 0.04 -0.03 0.00 0.00 0.00 0.00 179.25 179.29 1hqs h ALA 319 N 1.58 1.40 0.00 0.00 0.00 -1.31 0.28 119.26 121.21 1hqs h ALA 319 Ca 0.48 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.26 1hqs h ALA 319 Cb 0.66 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1hqs h ALA 319 CO -0.25 0.04 -0.48 1.96 0.00 0.00 0.00 179.25 180.52 1hqs h GLN 320 N 0.00 0.00 0.00 0.00 4.20 -0.86 -3.37 115.11 115.08 1hqs h GLN 320 Ca -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1hqs h GLN 320 Cb 0.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1hqs h GLN 320 CO 0.00 0.48 -0.50 1.33 -0.67 0.00 0.00 178.83 179.47 1hqs n VAL 321 N -3.44 2.05 0.00 -0.54 0.24 -0.42 -4.58 118.33 111.63 1hqs n VAL 321 Ca 0.00 -3.05 0.00 0.00 -2.04 0.00 0.00 64.34 59.25 1hqs n VAL 321 Cb 0.62 -0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 1hqs n VAL 321 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1hqs n GLY 322 N -1.04 1.77 7.00 7.63 0.00 -1.08 -4.71 105.19 114.77 1hqs n GLY 322 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1hqs n GLY 322 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqs n GLY 323 N 0.00 -0.95 0.36 -0.02 0.00 0.84 -4.23 105.19 101.19 1hqs n GLY 323 Ca 0.00 -1.21 -0.00 0.00 0.00 0.00 0.00 46.02 44.81 1hqs n GLY 323 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1hqs h ILE 324 N 0.00 1.21 0.00 -0.61 2.04 -1.93 -1.53 117.51 116.69 1hqs h ILE 324 Ca 0.00 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1hqs h ILE 324 Cb 0.00 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.07 1hqs h ILE 324 CO 0.00 0.20 0.00 0.61 0.00 0.00 0.00 178.15 178.96 1hqs n GLY 325 N -1.41 -0.51 0.00 5.37 0.00 -1.26 -3.13 105.19 104.24 1hqs n GLY 325 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.10 1hqs n GLY 325 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1hqs n ILE 326 N -1.40 0.00 -2.42 -0.61 3.06 -1.03 -2.49 119.36 114.47 1hqs n ILE 326 Ca 0.01 -0.04 -0.43 0.00 -2.50 0.00 0.00 62.75 59.79 1hqs n ILE 326 Cb 0.03 1.15 -0.02 0.00 0.54 0.00 0.00 39.64 41.34 1hqs n ILE 326 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1hqs s ALA 327 N -0.07 3.50 0.35 1.51 0.00 -0.61 -4.22 121.76 122.23 1hqs s ALA 327 Ca 0.00 0.27 0.02 0.00 0.00 0.00 0.00 51.96 52.25 1hqs s ALA 327 Cb 0.00 -3.70 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 1hqs s ALA 327 CO 0.00 -1.49 0.53 -1.25 0.00 0.00 0.00 175.76 173.55 1hqs s PRO 328 N 3.86 3.36 0.05 0.00 0.04 -1.26 -3.06 135.00 137.99 1hqs s PRO 328 Ca 0.56 -0.50 -0.11 0.00 0.04 0.00 0.00 61.00 60.98 1hqs s PRO 328 Cb -0.19 -2.70 0.01 0.00 0.04 0.00 0.00 34.50 31.66 1hqs s PRO 328 CO 0.19 0.11 0.24 0.20 0.04 0.00 0.00 177.00 177.78 1hqs s GLY 329 N -4.07 -0.02 -0.04 0.56 0.00 -0.15 -4.31 107.32 99.28 1hqs s GLY 329 Ca 0.41 -0.23 -0.01 0.00 0.00 0.00 0.00 44.72 44.89 1hqs s GLY 329 CO 0.35 -0.42 0.06 0.00 0.00 0.00 0.00 173.10 173.09 1hqs s ALA 330 N -2.82 0.05 -0.35 3.20 0.00 -0.54 -1.64 121.76 119.66 1hqs s ALA 330 Ca -0.03 0.35 -0.14 0.00 0.00 0.00 0.00 51.96 52.14 1hqs s ALA 330 Cb 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 23.12 22.71 1hqs s ALA 330 CO -0.05 -0.23 0.29 -0.80 0.00 0.00 0.00 175.76 174.97 1hqs s ASN 331 N 1.43 6.11 -0.02 0.00 0.01 0.38 -0.06 114.94 122.79 1hqs s ASN 331 Ca -0.05 -0.39 0.02 0.00 -0.71 0.00 0.00 52.86 51.74 1hqs s ASN 331 Cb -0.13 -2.16 -0.00 0.00 0.41 0.00 0.00 41.25 39.37 1hqs s ASN 331 CO -0.04 -0.29 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.55 1hqs s ILE 332 N 1.84 0.68 -0.44 0.60 1.01 0.55 -0.71 121.20 124.72 1hqs s ILE 332 Ca 0.08 -0.33 -0.11 0.00 0.00 0.00 0.00 60.65 60.29 1hqs s ILE 332 Cb -0.17 -0.60 0.08 0.00 0.01 0.00 0.00 42.46 41.78 1hqs s ILE 332 CO 0.11 0.21 0.31 0.21 0.00 0.00 0.00 174.94 175.78 1hqs s ASN 333 N 0.04 5.80 0.54 3.58 3.84 -0.39 -1.71 114.94 126.63 1hqs s ASN 333 Ca -0.00 -1.49 0.31 0.00 0.21 0.00 0.00 52.86 51.89 1hqs s ASN 333 Cb -0.06 -2.05 1.48 0.00 -0.55 0.00 0.00 41.25 40.07 1hqs s ASN 333 CO -0.00 -0.58 2.06 1.88 -2.79 0.00 0.00 177.10 177.66 1hqs h TYR 334 N 8.52 0.00 0.13 0.43 -1.99 -1.91 -1.75 116.97 120.39 1hqs h TYR 334 Ca -0.24 0.00 -0.26 0.00 2.00 0.00 0.00 58.73 60.22 1hqs h TYR 334 Cb 1.09 0.00 0.03 0.00 2.00 0.00 0.00 36.73 39.85 1hqs h TYR 334 CO 0.62 0.10 -1.11 0.93 -0.00 0.00 0.00 178.16 178.70 1hqs h GLU 335 N 0.00 0.52 0.00 4.88 5.08 -1.92 -3.37 114.58 119.76 1hqs h GLU 335 Ca -0.00 -0.73 0.00 0.00 -1.00 0.00 0.00 59.36 57.63 1hqs h GLU 335 Cb 0.39 0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1hqs h GLU 335 CO 0.01 1.33 -1.23 0.25 -1.00 0.00 0.00 179.01 178.37 1hqs n THR 336 N -3.91 0.11 0.00 1.13 -2.24 -1.20 -4.02 114.28 104.14 1hqs n THR 336 Ca -0.14 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1hqs n THR 336 Cb 0.93 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 1hqs n THR 336 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hqs n GLY 337 N 1.37 2.29 3.77 3.38 0.00 -0.66 -4.79 105.19 110.54 1hqs n GLY 337 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1hqs n GLY 337 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1hqs s HIS 338 N -2.29 2.86 -0.15 1.61 3.76 -1.24 -4.80 115.29 115.03 1hqs s HIS 338 Ca 0.00 1.44 -0.28 0.00 -0.15 0.00 0.00 55.06 56.07 1hqs s HIS 338 Cb 0.00 -3.61 0.07 0.00 1.11 0.00 0.00 32.58 30.16 1hqs s HIS 338 CO 0.00 -1.93 0.73 0.00 -0.85 0.00 0.00 174.74 172.69 1hqs s ALA 339 N -1.30 -1.79 -0.10 -1.40 0.00 -0.46 -1.27 121.76 115.44 1hqs s ALA 339 Ca 0.57 1.64 0.01 0.00 0.00 0.00 0.00 51.96 54.18 1hqs s ALA 339 Cb -0.36 -0.56 0.02 0.00 0.00 0.00 0.00 23.12 22.22 1hqs s ALA 339 CO 0.46 -0.35 -0.13 0.42 0.00 0.00 0.00 175.76 176.17 1hqs s ILE 340 N -0.51 1.31 -0.12 0.00 1.01 0.11 -1.49 121.20 121.50 1hqs s ILE 340 Ca -0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 60.65 60.01 1hqs s ILE 340 Cb -0.02 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 1hqs s ILE 340 CO 0.05 0.41 0.10 -0.36 0.00 0.00 0.00 174.94 175.14 1hqs s PHE 341 N 1.12 3.44 0.18 3.97 0.40 0.16 -0.47 117.98 126.78 1hqs s PHE 341 Ca -0.05 0.38 -0.23 0.00 -0.60 0.00 0.00 56.93 56.43 1hqs s PHE 341 Cb -0.14 -1.93 0.06 0.00 0.51 0.00 0.00 43.02 41.51 1hqs s PHE 341 CO -0.03 0.58 0.71 -1.83 0.70 0.00 0.00 175.22 175.35 1hqs s GLU 342 N -0.75 1.37 0.59 0.44 -1.05 -0.65 -0.57 118.70 118.08 1hqs s GLU 342 Ca 0.13 -0.63 -0.13 0.00 -0.15 0.00 0.00 54.97 54.18 1hqs s GLU 342 Cb -0.12 0.55 -0.05 0.00 -0.44 0.00 0.00 34.13 34.08 1hqs s GLU 342 CO 0.03 -0.61 1.02 0.00 0.95 0.00 0.00 175.26 176.64 1hqs s ALA 343 N -3.68 2.99 0.28 -0.84 0.00 -1.26 -0.98 121.76 118.27 1hqs s ALA 343 Ca 0.06 0.08 0.16 0.00 0.00 0.00 0.00 51.96 52.26 1hqs s ALA 343 Cb -0.03 -3.12 0.70 0.00 0.00 0.00 0.00 23.12 20.67 1hqs s ALA 343 CO -0.05 -0.61 1.77 1.79 0.00 0.00 0.00 175.76 178.66 1hqs h THR 344 N 0.15 1.10 0.00 0.00 1.35 -1.84 -3.45 112.91 110.22 1hqs h THR 344 Ca -0.45 -1.48 0.00 0.00 -0.55 0.00 0.00 66.41 63.92 1hqs h THR 344 Cb 1.19 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 1hqs h THR 344 CO 0.61 0.40 0.00 1.41 -0.25 0.00 0.00 175.52 177.68 1hqs n HIS 345 N -3.78 0.00 0.00 4.73 8.25 -1.26 -5.10 115.22 118.06 1hqs n HIS 345 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1hqs n HIS 345 Cb 0.47 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1hqs n HIS 345 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hqs n GLY 346 N 0.00 1.10 7.00 -1.41 0.00 -1.26 -5.08 105.19 105.55 1hqs n GLY 346 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.30 1hqs n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hqs n THR 347 N 0.00 0.00 -1.78 2.61 -2.24 -1.26 -4.91 114.28 106.69 1hqs n THR 347 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1hqs n THR 347 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1hqs n THR 347 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hqs n ALA 348 N 4.93 -0.01 0.38 6.98 0.00 -1.26 -4.68 120.51 126.84 1hqs n ALA 348 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1hqs n ALA 348 Cb 0.00 -0.45 0.50 0.00 0.00 0.00 0.00 19.45 19.50 1hqs n ALA 348 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1hqs n PRO 349 N -0.91 0.19 0.00 0.00 -0.04 -1.26 -1.23 135.00 131.74 1hqs n PRO 349 Ca 0.00 0.44 0.12 0.00 -0.04 0.00 0.00 63.50 64.02 1hqs n PRO 349 Cb 0.45 -1.87 0.57 0.00 -0.04 0.00 0.00 33.50 32.60 1hqs n PRO 349 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1hqs n LYS 350 N -2.23 0.10 -0.13 0.54 5.02 -1.26 -2.56 118.16 117.64 1hqs n LYS 350 Ca 0.02 0.06 0.08 0.00 -2.02 0.00 0.00 58.31 56.45 1hqs n LYS 350 Cb 0.21 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 33.87 1hqs n LYS 350 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1hqs n TYR 351 N -1.44 0.35 -1.64 2.13 0.53 -0.37 -4.92 117.16 111.80 1hqs n TYR 351 Ca 0.08 -0.26 -0.46 0.00 -1.02 0.00 0.00 57.90 56.24 1hqs n TYR 351 Cb 0.27 -0.01 -0.04 0.00 -1.03 0.00 0.00 39.34 38.53 1hqs n TYR 351 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1hqs n ALA 352 N 0.96 1.23 -0.08 -0.72 0.00 -1.06 -1.02 120.51 119.82 1hqs n ALA 352 Ca 0.13 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1hqs n ALA 352 Cb 0.46 -2.62 0.00 0.00 0.00 0.00 0.00 19.45 17.29 1hqs n ALA 352 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hqs n GLY 353 N 4.86 1.81 0.34 0.00 0.00 -1.26 -4.90 105.19 106.03 1hqs n GLY 353 Ca 0.25 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.41 1hqs n GLY 353 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hqs n LEU 354 N 0.00 1.05 -3.61 0.99 4.77 -0.18 -4.94 117.00 115.08 1hqs n LEU 354 Ca 0.00 -0.36 -0.22 0.00 -0.03 0.00 0.00 56.01 55.40 1hqs n LEU 354 Cb 0.00 -0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1hqs n LEU 354 CO 0.00 0.18 0.13 -0.67 -1.33 0.00 0.00 177.39 175.70 1hqs n ASP 355 N -0.17 -3.83 -0.05 -1.43 2.03 -1.26 -4.93 116.55 106.91 1hqs n ASP 355 Ca 0.20 -0.65 -0.09 0.00 0.52 0.00 0.00 54.79 54.77 1hqs n ASP 355 Cb 0.28 -4.72 -0.05 0.00 -0.72 0.00 0.00 41.12 35.91 1hqs n ASP 355 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1hqs n LYS 356 N -4.55 0.26 -1.32 -0.67 5.02 -1.26 -0.62 118.16 115.02 1hqs n LYS 356 Ca -0.14 0.08 -0.35 0.00 -2.02 0.00 0.00 58.31 55.88 1hqs n LYS 356 Cb 0.61 -1.11 0.09 0.00 -0.02 0.00 0.00 35.03 34.60 1hqs n LYS 356 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1hqs n VAL 357 N -3.04 2.71 -2.37 -0.18 0.24 -1.26 -4.18 118.33 110.25 1hqs n VAL 357 Ca -0.20 -0.34 -0.43 0.00 -2.04 0.00 0.00 64.34 61.33 1hqs n VAL 357 Cb 0.69 -1.13 -0.02 0.00 -1.47 0.00 0.00 33.84 31.91 1hqs n VAL 357 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1hqs s ASN 358 N -1.72 6.85 0.00 -1.34 3.84 -1.26 -4.33 114.94 116.99 1hqs s ASN 358 Ca 0.73 1.67 0.27 0.00 0.21 0.00 0.00 52.86 55.74 1hqs s ASN 358 Cb -0.33 -2.54 1.01 0.00 -0.55 0.00 0.00 41.25 38.84 1hqs s ASN 358 CO 0.50 -0.84 1.72 -0.81 -2.79 0.00 0.00 177.10 174.88 1hqs n PRO 359 N 6.81 1.66 -0.29 0.43 -0.04 -1.26 -4.45 135.00 137.86 1hqs n PRO 359 Ca 0.15 -0.96 0.10 0.00 -0.04 0.00 0.00 63.50 62.74 1hqs n PRO 359 Cb 0.45 -1.46 0.33 0.00 -0.04 0.00 0.00 33.50 32.78 1hqs n PRO 359 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1hqs h SER 360 N 2.26 0.74 -0.42 3.54 0.02 -1.91 -1.80 113.55 115.98 1hqs h SER 360 Ca 0.00 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1hqs h SER 360 Cb 0.48 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1hqs h SER 360 CO 0.00 0.39 0.25 0.77 -1.14 0.00 0.00 176.83 177.09 1hqs h SER 361 N 0.79 0.51 0.47 3.07 4.64 -1.66 0.29 113.55 121.66 1hqs h SER 361 Ca 0.45 -0.06 -0.16 0.00 -0.47 0.00 0.00 61.79 61.55 1hqs h SER 361 Cb 0.62 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1hqs h SER 361 CO -0.22 0.42 -0.71 0.58 -0.87 0.00 0.00 176.83 176.04 1hqs h VAL 362 N 0.55 1.43 -0.39 0.95 2.07 -1.80 -1.35 116.25 117.72 1hqs h VAL 362 Ca 0.15 -2.23 -0.06 0.00 0.82 0.00 0.00 66.70 65.37 1hqs h VAL 362 Cb 0.01 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1hqs h VAL 362 CO -0.03 0.65 0.00 0.40 0.02 0.00 0.00 177.57 178.62 1hqs h ILE 363 N 0.14 1.26 0.00 4.57 2.04 -0.98 -0.15 117.51 124.38 1hqs h ILE 363 Ca -0.02 -1.00 -0.06 0.00 1.00 0.00 0.00 64.86 64.79 1hqs h ILE 363 Cb 1.25 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 1hqs h ILE 363 CO 0.11 0.34 -0.28 -0.07 0.00 0.00 0.00 178.15 178.24 1hqs h LEU 364 N 0.52 0.00 -0.61 1.44 3.38 -0.33 -0.96 115.31 118.75 1hqs h LEU 364 Ca 0.11 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1hqs h LEU 364 Cb 0.47 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1hqs h LEU 364 CO 0.02 0.28 -0.62 0.77 0.09 0.00 0.00 178.44 178.99 1hqs h SER 365 N 0.00 0.00 0.34 -0.43 4.64 -0.79 -2.60 113.55 114.71 1hqs h SER 365 Ca -0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 1hqs h SER 365 Cb 0.69 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.77 1hqs h SER 365 CO 0.04 0.62 -0.51 1.23 -0.87 0.00 0.00 176.83 177.34 1hqs h GLY 366 N 2.24 0.21 1.04 -0.77 0.00 0.23 -1.07 103.07 104.96 1hqs h GLY 366 Ca -0.01 -0.23 -0.07 0.00 0.00 0.00 0.00 47.33 47.02 1hqs h GLY 366 CO 0.08 0.21 0.11 -2.08 0.00 0.00 0.00 176.54 174.86 1hqs h VAL 367 N 0.16 1.26 -0.32 4.60 2.07 -0.95 0.13 116.25 123.19 1hqs h VAL 367 Ca 0.00 -0.98 -0.09 0.00 0.82 0.00 0.00 66.70 66.45 1hqs h VAL 367 Cb 0.95 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1hqs h VAL 367 CO 0.08 0.37 -0.18 -0.07 0.02 0.00 0.00 177.57 177.78 1hqs h LEU 368 N 0.92 0.59 -0.38 2.57 3.38 -1.08 -1.20 115.31 120.11 1hqs h LEU 368 Ca 0.19 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 1hqs h LEU 368 Cb 0.41 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1hqs h LEU 368 CO 0.01 0.78 0.05 0.25 0.09 0.00 0.00 178.44 179.62 1hqs h LEU 369 N 0.53 0.62 -0.77 1.67 6.46 -0.70 -0.60 115.31 122.51 1hqs h LEU 369 Ca 0.09 -0.27 -0.01 0.00 -0.12 0.00 0.00 57.88 57.56 1hqs h LEU 369 Cb 0.62 -0.16 -0.04 0.00 -0.73 0.00 0.00 40.66 40.35 1hqs h LEU 369 CO 0.04 0.73 0.45 -0.07 -0.62 0.00 0.00 178.44 178.98 1hqs h LEU 370 N 0.48 0.94 -0.70 2.25 3.38 -0.36 -1.10 115.31 120.19 1hqs h LEU 370 Ca 0.11 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1hqs h LEU 370 Cb 0.39 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1hqs h LEU 370 CO 0.01 0.74 0.10 -0.33 0.09 0.00 0.00 178.44 179.05 1hqs h GLU 371 N 1.06 1.09 -0.13 1.13 5.08 -1.08 0.04 114.58 121.76 1hqs h GLU 371 Ca 0.27 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1hqs h GLU 371 Cb -0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1hqs h GLU 371 CO -0.05 1.00 -0.09 1.25 -1.00 0.00 0.00 179.01 180.13 1hqs h HIS 372 N 1.02 0.20 0.00 4.33 2.76 -0.27 -1.21 115.15 121.98 1hqs h HIS 372 Ca 0.20 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1hqs h HIS 372 Cb 0.45 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.35 1hqs h HIS 372 CO 0.03 0.29 0.00 1.28 -1.30 0.00 0.00 177.93 178.23 1hqs n LEU 373 N -4.33 0.65 0.00 0.26 4.77 -0.49 -4.90 117.00 112.95 1hqs n LEU 373 Ca -0.01 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 1hqs n LEU 373 Cb 0.22 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1hqs n LEU 373 CO 0.37 -0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 1hqs n GLY 374 N 1.22 0.66 2.66 -0.72 0.00 -0.46 -4.83 105.19 103.72 1hqs n GLY 374 Ca 0.06 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1hqs n GLY 374 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1hqs n TRP 375 N -2.61 2.77 0.15 1.61 7.02 -0.05 -4.81 117.44 121.52 1hqs n TRP 375 Ca 0.00 -2.54 0.05 0.00 -1.02 0.00 0.00 57.50 53.99 1hqs n TRP 375 Cb 0.00 -1.24 0.51 0.00 -2.42 0.00 0.00 31.31 28.17 1hqs n TRP 375 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1hqs h ASN 376 N 4.09 0.19 -0.55 -0.99 2.35 -1.87 -2.48 115.58 116.32 1hqs h ASN 376 Ca 0.55 -0.01 -0.05 0.00 -0.55 0.00 0.00 56.30 56.24 1hqs h ASN 376 Cb 0.29 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 1hqs h ASN 376 CO 1.22 0.20 0.16 -0.08 -1.65 0.00 0.00 177.43 177.28 1hqs h GLU 377 N 0.21 0.86 -0.56 0.81 4.57 -1.95 0.23 114.58 118.75 1hqs h GLU 377 Ca 0.05 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 58.00 1hqs h GLU 377 Cb 0.09 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1hqs h GLU 377 CO -0.00 0.79 0.18 0.00 -1.18 0.00 0.00 179.01 178.79 1hqs h ALA 378 N 1.03 0.74 -0.48 2.92 0.00 -1.73 -2.08 119.26 119.66 1hqs h ALA 378 Ca 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1hqs h ALA 378 Cb 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1hqs h ALA 378 CO -0.00 0.40 0.27 0.00 0.00 0.00 0.00 179.25 179.92 1hqs h ALA 379 N 1.04 0.61 0.00 0.00 0.00 -1.23 -2.40 119.26 117.28 1hqs h ALA 379 Ca 0.18 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1hqs h ALA 379 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1hqs h ALA 379 CO -0.01 0.12 -0.29 -0.44 0.00 0.00 0.00 179.25 178.64 1hqs h ASP 380 N 0.63 0.00 -0.43 0.00 3.32 -0.80 -1.88 116.42 117.27 1hqs h ASP 380 Ca 0.17 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 1hqs h ASP 380 Cb 0.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1hqs h ASP 380 CO -0.03 0.29 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.70 1hqs h LEU 381 N 0.00 0.75 -0.18 1.55 4.07 -0.90 -1.62 115.31 118.97 1hqs h LEU 381 Ca -0.00 -0.31 -0.02 0.00 0.08 0.00 0.00 57.88 57.63 1hqs h LEU 381 Cb 0.55 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 1hqs h LEU 381 CO 0.04 0.88 0.04 0.58 -1.08 0.00 0.00 178.44 178.90 1hqs h VAL 382 N 0.59 1.21 -0.01 1.22 2.07 -1.06 -2.12 116.25 118.15 1hqs h VAL 382 Ca 0.12 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 66.98 1hqs h VAL 382 Cb 0.50 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.56 1hqs h VAL 382 CO 0.02 0.21 -0.08 0.40 0.02 0.00 0.00 177.57 178.15 1hqs h ILE 383 N 0.10 0.80 -0.59 4.57 2.04 -1.28 0.45 117.51 123.60 1hqs h ILE 383 Ca 0.06 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.97 1hqs h ILE 383 Cb 0.28 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 1hqs h ILE 383 CO 0.00 0.00 0.31 0.11 0.00 0.00 0.00 178.15 178.57 1hqs h LYS 384 N -0.13 0.56 -0.50 2.37 1.79 -1.32 -0.22 116.57 119.12 1hqs h LYS 384 Ca 0.03 -0.03 -0.10 0.00 -2.18 0.00 0.00 60.65 58.37 1hqs h LYS 384 Cb 0.17 -0.13 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 1hqs h LYS 384 CO -0.09 0.37 -0.07 1.03 -1.08 0.00 0.00 179.45 179.61 1hqs h SER 385 N 0.58 0.89 -0.60 0.86 0.87 -1.03 -1.23 113.55 113.89 1hqs h SER 385 Ca 0.26 -0.26 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 1hqs h SER 385 Cb 0.17 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 1hqs h SER 385 CO -0.18 0.99 0.13 -0.03 -0.53 0.00 0.00 176.83 177.21 1hqs h MET 386 N 0.82 0.98 -0.44 2.24 1.85 -0.33 0.13 114.93 120.18 1hqs h MET 386 Ca 0.14 -0.25 -0.02 0.00 -0.61 0.00 0.00 59.70 58.96 1hqs h MET 386 Cb 0.59 -0.12 -0.02 0.00 0.43 0.00 0.00 31.60 32.47 1hqs h MET 386 CO 0.04 0.91 0.19 0.93 -0.40 0.00 0.00 176.91 178.57 1hqs h GLU 387 N 0.89 0.65 -0.40 0.39 5.08 -0.84 -0.91 114.58 119.43 1hqs h GLU 387 Ca 0.19 -0.11 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 1hqs h GLU 387 Cb 0.38 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 1hqs h GLU 387 CO 0.01 0.58 -0.26 -0.22 -1.00 0.00 0.00 179.01 178.11 1hqs h LYS 388 N 0.56 0.89 -0.19 2.33 3.64 -1.02 -2.25 116.57 120.51 1hqs h LYS 388 Ca 0.15 -0.42 -0.02 0.00 -1.27 0.00 0.00 60.65 59.09 1hqs h LYS 388 Cb 0.17 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.97 1hqs h LYS 388 CO -0.01 1.07 0.03 1.15 -2.27 0.00 0.00 179.45 179.42 1hqs h THR 389 N 0.70 1.22 -0.50 1.00 2.02 -0.58 -1.40 112.91 115.37 1hqs h THR 389 Ca 0.08 -0.73 -0.05 0.00 0.77 0.00 0.00 66.41 66.49 1hqs h THR 389 Cb 0.84 1.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.56 1hqs h THR 389 CO 0.07 0.22 0.13 0.40 0.37 0.00 0.00 175.52 176.71 1hqs h ILE 390 N 0.12 1.24 -0.21 3.11 2.04 -1.23 -2.62 117.51 119.97 1hqs h ILE 390 Ca 0.06 -0.83 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1hqs h ILE 390 Cb 0.31 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1hqs h ILE 390 CO 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 178.15 178.43 1hqs h ALA 391 N 1.00 1.58 0.00 1.87 0.00 -1.36 -0.56 119.26 121.79 1hqs h ALA 391 Ca 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1hqs h ALA 391 Cb 0.32 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1hqs h ALA 391 CO 0.00 0.31 0.00 -1.13 0.00 0.00 0.00 179.25 178.43 1hqs n SER 392 N -4.34 0.45 -0.53 0.00 3.41 -0.53 -4.89 113.62 107.19 1hqs n SER 392 Ca 0.00 0.60 -0.06 0.00 -0.26 0.00 0.00 58.87 59.15 1hqs n SER 392 Cb 0.20 -0.70 -0.02 0.00 -0.26 0.00 0.00 64.21 63.43 1hqs n SER 392 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1hqs n LYS 393 N -1.99 -0.45 -3.24 4.33 5.02 -0.22 -4.84 118.16 116.76 1hqs n LYS 393 Ca 0.03 0.63 -0.46 0.00 -2.02 0.00 0.00 58.31 56.49 1hqs n LYS 393 Cb 0.23 -4.41 -0.03 0.00 -0.02 0.00 0.00 35.03 30.80 1hqs n LYS 393 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1hqs s VAL 394 N -2.25 5.29 0.28 -0.18 1.01 -1.17 -0.21 120.40 123.17 1hqs s VAL 394 Ca 0.00 -1.90 0.02 0.00 0.00 0.00 0.00 61.98 60.10 1hqs s VAL 394 Cb 0.00 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 1hqs s VAL 394 CO 0.00 -1.06 0.15 0.68 0.00 0.00 0.00 175.10 174.87 1hqs s VAL 395 N 1.20 0.27 0.83 2.92 -7.23 -1.02 -4.62 120.40 112.76 1hqs s VAL 395 Ca 0.15 -2.00 -0.12 0.00 -1.81 0.00 0.00 61.98 58.20 1hqs s VAL 395 Cb -0.17 -2.53 0.10 0.00 0.56 0.00 0.00 36.38 34.34 1hqs s VAL 395 CO -0.04 0.00 1.19 0.42 -0.31 0.00 0.00 175.10 176.36 1hqs s THR 396 N -3.74 2.00 0.27 5.32 -4.23 -1.26 -0.64 115.64 113.36 1hqs s THR 396 Ca 0.37 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.88 1hqs s THR 396 Cb 0.06 -2.97 0.26 0.00 1.34 0.00 0.00 72.50 71.18 1hqs s THR 396 CO 0.16 0.00 1.79 0.10 -0.54 0.00 0.00 174.62 176.14 1hqs h TYR 397 N -1.16 0.94 -0.78 3.99 -0.00 -1.76 0.13 116.97 118.33 1hqs h TYR 397 Ca -0.46 0.03 0.15 0.00 0.00 0.00 0.00 58.73 58.45 1hqs h TYR 397 Cb 1.32 -0.28 -0.05 0.00 0.00 0.00 0.00 36.73 37.72 1hqs h TYR 397 CO 0.17 0.29 0.52 0.38 -0.00 0.00 0.00 178.16 179.53 1hqs h ASP 398 N 0.78 0.43 0.02 0.10 2.03 -1.93 -1.42 116.42 116.42 1hqs h ASP 398 Ca 0.48 0.03 -0.27 0.00 -0.73 0.00 0.00 57.03 56.54 1hqs h ASP 398 Cb 0.60 -0.06 -0.03 0.00 -0.83 0.00 0.00 39.33 39.01 1hqs h ASP 398 CO -0.32 0.22 -1.45 0.49 -1.03 0.00 0.00 179.24 177.14 1hqs n PHE 399 N -4.49 0.99 -0.23 4.15 3.72 -0.79 -4.42 117.46 116.38 1hqs n PHE 399 Ca 0.15 0.39 0.04 0.00 -0.05 0.00 0.00 57.45 57.97 1hqs n PHE 399 Cb 0.53 -1.10 0.15 0.00 -0.94 0.00 0.00 39.48 38.11 1hqs n PHE 399 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1hqs h ALA 400 N -0.44 0.80 0.00 4.37 0.00 -0.45 -0.02 119.26 123.52 1hqs h ALA 400 Ca -0.38 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1hqs h ALA 400 Cb 1.44 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1hqs h ALA 400 CO -0.18 -0.37 0.00 2.89 0.00 0.00 0.00 179.25 181.59 1hqs n ARG 401 N -5.22 0.64 -0.00 0.00 1.85 -0.56 -2.22 116.66 111.14 1hqs n ARG 401 Ca 0.12 0.00 0.04 0.00 -1.00 0.00 0.00 57.85 57.01 1hqs n ARG 401 Cb 0.42 -1.47 -0.05 0.00 -1.05 0.00 0.00 32.46 30.30 1hqs n ARG 401 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1hqs n LEU 402 N -0.97 0.23 -4.85 2.89 4.77 -0.07 -5.02 117.00 113.97 1hqs n LEU 402 Ca 0.14 -0.29 -0.24 0.00 -0.03 0.00 0.00 56.01 55.59 1hqs n LEU 402 Cb 0.07 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1hqs n LEU 402 CO 0.11 0.06 -0.16 -0.04 -1.33 0.00 0.00 177.39 176.03 1hqs s MET 403 N -2.11 3.07 -0.22 3.23 -1.94 -0.90 -4.90 119.30 115.53 1hqs s MET 403 Ca 0.01 -0.88 -0.08 0.00 -1.71 0.00 0.00 55.69 53.03 1hqs s MET 403 Cb 0.06 -2.70 -0.04 0.00 2.01 0.00 0.00 34.83 34.16 1hqs s MET 403 CO 0.34 0.45 0.09 -0.51 -0.01 0.00 0.00 175.02 175.38 1hqs s ASP 404 N -3.50 5.59 -0.50 3.03 1.11 -1.26 -4.30 116.67 116.83 1hqs s ASP 404 Ca 0.33 -0.00 0.00 0.00 0.18 0.00 0.00 52.55 53.05 1hqs s ASP 404 Cb -0.09 -1.99 0.00 0.00 1.07 0.00 0.00 42.92 41.91 1hqs s ASP 404 CO 0.25 0.08 0.00 0.61 1.18 0.00 0.00 175.17 177.30 1hqs n GLY 405 N 4.16 0.50 3.86 0.21 0.00 -1.26 -5.02 105.19 107.64 1hqs n GLY 405 Ca -0.16 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.79 1hqs n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hqs s ALA 406 N -2.22 3.14 -0.47 4.61 0.00 -1.26 -4.99 121.76 120.57 1hqs s ALA 406 Ca 0.00 0.02 -0.10 0.00 0.00 0.00 0.00 51.96 51.87 1hqs s ALA 406 Cb 0.00 -3.01 0.11 0.00 0.00 0.00 0.00 23.12 20.22 1hqs s ALA 406 CO 0.00 -0.31 0.35 0.99 0.00 0.00 0.00 175.76 176.79 1hqs s THR 407 N -2.71 4.40 0.13 0.00 2.01 0.71 -5.02 115.64 115.15 1hqs s THR 407 Ca 0.56 -1.62 -0.31 0.00 0.31 0.00 0.00 61.69 60.63 1hqs s THR 407 Cb -0.10 -3.83 -0.08 0.00 0.01 0.00 0.00 72.50 68.50 1hqs s THR 407 CO 0.37 -0.71 1.36 -0.70 -0.69 0.00 0.00 174.62 174.25 1hqs s GLU 408 N 1.42 4.34 0.15 4.92 2.12 -1.26 -2.44 118.70 127.96 1hqs s GLU 408 Ca 0.05 2.05 0.05 0.00 0.36 0.00 0.00 54.97 57.47 1hqs s GLU 408 Cb -0.26 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 1hqs s GLU 408 CO 0.01 -0.39 -0.11 0.14 -0.54 0.00 0.00 175.26 174.37 1hqs s VAL 409 N 0.93 1.22 0.91 3.70 -7.23 0.18 -4.95 120.40 115.17 1hqs s VAL 409 Ca 0.63 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 58.61 1hqs s VAL 409 Cb -0.36 -1.86 0.14 0.00 0.56 0.00 0.00 36.38 34.85 1hqs s VAL 409 CO 0.32 -0.73 1.09 -0.54 -0.31 0.00 0.00 175.10 174.92 1hqs s LYS 410 N -3.73 1.13 0.12 4.82 1.02 -1.26 -4.16 119.74 117.67 1hqs s LYS 410 Ca 0.17 0.88 -0.20 0.00 0.02 0.00 0.00 55.97 56.84 1hqs s LYS 410 Cb 0.02 -1.79 -0.05 0.00 -0.52 0.00 0.00 37.83 35.49 1hqs s LYS 410 CO 0.01 -2.35 1.73 0.00 -0.92 0.00 0.00 175.35 173.82 1hqs h SER 412 N 0.05 0.72 0.74 0.00 4.64 -1.89 -2.51 113.55 115.31 1hqs h SER 412 Ca 0.08 -0.12 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 1hqs h SER 412 Cb 0.09 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 1hqs h SER 412 CO -0.13 0.71 -0.60 -0.33 -0.87 0.00 0.00 176.83 175.61 1hqs h GLU 413 N 0.75 0.00 -0.47 4.77 5.08 -1.82 -2.59 114.58 120.31 1hqs h GLU 413 Ca 0.17 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.41 1hqs h GLU 413 Cb 0.28 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1hqs h GLU 413 CO -0.00 0.60 -0.16 0.35 -1.00 0.00 0.00 179.01 178.80 1hqs h PHE 414 N 0.00 1.01 -0.70 4.33 3.57 -0.70 -1.18 116.94 123.27 1hqs h PHE 414 Ca -0.01 -0.22 -0.01 0.00 3.53 0.00 0.00 57.97 61.27 1hqs h PHE 414 Cb 1.14 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.60 1hqs h PHE 414 CO 0.00 0.99 0.40 0.78 -2.23 0.00 0.00 178.31 178.25 1hqs h GLY 415 N 0.95 1.03 1.73 2.40 0.00 -1.32 -1.54 103.07 106.31 1hqs h GLY 415 Ca 0.12 -0.45 -0.10 0.00 0.00 0.00 0.00 47.33 46.91 1hqs h GLY 415 CO 0.05 0.43 -0.33 0.83 0.00 0.00 0.00 176.54 177.52 1hqs h GLU 416 N 0.95 0.31 -0.40 4.80 5.08 -1.10 -2.10 114.58 122.12 1hqs h GLU 416 Ca 0.25 -0.13 -0.13 0.00 -1.00 0.00 0.00 59.36 58.35 1hqs h GLU 416 Cb 0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1hqs h GLU 416 CO -0.04 0.61 -0.27 1.49 -1.00 0.00 0.00 179.01 179.79 1hqs h GLU 417 N 0.27 0.86 -0.28 2.33 4.57 -0.80 -1.13 114.58 120.40 1hqs h GLU 417 Ca 0.03 -0.38 -0.01 0.00 -1.18 0.00 0.00 59.36 57.82 1hqs h GLU 417 Cb 0.72 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.27 1hqs h GLU 417 CO 0.05 1.02 0.12 -0.07 -1.18 0.00 0.00 179.01 178.96 1hqs h LEU 418 N 0.73 0.38 -0.87 1.64 3.38 -0.90 0.11 115.31 119.77 1hqs h LEU 418 Ca 0.09 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1hqs h LEU 418 Cb 0.82 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1hqs h LEU 418 CO 0.07 0.43 0.51 0.40 0.09 0.00 0.00 178.44 179.94 1hqs h ILE 419 N 0.30 1.25 -0.81 1.22 2.04 -1.33 -1.28 117.51 118.90 1hqs h ILE 419 Ca 0.09 -0.56 0.02 0.00 1.00 0.00 0.00 64.86 65.41 1hqs h ILE 419 Cb 0.16 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.23 1hqs h ILE 419 CO -0.01 0.26 0.53 0.50 0.00 0.00 0.00 178.15 179.43 1hqs h LYS 420 N 1.21 1.03 -0.02 2.37 3.64 -0.67 -2.36 116.57 121.77 1hqs h LYS 420 Ca 0.31 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.63 1hqs h LYS 420 Cb -0.02 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.57 1hqs h LYS 420 CO -0.06 0.68 0.00 0.09 -2.27 0.00 0.00 179.45 177.89 1hqs n ASN 421 N -4.55 0.23 -4.62 4.20 3.02 0.34 -4.84 115.26 109.04 1hqs n ASN 421 Ca 0.09 -1.34 -0.43 0.00 -0.03 0.00 0.00 54.58 52.87 1hqs n ASN 421 Cb 0.05 -0.01 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 1hqs n ASN 421 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1hqs s MET 422 N -1.98 3.71 0.00 3.52 -1.94 -0.86 -4.54 119.30 117.21 1hqs s MET 422 Ca 0.34 1.27 0.12 0.00 -1.71 0.00 0.00 55.69 55.71 1hqs s MET 422 Cb 0.16 -4.00 0.09 0.00 2.01 0.00 0.00 34.83 33.09 1hqs s MET 422 CO 0.27 -1.39 0.87 -0.25 -0.01 0.00 0.00 175.02 174.51