#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qxs n PRO 2 N 0.00 2.34 -1.86 3.17 -0.02 -1.23 -4.83 135.00 132.57 1qxs n PRO 2 Ca 0.00 0.77 -0.38 0.00 -2.02 0.00 0.00 63.50 61.87 1qxs n PRO 2 Cb 0.00 -3.06 0.03 0.00 -0.02 0.00 0.00 33.50 30.46 1qxs n PRO 2 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1qxs s ILE 3 N 6.25 2.25 -0.33 4.25 1.01 0.18 -4.62 121.20 130.19 1qxs s ILE 3 Ca 0.95 0.19 -0.13 0.00 0.00 0.00 0.00 60.65 61.66 1qxs s ILE 3 Cb -0.43 -3.09 -0.02 0.00 0.01 0.00 0.00 42.46 38.92 1qxs s ILE 3 CO 0.40 -0.00 0.24 -0.75 0.00 0.00 0.00 174.94 174.83 1qxs s LYS 4 N -2.90 3.58 0.08 2.79 2.47 -1.26 0.32 119.74 124.82 1qxs s LYS 4 Ca 0.71 -0.57 0.08 0.00 -1.56 0.00 0.00 55.97 54.63 1qxs s LYS 4 Cb -0.38 -3.78 -0.03 0.00 -1.46 0.00 0.00 37.83 32.18 1qxs s LYS 4 CO 0.45 -0.40 -0.22 0.08 0.16 0.00 0.00 175.35 175.42 1qxs s VAL 5 N 1.75 1.78 -0.26 4.02 1.01 -1.03 -1.54 120.40 126.12 1qxs s VAL 5 Ca 0.07 -1.41 -0.03 0.00 0.00 0.00 0.00 61.98 60.61 1qxs s VAL 5 Cb -0.17 -1.58 0.09 0.00 0.00 0.00 0.00 36.38 34.72 1qxs s VAL 5 CO 0.11 0.10 0.09 -0.83 0.00 0.00 0.00 175.10 174.57 1qxs s GLY 6 N -1.57 0.73 -0.26 4.51 0.00 0.14 -2.86 107.32 108.01 1qxs s GLY 6 Ca 0.08 -1.12 -0.29 0.00 0.00 0.00 0.00 44.72 43.39 1qxs s GLY 6 CO 0.03 1.73 1.05 -0.42 0.00 0.00 0.00 173.10 175.50 1qxs s ILE 7 N 1.88 4.62 -0.35 0.90 1.01 -1.23 -1.42 121.20 126.61 1qxs s ILE 7 Ca 0.06 1.92 -0.07 0.00 0.00 0.00 0.00 60.65 62.56 1qxs s ILE 7 Cb -0.17 -4.35 0.04 0.00 0.01 0.00 0.00 42.46 38.00 1qxs s ILE 7 CO -0.24 -0.29 0.13 0.21 0.00 0.00 0.00 174.94 174.75 1qxs s ASN 8 N 1.37 5.38 0.00 3.58 3.04 -0.14 -2.41 114.94 125.76 1qxs s ASN 8 Ca 0.44 -1.19 0.00 0.00 0.04 0.00 0.00 52.86 52.15 1qxs s ASN 8 Cb -0.14 -1.89 0.00 0.00 -1.54 0.00 0.00 41.25 37.68 1qxs s ASN 8 CO 0.09 -0.36 0.00 0.61 -3.04 0.00 0.00 177.10 174.41 1qxs n GLY 9 N 4.83 0.67 3.49 1.21 0.00 0.04 -0.66 105.19 114.78 1qxs n GLY 9 Ca -0.12 -0.50 -0.29 0.00 0.00 0.00 0.00 46.02 45.11 1qxs n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1qxs n PHE 10 N 0.00 1.68 -1.25 1.61 7.35 0.40 -4.13 117.46 123.12 1qxs n PHE 10 Ca 0.00 -1.02 0.00 0.00 -0.76 0.00 0.00 57.45 55.67 1qxs n PHE 10 Cb 0.00 -2.21 0.00 0.00 0.35 0.00 0.00 39.48 37.62 1qxs n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1qxs n GLY 11 N 5.56 5.20 0.39 7.13 0.00 -1.26 -4.73 105.19 117.48 1qxs n GLY 11 Ca 0.45 -1.58 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 1qxs n GLY 11 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1qxs h ARG 12 N 0.00 -0.30 0.02 1.61 9.65 -1.93 0.20 114.38 123.63 1qxs h ARG 12 Ca 0.00 0.02 -0.23 0.00 -1.10 0.00 0.00 59.98 58.67 1qxs h ARG 12 Cb 0.00 0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 1qxs h ARG 12 CO 0.00 -0.20 -1.16 0.82 2.80 0.00 0.00 179.97 182.23 1qxs h ILE 13 N -0.31 1.53 -0.21 1.20 1.08 -1.89 -2.85 117.51 116.06 1qxs h ILE 13 Ca 0.14 -3.25 -0.00 0.00 -0.39 0.00 0.00 64.86 61.36 1qxs h ILE 13 Cb 0.58 2.79 -0.01 0.00 -3.07 0.00 0.00 36.82 37.11 1qxs h ILE 13 CO -0.59 0.89 0.11 1.23 -0.69 0.00 0.00 178.15 179.10 1qxs h GLY 14 N 2.87 0.32 1.11 5.37 0.00 -1.63 0.10 103.07 111.22 1qxs h GLY 14 Ca -0.08 -0.15 -0.09 0.00 0.00 0.00 0.00 47.33 47.01 1qxs h GLY 14 CO 0.13 0.14 0.01 3.21 0.00 0.00 0.00 176.54 180.04 1qxs h ARG 15 N 0.23 1.07 -0.56 4.80 3.08 -0.71 -2.37 114.38 119.92 1qxs h ARG 15 Ca 0.07 -0.33 -0.05 0.00 0.07 0.00 0.00 59.98 59.75 1qxs h ARG 15 Cb 0.07 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 1qxs h ARG 15 CO -0.01 1.03 0.15 0.52 -1.07 0.00 0.00 179.97 180.59 1qxs h MET 16 N 0.98 0.86 -0.31 0.04 2.86 -1.24 0.29 114.93 118.41 1qxs h MET 16 Ca 0.18 -0.17 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 1qxs h MET 16 Cb 0.54 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.05 1qxs h MET 16 CO 0.03 0.76 -0.05 0.28 1.06 0.00 0.00 176.91 178.98 1qxs h VAL 17 N 0.83 1.21 -0.13 -2.22 2.07 -0.52 0.38 116.25 117.86 1qxs h VAL 17 Ca 0.18 -0.87 -0.08 0.00 0.82 0.00 0.00 66.70 66.76 1qxs h VAL 17 Cb 0.28 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1qxs h VAL 17 CO -0.00 0.29 -0.24 0.15 0.02 0.00 0.00 177.57 177.78 1qxs h PHE 18 N 0.47 0.50 0.00 1.57 3.04 -0.79 -2.39 116.94 119.34 1qxs h PHE 18 Ca 0.10 -0.18 0.00 0.00 3.98 0.00 0.00 57.97 61.87 1qxs h PHE 18 Cb 0.39 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 38.80 1qxs h PHE 18 CO 0.01 0.86 0.00 1.04 -2.02 0.00 0.00 178.31 178.20 1qxs n GLN 19 N -4.46 0.07 -0.02 1.11 6.02 -0.00 -1.83 117.38 118.27 1qxs n GLN 19 Ca -0.07 0.20 -0.16 0.00 -0.01 0.00 0.00 57.00 56.97 1qxs n GLN 19 Cb 0.44 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 30.07 1qxs n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1qxs h ALA 20 N 2.61 0.00 0.70 -1.58 0.00 -0.45 -2.92 119.26 117.64 1qxs h ALA 20 Ca 0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1qxs h ALA 20 Cb 0.24 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1qxs h ALA 20 CO 0.00 0.11 -0.47 -0.07 0.00 0.00 0.00 179.25 178.82 1qxs h LEU 21 N -0.60 -1.19 -0.54 0.00 3.38 -0.90 -2.94 115.31 112.52 1qxs h LEU 21 Ca -0.04 0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.11 1qxs h LEU 21 Cb 1.11 0.36 -0.10 0.00 0.09 0.00 0.00 40.66 42.11 1qxs h LEU 21 CO 0.05 -0.70 -0.12 0.00 0.09 0.00 0.00 178.44 177.76 1qxs h GLU 23 N 0.01 0.58 -0.45 0.00 4.81 -1.43 0.28 114.58 118.38 1qxs h GLU 23 Ca 0.26 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1qxs h GLU 23 Cb 0.40 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1qxs h GLU 23 CO -0.55 0.38 0.00 -0.25 -0.73 0.00 0.00 179.01 177.86 1qxs n ASP 24 N -4.69 2.38 -3.06 1.04 8.00 -0.06 -4.93 116.55 115.23 1qxs n ASP 24 Ca 0.23 -2.02 -0.22 0.00 0.71 0.00 0.00 54.79 53.48 1qxs n ASP 24 Cb 0.68 -0.30 0.03 0.00 -0.02 0.00 0.00 41.12 41.50 1qxs n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qxs n GLY 25 N 1.15 -0.52 0.00 0.44 0.00 0.99 -4.88 105.19 102.38 1qxs n GLY 25 Ca 0.15 0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.39 1qxs n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qxs n LEU 26 N -3.93 0.79 -4.68 0.99 4.77 -0.88 -4.67 117.00 109.39 1qxs n LEU 26 Ca -0.10 -0.30 -0.42 0.00 -0.03 0.00 0.00 56.01 55.16 1qxs n LEU 26 Cb 0.61 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1qxs n LEU 26 CO 0.47 0.19 1.24 -0.22 -1.33 0.00 0.00 177.39 177.75 1qxs s LEU 27 N -3.08 4.31 0.00 2.23 2.96 -1.26 0.51 118.68 124.35 1qxs s LEU 27 Ca 0.08 2.19 0.00 0.00 -0.22 0.00 0.00 54.13 56.18 1qxs s LEU 27 Cb 0.16 -3.55 0.00 0.00 0.50 0.00 0.00 46.19 43.30 1qxs s LEU 27 CO 0.81 -0.83 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 1qxs n GLY 28 N 3.88 1.83 0.00 7.98 0.00 0.39 -4.80 105.19 114.47 1qxs n GLY 28 Ca 0.15 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1qxs n GLY 28 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1qxs n THR 29 N 0.00 0.00 -0.02 2.61 -1.04 -1.19 -4.63 114.28 110.01 1qxs n THR 29 Ca 0.00 0.03 -0.11 0.00 -2.04 0.00 0.00 64.05 61.94 1qxs n THR 29 Cb 0.00 -0.44 -0.04 0.00 -1.82 0.00 0.00 70.33 68.03 1qxs n THR 29 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 1qxs h GLU 30 N 0.00 0.20 -6.64 -2.82 4.39 -1.77 -3.25 114.58 104.69 1qxs h GLU 30 Ca 0.00 -0.01 -0.66 0.00 0.34 0.00 0.00 59.36 59.02 1qxs h GLU 30 Cb 0.00 -0.04 -0.17 0.00 -0.10 0.00 0.00 28.75 28.43 1qxs h GLU 30 CO 0.00 0.14 -0.78 0.42 -1.16 0.00 0.00 179.01 177.63 1qxs s ILE 31 N -6.13 2.88 -0.21 3.13 1.01 0.18 0.47 121.20 122.54 1qxs s ILE 31 Ca -0.13 -1.60 -0.03 0.00 0.00 0.00 0.00 60.65 58.89 1qxs s ILE 31 Cb 0.08 -2.35 0.06 0.00 0.01 0.00 0.00 42.46 40.26 1qxs s ILE 31 CO 0.68 0.02 0.05 -0.62 0.00 0.00 0.00 174.94 175.08 1qxs s ASP 32 N -2.38 2.97 -0.69 3.58 -1.08 0.15 0.15 116.67 119.36 1qxs s ASP 32 Ca 0.20 -0.88 -0.27 0.00 -0.52 0.00 0.00 52.55 51.07 1qxs s ASP 32 Cb -0.10 -0.57 0.03 0.00 -1.46 0.00 0.00 42.92 40.83 1qxs s ASP 32 CO 0.11 -0.33 1.24 -0.69 0.52 0.00 0.00 175.17 176.03 1qxs s VAL 33 N 1.88 3.83 0.06 1.11 1.01 -1.26 -2.47 120.40 124.55 1qxs s VAL 33 Ca 0.01 0.51 -0.19 0.00 0.00 0.00 0.00 61.98 62.31 1qxs s VAL 33 Cb -0.17 -4.86 -0.12 0.00 0.00 0.00 0.00 36.38 31.23 1qxs s VAL 33 CO -0.11 -1.70 1.39 0.58 0.00 0.00 0.00 175.10 175.27 1qxs h VAL 34 N 6.06 1.32 -1.52 2.92 2.07 -1.82 -3.40 116.25 121.88 1qxs h VAL 34 Ca -0.27 -1.25 0.08 0.00 0.82 0.00 0.00 66.70 66.08 1qxs h VAL 34 Cb 1.05 1.72 -0.27 0.00 -1.52 0.00 0.00 31.29 32.27 1qxs h VAL 34 CO 1.25 0.38 0.50 0.00 0.02 0.00 0.00 177.57 179.72 1qxs s ALA 35 N -4.45 -2.03 0.06 1.67 0.00 -1.26 -2.18 121.76 113.55 1qxs s ALA 35 Ca -0.14 1.88 0.00 0.00 0.00 0.00 0.00 51.96 53.70 1qxs s ALA 35 Cb 0.06 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.67 1qxs s ALA 35 CO 0.76 -0.23 0.00 1.33 0.00 0.00 0.00 175.76 177.63 1qxs n VAL 36 N 2.27 0.00 0.00 0.00 0.24 -0.05 -3.55 118.33 117.24 1qxs n VAL 36 Ca -0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.17 1qxs n VAL 36 Cb 0.56 -1.06 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 1qxs n VAL 36 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 1qxs n VAL 37 N -0.20 0.00 -1.72 3.34 3.14 -1.01 -3.09 118.33 118.79 1qxs n VAL 37 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1qxs n VAL 37 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1qxs n VAL 37 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1qxs n ASP 38 N 0.00 0.00 0.35 6.55 -0.08 -1.26 0.15 116.55 122.26 1qxs n ASP 38 Ca 0.00 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.12 1qxs n ASP 38 Cb 0.00 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.38 1qxs n ASP 38 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 1qxs h MET 39 N 0.00 -0.88 0.00 -0.67 2.86 -1.93 -3.24 114.93 111.06 1qxs h MET 39 Ca 0.00 0.06 -0.42 0.00 -2.06 0.00 0.00 59.70 57.29 1qxs h MET 39 Cb 0.00 0.20 0.03 0.00 0.06 0.00 0.00 31.60 31.89 1qxs h MET 39 CO 0.00 -0.56 -0.05 0.27 1.06 0.00 0.00 176.91 177.63 1qxs n ASN 40 N -5.41 1.77 -0.57 1.22 0.23 -1.26 -4.22 115.26 107.01 1qxs n ASN 40 Ca -0.12 -2.30 0.06 0.00 -0.53 0.00 0.00 54.58 51.69 1qxs n ASN 40 Cb 0.38 -0.38 0.11 0.00 -2.08 0.00 0.00 39.78 37.81 1qxs n ASN 40 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 1qxs n THR 41 N -2.14 1.28 -2.55 5.53 -2.24 -1.26 -4.86 114.28 108.05 1qxs n THR 41 Ca 0.14 -1.90 -0.42 0.00 -2.27 0.00 0.00 64.05 59.60 1qxs n THR 41 Cb 0.52 0.13 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1qxs n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qxs s ASP 42 N -2.47 6.32 0.43 3.42 -1.08 -1.26 -4.39 116.67 117.63 1qxs s ASP 42 Ca 0.28 -0.03 0.16 0.00 -0.52 0.00 0.00 52.55 52.45 1qxs s ASP 42 Cb 0.27 -2.55 0.96 0.00 -1.46 0.00 0.00 42.92 40.13 1qxs s ASP 42 CO -0.04 -1.62 1.93 0.00 0.52 0.00 0.00 175.17 175.95 1qxs h ALA 43 N 9.90 1.45 -0.46 3.66 0.00 -1.85 -1.01 119.26 130.95 1qxs h ALA 43 Ca -0.26 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.32 1qxs h ALA 43 Cb 1.06 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1qxs h ALA 43 CO 1.21 0.32 -0.08 0.93 0.00 0.00 0.00 179.25 181.64 1qxs h GLU 44 N 0.00 0.82 0.09 0.00 5.08 -1.90 0.52 114.58 119.19 1qxs h GLU 44 Ca -0.00 -0.26 -0.26 0.00 -1.00 0.00 0.00 59.36 57.84 1qxs h GLU 44 Cb 0.49 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.68 1qxs h GLU 44 CO 0.03 0.87 -1.15 -0.92 -1.00 0.00 0.00 179.01 176.85 1qxs h TYR 45 N 0.74 0.62 0.29 4.33 3.20 -1.85 -2.01 116.97 122.29 1qxs h TYR 45 Ca 0.13 -0.40 -0.01 0.00 3.14 0.00 0.00 58.73 61.58 1qxs h TYR 45 Cb 0.56 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.79 1qxs h TYR 45 CO 0.03 1.27 -0.14 0.74 -1.64 0.00 0.00 178.16 178.42 1qxs h PHE 46 N 0.16 -0.36 -0.98 -3.82 -1.00 -0.98 -1.34 116.94 108.62 1qxs h PHE 46 Ca -0.13 -0.01 0.19 0.00 2.81 0.00 0.00 57.97 60.83 1qxs h PHE 46 Cb 1.83 0.12 -0.09 0.00 3.61 0.00 0.00 35.95 41.41 1qxs h PHE 46 CO 0.07 -0.05 0.61 0.00 -1.61 0.00 0.00 178.31 177.34 1qxs h ALA 47 N -0.07 1.78 0.18 2.45 0.00 -0.02 -1.25 119.26 122.33 1qxs h ALA 47 Ca -0.04 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1qxs h ALA 47 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1qxs h ALA 47 CO 0.06 -0.12 -0.09 -0.92 0.00 0.00 0.00 179.25 178.18 1qxs h TYR 48 N 0.71 -0.23 -0.77 0.00 3.20 -1.12 -0.79 116.97 117.97 1qxs h TYR 48 Ca 0.54 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.55 1qxs h TYR 48 Cb 0.92 0.08 -0.05 0.00 1.54 0.00 0.00 36.73 39.21 1qxs h TYR 48 CO -0.00 0.03 0.51 1.96 -1.64 0.00 0.00 178.16 179.02 1qxs h GLN 49 N -0.48 0.49 -0.09 1.82 4.20 -0.23 -2.26 115.11 118.55 1qxs h GLN 49 Ca -0.03 -0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.48 1qxs h GLN 49 Cb 0.36 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 28.04 1qxs h GLN 49 CO 0.04 0.32 -0.64 0.52 -0.67 0.00 0.00 178.83 178.40 1qxs h MET 50 N 0.50 0.60 -0.70 1.46 2.86 -1.06 -3.34 114.93 115.25 1qxs h MET 50 Ca 0.38 -0.52 -0.00 0.00 -2.06 0.00 0.00 59.70 57.49 1qxs h MET 50 Cb 0.75 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.50 1qxs h MET 50 CO -0.13 1.14 0.42 -0.09 1.06 0.00 0.00 176.91 179.31 1qxs h ARG 51 N 0.23 0.95 -5.84 1.72 2.43 -0.57 -3.35 114.38 109.95 1qxs h ARG 51 Ca -0.05 -0.09 -0.64 0.00 -0.81 0.00 0.00 59.98 58.38 1qxs h ARG 51 Cb 1.29 -0.20 -0.31 0.00 -0.42 0.00 0.00 29.97 30.33 1qxs h ARG 51 CO 0.13 0.68 -0.87 0.71 -1.51 0.00 0.00 179.97 179.11 1qxs s TYR 52 N -5.98 2.16 -0.03 2.20 2.02 -1.02 -0.83 117.35 115.87 1qxs s TYR 52 Ca -0.13 -0.60 0.01 0.00 -0.37 0.00 0.00 57.07 55.98 1qxs s TYR 52 Cb 0.14 -1.42 0.02 0.00 -0.40 0.00 0.00 41.96 40.30 1qxs s TYR 52 CO 0.78 -0.17 -0.03 0.34 -1.57 0.00 0.00 175.55 174.89 1qxs s ASP 53 N -0.16 0.69 0.21 2.29 -1.08 -0.95 -4.72 116.67 112.95 1qxs s ASP 53 Ca -0.02 -0.09 -0.08 0.00 -0.52 0.00 0.00 52.55 51.84 1qxs s ASP 53 Cb -0.12 -0.27 0.17 0.00 -1.46 0.00 0.00 42.92 41.23 1qxs s ASP 53 CO 0.03 -0.03 1.81 0.74 0.52 0.00 0.00 175.17 178.24 1qxs h THR 54 N 5.84 1.25 0.02 1.71 2.02 -1.96 -2.90 112.91 118.90 1qxs h THR 54 Ca -0.37 -0.69 -0.39 0.00 0.77 0.00 0.00 66.41 65.73 1qxs h THR 54 Cb 1.16 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 67.72 1qxs h THR 54 CO 0.48 0.30 -2.36 0.55 0.37 0.00 0.00 175.52 174.86 1qxs n VAL 55 N -4.35 1.55 0.65 3.16 3.14 -1.26 -4.59 118.33 116.63 1qxs n VAL 55 Ca 0.08 -0.54 0.06 0.00 -2.96 0.00 0.00 64.34 60.98 1qxs n VAL 55 Cb 0.13 -1.57 0.18 0.00 -1.06 0.00 0.00 33.84 31.53 1qxs n VAL 55 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 1qxs n HIS 56 N -3.49 0.59 -4.11 1.45 8.25 -1.26 -4.97 115.22 111.68 1qxs n HIS 56 Ca -0.44 -0.28 0.00 0.00 -0.26 0.00 0.00 57.72 56.74 1qxs n HIS 56 Cb 0.97 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 32.06 1qxs n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qxs n GLY 57 N 1.08 -1.76 3.78 -1.41 0.00 -1.09 -4.87 105.19 100.91 1qxs n GLY 57 Ca 0.14 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.42 1qxs n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qxs s LYS 58 N 0.00 4.43 0.26 1.61 1.02 -1.26 -2.24 119.74 123.56 1qxs s LYS 58 Ca 0.00 0.98 -0.31 0.00 0.02 0.00 0.00 55.97 56.67 1qxs s LYS 58 Cb 0.00 -3.29 -0.12 0.00 -0.52 0.00 0.00 37.83 33.90 1qxs s LYS 58 CO 0.00 0.50 1.65 0.12 -0.92 0.00 0.00 175.35 176.70 1qxs s PHE 59 N -0.77 2.80 -2.10 3.18 5.36 -0.01 -4.89 117.98 121.54 1qxs s PHE 59 Ca 0.34 0.59 0.15 0.00 -0.96 0.00 0.00 56.93 57.05 1qxs s PHE 59 Cb -0.21 -4.11 0.59 0.00 -0.34 0.00 0.00 43.02 38.95 1qxs s PHE 59 CO 0.23 -3.94 1.42 1.63 -1.46 0.00 0.00 175.22 173.10 1qxs n LYS 60 N 2.87 1.50 -3.87 10.12 5.02 -1.26 -4.74 118.16 127.81 1qxs n LYS 60 Ca 0.11 -0.77 -0.28 0.00 -2.02 0.00 0.00 58.31 55.36 1qxs n LYS 60 Cb 0.36 -1.28 -0.17 0.00 -0.02 0.00 0.00 35.03 33.93 1qxs n LYS 60 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1qxs s TYR 61 N -1.79 1.56 0.18 2.13 1.51 -1.26 -5.10 117.35 114.57 1qxs s TYR 61 Ca 0.24 -0.99 -0.31 0.00 -1.01 0.00 0.00 57.07 55.00 1qxs s TYR 61 Cb 0.13 -1.25 -0.16 0.00 -0.11 0.00 0.00 41.96 40.56 1qxs s TYR 61 CO 0.19 -0.59 0.91 -1.91 -1.11 0.00 0.00 175.55 173.03 1qxs n GLU 62 N 4.91 0.64 -4.67 -0.62 2.13 -1.26 -4.84 120.64 116.94 1qxs n GLU 62 Ca -0.11 0.23 -0.25 0.00 0.66 0.00 0.00 57.16 57.68 1qxs n GLU 62 Cb 0.48 -1.54 -0.16 0.00 0.27 0.00 0.00 31.44 30.49 1qxs n GLU 62 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1qxs s VAL 63 N -0.60 1.24 0.33 6.31 1.01 -1.26 -3.36 120.40 124.07 1qxs s VAL 63 Ca 0.70 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 62.16 1qxs s VAL 63 Cb -0.91 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1qxs s VAL 63 CO 0.56 0.38 0.15 0.42 0.00 0.00 0.00 175.10 176.60 1qxs s THR 64 N 0.51 0.44 0.02 3.92 -4.23 -0.81 -5.03 115.64 110.46 1qxs s THR 64 Ca -0.13 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.38 1qxs s THR 64 Cb -0.15 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.18 1qxs s THR 64 CO 0.04 0.00 -0.02 0.42 -0.54 0.00 0.00 174.62 174.52 1qxs s THR 65 N -3.48 0.09 0.00 3.99 -4.23 -1.26 -1.32 115.64 109.43 1qxs s THR 65 Ca 0.33 -0.75 0.00 0.00 -1.18 0.00 0.00 61.69 60.09 1qxs s THR 65 Cb 0.05 -0.22 0.00 0.00 1.34 0.00 0.00 72.50 73.66 1qxs s THR 65 CO 0.17 -0.41 0.00 0.35 -0.54 0.00 0.00 174.62 174.19 1qxs n THR 66 N 1.85 0.00 -4.75 3.99 -2.24 -1.03 -4.97 114.28 107.13 1qxs n THR 66 Ca -0.22 0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.24 1qxs n THR 66 Cb 0.56 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.71 1qxs n THR 66 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1qxs s LYS 67 N 1.07 2.17 0.00 -0.78 1.02 -1.26 -1.96 119.74 120.01 1qxs s LYS 67 Ca 0.00 -2.38 0.00 0.00 0.02 0.00 0.00 55.97 53.61 1qxs s LYS 67 Cb 0.00 -1.50 0.00 0.00 -0.52 0.00 0.00 37.83 35.81 1qxs s LYS 67 CO 0.00 -0.35 0.00 -1.13 -0.92 0.00 0.00 175.35 172.95 1qxs n SER 68 N -1.25 0.52 -3.35 2.83 3.41 -1.26 -4.82 113.62 109.70 1qxs n SER 68 Ca -0.18 -0.43 0.02 0.00 -0.26 0.00 0.00 58.87 58.02 1qxs n SER 68 Cb 0.67 0.96 -0.05 0.00 -0.26 0.00 0.00 64.21 65.54 1qxs n SER 68 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1qxs s SER 69 N -1.07 -0.23 0.66 4.04 0.15 -1.26 -5.03 113.70 110.97 1qxs s SER 69 Ca 0.00 0.32 0.16 0.00 0.70 0.00 0.00 55.95 57.14 1qxs s SER 69 Cb 0.00 1.22 0.89 0.00 -1.71 0.00 0.00 66.02 66.42 1qxs s SER 69 CO 0.00 -0.05 1.50 -0.65 1.20 0.00 0.00 173.24 175.24 1qxs h PRO 70 N 6.74 0.00 0.00 5.44 0.11 -2.03 0.75 132.00 143.01 1qxs h PRO 70 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1qxs h PRO 70 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1qxs h PRO 70 CO 0.11 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.77 1qxs n SER 71 N -2.73 0.00 -4.83 -2.05 3.41 -1.26 -4.70 113.62 101.46 1qxs n SER 71 Ca -0.01 -0.43 -0.36 0.00 -0.26 0.00 0.00 58.87 57.81 1qxs n SER 71 Cb 0.67 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.56 1qxs n SER 71 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1qxs s VAL 72 N -2.00 4.79 -0.01 -3.33 1.01 0.25 -5.02 120.40 116.08 1qxs s VAL 72 Ca 0.17 1.01 -0.25 0.00 0.00 0.00 0.00 61.98 62.91 1qxs s VAL 72 Cb 0.08 -3.80 -0.18 0.00 0.00 0.00 0.00 36.38 32.48 1qxs s VAL 72 CO 0.13 0.34 1.20 0.00 0.00 0.00 0.00 175.10 176.77 1qxs h ALA 73 N 3.86 -0.17 -2.71 5.51 0.00 -1.90 -3.46 119.26 120.39 1qxs h ALA 73 Ca -0.49 -0.21 -0.40 0.00 0.00 0.00 0.00 54.91 53.80 1qxs h ALA 73 Cb 1.20 0.06 -0.17 0.00 0.00 0.00 0.00 17.79 18.88 1qxs h ALA 73 CO 0.65 -0.37 -0.75 0.15 0.00 0.00 0.00 179.25 178.93 1qxs s LYS 74 N -4.30 1.06 0.18 0.00 1.02 -1.26 -5.10 119.74 111.35 1qxs s LYS 74 Ca -0.15 -1.31 -0.31 0.00 0.02 0.00 0.00 55.97 54.22 1qxs s LYS 74 Cb 0.02 -0.88 -0.16 0.00 -0.52 0.00 0.00 37.83 36.28 1qxs s LYS 74 CO 0.60 0.16 0.88 -0.25 -0.92 0.00 0.00 175.35 175.82 1qxs n ASP 75 N 0.31 0.19 -0.03 2.83 9.92 -1.26 -4.86 116.55 123.64 1qxs n ASP 75 Ca -0.14 1.15 0.00 0.00 -0.53 0.00 0.00 54.79 55.27 1qxs n ASP 75 Cb 0.58 -1.09 0.01 0.00 -0.64 0.00 0.00 41.12 39.97 1qxs n ASP 75 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1qxs n ASP 76 N 1.77 0.82 -4.38 -2.24 5.75 -0.87 -2.74 116.55 114.67 1qxs n ASP 76 Ca 0.16 -1.50 -0.32 0.00 -0.01 0.00 0.00 54.79 53.12 1qxs n ASP 76 Cb 0.24 -0.03 -0.15 0.00 -1.03 0.00 0.00 41.12 40.15 1qxs n ASP 76 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1qxs s THR 77 N -0.48 2.51 -0.42 2.12 2.01 -0.83 -1.69 115.64 118.87 1qxs s THR 77 Ca 0.01 -0.93 -0.03 0.00 0.31 0.00 0.00 61.69 61.06 1qxs s THR 77 Cb 0.01 -1.94 0.11 0.00 0.01 0.00 0.00 72.50 70.70 1qxs s THR 77 CO 0.00 0.58 0.22 -0.22 -0.69 0.00 0.00 174.62 174.52 1qxs s LEU 78 N -0.56 5.27 -0.55 4.42 2.96 0.39 -2.47 118.68 128.14 1qxs s LEU 78 Ca 0.08 -2.08 -0.22 0.00 -0.22 0.00 0.00 54.13 51.69 1qxs s LEU 78 Cb -0.11 -1.84 0.05 0.00 0.50 0.00 0.00 46.19 44.79 1qxs s LEU 78 CO 0.01 -0.54 0.85 -0.69 -1.32 0.00 0.00 176.35 174.65 1qxs s VAL 79 N 1.07 4.53 -0.55 1.68 1.01 -0.43 0.52 120.40 128.23 1qxs s VAL 79 Ca 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 1qxs s VAL 79 Cb -0.23 -4.48 0.14 0.00 0.00 0.00 0.00 36.38 31.81 1qxs s VAL 79 CO -0.04 -1.06 0.40 -0.69 0.00 0.00 0.00 175.10 173.71 1qxs s VAL 80 N 3.55 4.02 -0.58 2.92 1.01 0.17 -1.93 120.40 129.56 1qxs s VAL 80 Ca 0.25 -2.33 -0.03 0.00 0.00 0.00 0.00 61.98 59.87 1qxs s VAL 80 Cb -0.15 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.60 1qxs s VAL 80 CO 0.16 -0.82 0.50 0.59 0.00 0.00 0.00 175.10 175.53 1qxs n ASN 81 N 4.25 -3.35 0.00 3.32 3.02 -1.21 -3.35 115.26 117.93 1qxs n ASN 81 Ca 0.01 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 1qxs n ASN 81 Cb 0.41 -2.53 0.00 0.00 -0.61 0.00 0.00 39.78 37.05 1qxs n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qxs n GLY 82 N -1.14 2.11 3.75 7.41 0.00 -1.26 -4.99 105.19 111.07 1qxs n GLY 82 Ca -0.04 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 1qxs n GLY 82 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1qxs s HIS 83 N -0.40 3.38 -0.11 1.61 5.04 -1.21 -5.00 115.29 118.60 1qxs s HIS 83 Ca 0.00 1.46 -0.01 0.00 -1.54 0.00 0.00 55.06 54.98 1qxs s HIS 83 Cb 0.00 -3.46 -0.02 0.00 0.04 0.00 0.00 32.58 29.14 1qxs s HIS 83 CO 0.00 -1.24 -0.08 -0.98 -2.34 0.00 0.00 174.74 170.10 1qxs s ARG 84 N -0.78 3.23 0.09 2.88 1.70 -1.26 0.41 118.95 125.21 1qxs s ARG 84 Ca 0.51 -0.59 0.07 0.00 -0.47 0.00 0.00 55.73 55.25 1qxs s ARG 84 Cb -0.34 -2.69 -0.04 0.00 -0.57 0.00 0.00 34.95 31.31 1qxs s ARG 84 CO 0.41 0.39 -0.14 0.42 -1.08 0.00 0.00 175.30 175.30 1qxs s ILE 85 N -0.07 3.13 -0.05 4.99 1.09 0.18 -4.77 121.20 125.70 1qxs s ILE 85 Ca -0.00 -1.28 -0.02 0.00 -1.10 0.00 0.00 60.65 58.25 1qxs s ILE 85 Cb -0.13 -2.42 -0.04 0.00 -1.06 0.00 0.00 42.46 38.81 1qxs s ILE 85 CO 0.03 0.18 0.05 -0.22 -0.10 0.00 0.00 174.94 174.88 1qxs s LEU 86 N -1.97 3.82 -0.77 2.97 2.96 -0.93 0.15 118.68 124.91 1qxs s LEU 86 Ca 0.19 0.18 -0.11 0.00 -0.22 0.00 0.00 54.13 54.17 1qxs s LEU 86 Cb -0.11 -2.04 0.20 0.00 0.50 0.00 0.00 46.19 44.74 1qxs s LEU 86 CO 0.10 0.34 0.67 0.00 -1.32 0.00 0.00 176.35 176.14 1qxs s VAL 88 N 0.09 3.02 0.09 0.00 -7.23 -1.18 -4.77 120.40 110.42 1qxs s VAL 88 Ca 0.18 0.33 -0.30 0.00 -1.81 0.00 0.00 61.98 60.38 1qxs s VAL 88 Cb -0.13 -2.88 -0.05 0.00 0.56 0.00 0.00 36.38 33.87 1qxs s VAL 88 CO -0.07 -0.43 0.95 -0.75 -0.31 0.00 0.00 175.10 174.49 1qxs s LYS 89 N -4.97 4.66 0.48 4.82 2.36 -1.26 -4.41 119.74 121.42 1qxs s LYS 89 Ca 0.62 1.42 -0.24 0.00 -2.55 0.00 0.00 55.97 55.22 1qxs s LYS 89 Cb -0.17 -3.39 -0.07 0.00 -1.05 0.00 0.00 37.83 33.16 1qxs s LYS 89 CO 0.56 0.18 1.30 0.00 1.55 0.00 0.00 175.35 178.94 1qxs s ALA 90 N 0.14 3.02 0.07 3.13 0.00 -1.23 -4.96 121.76 121.93 1qxs s ALA 90 Ca 0.47 1.22 0.06 0.00 0.00 0.00 0.00 51.96 53.71 1qxs s ALA 90 Cb -0.23 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.36 1qxs s ALA 90 CO 0.29 -1.03 -0.17 -0.65 0.00 0.00 0.00 175.76 174.20 1qxs s GLN 91 N -2.63 0.98 0.16 0.00 -1.52 -1.26 -5.01 119.66 110.38 1qxs s GLN 91 Ca 0.65 -0.96 0.26 0.00 -1.95 0.00 0.00 55.36 53.36 1qxs s GLN 91 Cb -0.37 -1.07 0.92 0.00 -0.22 0.00 0.00 33.01 32.27 1qxs s GLN 91 CO 0.46 0.25 1.79 0.54 -0.25 0.00 0.00 175.29 178.08 1qxs n ARG 92 N 1.45 0.18 -3.91 2.91 1.74 -1.26 -4.58 116.66 113.18 1qxs n ARG 92 Ca -0.20 0.19 -0.28 0.00 -0.77 0.00 0.00 57.85 56.80 1qxs n ARG 92 Cb 0.54 -1.73 -0.17 0.00 -1.02 0.00 0.00 32.46 30.08 1qxs n ARG 92 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1qxs s ASN 93 N -4.07 2.67 0.57 0.55 3.04 -1.26 -5.00 114.94 111.43 1qxs s ASN 93 Ca 0.10 -0.56 0.33 0.00 0.04 0.00 0.00 52.86 52.77 1qxs s ASN 93 Cb 0.13 -0.93 1.45 0.00 -1.54 0.00 0.00 41.25 40.36 1qxs s ASN 93 CO 0.54 -0.15 1.76 -0.65 -3.04 0.00 0.00 177.10 175.56 1qxs h PRO 94 N 8.12 0.00 0.00 0.43 0.11 -1.83 0.37 132.00 139.21 1qxs h PRO 94 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1qxs h PRO 94 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1qxs h PRO 94 CO 0.42 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.21 1qxs n ALA 95 N -2.57 1.69 1.55 -0.75 0.00 -1.11 -2.92 120.51 116.40 1qxs n ALA 95 Ca 0.20 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.82 1qxs n ALA 95 Cb 1.12 -1.35 0.58 0.00 0.00 0.00 0.00 19.45 19.80 1qxs n ALA 95 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1qxs n ASP 96 N -2.00 1.19 -4.74 0.00 8.00 0.13 -4.08 116.55 115.05 1qxs n ASP 96 Ca 0.03 -1.33 -0.40 0.00 0.71 0.00 0.00 54.79 53.80 1qxs n ASP 96 Cb 0.22 0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.28 1qxs n ASP 96 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1qxs s LEU 97 N -2.07 4.44 0.00 0.64 2.01 -1.15 -4.93 118.68 117.63 1qxs s LEU 97 Ca 0.38 1.49 -0.01 0.00 0.01 0.00 0.00 54.13 55.99 1qxs s LEU 97 Cb 0.21 -3.28 -0.04 0.00 0.01 0.00 0.00 46.19 43.08 1qxs s LEU 97 CO 0.36 -0.02 1.27 -0.81 1.01 0.00 0.00 176.35 178.16 1qxs n PRO 98 N 2.93 0.62 -0.19 1.29 -0.04 -1.26 -4.46 135.00 133.88 1qxs n PRO 98 Ca -0.01 -0.15 -0.01 0.00 -0.04 0.00 0.00 63.50 63.28 1qxs n PRO 98 Cb 0.50 -1.42 0.09 0.00 -0.04 0.00 0.00 33.50 32.64 1qxs n PRO 98 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1qxs h TRP 99 N 3.25 0.41 0.35 0.54 -0.00 -1.87 0.25 115.95 118.87 1qxs h TRP 99 Ca 0.03 0.03 -0.00 0.00 -0.00 0.00 0.00 58.89 58.94 1qxs h TRP 99 Cb 0.55 -0.09 -0.03 0.00 -0.00 0.00 0.00 29.16 29.58 1qxs h TRP 99 CO 0.70 0.13 -0.50 0.78 -0.00 0.00 0.00 178.44 179.55 1qxs h GLY 100 N 0.42 -1.17 0.97 1.49 0.00 0.17 -0.79 103.07 104.16 1qxs h GLY 100 Ca 0.29 0.59 -0.02 0.00 0.00 0.00 0.00 47.33 48.18 1qxs h GLY 100 CO -0.27 -0.33 0.21 1.70 0.00 0.00 0.00 176.54 177.85 1qxs h LYS 101 N -0.89 0.68 0.00 4.80 3.64 -1.76 -2.00 116.57 121.05 1qxs h LYS 101 Ca -0.04 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1qxs h LYS 101 Cb 0.82 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 1qxs h LYS 101 CO -0.15 0.59 0.10 -0.07 -2.27 0.00 0.00 179.45 177.65 1qxs h LEU 102 N 0.61 0.00 -0.86 5.20 -0.00 -0.29 -3.45 115.31 116.52 1qxs h LEU 102 Ca 0.16 0.00 -0.18 0.00 -0.00 0.00 0.00 57.88 57.85 1qxs h LEU 102 Cb 0.14 0.00 0.06 0.00 -0.00 0.00 0.00 40.66 40.87 1qxs h LEU 102 CO -0.02 0.00 -0.31 0.61 -0.00 0.00 0.00 178.44 178.72 1qxs n GLY 103 N -1.18 0.25 3.25 0.83 0.00 -0.38 -5.01 105.19 102.95 1qxs n GLY 103 Ca -0.02 -0.25 -0.38 0.00 0.00 0.00 0.00 46.02 45.37 1qxs n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qxs s VAL 104 N -3.13 3.75 -0.15 1.61 1.01 -0.72 -4.93 120.40 117.84 1qxs s VAL 104 Ca 0.26 -1.28 -0.22 0.00 0.00 0.00 0.00 61.98 60.75 1qxs s VAL 104 Cb -0.12 -3.19 -0.19 0.00 0.00 0.00 0.00 36.38 32.88 1qxs s VAL 104 CO 0.33 -0.27 0.45 1.05 0.00 0.00 0.00 175.10 176.66 1qxs h GLU 105 N 8.22 0.00 -6.20 2.72 4.11 -1.87 -3.37 114.58 118.18 1qxs h GLU 105 Ca -0.22 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.64 1qxs h GLU 105 Cb 1.08 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.28 1qxs h GLU 105 CO 0.63 0.79 -0.01 0.71 0.07 0.00 0.00 179.01 181.19 1qxs s TYR 106 N -2.16 3.77 -0.20 2.06 1.51 -0.59 -0.62 117.35 121.12 1qxs s TYR 106 Ca -0.19 1.27 -0.04 0.00 -1.01 0.00 0.00 57.07 57.11 1qxs s TYR 106 Cb 0.00 -2.55 0.07 0.00 -0.11 0.00 0.00 41.96 39.37 1qxs s TYR 106 CO 0.53 0.51 0.07 0.54 -1.11 0.00 0.00 175.55 176.09 1qxs s VAL 107 N -0.81 0.23 -0.68 0.71 0.11 -0.57 0.27 120.40 119.67 1qxs s VAL 107 Ca 0.30 -0.48 -0.27 0.00 -2.93 0.00 0.00 61.98 58.61 1qxs s VAL 107 Cb -0.19 -0.88 0.00 0.00 -1.53 0.00 0.00 36.38 33.78 1qxs s VAL 107 CO 0.19 -0.33 1.59 -0.63 -3.33 0.00 0.00 175.10 172.59 1qxs s ILE 108 N 1.98 3.53 -0.79 7.04 1.01 -0.51 -2.44 121.20 131.03 1qxs s ILE 108 Ca 0.02 0.27 -0.24 0.00 0.00 0.00 0.00 60.65 60.70 1qxs s ILE 108 Cb -0.17 -4.40 0.05 0.00 0.01 0.00 0.00 42.46 37.96 1qxs s ILE 108 CO -0.13 -1.36 1.21 -0.70 0.00 0.00 0.00 174.94 173.97 1qxs s GLU 109 N 6.42 3.28 -0.19 2.79 -6.30 -0.04 -0.96 118.70 123.70 1qxs s GLU 109 Ca 0.52 -0.70 0.13 0.00 -2.50 0.00 0.00 54.97 52.42 1qxs s GLU 109 Cb -0.10 -4.49 0.39 0.00 0.00 0.00 0.00 34.13 29.94 1qxs s GLU 109 CO 0.17 -2.04 1.21 -1.13 0.02 0.00 0.00 175.26 173.49 1qxs n SER 110 N 8.59 1.87 0.04 -1.70 3.41 0.17 -2.40 113.62 123.59 1qxs n SER 110 Ca 0.09 -3.72 -0.15 0.00 -0.26 0.00 0.00 58.87 54.83 1qxs n SER 110 Cb 0.48 -0.51 -0.04 0.00 -0.26 0.00 0.00 64.21 63.88 1qxs n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1qxs h THR 111 N 0.78 1.35 0.00 6.66 1.35 -1.60 -3.44 112.91 118.01 1qxs h THR 111 Ca 0.00 -2.23 0.00 0.00 -0.55 0.00 0.00 66.41 63.63 1qxs h THR 111 Cb 1.01 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 69.67 1qxs h THR 111 CO 0.00 0.68 0.00 0.61 -0.25 0.00 0.00 175.52 176.57 1qxs n GLY 112 N 0.82 0.78 0.27 5.82 0.00 -1.26 -4.92 105.19 106.70 1qxs n GLY 112 Ca -0.07 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.99 1qxs n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qxs n LEU 113 N 0.00 1.47 -2.12 0.99 4.77 -1.26 -4.64 117.00 116.20 1qxs n LEU 113 Ca 0.00 -0.93 -0.10 0.00 -0.03 0.00 0.00 56.01 54.95 1qxs n LEU 113 Cb 0.00 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1qxs n LEU 113 CO 0.00 0.30 0.12 0.49 -1.33 0.00 0.00 177.39 176.97 1qxs n PHE 114 N 0.21 1.71 0.93 -1.77 3.72 -1.26 -4.79 117.46 116.21 1qxs n PHE 114 Ca 0.04 -1.98 0.04 0.00 -0.05 0.00 0.00 57.45 55.51 1qxs n PHE 114 Cb 0.19 -0.28 0.25 0.00 -0.94 0.00 0.00 39.48 38.70 1qxs n PHE 114 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1qxs n THR 115 N -0.61 0.00 -3.44 4.37 -2.24 -1.26 -3.32 114.28 107.77 1qxs n THR 115 Ca 0.25 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.65 1qxs n THR 115 Cb 0.89 -0.55 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 1qxs n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qxs s ALA 116 N -2.00 3.61 0.02 6.98 0.00 -1.26 -1.18 121.76 127.94 1qxs s ALA 116 Ca 0.13 -0.23 -0.05 0.00 0.00 0.00 0.00 51.96 51.80 1qxs s ALA 116 Cb 0.06 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.69 1qxs s ALA 116 CO 0.10 0.28 1.09 -0.22 0.00 0.00 0.00 175.76 177.01 1qxs h LYS 117 N 5.57 -0.04 -0.14 0.00 1.63 0.53 0.41 116.57 124.54 1qxs h LYS 117 Ca -0.47 0.00 0.05 0.00 -0.85 0.00 0.00 60.65 59.38 1qxs h LYS 117 Cb 1.20 0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.78 1qxs h LYS 117 CO 0.68 -0.02 -0.28 0.00 -3.45 0.00 0.00 179.45 176.37 1qxs h ALA 118 N -0.96 -0.29 -0.44 5.00 0.00 -1.87 -0.88 119.26 119.81 1qxs h ALA 118 Ca 0.02 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.03 1qxs h ALA 118 Cb 0.08 0.55 -0.09 0.00 0.00 0.00 0.00 17.79 18.33 1qxs h ALA 118 CO -0.12 -0.75 -0.44 0.00 0.00 0.00 0.00 179.25 177.95 1qxs h ALA 119 N 0.54 -0.43 0.00 0.00 0.00 -1.76 0.24 119.26 117.85 1qxs h ALA 119 Ca 0.10 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1qxs h ALA 119 Cb 0.51 0.92 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1qxs h ALA 119 CO -0.34 -0.87 -0.11 0.00 0.00 0.00 0.00 179.25 177.94 1qxs h ALA 120 N 0.44 1.71 0.00 0.00 0.00 -0.65 -1.32 119.26 119.44 1qxs h ALA 120 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1qxs h ALA 120 Cb 0.58 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1qxs h ALA 120 CO -0.60 0.13 0.00 0.39 0.00 0.00 0.00 179.25 179.17 1qxs n GLU 121 N -4.24 0.01 0.26 0.00 1.02 0.84 -0.95 120.64 117.57 1qxs n GLU 121 Ca -0.03 0.40 0.10 0.00 -0.02 0.00 0.00 57.16 57.62 1qxs n GLU 121 Cb 0.18 -1.50 0.67 0.00 -0.02 0.00 0.00 31.44 30.78 1qxs n GLU 121 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1qxs h GLY 122 N 0.69 0.00 1.83 0.62 0.00 -1.09 -0.97 103.07 104.17 1qxs h GLY 122 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1qxs h GLY 122 CO 0.00 0.00 -0.17 0.45 0.00 0.00 0.00 176.54 176.82 1qxs h HIS 123 N 0.00 0.21 -0.02 5.60 3.86 -1.17 -2.28 115.15 121.36 1qxs h HIS 123 Ca -0.00 -0.03 -0.19 0.00 -1.16 0.00 0.00 60.37 58.99 1qxs h HIS 123 Cb 0.21 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.61 1qxs h HIS 123 CO 0.00 0.37 -0.82 -0.07 0.86 0.00 0.00 177.93 178.27 1qxs h LEU 124 N 0.19 0.34 -0.57 2.43 3.38 -1.35 -2.25 115.31 117.48 1qxs h LEU 124 Ca 0.04 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.60 1qxs h LEU 124 Cb 0.42 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1qxs h LEU 124 CO 0.03 1.02 -0.68 0.03 0.09 0.00 0.00 178.44 178.92 1qxs h ARG 125 N 0.17 0.17 0.00 1.13 3.08 -1.40 -2.67 114.38 114.85 1qxs h ARG 125 Ca -0.04 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1qxs h ARG 125 Cb 1.42 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.50 1qxs h ARG 125 CO 0.13 0.79 0.00 0.41 -1.07 0.00 0.00 179.97 180.23 1qxs n GLY 126 N 0.44 -0.72 0.00 0.04 0.00 -0.88 -4.78 105.19 99.29 1qxs n GLY 126 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1qxs n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qxs n GLY 127 N -0.50 1.15 3.91 -0.02 0.00 -1.01 0.72 105.19 109.43 1qxs n GLY 127 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1qxs n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qxs s ALA 128 N -2.00 3.56 -0.08 4.61 0.00 -0.85 -3.94 121.76 123.05 1qxs s ALA 128 Ca 0.00 -0.55 -0.05 0.00 0.00 0.00 0.00 51.96 51.36 1qxs s ALA 128 Cb 0.00 -2.38 -0.02 0.00 0.00 0.00 0.00 23.12 20.73 1qxs s ALA 128 CO 0.00 0.08 -0.10 0.00 0.00 0.00 0.00 175.76 175.74 1qxs h ARG 129 N 1.27 0.00 -6.37 0.00 3.08 -1.07 -3.38 114.38 107.91 1qxs h ARG 129 Ca -0.48 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 58.88 1qxs h ARG 129 Cb 1.20 0.00 -0.23 0.00 0.08 0.00 0.00 29.97 31.02 1qxs h ARG 129 CO 0.64 0.00 -0.77 0.15 -1.07 0.00 0.00 179.97 178.92 1qxs s LYS 130 N -1.72 2.43 -0.16 0.04 -0.14 -0.78 -4.86 119.74 114.56 1qxs s LYS 130 Ca -0.08 -0.75 -0.00 0.00 -1.36 0.00 0.00 55.97 53.78 1qxs s LYS 130 Cb 0.01 -2.35 0.03 0.00 -1.68 0.00 0.00 37.83 33.85 1qxs s LYS 130 CO 0.13 0.61 -0.09 0.08 -0.76 0.00 0.00 175.35 175.31 1qxs s VAL 131 N -0.78 1.31 -0.22 3.17 1.01 0.25 -1.51 120.40 123.63 1qxs s VAL 131 Ca 0.12 -0.63 -0.12 0.00 0.00 0.00 0.00 61.98 61.36 1qxs s VAL 131 Cb -0.11 -1.37 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 1qxs s VAL 131 CO 0.02 0.27 0.21 -0.69 0.00 0.00 0.00 175.10 174.90 1qxs s VAL 132 N 1.57 5.34 -0.55 2.92 1.01 -1.02 -1.49 120.40 128.17 1qxs s VAL 132 Ca 0.02 0.30 -0.20 0.00 0.00 0.00 0.00 61.98 62.11 1qxs s VAL 132 Cb -0.14 -3.54 0.07 0.00 0.00 0.00 0.00 36.38 32.77 1qxs s VAL 132 CO -0.09 0.35 0.70 -0.63 0.00 0.00 0.00 175.10 175.44 1qxs s ILE 133 N 0.90 4.77 0.00 2.22 1.01 0.21 -0.86 121.20 129.45 1qxs s ILE 133 Ca 0.10 -0.58 -0.00 0.00 0.00 0.00 0.00 60.65 60.17 1qxs s ILE 133 Cb -0.13 -4.41 -0.02 0.00 0.01 0.00 0.00 42.46 37.91 1qxs s ILE 133 CO 0.04 -0.99 0.72 -1.54 0.00 0.00 0.00 174.94 173.17 1qxs n SER 134 N 6.46 1.33 -3.62 3.58 3.41 -1.01 -1.56 113.62 122.21 1qxs n SER 134 Ca -0.07 -1.46 0.01 0.00 -0.26 0.00 0.00 58.87 57.10 1qxs n SER 134 Cb 0.45 -0.30 -0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1qxs n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qxs s ALA 135 N 1.78 -2.23 0.19 7.33 0.00 -1.24 -4.94 121.76 122.64 1qxs s ALA 135 Ca 0.05 0.71 -0.32 0.00 0.00 0.00 0.00 51.96 52.40 1qxs s ALA 135 Cb 0.02 0.35 -0.11 0.00 0.00 0.00 0.00 23.12 23.38 1qxs s ALA 135 CO 0.00 -1.05 1.66 -2.14 0.00 0.00 0.00 175.76 174.24 1qxs s PRO 136 N -2.43 4.16 0.00 0.00 0.02 -1.22 -4.03 135.00 131.50 1qxs s PRO 136 Ca 0.14 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.67 1qxs s PRO 136 Cb 0.05 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.45 1qxs s PRO 136 CO -0.04 -0.70 0.00 0.00 -0.33 0.00 0.00 177.00 175.93 1qxs n ALA 137 N 4.03 0.00 -3.65 -1.55 0.00 -1.26 -4.78 120.51 113.30 1qxs n ALA 137 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.59 1qxs n ALA 137 Cb 0.37 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.75 1qxs n ALA 137 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1qxs s SER 138 N -1.00 -0.14 0.00 0.00 1.04 -0.32 -4.93 113.70 108.34 1qxs s SER 138 Ca 0.00 0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1qxs s SER 138 Cb 0.00 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.88 1qxs s SER 138 CO 0.00 -0.04 0.00 0.61 0.98 0.00 0.00 173.24 174.79 1qxs n GLY 139 N 2.66 1.94 1.21 7.32 0.00 -1.26 0.11 105.19 117.17 1qxs n GLY 139 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1qxs n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qxs n GLY 140 N -0.17 0.96 3.67 -0.02 0.00 -1.26 -4.70 105.19 103.67 1qxs n GLY 140 Ca 0.00 -0.54 -0.38 0.00 0.00 0.00 0.00 46.02 45.09 1qxs n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qxs s ALA 141 N -2.15 3.54 0.02 4.61 0.00 -1.26 -5.02 121.76 121.50 1qxs s ALA 141 Ca 0.00 -0.44 -0.30 0.00 0.00 0.00 0.00 51.96 51.22 1qxs s ALA 141 Cb 0.00 -2.70 -0.08 0.00 0.00 0.00 0.00 23.12 20.34 1qxs s ALA 141 CO 0.00 -0.32 1.93 0.21 0.00 0.00 0.00 175.76 177.59 1qxs s LYS 142 N 1.35 4.13 -0.27 0.00 2.47 -1.25 -4.71 119.74 121.45 1qxs s LYS 142 Ca 0.22 2.55 -0.15 0.00 -1.56 0.00 0.00 55.97 57.02 1qxs s LYS 142 Cb -0.15 -4.14 -0.04 0.00 -1.46 0.00 0.00 37.83 32.04 1qxs s LYS 142 CO 0.09 -0.96 0.37 0.99 0.16 0.00 0.00 175.35 175.99 1qxs s THR 143 N 4.48 5.17 0.23 3.43 2.01 -1.26 -1.49 115.64 128.22 1qxs s THR 143 Ca 0.87 0.54 0.09 0.00 0.31 0.00 0.00 61.69 63.49 1qxs s THR 143 Cb -0.41 -3.70 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 1qxs s THR 143 CO 0.40 0.14 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.70 1qxs s LEU 144 N 2.07 3.19 -0.25 4.42 1.43 -0.46 -4.82 118.68 124.26 1qxs s LEU 144 Ca 0.15 -0.56 -0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1qxs s LEU 144 Cb -0.16 -1.78 0.11 0.00 0.03 0.00 0.00 46.19 44.39 1qxs s LEU 144 CO 0.10 0.04 0.22 -0.69 0.23 0.00 0.00 176.35 176.25 1qxs s VAL 145 N -2.05 -0.28 -0.33 -1.59 1.01 -1.26 -4.16 120.40 111.73 1qxs s VAL 145 Ca 0.29 -0.39 -0.42 0.00 0.00 0.00 0.00 61.98 61.47 1qxs s VAL 145 Cb -0.08 -0.85 -0.17 0.00 0.00 0.00 0.00 36.38 35.29 1qxs s VAL 145 CO 0.19 -0.41 1.69 0.23 0.00 0.00 0.00 175.10 176.79 1qxs n MET 146 N 5.30 0.83 -0.54 2.72 0.00 -1.26 -0.60 117.12 123.57 1qxs n MET 146 Ca -0.04 0.30 0.00 0.00 0.00 0.00 0.00 57.70 57.96 1qxs n MET 146 Cb 0.47 -1.93 0.00 0.00 0.00 0.00 0.00 33.22 31.75 1qxs n MET 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1qxs n GLY 147 N 4.08 0.75 0.00 3.03 0.00 -1.26 -4.86 105.19 106.94 1qxs n GLY 147 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1qxs n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1qxs n VAL 148 N -2.26 0.00 -1.75 1.61 0.31 0.24 -4.97 118.33 111.51 1qxs n VAL 148 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1qxs n VAL 148 Cb 0.00 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.67 1qxs n VAL 148 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1qxs n ASN 149 N -1.73 0.00 0.29 4.52 6.94 -0.96 -4.96 115.26 119.37 1qxs n ASN 149 Ca 0.00 -0.88 0.15 0.00 -0.02 0.00 0.00 54.58 53.83 1qxs n ASN 149 Cb 0.21 0.00 0.79 0.00 -2.36 0.00 0.00 39.78 38.42 1qxs n ASN 149 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 1qxs h HIS 150 N 0.00 0.00 0.00 -2.53 2.07 -1.89 0.19 115.15 113.00 1qxs h HIS 150 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1qxs h HIS 150 Cb 0.71 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.69 1qxs h HIS 150 CO 0.00 0.00 0.00 0.72 -3.07 0.00 0.00 177.93 175.58 1qxs n HIS 151 N -2.71 0.00 1.13 6.12 8.25 -1.26 -2.89 115.22 123.85 1qxs n HIS 151 Ca -0.02 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.51 1qxs n HIS 151 Cb 0.28 -0.48 0.43 0.00 1.12 0.00 0.00 29.99 31.33 1qxs n HIS 151 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1qxs n GLU 152 N -1.48 0.56 -2.13 -0.41 1.02 0.68 -4.74 120.64 114.13 1qxs n GLU 152 Ca 0.07 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.79 1qxs n GLU 152 Cb 0.32 -1.40 -0.03 0.00 -0.02 0.00 0.00 31.44 30.32 1qxs n GLU 152 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1qxs s TYR 153 N -2.00 2.17 -0.54 -0.32 5.04 -1.14 -4.97 117.35 115.59 1qxs s TYR 153 Ca 0.21 0.53 -0.18 0.00 -2.44 0.00 0.00 57.07 55.20 1qxs s TYR 153 Cb 0.10 -3.92 0.09 0.00 0.35 0.00 0.00 41.96 38.59 1qxs s TYR 153 CO 0.17 -2.96 0.59 1.21 -1.34 0.00 0.00 175.55 173.22 1qxs s ASN 154 N 3.78 6.19 0.38 4.32 3.84 -1.26 -4.94 114.94 127.25 1qxs s ASN 154 Ca 0.70 -1.37 0.21 0.00 0.21 0.00 0.00 52.86 52.60 1qxs s ASN 154 Cb -0.26 -2.26 1.21 0.00 -0.55 0.00 0.00 41.25 39.39 1qxs s ASN 154 CO 0.27 -0.92 1.67 -0.65 -2.79 0.00 0.00 177.10 174.68 1qxs h PRO 155 N 9.00 0.24 -2.34 0.43 0.11 -1.90 -0.20 132.00 137.34 1qxs h PRO 155 Ca -0.29 -0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.12 1qxs h PRO 155 Cb 1.10 -0.05 -0.36 0.00 0.11 0.00 0.00 31.00 31.79 1qxs h PRO 155 CO 1.02 0.16 0.04 -1.13 -0.21 0.00 0.00 178.00 177.88 1qxs n SER 156 N -4.86 5.44 0.00 -2.05 3.41 -1.26 -4.43 113.62 109.87 1qxs n SER 156 Ca 0.32 -3.61 0.00 0.00 -0.26 0.00 0.00 58.87 55.33 1qxs n SER 156 Cb 1.12 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 1qxs n SER 156 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1qxs n GLU 157 N 0.22 0.00 -3.49 4.33 4.07 -0.74 -5.08 120.64 119.95 1qxs n GLU 157 Ca 0.35 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 57.02 1qxs n GLU 157 Cb 0.35 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.65 1qxs n GLU 157 CO 0.00 0.00 0.00 -1.01 -0.06 0.00 0.00 177.13 176.06 1qxs s HIS 158 N -1.46 3.40 -0.77 4.31 3.76 -0.16 -4.85 115.29 119.51 1qxs s HIS 158 Ca 0.00 -1.76 0.19 0.00 -0.15 0.00 0.00 55.06 53.34 1qxs s HIS 158 Cb 0.00 -3.58 -0.22 0.00 1.11 0.00 0.00 32.58 29.89 1qxs s HIS 158 CO 0.00 -1.00 0.75 0.72 -0.85 0.00 0.00 174.74 174.36 1qxs n HIS 159 N 4.93 0.00 -3.67 1.40 8.25 -1.26 -4.76 115.22 120.11 1qxs n HIS 159 Ca -0.08 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.15 1qxs n HIS 159 Cb 0.41 -0.07 -0.17 0.00 1.12 0.00 0.00 29.99 31.28 1qxs n HIS 159 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1qxs s VAL 160 N -2.88 0.01 0.51 1.59 1.01 -1.26 -0.59 120.40 118.80 1qxs s VAL 160 Ca 0.05 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.15 1qxs s VAL 160 Cb 0.14 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 36.09 1qxs s VAL 160 CO 0.79 -0.00 0.01 0.68 0.00 0.00 0.00 175.10 176.57 1qxs s VAL 161 N 2.11 1.15 -0.07 2.92 -7.23 -0.56 -3.82 120.40 114.90 1qxs s VAL 161 Ca 0.03 -1.99 0.01 0.00 -1.81 0.00 0.00 61.98 58.22 1qxs s VAL 161 Cb -0.14 -2.14 0.02 0.00 0.56 0.00 0.00 36.38 34.69 1qxs s VAL 161 CO -0.06 0.00 -0.06 -0.55 -0.31 0.00 0.00 175.10 174.12 1qxs s SER 162 N -3.89 1.53 -0.03 4.85 0.15 -0.55 -0.62 113.70 115.14 1qxs s SER 162 Ca 0.05 -0.20 0.05 0.00 0.70 0.00 0.00 55.95 56.55 1qxs s SER 162 Cb 0.01 -0.62 0.18 0.00 -1.71 0.00 0.00 66.02 63.88 1qxs s SER 162 CO 0.03 -0.07 0.98 -3.20 1.20 0.00 0.00 173.24 172.18 1qxs n ASN 163 N 4.39 1.54 -0.29 5.45 5.15 -0.60 -1.36 115.26 129.55 1qxs n ASN 163 Ca -0.18 -2.11 0.00 0.00 -0.60 0.00 0.00 54.58 51.69 1qxs n ASN 163 Cb 0.51 -0.32 0.00 0.00 -0.53 0.00 0.00 39.78 39.44 1qxs n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1qxs n ALA 164 N 0.09 0.00 -2.83 5.20 0.00 -1.26 -4.84 120.51 116.87 1qxs n ALA 164 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.24 1qxs n ALA 164 Cb 0.31 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.73 1qxs n ALA 164 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1qxs s SER 165 N -4.00 6.36 0.50 0.00 1.04 -1.26 -3.39 113.70 112.95 1qxs s SER 165 Ca 0.00 0.31 0.18 0.00 0.48 0.00 0.00 55.95 56.92 1qxs s SER 165 Cb 0.00 -1.97 1.26 0.00 0.10 0.00 0.00 66.02 65.41 1qxs s SER 165 CO 0.00 -0.04 2.07 0.00 0.98 0.00 0.00 173.24 176.25 1qxs h THR 167 N 0.09 1.32 -0.37 0.00 2.02 -1.94 -3.14 112.91 110.89 1qxs h THR 167 Ca 0.14 -2.47 -0.08 0.00 0.77 0.00 0.00 66.41 64.77 1qxs h THR 167 Cb 0.43 2.60 -0.02 0.00 -1.74 0.00 0.00 68.15 69.43 1qxs h THR 167 CO -0.01 0.75 -0.10 0.74 0.37 0.00 0.00 175.52 177.27 1qxs h THR 168 N 0.28 1.24 0.00 3.16 2.02 -1.65 -0.81 112.91 117.14 1qxs h THR 168 Ca -0.15 -1.06 0.00 0.00 0.77 0.00 0.00 66.41 65.96 1qxs h THR 168 Cb 1.82 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 69.30 1qxs h THR 168 CO 0.22 0.36 0.00 0.59 0.37 0.00 0.00 175.52 177.05 1qxs n ASN 169 N -4.19 0.03 -0.10 4.18 3.02 -0.63 -0.75 115.26 116.82 1qxs n ASN 169 Ca 0.01 0.51 -0.13 0.00 -0.03 0.00 0.00 54.58 54.94 1qxs n ASN 169 Cb 0.33 -0.52 -0.11 0.00 -0.61 0.00 0.00 39.78 38.88 1qxs n ASN 169 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qxs h LEU 171 N 0.00 -0.34 -0.71 0.00 6.46 -0.99 -3.34 115.31 116.39 1qxs h LEU 171 Ca -0.48 -0.12 0.11 0.00 -0.12 0.00 0.00 57.88 57.28 1qxs h LEU 171 Cb 1.81 0.09 -0.12 0.00 -0.73 0.00 0.00 40.66 41.71 1qxs h LEU 171 CO -0.05 0.14 -0.40 0.00 -0.62 0.00 0.00 178.44 177.50 1qxs h ALA 172 N -0.83 -0.14 -1.03 1.25 0.00 -1.19 0.22 119.26 117.54 1qxs h ALA 172 Ca -0.04 0.17 0.27 0.00 0.00 0.00 0.00 54.91 55.31 1qxs h ALA 172 Cb 0.44 0.94 -0.07 0.00 0.00 0.00 0.00 17.79 19.10 1qxs h ALA 172 CO 0.07 -0.74 0.69 -1.35 0.00 0.00 0.00 179.25 177.92 1qxs h PRO 173 N -0.14 0.25 -0.00 0.00 0.11 -1.78 0.64 132.00 131.07 1qxs h PRO 173 Ca 0.23 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.32 1qxs h PRO 173 Cb 0.56 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.61 1qxs h PRO 173 CO -0.77 0.16 -0.04 0.82 -0.21 0.00 0.00 178.00 177.96 1qxs h ILE 174 N 0.26 1.57 -0.43 4.15 1.08 -0.73 -3.09 117.51 120.31 1qxs h ILE 174 Ca 0.55 -1.72 -0.07 0.00 -0.39 0.00 0.00 64.86 63.23 1qxs h ILE 174 Cb 1.65 2.72 -0.02 0.00 -3.07 0.00 0.00 36.82 38.10 1qxs h ILE 174 CO -0.18 0.45 -0.01 0.58 -0.69 0.00 0.00 178.15 178.31 1qxs h VAL 175 N -0.67 1.23 -0.65 1.67 2.07 -0.03 -2.66 116.25 117.20 1qxs h VAL 175 Ca -0.00 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.58 1qxs h VAL 175 Cb 0.76 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1qxs h VAL 175 CO 0.01 0.33 0.43 -0.74 0.02 0.00 0.00 177.57 177.62 1qxs h HIS 176 N 0.65 0.82 -0.19 1.57 -0.00 0.17 -1.14 115.15 117.03 1qxs h HIS 176 Ca 0.13 0.02 -0.20 0.00 -0.00 0.00 0.00 60.37 60.32 1qxs h HIS 176 Cb 0.42 -0.28 0.01 0.00 -0.00 0.00 0.00 27.41 27.56 1qxs h HIS 176 CO 0.02 0.51 -0.65 0.28 -0.00 0.00 0.00 177.93 178.09 1qxs h VAL 177 N 0.88 1.29 -0.02 5.26 2.07 -1.39 -2.28 116.25 122.07 1qxs h VAL 177 Ca 0.24 -1.86 0.01 0.00 0.82 0.00 0.00 66.70 65.91 1qxs h VAL 177 Cb -0.10 1.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1qxs h VAL 177 CO -0.05 0.59 -0.05 -0.07 0.02 0.00 0.00 177.57 178.01 1qxs h LEU 178 N 0.51 -0.15 0.71 2.57 3.38 -1.13 0.28 115.31 121.47 1qxs h LEU 178 Ca -0.03 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1qxs h LEU 178 Cb 1.28 0.07 0.01 0.00 0.09 0.00 0.00 40.66 42.10 1qxs h LEU 178 CO 0.14 -0.08 -0.34 0.58 0.09 0.00 0.00 178.44 178.83 1qxs h VAL 179 N -0.08 0.28 -0.54 1.22 2.07 -1.29 0.81 116.25 118.71 1qxs h VAL 179 Ca 0.03 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1qxs h VAL 179 Cb 0.12 0.30 -0.03 0.00 -1.52 0.00 0.00 31.29 30.16 1qxs h VAL 179 CO -0.07 0.01 0.33 0.11 0.02 0.00 0.00 177.57 177.98 1qxs h LYS 180 N -1.01 0.73 -0.34 1.57 6.56 -1.35 -1.79 116.57 120.94 1qxs h LYS 180 Ca -0.10 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.43 1qxs h LYS 180 Cb 0.74 -0.16 0.00 0.00 -0.57 0.00 0.00 32.23 32.25 1qxs h LYS 180 CO 0.16 0.52 0.00 0.39 -2.06 0.00 0.00 179.45 178.46 1qxs n GLU 181 N -4.67 0.50 -0.46 3.15 -0.58 0.98 -4.76 120.64 114.79 1qxs n GLU 181 Ca 0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 1qxs n GLU 181 Cb 0.05 -1.17 0.00 0.00 -0.57 0.00 0.00 31.44 29.75 1qxs n GLU 181 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1qxs n GLY 182 N 0.17 1.22 0.24 0.62 0.00 -0.67 -4.87 105.19 101.90 1qxs n GLY 182 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 1qxs n GLY 182 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1qxs h PHE 183 N 0.00 0.77 -1.41 1.61 0.04 -1.05 -3.46 116.94 113.44 1qxs h PHE 183 Ca 0.00 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.78 1qxs h PHE 183 Cb 0.00 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 37.89 1qxs h PHE 183 CO 0.00 0.50 -0.37 0.41 -0.60 0.00 0.00 178.31 178.26 1qxs n GLY 184 N -1.20 -3.28 3.01 -1.45 0.00 -0.38 -2.09 105.19 99.79 1qxs n GLY 184 Ca 0.04 -1.13 -0.31 0.00 0.00 0.00 0.00 46.02 44.62 1qxs n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qxs s VAL 185 N -4.50 1.76 -0.14 1.61 1.01 -1.26 -2.40 120.40 116.49 1qxs s VAL 185 Ca 0.00 -1.19 -0.18 0.00 0.00 0.00 0.00 61.98 60.62 1qxs s VAL 185 Cb 0.00 -1.87 -0.15 0.00 0.00 0.00 0.00 36.38 34.36 1qxs s VAL 185 CO 0.00 0.09 0.38 -0.61 0.00 0.00 0.00 175.10 174.96 1qxs h GLN 186 N 7.92 0.00 -3.05 2.72 4.15 -1.44 -3.46 115.11 121.96 1qxs h GLN 186 Ca -0.25 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.03 1qxs h GLN 186 Cb 1.08 0.00 -0.23 0.00 0.21 0.00 0.00 27.48 28.54 1qxs h GLN 186 CO 0.47 0.61 -0.34 0.95 -1.93 0.00 0.00 178.83 178.59 1qxs s THR 187 N -2.04 0.03 -0.16 2.39 -4.23 -1.24 -4.87 115.64 105.52 1qxs s THR 187 Ca -0.14 -0.23 -0.21 0.00 -1.18 0.00 0.00 61.69 59.93 1qxs s THR 187 Cb -0.00 -0.50 0.05 0.00 1.34 0.00 0.00 72.50 73.39 1qxs s THR 187 CO 0.43 -0.12 0.55 -0.83 -0.54 0.00 0.00 174.62 174.10 1qxs s GLY 188 N -0.49 -0.41 -0.05 3.99 0.00 -0.20 -1.44 107.32 108.71 1qxs s GLY 188 Ca -0.06 1.37 0.04 0.00 0.00 0.00 0.00 44.72 46.08 1qxs s GLY 188 CO 0.02 1.13 -0.19 1.08 0.00 0.00 0.00 173.10 175.14 1qxs s LEU 189 N -0.16 1.94 -0.02 0.66 1.43 -0.78 -2.39 118.68 119.35 1qxs s LEU 189 Ca -0.04 -0.40 0.05 0.00 -1.03 0.00 0.00 54.13 52.71 1qxs s LEU 189 Cb -0.03 -1.07 -0.01 0.00 0.03 0.00 0.00 46.19 45.10 1qxs s LEU 189 CO 0.03 0.16 -0.16 0.00 0.23 0.00 0.00 176.35 176.61 1qxs s MET 190 N 0.08 1.44 -0.06 1.70 0.23 0.40 -2.04 119.30 121.05 1qxs s MET 190 Ca -0.06 -0.58 0.05 0.00 -1.03 0.00 0.00 55.69 54.07 1qxs s MET 190 Cb -0.13 -1.34 -0.02 0.00 -1.53 0.00 0.00 34.83 31.81 1qxs s MET 190 CO 0.03 0.31 -0.20 0.99 -2.03 0.00 0.00 175.02 174.12 1qxs s THR 191 N -0.23 2.53 -0.18 3.16 2.01 -1.10 -1.47 115.64 120.37 1qxs s THR 191 Ca 0.03 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.13 1qxs s THR 191 Cb -0.08 -1.96 0.03 0.00 0.01 0.00 0.00 72.50 70.50 1qxs s THR 191 CO 0.00 0.57 -0.15 0.28 -0.69 0.00 0.00 174.62 174.63 1qxs s THR 192 N -0.37 1.78 -0.61 -0.82 -1.32 -0.71 -1.02 115.64 112.58 1qxs s THR 192 Ca 0.03 -0.87 -0.27 0.00 -1.21 0.00 0.00 61.69 59.36 1qxs s THR 192 Cb -0.12 -1.70 0.03 0.00 -1.51 0.00 0.00 72.50 69.20 1qxs s THR 192 CO 0.02 0.39 1.17 -0.63 -2.21 0.00 0.00 174.62 173.36 1qxs s ILE 193 N 1.38 4.02 0.05 5.08 1.09 -0.88 -0.42 121.20 131.52 1qxs s ILE 193 Ca 0.03 0.70 0.04 0.00 -1.10 0.00 0.00 60.65 60.32 1qxs s ILE 193 Cb -0.14 -4.74 -0.04 0.00 -1.06 0.00 0.00 42.46 36.49 1qxs s ILE 193 CO -0.11 -1.41 -0.04 -2.28 -0.10 0.00 0.00 174.94 171.00 1qxs s HIS 194 N 4.94 2.92 0.38 3.97 2.46 0.37 -1.76 115.29 128.57 1qxs s HIS 194 Ca 0.39 -0.04 -0.11 0.00 0.47 0.00 0.00 55.06 55.77 1qxs s HIS 194 Cb -0.08 -1.56 -0.07 0.00 -0.13 0.00 0.00 32.58 30.73 1qxs s HIS 194 CO 0.22 0.43 0.75 -1.54 -2.47 0.00 0.00 174.74 172.13 1qxs s SER 195 N -1.85 6.57 0.94 9.88 1.04 -1.24 -0.41 113.70 128.62 1qxs s SER 195 Ca 0.21 1.15 -0.10 0.00 0.48 0.00 0.00 55.95 57.68 1qxs s SER 195 Cb -0.11 -2.33 0.15 0.00 0.10 0.00 0.00 66.02 63.83 1qxs s SER 195 CO 0.12 -0.35 1.07 0.00 0.98 0.00 0.00 173.24 175.07 1qxs n TYR 196 N -1.08 0.53 -4.37 5.02 0.18 -0.89 -4.83 117.16 111.73 1qxs n TYR 196 Ca 0.02 0.35 -0.21 0.00 1.88 0.00 0.00 57.90 59.95 1qxs n TYR 196 Cb 0.54 -1.96 -0.08 0.00 -0.38 0.00 0.00 39.34 37.45 1qxs n TYR 196 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 1qxs s THR 197 N -2.60 0.28 0.33 -3.48 -4.23 -1.26 -4.70 115.64 99.97 1qxs s THR 197 Ca 0.66 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.48 1qxs s THR 197 Cb -0.23 -2.45 0.31 0.00 1.34 0.00 0.00 72.50 71.47 1qxs s THR 197 CO 0.59 0.00 1.93 0.00 -0.54 0.00 0.00 174.62 176.60 1qxs h ALA 198 N 2.06 1.10 0.00 3.99 0.00 -1.97 -1.84 119.26 122.60 1qxs h ALA 198 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1qxs h ALA 198 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1qxs h ALA 198 CO 0.48 -0.10 -0.07 1.79 0.00 0.00 0.00 179.25 181.35 1qxs h THR 199 N 0.00 0.00 -4.28 0.00 1.35 -1.99 -3.46 112.91 104.53 1qxs h THR 199 Ca 0.00 -0.60 -0.39 0.00 -0.55 0.00 0.00 66.41 64.86 1qxs h THR 199 Cb 0.22 1.56 0.12 0.00 -1.73 0.00 0.00 68.15 68.32 1qxs h THR 199 CO 0.00 0.00 0.26 0.00 -0.25 0.00 0.00 175.52 175.53 1qxs n GLN 200 N -2.45 -0.70 -4.35 4.72 6.02 -0.69 -5.00 117.38 114.93 1qxs n GLN 200 Ca 0.05 -2.05 -0.29 0.00 -0.01 0.00 0.00 57.00 54.70 1qxs n GLN 200 Cb 0.46 -0.96 -0.12 0.00 1.02 0.00 0.00 30.24 30.63 1qxs n GLN 200 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1qxs s LYS 201 N -5.25 1.59 0.04 -1.09 3.01 -1.26 -5.00 119.74 111.77 1qxs s LYS 201 Ca 0.63 -1.26 -0.22 0.00 -1.01 0.00 0.00 55.97 54.11 1qxs s LYS 201 Cb -0.02 -2.01 -0.15 0.00 -1.01 0.00 0.00 37.83 34.64 1qxs s LYS 201 CO 0.43 0.47 1.41 1.79 0.51 0.00 0.00 175.35 179.96 1qxs h THR 202 N 3.72 1.30 -2.91 2.17 1.35 -1.97 -1.49 112.91 115.09 1qxs h THR 202 Ca -0.50 -0.99 -0.45 0.00 -0.55 0.00 0.00 66.41 63.92 1qxs h THR 202 Cb 1.17 1.72 -0.14 0.00 -1.73 0.00 0.00 68.15 69.17 1qxs h THR 202 CO 0.42 0.28 -0.73 0.68 -0.25 0.00 0.00 175.52 175.92 1qxs s VAL 203 N -4.69 1.72 -0.12 6.82 -7.23 -1.26 -3.89 120.40 111.74 1qxs s VAL 203 Ca -0.14 -2.20 -0.41 0.00 -1.81 0.00 0.00 61.98 57.41 1qxs s VAL 203 Cb 0.05 -2.03 -0.20 0.00 0.56 0.00 0.00 36.38 34.76 1qxs s VAL 203 CO 0.71 -0.60 1.19 0.47 -0.31 0.00 0.00 175.10 176.57 1qxs n ASP 204 N -0.35 0.29 -0.96 4.85 8.00 -1.26 -4.35 116.55 122.76 1qxs n ASP 204 Ca -0.08 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.57 1qxs n ASP 204 Cb 0.60 -0.90 0.00 0.00 -0.02 0.00 0.00 41.12 40.80 1qxs n ASP 204 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qxs n GLY 205 N 2.11 3.27 3.74 0.44 0.00 -0.86 -4.91 105.19 108.98 1qxs n GLY 205 Ca 0.23 -1.39 -0.40 0.00 0.00 0.00 0.00 46.02 44.45 1qxs n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qxs s VAL 206 N -2.37 4.46 -0.44 1.61 1.01 -1.26 -4.66 120.40 118.75 1qxs s VAL 206 Ca 0.00 1.95 0.05 0.00 0.00 0.00 0.00 61.98 63.97 1qxs s VAL 206 Cb 0.00 -4.26 0.28 0.00 0.00 0.00 0.00 36.38 32.40 1qxs s VAL 206 CO 0.00 0.38 1.06 -0.24 0.00 0.00 0.00 175.10 176.30 1qxs n SER 207 N 2.46 -2.35 0.31 3.32 2.88 -1.26 -4.85 113.62 114.14 1qxs n SER 207 Ca -0.00 -3.09 0.19 0.00 -1.33 0.00 0.00 58.87 54.63 1qxs n SER 207 Cb 0.49 1.65 1.06 0.00 -0.75 0.00 0.00 64.21 66.66 1qxs n SER 207 CO 0.00 0.00 0.00 -0.37 -1.23 0.00 0.00 175.04 173.44 1qxs h VAL 208 N 2.53 0.27 0.00 2.46 -1.51 -1.95 -0.01 116.25 118.04 1qxs h VAL 208 Ca -0.16 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.31 1qxs h VAL 208 Cb 1.09 0.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1qxs h VAL 208 CO 0.16 0.00 -0.25 0.11 -1.23 0.00 0.00 177.57 176.36 1qxs h LYS 209 N 0.00 0.00 -0.78 5.19 1.79 -2.03 -3.41 116.57 117.33 1qxs h LYS 209 Ca 0.00 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.40 1qxs h LYS 209 Cb 0.03 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 30.52 1qxs h LYS 209 CO -0.00 0.00 -0.38 0.34 -1.08 0.00 0.00 179.45 178.33 1qxs s ASP 210 N -4.49 -1.15 0.29 0.86 2.15 -0.07 -5.06 116.67 109.20 1qxs s ASP 210 Ca 0.09 -1.13 -0.02 0.00 0.43 0.00 0.00 52.55 51.91 1qxs s ASP 210 Cb 0.12 1.50 0.63 0.00 -0.30 0.00 0.00 42.92 44.87 1qxs s ASP 210 CO 0.65 -0.07 1.57 -0.50 -0.17 0.00 0.00 175.17 176.66 1qxs h TRP 211 N 5.31 -0.20 -0.30 -5.34 4.06 -1.65 0.25 115.95 118.07 1qxs h TRP 211 Ca 0.04 0.08 -0.14 0.00 2.06 0.00 0.00 58.89 60.92 1qxs h TRP 211 Cb 1.15 0.24 -0.01 0.00 -1.00 0.00 0.00 29.16 29.54 1qxs h TRP 211 CO 0.06 -0.42 -0.39 0.00 -3.56 0.00 0.00 178.44 174.13 1qxs h ARG 212 N 0.01 0.73 0.00 0.49 3.08 -1.91 -2.68 114.38 114.10 1qxs h ARG 212 Ca 0.55 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1qxs h ARG 212 Cb 1.03 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.09 1qxs h ARG 212 CO -0.93 0.99 0.00 0.41 -1.07 0.00 0.00 179.97 179.37 1qxs n GLY 213 N 0.05 -0.71 2.60 0.04 0.00 0.84 -2.39 105.19 105.62 1qxs n GLY 213 Ca -0.02 0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 1qxs n GLY 213 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qxs n GLY 214 N -1.07 5.80 3.06 -0.02 0.00 -0.98 -4.19 105.19 107.79 1qxs n GLY 214 Ca 0.01 -2.52 -0.17 0.00 0.00 0.00 0.00 46.02 43.34 1qxs n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qxs s ARG 215 N -3.86 0.65 -0.46 1.61 1.81 -1.00 -2.02 118.95 115.68 1qxs s ARG 215 Ca 0.54 -0.57 -0.26 0.00 -1.72 0.00 0.00 55.73 53.72 1qxs s ARG 215 Cb 0.44 -0.57 -0.13 0.00 -0.45 0.00 0.00 34.95 34.24 1qxs s ARG 215 CO -0.23 0.14 1.56 0.00 -0.68 0.00 0.00 175.30 176.09 1qxs n ALA 216 N 2.12 0.16 -0.15 2.13 0.00 -1.26 -4.57 120.51 118.94 1qxs n ALA 216 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 1qxs n ALA 216 Cb 0.56 -1.42 -0.01 0.00 0.00 0.00 0.00 19.45 18.58 1qxs n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qxs h ALA 217 N 6.71 0.58 0.00 0.00 0.00 -1.38 -3.19 119.26 121.98 1qxs h ALA 217 Ca -0.05 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1qxs h ALA 217 Cb 0.91 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1qxs h ALA 217 CO 0.80 0.40 0.00 0.00 0.00 0.00 0.00 179.25 180.44 1qxs n ALA 218 N -2.43 2.54 -0.97 0.00 0.00 -1.26 -3.75 120.51 114.64 1qxs n ALA 218 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1qxs n ALA 218 Cb 0.32 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1qxs n ALA 218 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1qxs n VAL 219 N -0.85 0.20 -4.25 0.00 0.24 -1.23 -4.72 118.33 107.72 1qxs n VAL 219 Ca 0.16 -0.21 -0.14 0.00 -2.04 0.00 0.00 64.34 62.10 1qxs n VAL 219 Cb 0.07 0.83 -0.10 0.00 -1.47 0.00 0.00 33.84 33.17 1qxs n VAL 219 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1qxs s ASN 220 N -0.35 1.00 -0.45 -1.34 0.01 -1.21 -5.06 114.94 107.54 1qxs s ASN 220 Ca 0.01 -1.27 -0.03 0.00 -0.71 0.00 0.00 52.86 50.86 1qxs s ASN 220 Cb 0.01 0.18 0.12 0.00 0.41 0.00 0.00 41.25 41.97 1qxs s ASN 220 CO 0.00 -0.67 0.25 -0.63 -1.51 0.00 0.00 177.10 174.54 1qxs s ILE 221 N -3.79 3.33 -0.18 0.60 1.01 -1.26 -4.04 121.20 116.88 1qxs s ILE 221 Ca 0.30 -2.27 -0.19 0.00 0.00 0.00 0.00 60.65 58.49 1qxs s ILE 221 Cb 0.07 -3.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 1qxs s ILE 221 CO 0.08 -0.73 0.53 -0.63 0.00 0.00 0.00 174.94 174.19 1qxs s ILE 222 N 0.87 5.11 0.53 2.92 1.09 -0.47 -4.87 121.20 126.38 1qxs s ILE 222 Ca 0.10 0.99 -0.17 0.00 -1.10 0.00 0.00 60.65 60.48 1qxs s ILE 222 Cb -0.22 -3.85 -0.07 0.00 -1.06 0.00 0.00 42.46 37.25 1qxs s ILE 222 CO -0.04 0.21 1.00 -2.84 -0.10 0.00 0.00 174.94 173.17 1qxs s PRO 223 N 1.41 3.81 -0.18 2.79 0.02 -1.26 0.22 135.00 141.81 1qxs s PRO 223 Ca 0.25 1.02 -0.28 0.00 0.02 0.00 0.00 61.00 62.02 1qxs s PRO 223 Cb -0.15 -2.11 0.09 0.00 0.02 0.00 0.00 34.50 32.34 1qxs s PRO 223 CO 0.10 -0.39 0.79 0.45 -0.33 0.00 0.00 177.00 177.63 1qxs s SER 224 N -2.96 -0.62 0.82 2.53 0.15 0.31 -4.80 113.70 109.13 1qxs s SER 224 Ca 0.60 0.96 -0.12 0.00 0.70 0.00 0.00 55.95 58.09 1qxs s SER 224 Cb -0.11 0.89 0.08 0.00 -1.71 0.00 0.00 66.02 65.17 1qxs s SER 224 CO 0.32 -0.37 1.17 0.42 1.20 0.00 0.00 173.24 175.97 1qxs s THR 225 N -0.40 2.07 -0.06 6.45 -4.23 -1.26 0.10 115.64 118.31 1qxs s THR 225 Ca -0.04 0.02 -0.31 0.00 -1.18 0.00 0.00 61.69 60.19 1qxs s THR 225 Cb -0.03 -2.99 0.07 0.00 1.34 0.00 0.00 72.50 70.89 1qxs s THR 225 CO 0.03 -0.03 0.70 0.28 -0.54 0.00 0.00 174.62 175.06 1qxs s THR 226 N -3.53 0.00 -1.13 3.99 -1.32 -1.23 -4.55 115.64 107.87 1qxs s THR 226 Ca 0.62 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 61.24 1qxs s THR 226 Cb -0.11 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.30 1qxs s THR 226 CO 0.50 0.00 1.35 0.61 -2.21 0.00 0.00 174.62 174.87 1qxs n GLY 227 N 0.97 2.79 0.31 6.08 0.00 -1.26 -4.52 105.19 109.56 1qxs n GLY 227 Ca -0.18 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.21 1qxs n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qxs h ALA 228 N 2.64 0.84 0.00 4.61 0.00 -1.96 0.36 119.26 125.75 1qxs h ALA 228 Ca 0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 1qxs h ALA 228 Cb 0.88 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 1qxs h ALA 228 CO 0.03 0.67 -0.58 0.00 0.00 0.00 0.00 179.25 179.37 1qxs h ALA 229 N 1.00 1.02 0.00 0.00 0.00 -1.89 -2.86 119.26 116.53 1qxs h ALA 229 Ca 0.17 -0.52 -0.20 0.00 0.00 0.00 0.00 54.91 54.36 1qxs h ALA 229 Cb 0.57 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1qxs h ALA 229 CO 0.03 0.72 -1.06 -0.22 0.00 0.00 0.00 179.25 178.72 1qxs h LYS 230 N 0.00 0.00 0.00 0.00 3.64 -1.57 -3.31 116.57 115.32 1qxs h LYS 230 Ca -0.01 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 1qxs h LYS 230 Cb 1.04 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.85 1qxs h LYS 230 CO 0.07 0.70 -0.26 0.00 -2.27 0.00 0.00 179.45 177.70 1qxs h ALA 231 N 1.17 1.10 -0.84 5.00 0.00 -0.08 -2.83 119.26 122.78 1qxs h ALA 231 Ca -0.08 -0.23 0.19 0.00 0.00 0.00 0.00 54.91 54.79 1qxs h ALA 231 Cb 1.70 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 19.40 1qxs h ALA 231 CO 0.10 0.32 0.56 0.28 0.00 0.00 0.00 179.25 180.51 1qxs h VAL 232 N 0.00 0.70 -0.09 0.00 2.07 -1.61 0.13 116.25 117.45 1qxs h VAL 232 Ca -0.00 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.43 1qxs h VAL 232 Cb 0.69 0.33 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1qxs h VAL 232 CO 0.03 0.06 0.11 1.23 0.02 0.00 0.00 177.57 179.02 1qxs h GLY 233 N 0.34 0.00 1.83 2.17 0.00 -1.70 1.22 103.07 106.93 1qxs h GLY 233 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1qxs h GLY 233 CO -0.13 0.00 -0.16 -0.33 0.00 0.00 0.00 176.54 175.92 1qxs h MET 234 N 0.00 0.00 0.00 4.80 2.86 -0.94 -2.77 114.93 118.88 1qxs h MET 234 Ca 0.04 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 1qxs h MET 234 Cb 0.25 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 1qxs h MET 234 CO -0.00 0.00 -1.83 0.28 1.06 0.00 0.00 176.91 176.42 1qxs n VAL 235 N -2.85 0.44 -3.27 -2.22 0.31 0.97 -4.72 118.33 106.99 1qxs n VAL 235 Ca 0.04 -0.47 -0.25 0.00 -0.01 0.00 0.00 64.34 63.65 1qxs n VAL 235 Cb 0.51 -0.19 -0.08 0.00 -0.91 0.00 0.00 33.84 33.16 1qxs n VAL 235 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1qxs n ILE 236 N -2.26 -0.86 -0.48 2.52 5.41 0.38 -4.69 119.36 119.38 1qxs n ILE 236 Ca -0.12 -3.80 0.39 0.00 1.00 0.00 0.00 62.75 60.22 1qxs n ILE 236 Cb 0.66 -1.85 0.68 0.00 -0.71 0.00 0.00 39.64 38.42 1qxs n ILE 236 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1qxs h PRO 237 N 4.63 0.06 -0.43 0.38 0.11 -1.69 0.47 132.00 135.53 1qxs h PRO 237 Ca 0.15 -0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.38 1qxs h PRO 237 Cb 0.89 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 1qxs h PRO 237 CO 0.43 0.04 0.57 0.77 -0.21 0.00 0.00 178.00 179.60 1qxs h SER 238 N 0.07 0.00 -0.03 -2.05 0.02 -1.94 0.35 113.55 109.97 1qxs h SER 238 Ca 0.83 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.78 1qxs h SER 238 Cb 2.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 65.29 1qxs h SER 238 CO -0.35 0.00 -0.02 0.35 -1.14 0.00 0.00 176.83 175.67 1qxs n THR 239 N -3.45 0.00 -1.43 -2.27 -2.24 0.15 -4.97 114.28 100.08 1qxs n THR 239 Ca 0.08 -0.46 -0.62 0.00 -2.27 0.00 0.00 64.05 60.78 1qxs n THR 239 Cb 0.74 1.36 -0.11 0.00 -2.10 0.00 0.00 70.33 70.22 1qxs n THR 239 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1qxs n GLN 240 N 1.14 0.00 -2.17 -0.78 -0.06 0.12 0.44 117.38 116.08 1qxs n GLN 240 Ca 0.14 0.00 -0.15 0.00 -2.00 0.00 0.00 57.00 54.99 1qxs n GLN 240 Cb 0.56 -1.48 -0.02 0.00 -4.06 0.00 0.00 30.24 25.25 1qxs n GLN 240 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1qxs n GLY 241 N 6.07 0.00 0.00 1.69 0.00 -1.26 -4.86 105.19 106.84 1qxs n GLY 241 Ca 0.45 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1qxs n GLY 241 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qxs n LYS 242 N -2.47 -0.08 -3.81 1.61 5.02 0.17 -5.03 118.16 113.57 1qxs n LYS 242 Ca -0.18 -0.66 -0.12 0.00 -2.02 0.00 0.00 58.31 55.34 1qxs n LYS 242 Cb 0.62 -0.94 -0.10 0.00 -0.02 0.00 0.00 35.03 34.58 1qxs n LYS 242 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1qxs s LEU 243 N -0.20 1.21 0.08 -0.35 1.43 -1.25 -1.03 118.68 118.57 1qxs s LEU 243 Ca 0.00 0.12 -0.27 0.00 -1.03 0.00 0.00 54.13 52.95 1qxs s LEU 243 Cb 0.00 0.88 0.09 0.00 0.03 0.00 0.00 46.19 47.18 1qxs s LEU 243 CO 0.00 -0.29 1.10 0.28 0.23 0.00 0.00 176.35 177.68 1qxs s THR 244 N -0.82 0.00 -0.60 5.49 -1.32 -1.00 -3.72 115.64 113.67 1qxs s THR 244 Ca -0.09 -0.48 0.00 0.00 -1.21 0.00 0.00 61.69 59.91 1qxs s THR 244 Cb -0.05 -2.08 0.00 0.00 -1.51 0.00 0.00 72.50 68.86 1qxs s THR 244 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 1qxs n GLY 245 N -0.50 -1.30 0.91 6.08 0.00 -1.25 -0.45 105.19 108.67 1qxs n GLY 245 Ca -0.07 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.84 1qxs n GLY 245 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1qxs n MET 246 N -0.11 1.62 -4.15 1.61 0.00 -0.54 -3.51 117.12 112.04 1qxs n MET 246 Ca 0.00 -0.92 -0.14 0.00 0.00 0.00 0.00 57.70 56.63 1qxs n MET 246 Cb 0.00 0.27 -0.11 0.00 0.00 0.00 0.00 33.22 33.38 1qxs n MET 246 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1qxs s SER 247 N -1.69 1.31 -0.25 3.17 0.15 0.29 -1.73 113.70 114.94 1qxs s SER 247 Ca 0.00 -0.73 -0.02 0.00 0.70 0.00 0.00 55.95 55.90 1qxs s SER 247 Cb 0.00 0.01 0.08 0.00 -1.71 0.00 0.00 66.02 64.40 1qxs s SER 247 CO 0.00 -0.23 0.07 -0.36 1.20 0.00 0.00 173.24 173.92 1qxs s PHE 248 N -2.08 1.23 -0.40 3.44 0.08 0.44 -0.53 117.98 120.16 1qxs s PHE 248 Ca 0.01 -1.21 -0.26 0.00 0.12 0.00 0.00 56.93 55.58 1qxs s PHE 248 Cb -0.05 -1.28 0.02 0.00 -0.57 0.00 0.00 43.02 41.14 1qxs s PHE 248 CO 0.00 -0.74 0.97 1.03 -0.10 0.00 0.00 175.22 176.37 1qxs s ARG 249 N 1.78 3.77 0.42 0.44 1.81 0.13 -0.48 118.95 126.83 1qxs s ARG 249 Ca 0.04 0.51 0.08 0.00 -1.72 0.00 0.00 55.73 54.64 1qxs s ARG 249 Cb -0.17 -3.84 -0.02 0.00 -0.45 0.00 0.00 34.95 30.47 1qxs s ARG 249 CO -0.18 -1.07 0.40 0.14 -0.68 0.00 0.00 175.30 173.91 1qxs s VAL 250 N 3.69 2.66 -1.02 3.52 -7.23 0.45 -1.36 120.40 121.11 1qxs s VAL 250 Ca 0.40 -1.31 -0.21 0.00 -1.81 0.00 0.00 61.98 59.04 1qxs s VAL 250 Cb -0.11 -2.97 -0.10 0.00 0.56 0.00 0.00 36.38 33.76 1qxs s VAL 250 CO 0.22 0.00 1.95 -2.65 -0.31 0.00 0.00 175.10 174.31 1qxs n PRO 251 N -1.59 1.84 -3.76 4.82 -0.02 -1.26 -2.98 135.00 132.05 1qxs n PRO 251 Ca 0.04 -2.24 -0.13 0.00 -2.02 0.00 0.00 63.50 59.15 1qxs n PRO 251 Cb 0.62 -3.25 -0.11 0.00 -0.02 0.00 0.00 33.50 30.74 1qxs n PRO 251 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1qxs s THR 252 N 6.47 0.01 0.06 3.45 -4.23 -1.26 -5.02 115.64 115.12 1qxs s THR 252 Ca 0.59 -0.05 0.26 0.00 -1.18 0.00 0.00 61.69 61.31 1qxs s THR 252 Cb 0.09 -0.48 0.27 0.00 1.34 0.00 0.00 72.50 73.73 1qxs s THR 252 CO 0.10 -0.03 1.83 1.55 -0.54 0.00 0.00 174.62 177.53 1qxs h PRO 253 N 5.44 0.00 -2.07 3.99 0.13 -1.89 -2.36 132.00 135.24 1qxs h PRO 253 Ca -0.27 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.93 1qxs h PRO 253 Cb 1.19 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.14 1qxs h PRO 253 CO 0.31 0.16 0.44 0.34 -0.23 0.00 0.00 178.00 179.02 1qxs s ASP 254 N -6.08 -0.43 0.00 1.44 2.15 -1.26 -4.77 116.67 107.72 1qxs s ASP 254 Ca 0.01 0.23 0.00 0.00 0.43 0.00 0.00 52.55 53.23 1qxs s ASP 254 Cb 0.09 0.40 0.00 0.00 -0.30 0.00 0.00 42.92 43.11 1qxs s ASP 254 CO 0.62 -0.56 0.00 0.52 -0.17 0.00 0.00 175.17 175.58 1qxs n VAL 255 N 0.22 -0.19 -4.16 1.11 0.31 -1.26 -4.86 118.33 109.50 1qxs n VAL 255 Ca -0.11 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.11 1qxs n VAL 255 Cb 0.60 -0.15 -0.10 0.00 -0.91 0.00 0.00 33.84 33.29 1qxs n VAL 255 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1qxs s SER 256 N -0.23 0.17 -0.05 4.52 0.01 0.07 -3.69 113.70 114.50 1qxs s SER 256 Ca 0.00 -1.28 -0.05 0.00 1.31 0.00 0.00 55.95 55.93 1qxs s SER 256 Cb 0.00 0.37 0.01 0.00 0.21 0.00 0.00 66.02 66.62 1qxs s SER 256 CO 0.00 -0.83 0.14 0.54 0.41 0.00 0.00 173.24 173.49 1qxs s VAL 257 N -4.11 -0.00 0.09 3.43 0.11 -0.72 -0.95 120.40 118.26 1qxs s VAL 257 Ca 0.33 0.00 -0.12 0.00 -2.93 0.00 0.00 61.98 59.25 1qxs s VAL 257 Cb 0.06 -0.20 -0.06 0.00 -1.53 0.00 0.00 36.38 34.65 1qxs s VAL 257 CO 0.08 0.00 0.46 -0.69 -3.33 0.00 0.00 175.10 171.63 1qxs s VAL 258 N 0.08 4.99 -0.53 2.04 1.01 0.46 -2.08 120.40 126.37 1qxs s VAL 258 Ca -0.00 0.66 0.04 0.00 0.00 0.00 0.00 61.98 62.68 1qxs s VAL 258 Cb -0.01 -3.69 0.16 0.00 0.00 0.00 0.00 36.38 32.84 1qxs s VAL 258 CO 0.00 0.32 0.39 -0.62 0.00 0.00 0.00 175.10 175.18 1qxs s ASP 259 N -1.64 3.08 -0.15 3.32 3.68 -0.19 -1.56 116.67 123.21 1qxs s ASP 259 Ca 0.33 -3.30 -0.23 0.00 2.13 0.00 0.00 52.55 51.48 1qxs s ASP 259 Cb -0.15 -0.98 -0.02 0.00 -1.45 0.00 0.00 42.92 40.31 1qxs s ASP 259 CO 0.18 -0.15 0.72 -0.22 0.13 0.00 0.00 175.17 175.83 1qxs s LEU 260 N -0.48 4.20 -0.17 -1.34 2.96 -0.50 -2.70 118.68 120.65 1qxs s LEU 260 Ca 0.27 1.06 -0.01 0.00 -0.22 0.00 0.00 54.13 55.23 1qxs s LEU 260 Cb -0.04 -3.07 -0.00 0.00 0.50 0.00 0.00 46.19 43.58 1qxs s LEU 260 CO -0.16 -0.28 -0.13 -0.89 -1.32 0.00 0.00 176.35 173.58 1qxs s THR 261 N 1.69 2.79 0.16 3.68 2.01 -0.87 0.13 115.64 125.24 1qxs s THR 261 Ca 0.35 -0.71 -0.11 0.00 0.31 0.00 0.00 61.69 61.53 1qxs s THR 261 Cb -0.17 -2.21 -0.00 0.00 0.01 0.00 0.00 72.50 70.14 1qxs s THR 261 CO 0.13 0.50 0.32 0.72 -0.69 0.00 0.00 174.62 175.60 1qxs s PHE 262 N 1.03 0.27 -0.15 4.92 -0.71 0.70 -1.87 117.98 122.16 1qxs s PHE 262 Ca -0.01 -0.63 -0.02 0.00 -1.04 0.00 0.00 56.93 55.22 1qxs s PHE 262 Cb -0.15 0.03 -0.02 0.00 -1.21 0.00 0.00 43.02 41.67 1qxs s PHE 262 CO -0.03 -0.74 -0.07 0.95 -1.34 0.00 0.00 175.22 173.99 1qxs s THR 263 N -3.94 3.54 0.48 -4.49 -4.23 -0.52 -0.28 115.64 106.21 1qxs s THR 263 Ca 0.14 -0.48 -0.20 0.00 -1.18 0.00 0.00 61.69 59.98 1qxs s THR 263 Cb 0.03 -2.54 -0.09 0.00 1.34 0.00 0.00 72.50 71.25 1qxs s THR 263 CO -0.02 0.50 1.01 0.00 -0.54 0.00 0.00 174.62 175.57 1qxs s ALA 264 N 0.47 2.93 0.37 3.99 0.00 -0.61 -1.24 121.76 127.66 1qxs s ALA 264 Ca -0.06 0.47 0.04 0.00 0.00 0.00 0.00 51.96 52.42 1qxs s ALA 264 Cb -0.15 -3.20 0.72 0.00 0.00 0.00 0.00 23.12 20.49 1qxs s ALA 264 CO 0.03 -0.23 2.02 0.00 0.00 0.00 0.00 175.76 177.59 1qxs h ALA 265 N 1.46 1.60 -2.04 0.00 0.00 -1.05 -3.43 119.26 115.80 1qxs h ALA 265 Ca -0.49 -0.05 -0.49 0.00 0.00 0.00 0.00 54.91 53.88 1qxs h ALA 265 Cb 1.20 -0.22 -0.13 0.00 0.00 0.00 0.00 17.79 18.64 1qxs h ALA 265 CO 0.60 0.36 -0.54 -0.98 0.00 0.00 0.00 179.25 178.69 1qxs s ARG 266 N -5.59 1.77 0.31 0.00 1.70 -1.24 -5.01 118.95 110.90 1qxs s ARG 266 Ca -0.09 -2.05 -0.27 0.00 -0.47 0.00 0.00 55.73 52.85 1qxs s ARG 266 Cb 0.17 -0.38 -0.09 0.00 -0.57 0.00 0.00 34.95 34.08 1qxs s ARG 266 CO 0.75 -0.46 1.03 -0.51 -1.08 0.00 0.00 175.30 175.04 1qxs s ASP 267 N -3.49 7.19 0.00 -2.89 1.01 -1.26 -4.80 116.67 112.43 1qxs s ASP 267 Ca 0.31 2.08 0.00 0.00 0.71 0.00 0.00 52.55 55.65 1qxs s ASP 267 Cb 0.04 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1qxs s ASP 267 CO 0.17 -0.18 0.00 0.35 0.21 0.00 0.00 175.17 175.72 1qxs n THR 268 N 0.77 0.00 -4.25 -1.27 -2.24 -0.82 -5.05 114.28 101.42 1qxs n THR 268 Ca 0.01 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.65 1qxs n THR 268 Cb 0.47 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.60 1qxs n THR 268 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1qxs s SER 269 N 0.44 0.85 0.41 3.42 1.04 -1.26 -3.92 113.70 114.68 1qxs s SER 269 Ca 0.00 -1.31 0.22 0.00 0.48 0.00 0.00 55.95 55.34 1qxs s SER 269 Cb 0.00 0.22 0.74 0.00 0.10 0.00 0.00 66.02 67.08 1qxs s SER 269 CO 0.00 -0.72 1.75 -0.29 0.98 0.00 0.00 173.24 174.96 1qxs h ILE 270 N 2.58 0.64 -0.17 -1.02 6.09 -1.92 -2.98 117.51 120.72 1qxs h ILE 270 Ca -0.37 -1.34 -0.02 0.00 -1.37 0.00 0.00 64.86 61.76 1qxs h ILE 270 Cb 1.23 1.89 -0.01 0.00 0.47 0.00 0.00 36.82 40.41 1qxs h ILE 270 CO 0.59 0.28 0.02 1.56 -3.07 0.00 0.00 178.15 177.54 1qxs h GLN 271 N 0.00 0.29 -0.81 2.19 7.50 -1.98 0.26 115.11 122.56 1qxs h GLN 271 Ca -0.00 -0.08 -0.04 0.00 0.50 0.00 0.00 58.65 59.03 1qxs h GLN 271 Cb 0.87 -0.03 -0.04 0.00 0.05 0.00 0.00 27.48 28.33 1qxs h GLN 271 CO 0.04 0.47 0.37 1.49 -1.50 0.00 0.00 178.83 179.69 1qxs h GLU 272 N 0.07 1.19 -0.35 1.46 4.81 -1.95 0.19 114.58 120.00 1qxs h GLU 272 Ca 0.05 -0.19 -0.12 0.00 -0.13 0.00 0.00 59.36 58.98 1qxs h GLU 272 Cb 0.32 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 1qxs h GLU 272 CO 0.00 0.93 -0.24 0.82 -0.73 0.00 0.00 179.01 179.79 1qxs h ILE 273 N 1.16 1.29 -0.70 2.32 2.04 -1.41 -1.01 117.51 121.20 1qxs h ILE 273 Ca 0.28 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1qxs h ILE 273 Cb 0.15 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.61 1qxs h ILE 273 CO -0.03 0.46 0.44 -0.78 0.00 0.00 0.00 178.15 178.24 1qxs h ASP 274 N 0.57 0.83 0.06 1.72 3.58 -0.03 -1.93 116.42 121.22 1qxs h ASP 274 Ca 0.07 -0.04 -0.08 0.00 0.42 0.00 0.00 57.03 57.39 1qxs h ASP 274 Cb 0.81 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.64 1qxs h ASP 274 CO 0.07 0.62 -0.25 0.00 -2.88 0.00 0.00 179.24 176.80 1qxs h ALA 275 N 1.24 1.25 -0.20 -0.78 0.00 -0.44 -2.43 119.26 117.89 1qxs h ALA 275 Ca 0.25 -0.32 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 1qxs h ALA 275 Cb -0.07 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1qxs h ALA 275 CO -0.05 0.50 -0.63 0.00 0.00 0.00 0.00 179.25 179.06 1qxs h ALA 276 N 1.45 0.34 -0.62 0.00 0.00 -0.83 -2.33 119.26 117.27 1qxs h ALA 276 Ca 0.04 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1qxs h ALA 276 Cb 0.61 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1qxs h ALA 276 CO 0.04 0.62 0.27 -0.07 0.00 0.00 0.00 179.25 180.11 1qxs h LEU 277 N 0.51 0.83 -0.97 0.00 3.38 -1.20 0.25 115.31 118.11 1qxs h LEU 277 Ca -0.02 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 1qxs h LEU 277 Cb 1.26 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1qxs h LEU 277 CO 0.13 0.76 -0.19 0.11 0.09 0.00 0.00 178.44 179.34 1qxs h LYS 278 N 0.85 0.52 0.04 1.13 1.57 -1.47 -1.65 116.57 117.56 1qxs h LYS 278 Ca 0.21 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1qxs h LYS 278 Cb 0.17 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1qxs h LYS 278 CO -0.02 0.69 -0.02 -0.09 -0.57 0.00 0.00 179.45 179.44 1qxs h ARG 279 N 0.47 -0.05 -0.55 3.15 2.43 -0.82 -2.95 114.38 116.07 1qxs h ARG 279 Ca 0.08 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1qxs h ARG 279 Cb 0.60 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 1qxs h ARG 279 CO 0.04 0.39 0.36 0.00 -1.51 0.00 0.00 179.97 179.25 1qxs h ALA 280 N 0.45 1.64 -0.25 2.80 0.00 -0.44 -1.93 119.26 121.53 1qxs h ALA 280 Ca -0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1qxs h ALA 280 Cb 0.45 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1qxs h ALA 280 CO 0.01 0.33 -0.25 0.66 0.00 0.00 0.00 179.25 179.99 1qxs h SER 281 N 0.71 0.48 0.24 0.00 4.64 -1.31 0.14 113.55 118.45 1qxs h SER 281 Ca 0.20 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1qxs h SER 281 Cb -0.04 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.92 1qxs h SER 281 CO -0.05 0.73 -0.16 0.29 -0.87 0.00 0.00 176.83 176.78 1qxs n LYS 282 N -4.12 0.90 0.00 4.77 5.02 -0.79 -2.49 118.16 121.44 1qxs n LYS 282 Ca -0.00 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.85 1qxs n LYS 282 Cb 0.41 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1qxs n LYS 282 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1qxs n THR 283 N -0.67 0.00 0.83 -0.18 -2.24 -0.81 -4.80 114.28 106.41 1qxs n THR 283 Ca 0.14 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.99 1qxs n THR 283 Cb 0.31 0.00 0.41 0.00 -2.10 0.00 0.00 70.33 68.95 1qxs n THR 283 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qxs n TYR 284 N 0.00 0.00 -0.32 4.78 4.11 -1.22 -2.48 117.16 122.03 1qxs n TYR 284 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.90 1qxs n TYR 284 Cb 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 39.34 39.27 1qxs n TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.86 175.53 1qxs n MET 285 N -1.07 1.34 -1.70 -3.48 2.81 0.44 -5.02 117.12 110.43 1qxs n MET 285 Ca 0.10 -0.96 -0.42 0.00 -1.81 0.00 0.00 57.70 54.60 1qxs n MET 285 Cb 0.06 -0.84 -0.00 0.00 -0.71 0.00 0.00 33.22 31.73 1qxs n MET 285 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1qxs n LYS 286 N -0.25 2.16 0.00 0.03 4.81 -1.03 0.66 118.16 124.53 1qxs n LYS 286 Ca 0.00 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.20 1qxs n LYS 286 Cb 0.26 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 32.95 1qxs n LYS 286 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1qxs n GLY 287 N 0.74 2.76 0.34 3.14 0.00 -1.26 -4.68 105.19 106.22 1qxs n GLY 287 Ca 0.05 -0.02 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1qxs n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1qxs n ILE 288 N 0.00 1.29 -3.96 -0.61 2.08 -0.01 -4.42 119.36 113.74 1qxs n ILE 288 Ca 0.00 -0.06 -0.35 0.00 0.56 0.00 0.00 62.75 62.90 1qxs n ILE 288 Cb 0.00 -1.97 -0.09 0.00 -0.75 0.00 0.00 39.64 36.83 1qxs n ILE 288 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1qxs s LEU 289 N -7.40 3.97 0.38 1.39 2.96 0.21 -0.73 118.68 119.45 1qxs s LEU 289 Ca -0.26 0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.87 1qxs s LEU 289 Cb 0.07 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 1qxs s LEU 289 CO 0.35 0.22 0.17 -0.83 -1.32 0.00 0.00 176.35 174.94 1qxs s GLY 290 N 0.07 2.50 0.23 7.98 0.00 -0.23 -4.39 107.32 113.48 1qxs s GLY 290 Ca 0.07 -1.46 -0.16 0.00 0.00 0.00 0.00 44.72 43.16 1qxs s GLY 290 CO 0.00 -1.73 0.53 -2.52 0.00 0.00 0.00 173.10 169.38 1qxs s TYR 291 N -3.30 0.08 0.02 1.90 1.13 -1.26 -0.63 117.35 115.29 1qxs s TYR 291 Ca 0.28 -0.45 -0.02 0.00 -1.41 0.00 0.00 57.07 55.47 1qxs s TYR 291 Cb 0.03 0.35 -0.02 0.00 -1.10 0.00 0.00 41.96 41.22 1qxs s TYR 291 CO 0.18 -0.99 0.02 -0.08 -2.51 0.00 0.00 175.55 172.16 1qxs s THR 292 N -3.94 0.12 -0.03 -3.49 -1.32 -0.30 -4.87 115.64 101.81 1qxs s THR 292 Ca 0.15 -1.01 0.05 0.00 -1.21 0.00 0.00 61.69 59.67 1qxs s THR 292 Cb -0.02 -0.54 0.08 0.00 -1.51 0.00 0.00 72.50 70.51 1qxs s THR 292 CO 0.04 -0.56 0.93 -0.90 -2.21 0.00 0.00 174.62 171.92 1qxs n ASP 293 N 1.26 1.33 -4.81 8.08 5.68 -1.26 -1.39 116.55 125.44 1qxs n ASP 293 Ca -0.22 -2.06 -0.27 0.00 -0.50 0.00 0.00 54.79 51.74 1qxs n ASP 293 Cb 0.56 -0.14 -0.05 0.00 -1.14 0.00 0.00 41.12 40.35 1qxs n ASP 293 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1qxs s GLU 294 N -1.11 2.96 -0.78 0.11 2.02 -1.26 -4.76 118.70 115.88 1qxs s GLU 294 Ca 0.08 -0.81 -0.08 0.00 0.02 0.00 0.00 54.97 54.18 1qxs s GLU 294 Cb 0.07 -2.70 -0.07 0.00 0.10 0.00 0.00 34.13 31.54 1qxs s GLU 294 CO 0.01 0.50 1.95 0.39 0.02 0.00 0.00 175.26 178.13 1qxs n GLU 295 N -0.26 1.74 -2.92 1.61 -0.58 -1.26 -4.91 120.64 114.05 1qxs n GLU 295 Ca -0.08 -1.41 -0.31 0.00 -0.42 0.00 0.00 57.16 54.94 1qxs n GLU 295 Cb 0.54 -2.48 -0.04 0.00 -0.57 0.00 0.00 31.44 28.89 1qxs n GLU 295 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1qxs s LEU 296 N 0.26 3.90 0.26 -4.62 1.43 -1.26 -5.10 118.68 113.55 1qxs s LEU 296 Ca 0.38 1.23 0.07 0.00 -1.03 0.00 0.00 54.13 54.79 1qxs s LEU 296 Cb 0.10 -4.09 -0.05 0.00 0.03 0.00 0.00 46.19 42.18 1qxs s LEU 296 CO -0.00 -0.34 -0.10 0.68 0.23 0.00 0.00 176.35 176.82 1qxs s VAL 297 N -2.24 1.75 0.03 -1.59 -7.23 -1.26 -5.02 120.40 104.84 1qxs s VAL 297 Ca 0.53 -2.17 -0.06 0.00 -1.81 0.00 0.00 61.98 58.47 1qxs s VAL 297 Cb -0.10 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.50 1qxs s VAL 297 CO 0.26 -0.39 0.41 -0.24 -0.31 0.00 0.00 175.10 174.82 1qxs n SER 298 N -0.53 -0.21 0.30 4.85 2.88 -1.26 0.73 113.62 120.38 1qxs n SER 298 Ca -0.06 0.46 0.18 0.00 -1.33 0.00 0.00 58.87 58.12 1qxs n SER 298 Cb 0.62 -0.10 0.94 0.00 -0.75 0.00 0.00 64.21 64.93 1qxs n SER 298 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1qxs h ALA 299 N -0.00 1.37 0.00 -1.46 0.00 -1.97 -1.82 119.26 115.38 1qxs h ALA 299 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1qxs h ALA 299 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1qxs h ALA 299 CO -0.19 -0.24 0.00 -0.25 0.00 0.00 0.00 179.25 178.58 1qxs n ASP 300 N -3.19 0.71 -1.44 0.00 8.00 0.22 -2.54 116.55 118.32 1qxs n ASP 300 Ca -0.01 0.63 0.11 0.00 0.71 0.00 0.00 54.79 56.23 1qxs n ASP 300 Cb 0.28 -0.80 0.34 0.00 -0.02 0.00 0.00 41.12 40.92 1qxs n ASP 300 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1qxs n PHE 301 N -2.24 1.15 -2.07 1.24 3.01 -0.68 -4.93 117.46 112.94 1qxs n PHE 301 Ca 0.03 -0.53 -0.42 0.00 1.01 0.00 0.00 57.45 57.55 1qxs n PHE 301 Cb 0.30 -0.08 -0.03 0.00 -0.01 0.00 0.00 39.48 39.67 1qxs n PHE 301 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1qxs s ILE 302 N -1.28 3.46 0.00 4.37 1.01 -1.05 -2.23 121.20 125.48 1qxs s ILE 302 Ca 0.50 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.94 1qxs s ILE 302 Cb 0.28 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 39.24 1qxs s ILE 302 CO 0.31 -0.02 0.00 0.59 0.00 0.00 0.00 174.94 175.82 1qxs n ASN 303 N 5.94 -2.53 -4.61 3.58 3.02 -1.26 -5.03 115.26 114.37 1qxs n ASN 303 Ca 0.15 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.29 1qxs n ASN 303 Cb 0.42 -0.47 -0.06 0.00 -0.61 0.00 0.00 39.78 39.06 1qxs n ASN 303 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1qxs s ASP 304 N -2.95 6.59 0.00 6.41 -1.08 -0.95 -4.94 116.67 119.76 1qxs s ASP 304 Ca 0.00 0.61 0.31 0.00 -0.52 0.00 0.00 52.55 52.95 1qxs s ASP 304 Cb 0.00 -2.36 1.76 0.00 -1.46 0.00 0.00 42.92 40.86 1qxs s ASP 304 CO 0.00 -0.49 2.16 -0.46 0.52 0.00 0.00 175.17 176.90 1qxs n ASN 305 N 5.94 0.00 -4.77 -0.34 6.94 -1.26 -2.89 115.26 118.87 1qxs n ASN 305 Ca 0.01 -0.67 -0.31 0.00 -0.02 0.00 0.00 54.58 53.58 1qxs n ASN 305 Cb 0.49 -0.11 0.08 0.00 -2.36 0.00 0.00 39.78 37.88 1qxs n ASN 305 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 1qxs s ARG 306 N -2.22 2.37 0.05 -3.83 3.00 -1.26 -4.41 118.95 112.65 1qxs s ARG 306 Ca 0.41 1.21 -0.00 0.00 0.00 0.00 0.00 55.73 57.34 1qxs s ARG 306 Cb 0.21 -1.91 -0.26 0.00 0.00 0.00 0.00 34.95 32.99 1qxs s ARG 306 CO 0.41 -1.56 1.05 0.77 0.00 0.00 0.00 175.30 175.97 1qxs h SER 307 N -0.90 0.29 -3.32 0.23 0.02 -1.14 -3.39 113.55 105.34 1qxs h SER 307 Ca -0.44 -0.35 -0.22 0.00 -0.84 0.00 0.00 61.79 59.93 1qxs h SER 307 Cb 1.23 -0.09 -0.31 0.00 0.14 0.00 0.00 62.40 63.37 1qxs h SER 307 CO 0.52 1.28 -0.55 -0.55 -1.14 0.00 0.00 176.83 176.39 1qxs s SER 308 N -6.93 -0.06 -0.35 3.07 0.15 -1.01 -3.98 113.70 104.59 1qxs s SER 308 Ca -0.04 0.43 -0.00 0.00 0.70 0.00 0.00 55.95 57.03 1qxs s SER 308 Cb 0.08 0.33 0.09 0.00 -1.71 0.00 0.00 66.02 64.81 1qxs s SER 308 CO 0.86 -0.17 0.09 -0.63 1.20 0.00 0.00 173.24 174.59 1qxs s ILE 309 N 1.42 2.85 0.10 6.45 -1.09 -0.66 -1.07 121.20 129.21 1qxs s ILE 309 Ca -0.07 -1.97 -0.31 0.00 -2.23 0.00 0.00 60.65 56.07 1qxs s ILE 309 Cb -0.11 -2.91 -0.08 0.00 -1.58 0.00 0.00 42.46 37.78 1qxs s ILE 309 CO -0.07 -0.49 1.51 -0.47 -1.23 0.00 0.00 174.94 174.18 1qxs s TYR 310 N 1.09 2.94 -0.74 3.97 5.04 0.20 0.09 117.35 129.94 1qxs s TYR 310 Ca 0.05 0.69 -0.18 0.00 -2.44 0.00 0.00 57.07 55.19 1qxs s TYR 310 Cb -0.21 -3.82 0.14 0.00 0.35 0.00 0.00 41.96 38.42 1qxs s TYR 310 CO -0.05 -3.05 0.85 0.34 -1.34 0.00 0.00 175.55 172.31 1qxs s ASP 311 N 1.55 6.44 0.09 4.32 -1.08 0.18 -1.14 116.67 127.02 1qxs s ASP 311 Ca 0.68 -1.87 -0.35 0.00 -0.52 0.00 0.00 52.55 50.50 1qxs s ASP 311 Cb -0.39 -2.31 -0.16 0.00 -1.46 0.00 0.00 42.92 38.60 1qxs s ASP 311 CO 0.30 -1.00 1.57 -1.28 0.52 0.00 0.00 175.17 175.29 1qxs h SER 312 N 8.79 -1.32 -0.02 -0.34 0.87 -1.50 -2.45 113.55 117.59 1qxs h SER 312 Ca -0.08 0.11 0.03 0.00 -1.23 0.00 0.00 61.79 60.63 1qxs h SER 312 Cb 1.06 0.44 -0.05 0.00 -0.44 0.00 0.00 62.40 63.41 1qxs h SER 312 CO 1.03 -0.63 -0.30 0.11 -0.53 0.00 0.00 176.83 176.51 1qxs h LYS 313 N -0.95 -0.42 0.00 2.24 1.79 -1.86 0.26 116.57 117.64 1qxs h LYS 313 Ca -0.05 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 1qxs h LYS 313 Cb 0.83 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 1qxs h LYS 313 CO -0.08 -0.28 0.07 0.00 -1.08 0.00 0.00 179.45 178.09 1qxs h ALA 314 N 0.34 1.07 0.03 3.86 0.00 -1.92 -0.71 119.26 121.94 1qxs h ALA 314 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.68 1qxs h ALA 314 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1qxs h ALA 314 CO -0.26 -0.07 -1.65 2.41 0.00 0.00 0.00 179.25 179.67 1qxs n THR 315 N -3.03 1.60 0.08 0.00 -1.04 -0.55 -3.57 114.28 107.77 1qxs n THR 315 Ca -0.03 -0.25 -0.01 0.00 -2.04 0.00 0.00 64.05 61.72 1qxs n THR 315 Cb 0.14 -1.92 0.29 0.00 -1.82 0.00 0.00 70.33 67.02 1qxs n THR 315 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1qxs h LEU 316 N -0.68 0.29 0.00 -4.42 3.38 -0.75 -3.02 115.31 110.12 1qxs h LEU 316 Ca -0.42 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1qxs h LEU 316 Cb 1.56 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1qxs h LEU 316 CO -0.15 0.55 -0.14 0.00 0.09 0.00 0.00 178.44 178.79 1qxs n GLN 317 N -4.15 0.12 -0.60 1.13 6.02 -0.29 -4.27 117.38 115.34 1qxs n GLN 317 Ca -0.01 0.08 0.06 0.00 -0.01 0.00 0.00 57.00 57.13 1qxs n GLN 317 Cb 0.37 -1.62 0.14 0.00 1.02 0.00 0.00 30.24 30.15 1qxs n GLN 317 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1qxs n ASN 318 N -1.83 1.59 -4.78 1.08 3.02 -1.14 -5.05 115.26 108.15 1qxs n ASN 318 Ca 0.06 -3.18 -0.23 0.00 -0.03 0.00 0.00 54.58 51.20 1qxs n ASN 318 Cb 0.38 -0.43 -0.06 0.00 -0.61 0.00 0.00 39.78 39.06 1qxs n ASN 318 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1qxs s ASN 319 N -2.71 4.61 0.26 6.41 -0.87 -1.23 -4.91 114.94 116.50 1qxs s ASN 319 Ca 0.32 -0.98 -0.30 0.00 -1.57 0.00 0.00 52.86 50.33 1qxs s ASN 319 Cb 0.31 -0.51 -0.09 0.00 -0.02 0.00 0.00 41.25 40.94 1qxs s ASN 319 CO -0.05 -0.57 1.06 -0.76 -2.57 0.00 0.00 177.10 174.21 1qxs s LEU 320 N -3.97 4.57 0.27 0.60 1.43 -1.26 -5.01 118.68 115.30 1qxs s LEU 320 Ca 0.43 2.18 -0.29 0.00 -1.03 0.00 0.00 54.13 55.41 1qxs s LEU 320 Cb 0.02 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.52 1qxs s LEU 320 CO 0.24 -0.08 1.13 -2.16 0.23 0.00 0.00 176.35 175.71 1qxs s PRO 321 N -1.26 4.59 0.00 1.29 0.04 -1.26 -3.27 135.00 135.13 1qxs s PRO 321 Ca 0.44 1.85 0.00 0.00 0.04 0.00 0.00 61.00 63.33 1qxs s PRO 321 Cb -0.30 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.05 1qxs s PRO 321 CO 0.38 0.13 0.00 1.63 0.04 0.00 0.00 177.00 179.18 1qxs n LYS 322 N 1.39 -0.14 -1.50 4.56 5.02 -1.26 -4.93 118.16 121.29 1qxs n LYS 322 Ca -0.00 0.04 -0.36 0.00 -2.02 0.00 0.00 58.31 55.96 1qxs n LYS 322 Cb 0.45 -4.34 0.09 0.00 -0.02 0.00 0.00 35.03 31.20 1qxs n LYS 322 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1qxs n GLU 323 N -1.79 0.77 0.00 1.97 4.07 -1.20 -4.97 120.64 119.48 1qxs n GLU 323 Ca 0.00 0.32 0.00 0.00 -0.06 0.00 0.00 57.16 57.42 1qxs n GLU 323 Cb 0.04 -2.43 0.00 0.00 -0.06 0.00 0.00 31.44 28.98 1qxs n GLU 323 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1qxs n ARG 324 N -2.19 0.29 0.00 5.31 1.74 -1.25 -4.45 116.66 116.12 1qxs n ARG 324 Ca 0.15 -0.65 0.00 0.00 -0.77 0.00 0.00 57.85 56.58 1qxs n ARG 324 Cb 0.49 -0.85 0.00 0.00 -1.02 0.00 0.00 32.46 31.08 1qxs n ARG 324 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1qxs n ARG 325 N -0.12 0.00 -2.62 5.56 5.12 -1.26 -1.95 116.66 121.39 1qxs n ARG 325 Ca 0.00 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.49 1qxs n ARG 325 Cb 0.17 -0.19 -0.02 0.00 -1.16 0.00 0.00 32.46 31.26 1qxs n ARG 325 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1qxs s PHE 326 N -1.49 2.99 0.08 -1.55 5.36 -1.26 -1.58 117.98 120.53 1qxs s PHE 326 Ca 0.00 0.98 0.01 0.00 -0.96 0.00 0.00 56.93 56.95 1qxs s PHE 326 Cb 0.00 -4.03 -0.04 0.00 -0.34 0.00 0.00 43.02 38.61 1qxs s PHE 326 CO 0.00 -1.02 -0.06 -0.06 -1.46 0.00 0.00 175.22 172.63 1qxs s PHE 327 N 4.04 0.76 -0.08 10.12 0.08 0.62 -4.73 117.98 128.78 1qxs s PHE 327 Ca 0.47 -0.93 0.03 0.00 0.12 0.00 0.00 56.93 56.61 1qxs s PHE 327 Cb -0.10 -0.47 0.01 0.00 -0.57 0.00 0.00 43.02 41.89 1qxs s PHE 327 CO 0.23 -0.21 -0.15 0.21 -0.10 0.00 0.00 175.22 175.19 1qxs s LYS 328 N -3.70 2.11 -0.14 0.44 2.20 -1.25 -0.21 119.74 119.19 1qxs s LYS 328 Ca 0.09 -0.55 0.02 0.00 -0.36 0.00 0.00 55.97 55.17 1qxs s LYS 328 Cb 0.05 -1.70 0.00 0.00 -1.51 0.00 0.00 37.83 34.67 1qxs s LYS 328 CO -0.06 0.04 -0.19 0.42 -0.36 0.00 0.00 175.35 175.21 1qxs s ILE 329 N 0.66 2.41 -0.27 5.43 -1.09 0.12 -4.85 121.20 123.60 1qxs s ILE 329 Ca -0.14 -0.87 -0.06 0.00 -2.23 0.00 0.00 60.65 57.35 1qxs s ILE 329 Cb -0.16 -1.98 0.00 0.00 -1.58 0.00 0.00 42.46 38.74 1qxs s ILE 329 CO 0.04 0.54 0.05 -0.69 -1.23 0.00 0.00 174.94 173.64 1qxs s VAL 330 N 0.65 3.86 -0.04 2.92 1.01 -1.26 -1.41 120.40 126.13 1qxs s VAL 330 Ca -0.10 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.32 1qxs s VAL 330 Cb -0.16 -2.92 0.01 0.00 0.00 0.00 0.00 36.38 33.31 1qxs s VAL 330 CO 0.02 0.19 -0.07 -0.55 0.00 0.00 0.00 175.10 174.69 1qxs s SER 331 N 1.51 1.12 0.70 3.32 0.15 -0.60 0.50 113.70 120.40 1qxs s SER 331 Ca 0.04 -0.17 -0.02 0.00 0.70 0.00 0.00 55.95 56.49 1qxs s SER 331 Cb -0.16 -0.46 0.11 0.00 -1.71 0.00 0.00 66.02 63.79 1qxs s SER 331 CO 0.01 -0.00 0.98 0.26 1.20 0.00 0.00 173.24 175.69 1qxs s TRP 332 N 0.62 2.00 0.00 3.44 0.52 0.11 0.18 118.94 125.81 1qxs s TRP 332 Ca -0.09 -0.09 0.00 0.00 0.02 0.00 0.00 56.10 55.94 1qxs s TRP 332 Cb -0.13 -3.06 0.00 0.00 -1.15 0.00 0.00 33.47 29.14 1qxs s TRP 332 CO 0.01 -1.58 0.00 2.48 0.02 0.00 0.00 176.95 177.88 1qxs n TYR 333 N -2.82 0.00 -2.61 -1.98 4.11 -0.12 -1.65 117.16 112.09 1qxs n TYR 333 Ca 0.13 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.61 1qxs n TYR 333 Cb 0.60 0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.92 1qxs n TYR 333 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1qxs s ASP 334 N 0.00 6.55 0.62 9.48 -1.08 -1.26 -0.75 116.67 130.23 1qxs s ASP 334 Ca 0.00 -1.63 0.10 0.00 -0.52 0.00 0.00 52.55 50.50 1qxs s ASP 334 Cb 0.00 -2.55 0.57 0.00 -1.46 0.00 0.00 42.92 39.48 1qxs s ASP 334 CO 0.00 -1.42 1.29 -0.55 0.52 0.00 0.00 175.17 175.02 1qxs h ASN 335 N 9.45 0.00 0.00 -0.34 -1.07 -1.89 -1.32 115.58 120.41 1qxs h ASN 335 Ca 0.22 0.00 -0.44 0.00 0.07 0.00 0.00 56.30 56.15 1qxs h ASN 335 Cb 1.00 0.00 -0.07 0.00 -2.07 0.00 0.00 38.32 37.18 1qxs h ASN 335 CO 1.39 0.00 -2.41 -0.62 0.07 0.00 0.00 177.43 175.86 1qxs n GLU 336 N -2.54 0.59 0.00 4.14 1.02 -1.26 -4.44 120.64 118.15 1qxs n GLU 336 Ca -0.01 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.42 1qxs n GLU 336 Cb 0.74 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.64 1qxs n GLU 336 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1qxs n TRP 337 N -4.21 0.00 -0.34 -0.32 -0.00 -0.54 -2.85 117.44 109.19 1qxs n TRP 337 Ca -0.52 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 56.91 1qxs n TRP 337 Cb 0.87 -0.49 -0.04 0.00 -0.00 0.00 0.00 31.31 31.66 1qxs n TRP 337 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 1qxs h GLY 338 N 0.00 -0.47 0.16 5.87 0.00 -1.32 -1.59 103.07 105.71 1qxs h GLY 338 Ca 0.00 0.65 0.07 0.00 0.00 0.00 0.00 47.33 48.05 1qxs h GLY 338 CO 0.00 -0.09 -0.19 -1.82 0.00 0.00 0.00 176.54 174.44 1qxs h TYR 339 N -0.08 -0.49 -0.80 5.60 5.03 -1.72 -0.82 116.97 123.69 1qxs h TYR 339 Ca 0.22 0.04 0.16 0.00 2.58 0.00 0.00 58.73 61.72 1qxs h TYR 339 Cb 0.52 0.26 -0.10 0.00 1.55 0.00 0.00 36.73 38.96 1qxs h TYR 339 CO -0.88 -0.27 0.34 0.77 -1.32 0.00 0.00 178.16 176.80 1qxs h SER 340 N -0.16 0.33 -0.26 -2.11 0.02 -1.16 0.23 113.55 110.44 1qxs h SER 340 Ca 0.16 0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 61.20 1qxs h SER 340 Cb 0.40 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1qxs h SER 340 CO -0.40 0.11 0.09 0.45 -1.14 0.00 0.00 176.83 175.94 1qxs h HIS 341 N 0.47 0.47 -0.21 3.45 3.86 -0.52 -1.85 115.15 120.82 1qxs h HIS 341 Ca 0.45 -0.02 -0.13 0.00 -1.16 0.00 0.00 60.37 59.51 1qxs h HIS 341 Cb 0.70 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 1qxs h HIS 341 CO -0.15 0.41 -0.42 0.00 0.86 0.00 0.00 177.93 178.64 1qxs h ARG 342 N 0.47 0.48 -0.35 2.45 2.47 0.29 -1.42 114.38 118.78 1qxs h ARG 342 Ca 0.11 -0.25 0.02 0.00 -1.26 0.00 0.00 59.98 58.61 1qxs h ARG 342 Cb 0.17 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.47 1qxs h ARG 342 CO -0.01 0.82 0.19 0.28 0.56 0.00 0.00 179.97 181.81 1qxs h VAL 343 N 0.40 1.00 -0.31 2.04 2.07 -0.32 0.16 116.25 121.30 1qxs h VAL 343 Ca 0.03 -0.13 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 1qxs h VAL 343 Cb 0.90 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1qxs h VAL 343 CO 0.08 0.07 0.03 0.58 0.02 0.00 0.00 177.57 178.35 1qxs h VAL 344 N 0.38 1.24 -0.58 2.57 2.07 -1.39 -1.68 116.25 118.88 1qxs h VAL 344 Ca 0.14 -0.86 0.09 0.00 0.82 0.00 0.00 66.70 66.90 1qxs h VAL 344 Cb 0.04 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 1qxs h VAL 344 CO -0.09 0.28 0.19 0.44 0.02 0.00 0.00 177.57 178.42 1qxs h ASP 345 N 0.33 0.17 -0.20 0.57 3.32 -0.56 0.37 116.42 120.43 1qxs h ASP 345 Ca 0.09 0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.15 1qxs h ASP 345 Cb 0.38 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1qxs h ASP 345 CO 0.01 0.11 -0.10 0.25 -1.72 0.00 0.00 179.24 177.79 1qxs h LEU 346 N 0.36 0.55 -0.34 1.55 5.85 -0.56 -0.27 115.31 122.45 1qxs h LEU 346 Ca 0.29 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 1qxs h LEU 346 Cb 0.37 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1qxs h LEU 346 CO -0.31 0.69 -0.26 0.58 -0.34 0.00 0.00 178.44 178.80 1qxs h VAL 347 N 0.53 1.29 0.00 1.05 2.07 -0.15 -0.61 116.25 120.43 1qxs h VAL 347 Ca 0.10 -1.42 -0.11 0.00 0.82 0.00 0.00 66.70 66.09 1qxs h VAL 347 Cb 0.49 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1qxs h VAL 347 CO 0.03 0.46 -0.55 0.03 0.02 0.00 0.00 177.57 177.57 1qxs h ARG 348 N 0.57 0.00 -0.08 1.57 3.08 -0.09 -2.24 114.38 117.19 1qxs h ARG 348 Ca 0.06 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.94 1qxs h ARG 348 Cb 0.83 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.89 1qxs h ARG 348 CO 0.07 0.55 -0.64 1.25 -1.07 0.00 0.00 179.97 180.13 1qxs h HIS 349 N 0.00 0.80 -0.50 3.04 2.76 -0.93 -1.64 115.15 118.68 1qxs h HIS 349 Ca -0.01 -0.38 -0.00 0.00 -2.20 0.00 0.00 60.37 57.78 1qxs h HIS 349 Cb 1.02 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.84 1qxs h HIS 349 CO 0.00 1.18 0.30 0.52 -1.30 0.00 0.00 177.93 178.63 1qxs h MET 350 N 0.19 0.66 0.19 5.26 2.86 -1.03 -1.42 114.93 121.65 1qxs h MET 350 Ca -0.06 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1qxs h MET 350 Cb 1.30 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.81 1qxs h MET 350 CO 0.13 0.47 -0.09 0.00 1.06 0.00 0.00 176.91 178.48 1qxs h ALA 351 N 1.65 -0.26 -0.84 6.32 0.00 -1.30 0.26 119.26 125.09 1qxs h ALA 351 Ca 0.18 -0.20 0.19 0.00 0.00 0.00 0.00 54.91 55.08 1qxs h ALA 351 Cb -0.02 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 17.75 1qxs h ALA 351 CO -0.03 -0.44 0.34 1.03 0.00 0.00 0.00 179.25 180.15 1qxs h SER 352 N -0.67 0.28 0.45 0.00 0.87 -0.97 0.60 113.55 114.11 1qxs h SER 352 Ca -0.03 0.14 -0.31 0.00 -1.23 0.00 0.00 61.79 60.37 1qxs h SER 352 Cb 0.48 0.13 0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1qxs h SER 352 CO 0.04 0.03 -1.38 0.11 -0.53 0.00 0.00 176.83 175.10 1qxs h LYS 353 N 0.40 0.39 -0.18 2.24 1.79 -1.26 -3.14 116.57 116.82 1qxs h LYS 353 Ca 0.50 -0.67 -0.00 0.00 -2.18 0.00 0.00 60.65 58.29 1qxs h LYS 353 Cb 0.89 0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 31.78 1qxs h LYS 353 CO -0.49 1.32 0.11 -0.44 -1.08 0.00 0.00 179.45 178.86 1qxs h ASP 354 N 0.11 0.23 0.00 0.86 3.45 0.61 -0.23 116.42 121.45 1qxs h ASP 354 Ca -0.20 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.19 1qxs h ASP 354 Cb 2.07 -0.06 0.00 0.00 -0.56 0.00 0.00 39.33 40.78 1qxs h ASP 354 CO 0.23 0.23 0.00 0.54 -1.57 0.00 0.00 179.24 178.68 1qxs n ARG 355 N -4.91 0.00 0.34 3.56 3.00 0.20 -1.65 116.66 117.19 1qxs n ARG 355 Ca -0.04 0.70 0.21 0.00 -0.01 0.00 0.00 57.85 58.72 1qxs n ARG 355 Cb 0.06 -1.45 1.14 0.00 0.00 0.00 0.00 32.46 32.22 1qxs n ARG 355 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 1qxs h SER 356 N 0.00 0.00 -0.09 0.55 0.02 -1.59 -1.65 113.55 110.78 1qxs h SER 356 Ca 0.00 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1qxs h SER 356 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1qxs h SER 356 CO 0.00 0.00 0.23 0.00 -1.14 0.00 0.00 176.83 175.92 1qxs h ALA 357 N 1.87 1.48 0.00 3.77 0.00 -0.08 -2.99 119.26 123.30 1qxs h ALA 357 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qxs h ALA 357 Cb 0.13 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1qxs h ALA 357 CO 0.00 -0.28 -0.10 2.89 0.00 0.00 0.00 179.25 181.76 1qxs n ARG 358 N -3.29 0.00 0.00 0.00 1.85 -0.95 -5.07 116.66 109.20 1qxs n ARG 358 Ca -0.00 -0.38 0.00 0.00 -1.00 0.00 0.00 57.85 56.47 1qxs n ARG 358 Cb 0.32 -0.28 0.00 0.00 -1.05 0.00 0.00 32.46 31.44 1qxs n ARG 358 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09