#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qxs s PRO 2 N 0.00 3.24 -0.21 2.12 0.02 -1.25 -4.98 135.00 133.94 1qxs s PRO 2 Ca 0.00 1.42 -0.15 0.00 0.02 0.00 0.00 61.00 62.29 1qxs s PRO 2 Cb 0.00 -2.01 -0.04 0.00 0.02 0.00 0.00 34.50 32.47 1qxs s PRO 2 CO 0.00 -0.90 0.36 0.96 -0.33 0.00 0.00 177.00 177.08 1qxs s ILE 3 N -2.12 5.23 -0.14 2.83 -4.36 -0.82 -4.81 121.20 117.01 1qxs s ILE 3 Ca 0.68 0.62 -0.29 0.00 -0.26 0.00 0.00 60.65 61.40 1qxs s ILE 3 Cb -0.20 -3.69 -0.05 0.00 1.25 0.00 0.00 42.46 39.77 1qxs s ILE 3 CO 0.32 0.27 1.78 -0.54 0.24 0.00 0.00 174.94 177.02 1qxs s LYS 4 N 1.27 3.83 0.06 0.37 -0.14 -1.26 -1.92 119.74 121.95 1qxs s LYS 4 Ca 0.17 2.00 0.08 0.00 -1.36 0.00 0.00 55.97 56.86 1qxs s LYS 4 Cb -0.15 -4.10 -0.03 0.00 -1.68 0.00 0.00 37.83 31.87 1qxs s LYS 4 CO 0.07 -1.28 -0.20 0.08 -0.76 0.00 0.00 175.35 173.27 1qxs s VAL 5 N 5.34 2.67 -0.03 3.17 1.01 -0.50 -2.16 120.40 129.90 1qxs s VAL 5 Ca 0.80 -1.31 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1qxs s VAL 5 Cb -0.31 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 33.94 1qxs s VAL 5 CO 0.32 0.28 -0.06 -0.83 0.00 0.00 0.00 175.10 174.81 1qxs s GLY 6 N -1.58 0.43 -0.40 4.51 0.00 -0.11 -0.26 107.32 109.91 1qxs s GLY 6 Ca 0.15 -0.19 -0.07 0.00 0.00 0.00 0.00 44.72 44.61 1qxs s GLY 6 CO 0.06 0.09 0.21 -0.42 0.00 0.00 0.00 173.10 173.04 1qxs s ILE 7 N 0.40 3.91 -0.46 0.90 1.01 -0.14 -1.70 121.20 125.12 1qxs s ILE 7 Ca -0.05 -1.47 -0.25 0.00 0.00 0.00 0.00 60.65 58.88 1qxs s ILE 7 Cb -0.09 -3.40 0.03 0.00 0.01 0.00 0.00 42.46 39.00 1qxs s ILE 7 CO 0.00 -0.46 0.88 0.21 0.00 0.00 0.00 174.94 175.57 1qxs s ASN 8 N 1.90 6.46 0.00 3.58 3.04 -1.02 -1.14 114.94 127.76 1qxs s ASN 8 Ca 0.03 0.01 0.00 0.00 0.04 0.00 0.00 52.86 52.93 1qxs s ASN 8 Cb -0.22 -2.43 0.00 0.00 -1.54 0.00 0.00 41.25 37.06 1qxs s ASN 8 CO 0.01 -1.02 0.00 0.61 -3.04 0.00 0.00 177.10 173.66 1qxs n GLY 9 N 4.96 -0.10 2.67 1.21 0.00 0.34 -0.54 105.19 113.73 1qxs n GLY 9 Ca 0.05 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 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 2.64 0.00 1.61 7.35 -0.96 -3.88 117.46 124.22 1qxs n PHE 10 Ca 0.00 -2.67 0.00 0.00 -0.76 0.00 0.00 57.45 54.02 1qxs n PHE 10 Cb 0.00 -1.49 0.00 0.00 0.35 0.00 0.00 39.48 38.34 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 1.05 2.91 0.23 7.13 0.00 -1.26 -4.52 105.19 110.72 1qxs n GLY 11 Ca 0.48 -0.90 -0.03 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.04 0.03 1.61 9.65 -1.94 0.22 114.38 123.91 1qxs h ARG 12 Ca 0.00 0.00 -0.32 0.00 -1.10 0.00 0.00 59.98 58.56 1qxs h ARG 12 Cb 0.00 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.54 1qxs h ARG 12 CO 0.00 -0.02 -1.86 -0.89 2.80 0.00 0.00 179.97 180.00 1qxs n ILE 13 N -5.38 1.63 -0.25 1.20 2.08 -1.26 -2.63 119.36 114.74 1qxs n ILE 13 Ca 0.04 -0.76 -0.06 0.00 0.56 0.00 0.00 62.75 62.53 1qxs n ILE 13 Cb 0.29 -1.17 0.05 0.00 -0.75 0.00 0.00 39.64 38.06 1qxs n ILE 13 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1qxs h GLY 14 N 2.93 1.06 0.94 7.39 0.00 -1.64 -0.60 103.07 113.16 1qxs h GLY 14 Ca -0.35 -0.50 -0.18 0.00 0.00 0.00 0.00 47.33 46.30 1qxs h GLY 14 CO 0.07 0.48 -0.68 3.21 0.00 0.00 0.00 176.54 179.62 1qxs h ARG 15 N 0.97 0.55 -0.10 4.80 3.08 -0.71 -2.85 114.38 120.13 1qxs h ARG 15 Ca 0.24 -0.52 -0.05 0.00 0.07 0.00 0.00 59.98 59.72 1qxs h ARG 15 Cb 0.08 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1qxs h ARG 15 CO -0.04 1.15 -0.17 0.52 -1.07 0.00 0.00 179.97 180.37 1qxs h MET 16 N 0.15 0.16 -0.27 0.04 2.86 -1.44 0.26 114.93 116.69 1qxs h MET 16 Ca -0.07 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1qxs h MET 16 Cb 1.35 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.97 1qxs h MET 16 CO 0.14 0.33 0.11 0.28 1.06 0.00 0.00 176.91 178.83 1qxs h VAL 17 N 0.15 1.17 -0.29 -2.22 2.07 -1.10 -0.30 116.25 115.73 1qxs h VAL 17 Ca 0.03 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 67.03 1qxs h VAL 17 Cb 0.39 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1qxs h VAL 17 CO 0.03 0.17 0.17 0.15 0.02 0.00 0.00 177.57 178.10 1qxs h PHE 18 N 0.29 0.39 -0.30 1.57 3.04 -1.08 -1.54 116.94 119.31 1qxs h PHE 18 Ca 0.09 -0.01 -0.00 0.00 3.98 0.00 0.00 57.97 62.03 1qxs h PHE 18 Cb 0.17 -0.13 -0.01 0.00 2.56 0.00 0.00 35.95 38.54 1qxs h PHE 18 CO -0.01 0.31 0.16 0.37 -2.02 0.00 0.00 178.31 177.12 1qxs h GLN 19 N 0.36 0.40 -0.51 1.11 4.15 -0.78 -0.50 115.11 119.33 1qxs h GLN 19 Ca 0.10 -0.03 -0.12 0.00 0.77 0.00 0.00 58.65 59.37 1qxs h GLN 19 Cb 0.04 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1qxs h GLN 19 CO -0.02 0.29 -0.16 0.00 -1.93 0.00 0.00 178.83 177.01 1qxs h ALA 20 N 1.78 0.71 -0.23 3.38 0.00 -0.44 -1.24 119.26 123.22 1qxs h ALA 20 Ca 0.11 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1qxs h ALA 20 Cb 0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1qxs h ALA 20 CO -0.02 0.66 0.15 -0.07 0.00 0.00 0.00 179.25 179.97 1qxs h LEU 21 N 0.88 0.27 -0.50 0.00 3.38 -0.15 -1.73 115.31 117.45 1qxs h LEU 21 Ca 0.12 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1qxs h LEU 21 Cb 0.74 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1qxs h LEU 21 CO 0.06 0.21 0.18 0.00 0.09 0.00 0.00 178.44 178.98 1qxs h GLU 23 N 0.67 0.18 -0.39 0.00 4.81 -1.01 -2.41 114.58 116.44 1qxs h GLU 23 Ca 0.16 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1qxs h GLU 23 Cb 0.23 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1qxs h GLU 23 CO -0.01 0.12 0.00 -0.25 -0.73 0.00 0.00 179.01 178.14 1qxs n ASP 24 N -5.08 1.18 -3.12 1.04 8.00 -0.67 -4.89 116.55 113.01 1qxs n ASP 24 Ca 0.00 -2.06 -0.23 0.00 0.71 0.00 0.00 54.79 53.22 1qxs n ASP 24 Cb 0.14 -0.24 0.03 0.00 -0.02 0.00 0.00 41.12 41.03 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 0.56 -0.52 0.08 0.44 0.00 -0.91 -4.90 105.19 99.94 1qxs n GLY 25 Ca 0.05 0.13 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 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 -4.03 0.31 -4.70 0.99 4.77 -0.79 -4.76 117.00 108.79 1qxs n LEU 26 Ca -0.09 0.14 -0.43 0.00 -0.03 0.00 0.00 56.01 55.60 1qxs n LEU 26 Cb 0.60 0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.90 1qxs n LEU 26 CO 0.49 0.27 1.42 -0.11 -1.33 0.00 0.00 177.39 178.14 1qxs n LEU 27 N -2.70 3.93 0.00 2.23 7.94 -1.20 -1.20 117.00 126.00 1qxs n LEU 27 Ca -0.18 1.02 0.00 0.00 -1.11 0.00 0.00 56.01 55.73 1qxs n LEU 27 Cb 0.92 -1.54 0.00 0.00 0.53 0.00 0.00 43.42 43.34 1qxs n LEU 27 CO 0.44 0.13 0.00 0.61 -1.11 0.00 0.00 177.39 177.46 1qxs n GLY 28 N 4.08 0.87 0.23 -3.96 0.00 0.11 -4.83 105.19 101.69 1qxs n GLY 28 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.24 0.00 0.03 2.61 -1.04 -0.34 -4.93 114.28 108.37 1qxs n THR 29 Ca 0.00 0.00 -0.19 0.00 -2.04 0.00 0.00 64.05 61.82 1qxs n THR 29 Cb 0.00 -0.32 -0.11 0.00 -1.82 0.00 0.00 70.33 68.08 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 0.51 -6.23 -2.82 3.07 -1.63 -3.32 114.58 104.15 1qxs h GLU 30 Ca 0.00 -0.57 -0.64 0.00 -0.50 0.00 0.00 59.36 57.65 1qxs h GLU 30 Cb 0.00 0.17 -0.30 0.00 -0.84 0.00 0.00 28.75 27.78 1qxs h GLU 30 CO 0.00 1.21 -0.87 0.42 -1.40 0.00 0.00 179.01 178.37 1qxs s ILE 31 N -3.16 1.78 -0.38 3.13 1.01 -0.75 -1.94 121.20 120.90 1qxs s ILE 31 Ca -0.12 -0.96 0.04 0.00 0.00 0.00 0.00 60.65 59.61 1qxs s ILE 31 Cb 0.04 -1.48 0.11 0.00 0.01 0.00 0.00 42.46 41.14 1qxs s ILE 31 CO 0.86 0.50 0.09 -0.62 0.00 0.00 0.00 174.94 175.78 1qxs s ASP 32 N -0.53 4.65 -0.64 3.58 -1.08 -0.81 0.04 116.67 121.89 1qxs s ASP 32 Ca 0.09 -2.32 -0.27 0.00 -0.52 0.00 0.00 52.55 49.53 1qxs s ASP 32 Cb -0.09 -1.60 -0.01 0.00 -1.46 0.00 0.00 42.92 39.76 1qxs s ASP 32 CO -0.01 -0.35 1.70 -0.69 0.52 0.00 0.00 175.17 176.34 1qxs s VAL 33 N 0.68 3.46 0.25 1.11 1.01 -1.26 -1.41 120.40 124.24 1qxs s VAL 33 Ca 0.12 0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.40 1qxs s VAL 33 Cb -0.20 -4.20 -0.01 0.00 0.00 0.00 0.00 36.38 31.97 1qxs s VAL 33 CO -0.07 -1.15 1.61 0.58 0.00 0.00 0.00 175.10 176.07 1qxs h VAL 34 N 6.66 1.34 -1.43 2.92 2.07 -0.94 -3.42 116.25 123.44 1qxs h VAL 34 Ca -0.27 -1.73 0.21 0.00 0.82 0.00 0.00 66.70 65.74 1qxs h VAL 34 Cb 1.13 1.79 -0.21 0.00 -1.52 0.00 0.00 31.29 32.48 1qxs h VAL 34 CO 1.23 0.52 0.78 0.00 0.02 0.00 0.00 177.57 180.13 1qxs s ALA 35 N -4.00 -2.05 0.27 1.67 0.00 -1.23 -2.68 121.76 113.75 1qxs s ALA 35 Ca -0.05 1.64 0.11 0.00 0.00 0.00 0.00 51.96 53.66 1qxs s ALA 35 Cb 0.12 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.67 1qxs s ALA 35 CO 0.80 -0.47 -0.18 0.14 0.00 0.00 0.00 175.76 176.05 1qxs s VAL 36 N -1.89 2.33 -0.08 0.00 -7.23 -0.59 -0.96 120.40 111.99 1qxs s VAL 36 Ca 0.07 -2.36 -0.05 0.00 -1.81 0.00 0.00 61.98 57.83 1qxs s VAL 36 Cb -0.01 -2.27 0.03 0.00 0.56 0.00 0.00 36.38 34.69 1qxs s VAL 36 CO -0.05 -0.42 0.18 0.54 -0.31 0.00 0.00 175.10 175.05 1qxs s VAL 37 N -2.60 -0.02 0.00 1.32 0.11 -0.29 -1.99 120.40 116.92 1qxs s VAL 37 Ca 0.29 0.08 0.00 0.00 -2.93 0.00 0.00 61.98 59.42 1qxs s VAL 37 Cb -0.04 -0.28 0.00 0.00 -1.53 0.00 0.00 36.38 34.53 1qxs s VAL 37 CO 0.14 0.03 0.00 -0.67 -3.33 0.00 0.00 175.10 171.27 1qxs n ASP 38 N 3.58 0.00 -0.33 3.54 -0.08 -1.25 -0.51 116.55 121.50 1qxs n ASP 38 Ca -0.19 -0.33 0.00 0.00 -1.51 0.00 0.00 54.79 52.77 1qxs n ASP 38 Cb 0.56 0.00 0.07 0.00 2.34 0.00 0.00 41.12 44.08 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 -0.03 0.00 -0.67 2.86 -1.96 -0.83 114.93 114.30 1qxs h MET 39 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1qxs h MET 39 Cb 0.00 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.67 1qxs h MET 39 CO 0.00 -0.02 0.00 0.27 1.06 0.00 0.00 176.91 178.22 1qxs n ASN 40 N -5.51 0.93 -0.11 1.22 0.23 -1.26 -4.07 115.26 106.69 1qxs n ASN 40 Ca 0.11 0.00 0.04 0.00 -0.53 0.00 0.00 54.58 54.20 1qxs n ASN 40 Cb 0.42 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.18 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 0.00 1.13 -2.03 5.53 -2.24 -1.26 -4.51 114.28 110.90 1qxs n THR 41 Ca 0.00 -1.30 -0.26 0.00 -2.27 0.00 0.00 64.05 60.22 1qxs n THR 41 Cb 0.00 0.22 -0.06 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.73 4.99 0.26 3.42 -1.08 -1.26 -4.26 116.67 117.01 1qxs s ASP 42 Ca 0.14 -1.08 -0.02 0.00 -0.52 0.00 0.00 52.55 51.07 1qxs s ASP 42 Cb 0.12 -2.57 0.54 0.00 -1.46 0.00 0.00 42.92 39.55 1qxs s ASP 42 CO 0.01 -3.00 1.71 0.00 0.52 0.00 0.00 175.17 174.42 1qxs h ALA 43 N 10.68 1.15 -1.00 3.66 0.00 -1.80 -0.43 119.26 131.51 1qxs h ALA 43 Ca 0.14 0.14 0.22 0.00 0.00 0.00 0.00 54.91 55.42 1qxs h ALA 43 Cb 0.98 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 18.80 1qxs h ALA 43 CO 1.20 -0.27 0.62 1.49 0.00 0.00 0.00 179.25 182.29 1qxs h GLU 44 N 0.40 0.58 0.01 0.00 4.81 -1.87 0.33 114.58 118.84 1qxs h GLU 44 Ca 0.46 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.46 1qxs h GLU 44 Cb 0.77 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1qxs h GLU 44 CO -0.47 0.38 -0.91 -0.92 -0.73 0.00 0.00 179.01 176.37 1qxs h TYR 45 N 0.60 0.06 -0.31 0.92 3.20 -1.49 -2.84 116.97 117.11 1qxs h TYR 45 Ca 0.59 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 62.33 1qxs h TYR 45 Cb 1.15 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.40 1qxs h TYR 45 CO -0.00 0.92 -0.18 0.74 -1.64 0.00 0.00 178.16 177.99 1qxs h PHE 46 N 0.02 0.62 -0.02 -3.82 -1.00 -0.03 -1.95 116.94 110.76 1qxs h PHE 46 Ca -0.02 -0.12 -0.00 0.00 2.81 0.00 0.00 57.97 60.64 1qxs h PHE 46 Cb 1.59 -0.16 -0.00 0.00 3.61 0.00 0.00 35.95 40.99 1qxs h PHE 46 CO 0.01 0.72 0.01 0.00 -1.61 0.00 0.00 178.31 177.43 1qxs h ALA 47 N 1.29 0.03 -0.79 2.45 0.00 -0.80 -1.43 119.26 120.02 1qxs h ALA 47 Ca 0.08 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 54.99 1qxs h ALA 47 Cb 0.61 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.31 1qxs h ALA 47 CO 0.04 -0.35 0.41 -0.92 0.00 0.00 0.00 179.25 178.43 1qxs h TYR 48 N -0.19 0.73 -0.16 0.00 3.20 -1.25 1.15 116.97 120.46 1qxs h TYR 48 Ca 0.01 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.78 1qxs h TYR 48 Cb 0.24 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1qxs h TYR 48 CO 0.00 0.23 -0.45 1.96 -1.64 0.00 0.00 178.16 178.26 1qxs h GLN 49 N 0.64 0.38 0.13 1.82 4.20 -1.21 -2.48 115.11 118.59 1qxs h GLN 49 Ca 0.41 -0.20 -0.29 0.00 0.06 0.00 0.00 58.65 58.63 1qxs h GLN 49 Cb 0.50 0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.30 1qxs h GLN 49 CO -0.31 0.76 -1.25 0.52 -0.67 0.00 0.00 178.83 177.88 1qxs h MET 50 N 0.31 0.49 -0.46 1.46 2.86 -0.07 -3.35 114.93 116.18 1qxs h MET 50 Ca 0.02 -0.71 -0.04 0.00 -2.06 0.00 0.00 59.70 56.92 1qxs h MET 50 Cb 0.92 0.24 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 1qxs h MET 50 CO 0.08 1.31 0.14 -0.09 1.06 0.00 0.00 176.91 179.42 1qxs h ARG 51 N 0.20 0.71 -5.36 1.72 2.43 0.14 -3.38 114.38 110.83 1qxs h ARG 51 Ca -0.17 -0.15 -0.67 0.00 -0.81 0.00 0.00 59.98 58.17 1qxs h ARG 51 Cb 1.93 -0.10 -0.31 0.00 -0.42 0.00 0.00 29.97 31.07 1qxs h ARG 51 CO 0.23 0.68 -0.84 0.71 -1.51 0.00 0.00 179.97 179.23 1qxs s TYR 52 N -5.41 2.63 -0.07 2.20 2.02 -0.94 -0.66 117.35 117.12 1qxs s TYR 52 Ca -0.13 -0.91 -0.00 0.00 -0.37 0.00 0.00 57.07 55.66 1qxs s TYR 52 Cb 0.11 -1.75 0.02 0.00 -0.40 0.00 0.00 41.96 39.95 1qxs s TYR 52 CO 0.78 -0.35 -0.04 0.34 -1.57 0.00 0.00 175.55 174.71 1qxs s ASP 53 N 0.32 1.56 0.41 2.29 -1.08 -1.21 -4.70 116.67 114.27 1qxs s ASP 53 Ca -0.16 -0.17 0.12 0.00 -0.52 0.00 0.00 52.55 51.83 1qxs s ASP 53 Cb -0.17 -0.57 0.96 0.00 -1.46 0.00 0.00 42.92 41.68 1qxs s ASP 53 CO 0.08 -0.12 1.96 0.74 0.52 0.00 0.00 175.17 178.35 1qxs h THR 54 N 6.21 0.91 0.00 1.71 2.02 -1.96 -1.38 112.91 120.41 1qxs h THR 54 Ca -0.28 -0.17 -0.15 0.00 0.77 0.00 0.00 66.41 66.58 1qxs h THR 54 Cb 1.14 0.37 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1qxs h THR 54 CO 0.37 0.09 -1.79 0.55 0.37 0.00 0.00 175.52 175.11 1qxs n VAL 55 N -4.48 0.55 -0.42 3.16 3.14 -1.26 -4.59 118.33 114.44 1qxs n VAL 55 Ca 0.11 -0.46 0.08 0.00 -2.96 0.00 0.00 64.34 61.11 1qxs n VAL 55 Cb 0.37 -0.34 0.24 0.00 -1.06 0.00 0.00 33.84 33.05 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 -2.29 0.83 -3.12 1.45 8.25 -1.22 -4.96 115.22 114.16 1qxs n HIS 56 Ca -0.14 -0.57 0.09 0.00 -0.26 0.00 0.00 57.72 56.84 1qxs n HIS 56 Cb 0.71 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.69 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 0.72 -1.48 3.70 -1.41 0.00 -0.52 -4.79 105.19 101.41 1qxs n GLY 57 Ca 0.18 -1.10 -0.44 0.00 0.00 0.00 0.00 46.02 44.66 1qxs n GLY 57 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qxs n LYS 58 N -2.94 2.47 -1.74 1.61 5.02 -1.26 -3.34 118.16 117.97 1qxs n LYS 58 Ca 0.00 0.89 -0.43 0.00 -2.02 0.00 0.00 58.31 56.75 1qxs n LYS 58 Cb 0.31 -2.69 -0.03 0.00 -0.02 0.00 0.00 35.03 32.61 1qxs n LYS 58 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1qxs s PHE 59 N 0.89 1.40 0.55 2.13 5.36 0.16 -4.85 117.98 123.63 1qxs s PHE 59 Ca 0.75 0.37 0.26 0.00 -0.96 0.00 0.00 56.93 57.36 1qxs s PHE 59 Cb -0.59 -4.02 1.47 0.00 -0.34 0.00 0.00 43.02 39.54 1qxs s PHE 59 CO 0.37 -4.03 2.02 0.87 -1.46 0.00 0.00 175.22 172.98 1qxs h LYS 60 N 13.38 0.00 -5.66 10.12 6.56 -1.89 -3.42 116.57 135.65 1qxs h LYS 60 Ca -0.40 0.00 -0.65 0.00 -1.06 0.00 0.00 60.65 58.53 1qxs h LYS 60 Cb 1.22 0.00 -0.07 0.00 -0.57 0.00 0.00 32.23 32.80 1qxs h LYS 60 CO 0.97 0.00 -0.43 0.71 -2.06 0.00 0.00 179.45 178.64 1qxs s TYR 61 N -4.86 3.60 0.58 -1.35 4.12 -1.26 -5.08 117.35 113.10 1qxs s TYR 61 Ca -0.05 0.59 -0.20 0.00 0.02 0.00 0.00 57.07 57.43 1qxs s TYR 61 Cb 0.18 -2.02 -0.04 0.00 -1.52 0.00 0.00 41.96 38.55 1qxs s TYR 61 CO 0.65 0.67 1.25 -2.00 0.02 0.00 0.00 175.55 176.14 1qxs s GLU 62 N -0.88 3.03 -0.09 -0.62 2.12 -1.26 -5.00 118.70 116.00 1qxs s GLU 62 Ca 0.16 1.94 -0.04 0.00 0.36 0.00 0.00 54.97 57.40 1qxs s GLU 62 Cb -0.13 -2.04 0.05 0.00 0.26 0.00 0.00 34.13 32.27 1qxs s GLU 62 CO 0.05 -1.19 0.18 0.08 -0.54 0.00 0.00 175.26 173.84 1qxs s VAL 63 N -1.49 -0.26 0.47 3.70 1.01 -1.26 -3.93 120.40 118.64 1qxs s VAL 63 Ca 0.76 0.32 0.01 0.00 0.00 0.00 0.00 61.98 63.06 1qxs s VAL 63 Cb -0.33 -0.32 -0.00 0.00 0.00 0.00 0.00 36.38 35.73 1qxs s VAL 63 CO 0.37 0.13 0.04 0.35 0.00 0.00 0.00 175.10 176.00 1qxs n THR 64 N 5.17 0.00 -4.08 3.92 -2.24 -0.31 -4.94 114.28 111.80 1qxs n THR 64 Ca -0.08 -2.33 -0.11 0.00 -2.27 0.00 0.00 64.05 59.26 1qxs n THR 64 Cb 0.50 0.57 -0.11 0.00 -2.10 0.00 0.00 70.33 69.19 1qxs n THR 64 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1qxs s THR 65 N -2.86 0.51 0.06 4.28 -4.23 -1.26 0.51 115.64 112.65 1qxs s THR 65 Ca 0.06 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.23 1qxs s THR 65 Cb 0.00 -0.91 -0.00 0.00 1.34 0.00 0.00 72.50 72.93 1qxs s THR 65 CO 0.04 -0.57 0.08 0.35 -0.54 0.00 0.00 174.62 173.98 1qxs n THR 66 N 0.99 0.00 -4.68 3.99 -2.24 0.04 -4.95 114.28 107.42 1qxs n THR 66 Ca -0.20 -0.35 -0.33 0.00 -2.27 0.00 0.00 64.05 60.90 1qxs n THR 66 Cb 0.57 0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.88 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 -2.17 2.63 0.16 -0.78 1.02 -1.26 -1.55 119.74 117.79 1qxs s LYS 67 Ca 0.06 -0.63 -0.12 0.00 0.02 0.00 0.00 55.97 55.30 1qxs s LYS 67 Cb -0.00 -2.50 0.04 0.00 -0.52 0.00 0.00 37.83 34.85 1qxs s LYS 67 CO 0.04 0.64 1.65 0.66 -0.92 0.00 0.00 175.35 177.42 1qxs h SER 68 N 5.15 0.85 -4.49 2.83 4.64 -1.93 -3.45 113.55 117.15 1qxs h SER 68 Ca -0.48 -0.25 -0.09 0.00 -0.47 0.00 0.00 61.79 60.50 1qxs h SER 68 Cb 1.17 -0.22 -0.21 0.00 -0.31 0.00 0.00 62.40 62.82 1qxs h SER 68 CO 0.52 0.89 -0.08 -0.55 -0.87 0.00 0.00 176.83 176.73 1qxs s SER 69 N -6.27 -0.47 0.58 4.97 0.15 -1.26 -5.04 113.70 106.36 1qxs s SER 69 Ca -0.13 0.70 0.30 0.00 0.70 0.00 0.00 55.95 57.52 1qxs s SER 69 Cb 0.12 0.72 1.40 0.00 -1.71 0.00 0.00 66.02 66.55 1qxs s SER 69 CO 0.81 -0.36 1.79 -0.65 1.20 0.00 0.00 173.24 176.03 1qxs h PRO 70 N 4.33 0.00 -0.25 5.44 0.11 -2.03 0.07 132.00 139.68 1qxs h PRO 70 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1qxs h PRO 70 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1qxs h PRO 70 CO 0.29 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.95 1qxs n SER 71 N -3.71 0.25 -4.80 -2.05 3.41 -1.26 -4.75 113.62 100.70 1qxs n SER 71 Ca 0.13 -1.60 -0.36 0.00 -0.26 0.00 0.00 58.87 56.78 1qxs n SER 71 Cb 0.89 -0.12 -0.07 0.00 -0.26 0.00 0.00 64.21 64.65 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 -1.69 5.39 0.00 -3.33 1.01 0.01 -5.05 120.40 116.74 1qxs s VAL 72 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1qxs s VAL 72 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1qxs s VAL 72 CO 0.00 0.54 0.87 0.00 0.00 0.00 0.00 175.10 176.51 1qxs n ALA 73 N 2.66 -0.35 -2.47 5.51 0.00 -1.26 -4.85 120.51 119.76 1qxs n ALA 73 Ca -0.18 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.04 1qxs n ALA 73 Cb 0.54 0.03 -0.05 0.00 0.00 0.00 0.00 19.45 19.97 1qxs n ALA 73 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1qxs s LYS 74 N -2.49 2.50 0.50 0.00 1.02 -1.26 -5.08 119.74 114.93 1qxs s LYS 74 Ca 0.00 -1.48 -0.22 0.00 0.02 0.00 0.00 55.97 54.30 1qxs s LYS 74 Cb 0.00 -2.29 -0.09 0.00 -0.52 0.00 0.00 37.83 34.93 1qxs s LYS 74 CO 0.00 0.05 0.92 -0.25 -0.92 0.00 0.00 175.35 175.15 1qxs n ASP 75 N -1.28 0.76 0.00 2.83 9.92 -1.26 -4.90 116.55 122.61 1qxs n ASP 75 Ca -0.02 0.92 0.00 0.00 -0.53 0.00 0.00 54.79 55.17 1qxs n ASP 75 Cb 0.61 -1.33 0.00 0.00 -0.64 0.00 0.00 41.12 39.76 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 0.14 0.21 -4.07 -2.24 5.75 -0.90 -2.86 116.55 112.58 1qxs n ASP 76 Ca 0.11 -1.09 -0.29 0.00 -0.01 0.00 0.00 54.79 53.51 1qxs n ASP 76 Cb 0.43 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.35 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 -0.09 1.55 0.21 2.12 2.01 -0.59 -0.95 115.64 119.90 1qxs s THR 77 Ca 0.00 -0.68 -0.20 0.00 0.31 0.00 0.00 61.69 61.12 1qxs s THR 77 Cb 0.00 -1.41 -0.08 0.00 0.01 0.00 0.00 72.50 71.02 1qxs s THR 77 CO 0.00 0.45 0.73 -0.76 -0.69 0.00 0.00 174.62 174.35 1qxs s LEU 78 N 0.94 4.38 -0.21 4.42 1.02 0.20 -0.78 118.68 128.64 1qxs s LEU 78 Ca -0.07 1.44 -0.02 0.00 0.02 0.00 0.00 54.13 55.50 1qxs s LEU 78 Cb -0.15 -3.53 0.06 0.00 0.02 0.00 0.00 46.19 42.59 1qxs s LEU 78 CO -0.01 0.06 0.02 -0.69 0.02 0.00 0.00 176.35 175.74 1qxs s VAL 79 N -1.47 0.81 -0.41 -1.59 1.01 0.18 0.29 120.40 119.22 1qxs s VAL 79 Ca 0.42 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 1qxs s VAL 79 Cb -0.17 -1.27 0.09 0.00 0.00 0.00 0.00 36.38 35.03 1qxs s VAL 79 CO 0.21 -0.21 0.24 -0.69 0.00 0.00 0.00 175.10 174.65 1qxs s VAL 80 N 1.72 3.85 -1.10 2.92 1.01 0.28 -1.16 120.40 127.92 1qxs s VAL 80 Ca -0.02 -1.65 -0.25 0.00 0.00 0.00 0.00 61.98 60.06 1qxs s VAL 80 Cb -0.18 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.79 1qxs s VAL 80 CO -0.08 -0.57 0.66 -3.20 0.00 0.00 0.00 175.10 171.90 1qxs n ASN 81 N 4.80 -4.29 0.00 3.32 4.05 -1.25 -1.29 115.26 120.59 1qxs n ASN 81 Ca -0.08 -1.22 0.00 0.00 0.45 0.00 0.00 54.58 53.73 1qxs n ASN 81 Cb 0.42 -1.58 0.00 0.00 1.23 0.00 0.00 39.78 39.85 1qxs n ASN 81 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1qxs n GLY 82 N -1.98 2.28 3.65 8.20 0.00 -1.26 -4.98 105.19 111.11 1qxs n GLY 82 Ca -0.18 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.83 2.87 -0.08 1.61 5.04 -0.42 -5.01 115.29 118.48 1qxs s HIS 83 Ca 0.00 1.03 -0.13 0.00 -1.54 0.00 0.00 55.06 54.42 1qxs s HIS 83 Cb 0.00 -3.55 -0.05 0.00 0.04 0.00 0.00 32.58 29.02 1qxs s HIS 83 CO 0.00 -1.58 0.31 1.03 -2.34 0.00 0.00 174.74 172.16 1qxs s ARG 84 N 3.59 3.90 -0.07 2.88 0.52 -1.26 -0.56 118.95 127.96 1qxs s ARG 84 Ca 0.54 0.18 0.01 0.00 -0.52 0.00 0.00 55.73 55.94 1qxs s ARG 84 Cb -0.20 -3.28 0.02 0.00 0.52 0.00 0.00 34.95 32.01 1qxs s ARG 84 CO 0.15 0.57 -0.07 0.42 0.02 0.00 0.00 175.30 176.39 1qxs s ILE 85 N -0.58 0.81 -0.01 1.52 1.01 0.15 -4.79 121.20 119.30 1qxs s ILE 85 Ca 0.19 -0.24 -0.25 0.00 0.00 0.00 0.00 60.65 60.35 1qxs s ILE 85 Cb -0.14 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.47 1qxs s ILE 85 CO 0.08 0.30 0.78 -0.22 0.00 0.00 0.00 174.94 175.88 1qxs s LEU 86 N 1.15 4.37 -0.67 2.97 2.96 -1.09 0.58 118.68 128.95 1qxs s LEU 86 Ca -0.07 1.37 -0.18 0.00 -0.22 0.00 0.00 54.13 55.04 1qxs s LEU 86 Cb -0.14 -3.23 0.13 0.00 0.50 0.00 0.00 46.19 43.45 1qxs s LEU 86 CO -0.01 -0.10 0.76 0.00 -1.32 0.00 0.00 176.35 175.68 1qxs s VAL 88 N 2.23 4.74 0.08 0.00 -7.23 -0.84 -4.56 120.40 114.81 1qxs s VAL 88 Ca 0.15 0.73 -0.31 0.00 -1.81 0.00 0.00 61.98 60.74 1qxs s VAL 88 Cb -0.20 -3.75 -0.06 0.00 0.56 0.00 0.00 36.38 32.93 1qxs s VAL 88 CO 0.01 -0.63 1.20 -0.75 -0.31 0.00 0.00 175.10 174.62 1qxs s LYS 89 N -4.07 4.44 0.80 4.82 2.36 -1.26 -3.76 119.74 123.07 1qxs s LYS 89 Ca 0.53 1.78 -0.16 0.00 -2.55 0.00 0.00 55.97 55.57 1qxs s LYS 89 Cb -0.10 -3.33 -0.07 0.00 -1.05 0.00 0.00 37.83 33.28 1qxs s LYS 89 CO 0.34 -0.23 0.08 0.00 1.55 0.00 0.00 175.35 177.09 1qxs n ALA 90 N 3.75 -2.93 -3.59 3.13 0.00 -0.32 -4.89 120.51 115.66 1qxs n ALA 90 Ca 0.08 -0.39 -0.25 0.00 0.00 0.00 0.00 53.44 52.88 1qxs n ALA 90 Cb 0.46 -1.60 -0.17 0.00 0.00 0.00 0.00 19.45 18.14 1qxs n ALA 90 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1qxs s GLN 91 N -2.48 1.64 0.33 0.00 -1.52 -1.26 -5.01 119.66 111.35 1qxs s GLN 91 Ca 0.56 -0.37 0.01 0.00 -1.95 0.00 0.00 55.36 53.61 1qxs s GLN 91 Cb -0.30 -1.44 0.55 0.00 -0.22 0.00 0.00 33.01 31.59 1qxs s GLN 91 CO 0.67 -0.05 1.98 -0.09 -0.25 0.00 0.00 175.29 177.55 1qxs h ARG 92 N 7.29 0.91 -5.03 2.91 1.12 -1.96 -3.38 114.38 116.23 1qxs h ARG 92 Ca -0.31 -0.07 -0.67 0.00 -1.11 0.00 0.00 59.98 57.82 1qxs h ARG 92 Cb 1.17 -0.20 -0.35 0.00 -0.01 0.00 0.00 29.97 30.58 1qxs h ARG 92 CO 0.46 0.63 -0.85 1.21 -3.11 0.00 0.00 179.97 178.31 1qxs s ASN 93 N -6.43 3.35 0.44 -3.80 3.04 -1.26 -5.02 114.94 105.26 1qxs s ASN 93 Ca -0.10 -0.77 0.26 0.00 0.04 0.00 0.00 52.86 52.28 1qxs s ASN 93 Cb 0.17 -1.49 1.28 0.00 -1.54 0.00 0.00 41.25 39.67 1qxs s ASN 93 CO 0.78 -0.03 1.75 -0.65 -3.04 0.00 0.00 177.10 175.91 1qxs h PRO 94 N 7.91 0.23 0.00 0.43 0.11 -1.83 0.24 132.00 139.09 1qxs h PRO 94 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1qxs h PRO 94 Cb 1.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1qxs h PRO 94 CO 0.61 0.15 0.00 0.00 -0.21 0.00 0.00 178.00 178.55 1qxs h ALA 95 N 1.55 1.00 -0.38 -0.75 0.00 -1.82 -2.07 119.26 116.79 1qxs h ALA 95 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.54 1qxs h ALA 95 Cb 1.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.70 1qxs h ALA 95 CO -0.24 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.76 1qxs n ASP 96 N -2.67 3.80 -4.78 0.00 8.00 0.84 -4.02 116.55 117.72 1qxs n ASP 96 Ca -0.01 -2.51 -0.38 0.00 0.71 0.00 0.00 54.79 52.61 1qxs n ASP 96 Cb 0.12 -0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 40.58 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 -1.64 4.36 -0.32 0.64 2.01 -0.78 -4.97 118.68 117.98 1qxs s LEU 97 Ca 0.34 0.80 -0.05 0.00 0.01 0.00 0.00 54.13 55.23 1qxs s LEU 97 Cb 0.25 -2.56 -0.16 0.00 0.01 0.00 0.00 46.19 43.74 1qxs s LEU 97 CO 0.12 0.18 2.63 -0.81 1.01 0.00 0.00 176.35 179.47 1qxs n PRO 98 N 2.80 1.75 0.19 1.29 -0.04 -1.26 -4.56 135.00 135.18 1qxs n PRO 98 Ca -0.12 -0.99 -0.11 0.00 -0.04 0.00 0.00 63.50 62.25 1qxs n PRO 98 Cb 0.52 -2.05 -0.06 0.00 -0.04 0.00 0.00 33.50 31.87 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 4.43 -0.51 0.00 0.54 -0.00 -1.89 -2.75 115.95 115.78 1qxs h TRP 99 Ca 0.27 -0.01 0.00 0.00 -0.00 0.00 0.00 58.89 59.15 1qxs h TRP 99 Cb 0.83 0.17 0.00 0.00 -0.00 0.00 0.00 29.16 30.16 1qxs h TRP 99 CO 1.66 -0.21 0.30 0.78 -0.00 0.00 0.00 178.44 180.98 1qxs h GLY 100 N -1.04 0.00 -0.56 1.49 0.00 -1.33 0.53 103.07 102.16 1qxs h GLY 100 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1qxs h GLY 100 CO 0.09 0.00 -0.65 1.17 0.00 0.00 0.00 176.54 177.15 1qxs n LYS 101 N -2.83 0.74 -0.12 4.80 4.81 -1.21 -4.34 118.16 120.02 1qxs n LYS 101 Ca -0.02 -0.61 -0.16 0.00 -0.87 0.00 0.00 58.31 56.65 1qxs n LYS 101 Cb 0.35 -1.49 -0.13 0.00 0.02 0.00 0.00 35.03 33.78 1qxs n LYS 101 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1qxs n LEU 102 N -0.60 2.23 0.00 3.14 7.99 0.17 -5.01 117.00 124.92 1qxs n LEU 102 Ca 0.07 -0.10 0.00 0.00 -0.01 0.00 0.00 56.01 55.97 1qxs n LEU 102 Cb 0.41 -0.55 0.00 0.00 -0.11 0.00 0.00 43.42 43.18 1qxs n LEU 102 CO 0.34 0.82 0.00 0.61 -1.51 0.00 0.00 177.39 177.65 1qxs n GLY 103 N 2.15 0.95 3.70 -0.72 0.00 -0.10 -5.08 105.19 106.08 1qxs n GLY 103 Ca -0.42 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.00 4.30 -0.07 1.61 1.01 -1.21 -4.64 120.40 119.41 1qxs s VAL 104 Ca 0.00 1.64 0.08 0.00 0.00 0.00 0.00 61.98 63.70 1qxs s VAL 104 Cb 0.00 -4.05 -0.11 0.00 0.00 0.00 0.00 36.38 32.22 1qxs s VAL 104 CO 0.00 0.04 0.07 -1.84 0.00 0.00 0.00 175.10 173.37 1qxs n GLU 105 N 4.75 2.08 -4.53 2.72 0.28 -0.92 -4.19 120.64 120.84 1qxs n GLU 105 Ca 0.10 -0.02 -0.33 0.00 -0.16 0.00 0.00 57.16 56.74 1qxs n GLU 105 Cb 0.47 -1.22 -0.14 0.00 1.43 0.00 0.00 31.44 31.98 1qxs n GLU 105 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1qxs s TYR 106 N -2.31 2.90 -0.11 -1.84 1.51 -1.06 0.17 117.35 116.61 1qxs s TYR 106 Ca -0.04 -0.59 -0.00 0.00 -1.01 0.00 0.00 57.07 55.43 1qxs s TYR 106 Cb 0.03 -1.92 0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1qxs s TYR 106 CO 0.36 -0.21 -0.09 0.14 -1.11 0.00 0.00 175.55 174.64 1qxs s VAL 107 N 0.53 1.11 -0.67 0.71 -7.23 -0.90 -0.93 120.40 113.01 1qxs s VAL 107 Ca -0.06 -0.35 -0.27 0.00 -1.81 0.00 0.00 61.98 59.49 1qxs s VAL 107 Cb -0.15 -1.10 0.04 0.00 0.56 0.00 0.00 36.38 35.72 1qxs s VAL 107 CO 0.03 0.38 1.20 -0.63 -0.31 0.00 0.00 175.10 175.77 1qxs s ILE 108 N 1.58 3.91 -0.82 -0.62 1.01 -0.69 -2.20 121.20 123.38 1qxs s ILE 108 Ca 0.03 0.46 -0.25 0.00 0.00 0.00 0.00 60.65 60.89 1qxs s ILE 108 Cb -0.13 -4.81 0.01 0.00 0.01 0.00 0.00 42.46 37.54 1qxs s ILE 108 CO -0.07 -1.62 1.57 -0.70 0.00 0.00 0.00 174.94 174.12 1qxs s GLU 109 N 5.22 3.06 -0.12 2.79 2.56 -0.19 -2.43 118.70 129.60 1qxs s GLU 109 Ca 0.36 -0.30 0.15 0.00 0.00 0.00 0.00 54.97 55.18 1qxs s GLU 109 Cb -0.09 -4.70 0.26 0.00 2.00 0.00 0.00 34.13 31.60 1qxs s GLU 109 CO 0.18 -2.52 1.14 -1.13 -0.56 0.00 0.00 175.26 172.37 1qxs n SER 110 N 10.82 1.86 0.10 -1.70 3.41 0.29 -2.48 113.62 125.92 1qxs n SER 110 Ca 0.22 -2.99 -0.03 0.00 -0.26 0.00 0.00 58.87 55.81 1qxs n SER 110 Cb 0.50 -0.40 0.16 0.00 -0.26 0.00 0.00 64.21 64.20 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 1.44 1.39 0.00 6.66 1.35 -1.54 -3.43 112.91 118.78 1qxs h THR 111 Ca -0.01 -1.92 0.00 0.00 -0.55 0.00 0.00 66.41 63.93 1qxs h THR 111 Cb 1.09 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 69.49 1qxs h THR 111 CO 0.00 0.56 0.00 0.61 -0.25 0.00 0.00 175.52 176.45 1qxs n GLY 112 N 0.17 0.57 0.38 5.82 0.00 -1.26 -4.92 105.19 105.94 1qxs n GLY 112 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 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 1.65 -2.93 0.99 4.77 -1.26 -4.68 117.00 115.53 1qxs n LEU 113 Ca 0.00 -0.80 -0.22 0.00 -0.03 0.00 0.00 56.01 54.96 1qxs n LEU 113 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1qxs n LEU 113 CO 0.00 0.31 -0.00 0.49 -1.33 0.00 0.00 177.39 176.86 1qxs n PHE 114 N 0.01 2.34 0.86 -1.77 3.72 -1.26 -4.81 117.46 116.55 1qxs n PHE 114 Ca 0.07 -3.69 0.11 0.00 -0.05 0.00 0.00 57.45 53.89 1qxs n PHE 114 Cb 0.32 -0.40 0.30 0.00 -0.94 0.00 0.00 39.48 38.76 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 -0.08 0.32 -3.22 4.37 -2.24 -1.26 -4.01 114.28 108.16 1qxs n THR 115 Ca 0.28 -0.51 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 1qxs n THR 115 Cb 0.57 0.66 -0.08 0.00 -2.10 0.00 0.00 70.33 69.38 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 -1.68 3.44 0.12 6.98 0.00 -1.26 -1.35 121.76 128.00 1qxs s ALA 116 Ca 0.35 -1.15 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 1qxs s ALA 116 Cb 0.20 -3.09 0.25 0.00 0.00 0.00 0.00 23.12 20.47 1qxs s ALA 116 CO 0.28 -1.42 0.65 1.17 0.00 0.00 0.00 175.76 176.44 1qxs n LYS 117 N 5.84 -0.04 -0.04 0.00 3.00 0.84 0.15 118.16 127.92 1qxs n LYS 117 Ca -0.04 0.64 -0.11 0.00 -0.00 0.00 0.00 58.31 58.79 1qxs n LYS 117 Cb 0.48 -0.98 -0.06 0.00 0.00 0.00 0.00 35.03 34.48 1qxs n LYS 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1qxs h ALA 118 N 0.83 0.19 0.00 3.14 0.00 -1.88 -1.26 119.26 120.28 1qxs h ALA 118 Ca 0.22 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1qxs h ALA 118 Cb 0.40 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1qxs h ALA 118 CO -0.41 -0.16 -0.43 0.00 0.00 0.00 0.00 179.25 178.26 1qxs h ALA 119 N 0.82 1.22 0.00 0.00 0.00 0.10 -2.98 119.26 118.42 1qxs h ALA 119 Ca 0.05 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 1qxs h ALA 119 Cb 0.28 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1qxs h ALA 119 CO 0.00 0.53 -0.38 0.00 0.00 0.00 0.00 179.25 179.41 1qxs h ALA 120 N 1.57 0.82 0.00 0.00 0.00 -0.68 -3.19 119.26 117.78 1qxs h ALA 120 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1qxs h ALA 120 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1qxs h ALA 120 CO 0.06 0.10 0.00 0.39 0.00 0.00 0.00 179.25 179.79 1qxs n GLU 121 N -2.99 0.04 0.33 0.00 1.02 -0.49 -2.23 120.64 116.33 1qxs n GLU 121 Ca 0.02 0.33 0.22 0.00 -0.02 0.00 0.00 57.16 57.71 1qxs n GLU 121 Cb 0.57 -1.59 1.12 0.00 -0.02 0.00 0.00 31.44 31.52 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 1.99 0.00 2.00 0.62 0.00 -1.67 -0.29 103.07 105.72 1qxs h GLY 122 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 1qxs h GLY 122 CO 0.00 0.00 -0.48 0.45 0.00 0.00 0.00 176.54 176.51 1qxs h HIS 123 N 0.00 0.00 -0.16 5.60 3.86 -1.63 -1.60 115.15 121.21 1qxs h HIS 123 Ca -0.00 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.09 1qxs h HIS 123 Cb 0.10 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.57 1qxs h HIS 123 CO 0.00 0.48 -0.37 -0.07 0.86 0.00 0.00 177.93 178.82 1qxs h LEU 124 N 0.00 0.61 -1.29 2.43 3.38 -1.20 -2.00 115.31 117.24 1qxs h LEU 124 Ca -0.00 -0.57 -0.07 0.00 0.09 0.00 0.00 57.88 57.33 1qxs h LEU 124 Cb 0.98 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1qxs h LEU 124 CO 0.06 1.07 -0.32 0.03 0.09 0.00 0.00 178.44 179.37 1qxs h ARG 125 N 0.19 0.05 0.00 1.13 3.08 -1.44 -2.00 114.38 115.39 1qxs h ARG 125 Ca -0.00 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1qxs h ARG 125 Cb 0.98 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.02 1qxs h ARG 125 CO 0.08 0.37 -0.07 0.78 -1.07 0.00 0.00 179.97 180.07 1qxs h GLY 126 N 1.01 0.00 0.00 0.04 0.00 -1.18 -3.45 103.07 99.48 1qxs h GLY 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qxs h GLY 126 CO 0.04 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.19 1qxs n GLY 127 N -0.67 1.02 3.74 4.60 0.00 -0.77 -1.65 105.19 111.47 1qxs n GLY 127 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.18 3.40 -0.22 4.61 0.00 -0.76 -3.42 121.76 124.18 1qxs s ALA 128 Ca 0.00 -1.32 -0.16 0.00 0.00 0.00 0.00 51.96 50.48 1qxs s ALA 128 Cb 0.00 -1.17 -0.18 0.00 0.00 0.00 0.00 23.12 21.77 1qxs s ALA 128 CO 0.00 0.46 0.05 0.54 0.00 0.00 0.00 175.76 176.81 1qxs n ARG 129 N -0.36 0.60 -4.34 0.00 1.74 0.10 -4.13 116.66 110.27 1qxs n ARG 129 Ca -0.09 0.42 -0.20 0.00 -0.77 0.00 0.00 57.85 57.21 1qxs n ARG 129 Cb 0.55 -1.66 -0.11 0.00 -1.02 0.00 0.00 32.46 30.23 1qxs n ARG 129 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1qxs s LYS 130 N -2.44 1.32 -0.08 5.56 -0.14 0.13 -4.86 119.74 119.23 1qxs s LYS 130 Ca -0.31 -1.51 -0.03 0.00 -1.36 0.00 0.00 55.97 52.76 1qxs s LYS 130 Cb 0.09 -1.25 0.04 0.00 -1.68 0.00 0.00 37.83 35.03 1qxs s LYS 130 CO 0.59 0.23 0.16 0.08 -0.76 0.00 0.00 175.35 175.65 1qxs s VAL 131 N -2.51 -0.20 -0.26 3.17 1.01 -0.13 -2.12 120.40 119.35 1qxs s VAL 131 Ca 0.20 0.31 -0.09 0.00 0.00 0.00 0.00 61.98 62.39 1qxs s VAL 131 Cb -0.03 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 1qxs s VAL 131 CO 0.07 0.13 0.12 -0.69 0.00 0.00 0.00 175.10 174.73 1qxs s VAL 132 N 1.98 4.73 -0.24 2.92 1.01 -0.94 -1.91 120.40 127.95 1qxs s VAL 132 Ca -0.00 -0.03 -0.21 0.00 0.00 0.00 0.00 61.98 61.73 1qxs s VAL 132 Cb -0.12 -3.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 1qxs s VAL 132 CO -0.06 0.31 0.67 -0.63 0.00 0.00 0.00 175.10 175.39 1qxs s ILE 133 N 1.61 4.96 0.00 2.22 1.01 0.81 -1.02 121.20 130.79 1qxs s ILE 133 Ca 0.06 1.24 0.00 0.00 0.00 0.00 0.00 60.65 61.95 1qxs s ILE 133 Cb -0.15 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.34 1qxs s ILE 133 CO 0.06 0.03 1.82 -1.54 0.00 0.00 0.00 174.94 175.31 1qxs n SER 134 N 5.59 4.87 -3.61 3.58 3.41 -1.04 -0.68 113.62 125.75 1qxs n SER 134 Ca 0.01 -2.29 0.01 0.00 -0.26 0.00 0.00 58.87 56.33 1qxs n SER 134 Cb 0.49 -1.03 -0.01 0.00 -0.26 0.00 0.00 64.21 63.41 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 0.15 -2.24 0.09 7.33 0.00 -1.20 -4.93 121.76 120.96 1qxs s ALA 135 Ca 0.00 0.91 -0.32 0.00 0.00 0.00 0.00 51.96 52.55 1qxs s ALA 135 Cb 0.00 0.24 -0.11 0.00 0.00 0.00 0.00 23.12 23.25 1qxs s ALA 135 CO 0.00 -0.97 1.81 -2.30 0.00 0.00 0.00 175.76 174.31 1qxs n PRO 136 N -0.41 2.59 -2.96 0.00 -0.02 -1.24 -4.15 135.00 128.80 1qxs n PRO 136 Ca -0.07 0.94 -0.20 0.00 -2.02 0.00 0.00 63.50 62.15 1qxs n PRO 136 Cb 0.62 -2.81 0.07 0.00 -0.02 0.00 0.00 33.50 31.36 1qxs n PRO 136 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qxs s ALA 137 N 2.79 4.56 0.07 3.55 0.00 -1.26 -4.94 121.76 126.53 1qxs s ALA 137 Ca 0.84 -2.11 -0.09 0.00 0.00 0.00 0.00 51.96 50.60 1qxs s ALA 137 Cb -0.55 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.04 1qxs s ALA 137 CO 0.40 -0.99 0.19 -1.54 0.00 0.00 0.00 175.76 173.83 1qxs s SER 138 N -4.69 0.09 0.00 0.00 1.04 -0.46 -4.91 113.70 104.77 1qxs s SER 138 Ca 0.63 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.50 1qxs s SER 138 Cb -0.05 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.39 1qxs s SER 138 CO 0.40 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.56 1qxs n GLY 139 N 0.18 0.64 0.00 7.32 0.00 -1.26 0.29 105.19 112.36 1qxs n GLY 139 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.43 0.66 3.65 -0.02 0.00 -1.26 -4.81 105.19 101.98 1qxs n GLY 140 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.49 1qxs n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qxs n ALA 141 N -1.14 -0.30 -1.83 4.61 0.00 -1.26 -4.85 120.51 115.74 1qxs n ALA 141 Ca 0.00 0.44 -0.42 0.00 0.00 0.00 0.00 53.44 53.46 1qxs n ALA 141 Cb 0.00 -2.19 -0.03 0.00 0.00 0.00 0.00 19.45 17.23 1qxs n ALA 141 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1qxs s LYS 142 N 1.92 4.17 -0.32 0.00 2.47 -1.25 -4.60 119.74 122.14 1qxs s LYS 142 Ca 0.90 2.48 -0.11 0.00 -1.56 0.00 0.00 55.97 57.67 1qxs s LYS 142 Cb -0.94 -3.10 -0.02 0.00 -1.46 0.00 0.00 37.83 32.31 1qxs s LYS 142 CO 0.53 -0.65 0.20 0.99 0.16 0.00 0.00 175.35 176.58 1qxs s THR 143 N 0.89 5.01 -0.04 3.43 2.01 -1.26 -0.66 115.64 125.03 1qxs s THR 143 Ca 0.70 -0.23 0.04 0.00 0.31 0.00 0.00 61.69 62.50 1qxs s THR 143 Cb -0.46 -3.53 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 1qxs s THR 143 CO 0.35 0.07 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.44 1qxs s LEU 144 N 1.69 2.76 -0.21 4.42 1.43 -0.32 -4.78 118.68 123.67 1qxs s LEU 144 Ca 0.06 -0.21 -0.00 0.00 -1.03 0.00 0.00 54.13 52.94 1qxs s LEU 144 Cb -0.17 -1.57 0.06 0.00 0.03 0.00 0.00 46.19 44.53 1qxs s LEU 144 CO 0.09 0.33 -0.04 -0.69 0.23 0.00 0.00 176.35 176.27 1qxs s VAL 145 N -0.77 1.23 0.10 -1.59 1.01 -1.26 -4.21 120.40 114.90 1qxs s VAL 145 Ca 0.12 -0.94 -0.36 0.00 0.00 0.00 0.00 61.98 60.80 1qxs s VAL 145 Cb -0.11 -1.52 -0.17 0.00 0.00 0.00 0.00 36.38 34.59 1qxs s VAL 145 CO 0.01 -0.06 1.26 0.23 0.00 0.00 0.00 175.10 176.55 1qxs n MET 146 N 4.80 1.03 -0.71 2.72 0.00 -1.26 -0.56 117.12 123.13 1qxs n MET 146 Ca -0.11 0.37 0.00 0.00 0.00 0.00 0.00 57.70 57.96 1qxs n MET 146 Cb 0.46 -1.96 0.00 0.00 0.00 0.00 0.00 33.22 31.72 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 2.30 1.27 1.19 3.03 0.00 -1.26 -4.81 105.19 106.91 1qxs n GLY 147 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.00 0.34 -1.64 1.61 0.31 0.27 -4.96 118.33 112.25 1qxs n VAL 148 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 1qxs n VAL 148 Cb 0.00 -1.34 0.00 0.00 -0.91 0.00 0.00 33.84 31.59 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 -3.11 0.00 0.09 4.52 6.94 -0.82 -4.92 115.26 117.97 1qxs n ASN 149 Ca 0.00 -1.31 0.07 0.00 -0.02 0.00 0.00 54.58 53.32 1qxs n ASN 149 Cb 0.27 -0.06 0.35 0.00 -2.36 0.00 0.00 39.78 37.98 1qxs n ASN 149 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1qxs n HIS 150 N 0.00 0.42 1.06 -2.53 1.44 -1.19 -1.37 115.22 113.05 1qxs n HIS 150 Ca 0.00 0.21 0.14 0.00 -2.01 0.00 0.00 57.72 56.06 1qxs n HIS 150 Cb 0.56 -0.84 0.56 0.00 0.12 0.00 0.00 29.99 30.40 1qxs n HIS 150 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1qxs n HIS 151 N -1.93 0.00 1.36 -1.40 8.25 -1.26 -3.33 115.22 116.92 1qxs n HIS 151 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1qxs n HIS 151 Cb 0.05 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.74 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 -1.45 1.00 -2.57 -0.41 1.02 -0.47 -4.80 120.64 112.96 1qxs n GLU 152 Ca 0.08 -0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.79 1qxs n GLU 152 Cb 0.33 -1.32 -0.02 0.00 -0.02 0.00 0.00 31.44 30.40 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 -1.36 3.26 -0.51 -0.32 5.04 -1.21 -5.00 117.35 117.25 1qxs s TYR 153 Ca 0.00 1.35 -0.11 0.00 -2.44 0.00 0.00 57.07 55.87 1qxs s TYR 153 Cb 0.00 -3.33 0.13 0.00 0.35 0.00 0.00 41.96 39.11 1qxs s TYR 153 CO 0.00 -0.86 0.41 1.21 -1.34 0.00 0.00 175.55 174.97 1qxs s ASN 154 N 1.39 5.87 0.30 4.32 3.84 -1.26 -4.96 114.94 124.44 1qxs s ASN 154 Ca 0.51 -1.93 0.16 0.00 0.21 0.00 0.00 52.86 51.80 1qxs s ASN 154 Cb -0.20 -2.07 1.06 0.00 -0.55 0.00 0.00 41.25 39.48 1qxs s ASN 154 CO 0.16 -0.73 1.29 -2.65 -2.79 0.00 0.00 177.10 172.37 1qxs n PRO 155 N 4.94 -0.05 0.00 0.43 -0.02 -1.26 0.02 135.00 139.06 1qxs n PRO 155 Ca -0.08 1.13 0.11 0.00 -2.02 0.00 0.00 63.50 62.63 1qxs n PRO 155 Cb 0.41 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.84 1qxs n PRO 155 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1qxs n SER 156 N -4.87 1.22 -0.00 2.55 3.41 -1.26 -4.41 113.62 110.26 1qxs n SER 156 Ca 0.30 -1.05 0.06 0.00 -0.26 0.00 0.00 58.87 57.91 1qxs n SER 156 Cb 1.01 0.75 -0.08 0.00 -0.26 0.00 0.00 64.21 65.63 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 -1.08 2.09 -4.05 4.33 4.07 0.10 -4.95 120.64 121.16 1qxs n GLU 157 Ca 0.06 -0.04 -0.31 0.00 -0.06 0.00 0.00 57.16 56.81 1qxs n GLU 157 Cb 0.37 -1.15 -0.16 0.00 -0.06 0.00 0.00 31.44 30.44 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 -2.39 2.28 0.00 4.31 3.76 -0.44 -4.96 115.29 117.84 1qxs s HIS 158 Ca 0.01 -1.29 0.00 0.00 -0.15 0.00 0.00 55.06 53.63 1qxs s HIS 158 Cb 0.09 -1.65 0.00 0.00 1.11 0.00 0.00 32.58 32.12 1qxs s HIS 158 CO 0.50 -0.69 0.00 0.72 -0.85 0.00 0.00 174.74 174.42 1qxs n HIS 159 N 4.73 0.00 -3.56 1.40 8.25 -1.26 -4.79 115.22 119.99 1qxs n HIS 159 Ca -0.18 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 56.99 1qxs n HIS 159 Cb 0.50 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.48 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 -1.60 0.48 0.22 1.59 1.01 -1.26 -0.96 120.40 119.89 1qxs s VAL 160 Ca 0.00 -1.72 0.06 0.00 0.00 0.00 0.00 61.98 60.32 1qxs s VAL 160 Cb 0.00 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 1qxs s VAL 160 CO 0.00 -0.89 0.23 0.68 0.00 0.00 0.00 175.10 175.12 1qxs s VAL 161 N 1.13 4.72 -0.20 2.92 -7.23 -0.80 -3.80 120.40 117.13 1qxs s VAL 161 Ca 0.16 -1.18 -0.03 0.00 -1.81 0.00 0.00 61.98 59.11 1qxs s VAL 161 Cb -0.22 -3.52 -0.01 0.00 0.56 0.00 0.00 36.38 33.19 1qxs s VAL 161 CO -0.08 -0.28 -0.05 -0.55 -0.31 0.00 0.00 175.10 173.84 1qxs s SER 162 N -3.68 4.38 0.00 4.85 0.15 0.16 -0.13 113.70 119.44 1qxs s SER 162 Ca 0.33 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.65 1qxs s SER 162 Cb -0.09 -1.74 0.00 0.00 -1.71 0.00 0.00 66.02 62.49 1qxs s SER 162 CO 0.26 0.04 0.81 -3.20 1.20 0.00 0.00 173.24 172.35 1qxs n ASN 163 N 4.41 0.11 -0.41 5.45 5.15 0.14 -1.17 115.26 128.93 1qxs n ASN 163 Ca -0.18 -1.74 0.02 0.00 -0.60 0.00 0.00 54.58 52.08 1qxs n ASN 163 Cb 0.51 -0.05 -0.01 0.00 -0.53 0.00 0.00 39.78 39.71 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 -0.43 -0.40 -1.98 5.20 0.00 -1.26 -4.77 120.51 116.87 1qxs n ALA 164 Ca 0.00 0.05 -0.21 0.00 0.00 0.00 0.00 53.44 53.28 1qxs n ALA 164 Cb 0.03 -0.14 0.05 0.00 0.00 0.00 0.00 19.45 19.39 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 -3.97 5.11 0.13 0.00 1.04 -1.26 -3.24 113.70 111.51 1qxs s SER 165 Ca 0.00 -0.14 -0.13 0.00 0.48 0.00 0.00 55.95 56.17 1qxs s SER 165 Cb 0.00 -0.65 -0.04 0.00 0.10 0.00 0.00 66.02 65.44 1qxs s SER 165 CO 0.00 -1.27 1.50 0.00 0.98 0.00 0.00 173.24 174.45 1qxs h THR 167 N 0.63 1.27 -0.91 0.00 2.02 -1.95 -2.42 112.91 111.55 1qxs h THR 167 Ca 0.09 -0.85 0.16 0.00 0.77 0.00 0.00 66.41 66.58 1qxs h THR 167 Cb 0.75 1.71 -0.07 0.00 -1.74 0.00 0.00 68.15 68.80 1qxs h THR 167 CO 0.06 0.23 0.58 0.74 0.37 0.00 0.00 175.52 177.51 1qxs h THR 168 N -0.19 0.79 0.00 3.16 2.02 -1.78 0.34 112.91 117.25 1qxs h THR 168 Ca 0.02 -0.22 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 1qxs h THR 168 Cb 0.37 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1qxs h THR 168 CO 0.00 0.12 -0.03 0.78 0.37 0.00 0.00 175.52 176.76 1qxs h ASN 169 N 0.65 0.00 0.29 4.18 2.35 -1.08 0.30 115.58 122.28 1qxs h ASN 169 Ca 0.47 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.89 1qxs h ASN 169 Cb 0.82 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.15 1qxs h ASN 169 CO -0.22 0.03 -1.93 0.00 -1.65 0.00 0.00 177.43 173.66 1qxs h LEU 171 N 0.02 -0.13 -0.82 0.00 6.46 -0.89 -3.38 115.31 116.57 1qxs h LEU 171 Ca -0.38 -0.43 0.10 0.00 -0.12 0.00 0.00 57.88 57.05 1qxs h LEU 171 Cb 2.04 0.03 -0.12 0.00 -0.73 0.00 0.00 40.66 41.89 1qxs h LEU 171 CO 0.06 0.47 -0.51 0.00 -0.62 0.00 0.00 178.44 177.84 1qxs h ALA 172 N -0.23 -0.39 -0.93 1.25 0.00 -1.16 -0.63 119.26 117.17 1qxs h ALA 172 Ca -0.02 0.13 0.27 0.00 0.00 0.00 0.00 54.91 55.29 1qxs h ALA 172 Cb 0.55 1.18 -0.16 0.00 0.00 0.00 0.00 17.79 19.36 1qxs h ALA 172 CO 0.03 -0.88 0.20 -1.35 0.00 0.00 0.00 179.25 177.24 1qxs h PRO 173 N -0.11 0.11 0.42 0.00 0.11 -1.76 0.18 132.00 130.94 1qxs h PRO 173 Ca 0.19 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.27 1qxs h PRO 173 Cb 0.51 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.60 1qxs h PRO 173 CO -0.84 0.07 -0.20 0.82 -0.21 0.00 0.00 178.00 177.64 1qxs h ILE 174 N 0.11 0.35 -0.07 4.15 1.08 -1.32 -2.56 117.51 119.25 1qxs h ILE 174 Ca 0.60 -0.61 0.02 0.00 -0.39 0.00 0.00 64.86 64.48 1qxs h ILE 174 Cb 1.27 0.53 -0.00 0.00 -3.07 0.00 0.00 36.82 35.55 1qxs h ILE 174 CO -0.76 0.07 0.17 0.58 -0.69 0.00 0.00 178.15 177.52 1qxs h VAL 175 N -1.01 0.21 0.03 1.67 2.07 -0.69 -0.74 116.25 117.78 1qxs h VAL 175 Ca -0.06 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.32 1qxs h VAL 175 Cb 0.54 0.85 0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1qxs h VAL 175 CO 0.09 0.00 -0.58 -0.74 0.02 0.00 0.00 177.57 176.36 1qxs h HIS 176 N 0.00 0.52 -0.85 1.57 -0.00 -0.63 -1.53 115.15 114.22 1qxs h HIS 176 Ca 0.04 -0.31 -0.01 0.00 -0.00 0.00 0.00 60.37 60.09 1qxs h HIS 176 Cb 0.37 -0.05 -0.04 0.00 -0.00 0.00 0.00 27.41 27.69 1qxs h HIS 176 CO 0.00 1.15 0.48 0.28 -0.00 0.00 0.00 177.93 179.84 1qxs h VAL 177 N -0.26 1.24 0.25 5.26 2.07 -0.76 0.61 116.25 124.67 1qxs h VAL 177 Ca -0.08 -0.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 1qxs h VAL 177 Cb 1.34 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1qxs h VAL 177 CO 0.11 0.27 -0.12 -0.07 0.02 0.00 0.00 177.57 177.78 1qxs h LEU 178 N 1.18 -0.28 -0.73 2.57 3.38 -1.26 0.54 115.31 120.70 1qxs h LEU 178 Ca 0.30 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.10 1qxs h LEU 178 Cb 0.00 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1qxs h LEU 178 CO -0.05 -0.07 0.14 0.58 0.09 0.00 0.00 178.44 179.13 1qxs h VAL 179 N -0.49 1.26 -0.04 1.22 2.07 -1.00 0.13 116.25 119.41 1qxs h VAL 179 Ca -0.03 -1.00 -0.20 0.00 0.82 0.00 0.00 66.70 66.29 1qxs h VAL 179 Cb 0.36 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1qxs h VAL 179 CO 0.06 0.38 -0.83 0.50 0.02 0.00 0.00 177.57 177.70 1qxs h LYS 180 N 1.04 0.38 0.00 1.57 3.64 0.30 -2.99 116.57 120.52 1qxs h LYS 180 Ca 0.21 -0.36 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1qxs h LYS 180 Cb 0.40 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1qxs h LYS 180 CO 0.01 1.02 0.00 0.39 -2.27 0.00 0.00 179.45 178.60 1qxs n GLU 181 N -3.78 0.71 -0.65 1.90 -0.58 0.17 -4.89 120.64 113.52 1qxs n GLU 181 Ca -0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 1qxs n GLU 181 Cb 0.77 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.14 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 1.07 0.65 0.14 0.62 0.00 -1.08 -4.93 105.19 101.65 1qxs n GLY 182 Ca 0.19 -0.24 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 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 0.20 -2.26 1.61 0.04 -0.99 -3.45 116.94 112.09 1qxs h PHE 183 Ca 0.00 -0.10 0.13 0.00 2.80 0.00 0.00 57.97 60.80 1qxs h PHE 183 Cb 0.00 -0.03 -0.07 0.00 2.20 0.00 0.00 35.95 38.05 1qxs h PHE 183 CO 0.00 0.83 -0.73 0.41 -0.60 0.00 0.00 178.31 178.22 1qxs n GLY 184 N 0.57 -3.32 2.86 -1.45 0.00 -0.93 -1.50 105.19 101.42 1qxs n GLY 184 Ca -0.02 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.58 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 -4.27 1.15 -0.11 1.61 1.01 -1.26 -2.80 120.40 115.72 1qxs s VAL 185 Ca 0.00 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 60.90 1qxs s VAL 185 Cb 0.00 -1.52 -0.07 0.00 0.00 0.00 0.00 36.38 34.79 1qxs s VAL 185 CO 0.00 -0.16 0.20 -0.61 0.00 0.00 0.00 175.10 174.52 1qxs h GLN 186 N 8.06 0.00 -3.27 2.72 4.15 -1.46 -3.46 115.11 121.85 1qxs h GLN 186 Ca -0.17 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.10 1qxs h GLN 186 Cb 1.09 0.00 -0.23 0.00 0.21 0.00 0.00 27.48 28.55 1qxs h GLN 186 CO 0.39 0.27 -0.43 0.95 -1.93 0.00 0.00 178.83 178.08 1qxs s THR 187 N -1.75 0.04 -0.17 2.39 -4.23 -1.23 -4.81 115.64 105.89 1qxs s THR 187 Ca -0.06 -0.35 -0.18 0.00 -1.18 0.00 0.00 61.69 59.93 1qxs s THR 187 Cb -0.01 -0.43 0.05 0.00 1.34 0.00 0.00 72.50 73.45 1qxs s THR 187 CO 0.19 -0.19 0.49 -0.83 -0.54 0.00 0.00 174.62 173.74 1qxs s GLY 188 N -0.73 -0.37 -0.08 3.99 0.00 -0.47 -1.17 107.32 108.49 1qxs s GLY 188 Ca -0.08 1.33 0.02 0.00 0.00 0.00 0.00 44.72 46.00 1qxs s GLY 188 CO 0.02 1.13 -0.15 1.08 0.00 0.00 0.00 173.10 175.19 1qxs s LEU 189 N 0.12 1.71 0.22 0.66 1.43 0.38 -3.19 118.68 120.01 1qxs s LEU 189 Ca -0.01 -0.37 0.09 0.00 -1.03 0.00 0.00 54.13 52.81 1qxs s LEU 189 Cb -0.03 -0.97 -0.04 0.00 0.03 0.00 0.00 46.19 45.17 1qxs s LEU 189 CO 0.01 0.04 -0.05 0.00 0.23 0.00 0.00 176.35 176.58 1qxs s MET 190 N 0.72 2.18 -0.03 1.70 0.23 -0.89 -1.35 119.30 121.86 1qxs s MET 190 Ca -0.13 -1.33 -0.01 0.00 -1.03 0.00 0.00 55.69 53.19 1qxs s MET 190 Cb -0.16 -2.17 0.03 0.00 -1.53 0.00 0.00 34.83 31.00 1qxs s MET 190 CO 0.03 0.41 0.05 0.99 -2.03 0.00 0.00 175.02 174.47 1qxs s THR 191 N -1.98 -0.09 -0.22 3.16 2.01 -1.02 -1.89 115.64 115.61 1qxs s THR 191 Ca 0.28 0.33 -0.05 0.00 0.31 0.00 0.00 61.69 62.56 1qxs s THR 191 Cb -0.08 -0.12 -0.02 0.00 0.01 0.00 0.00 72.50 72.29 1qxs s THR 191 CO 0.17 0.14 -0.00 0.28 -0.69 0.00 0.00 174.62 174.52 1qxs s THR 192 N 1.67 3.77 -1.11 -0.82 -1.32 -0.57 0.44 115.64 117.71 1qxs s THR 192 Ca -0.02 -0.36 -0.17 0.00 -1.21 0.00 0.00 61.69 59.94 1qxs s THR 192 Cb -0.12 -2.73 0.13 0.00 -1.51 0.00 0.00 72.50 68.27 1qxs s THR 192 CO -0.03 0.40 1.37 -0.63 -2.21 0.00 0.00 174.62 173.52 1qxs s ILE 193 N 1.40 4.71 -0.01 5.08 1.09 -0.08 -1.53 121.20 131.86 1qxs s ILE 193 Ca 0.05 -2.02 -0.24 0.00 -1.10 0.00 0.00 60.65 57.34 1qxs s ILE 193 Cb -0.15 -4.92 -0.05 0.00 -1.06 0.00 0.00 42.46 36.29 1qxs s ILE 193 CO 0.00 -1.67 0.73 -2.28 -0.10 0.00 0.00 174.94 171.63 1qxs s HIS 194 N 2.60 3.66 0.44 3.97 2.46 -0.86 -2.90 115.29 124.67 1qxs s HIS 194 Ca 0.41 1.36 -0.22 0.00 0.47 0.00 0.00 55.06 57.09 1qxs s HIS 194 Cb -0.02 -2.81 -0.09 0.00 -0.13 0.00 0.00 32.58 29.53 1qxs s HIS 194 CO -0.03 0.19 1.02 -1.54 -2.47 0.00 0.00 174.74 171.91 1qxs s SER 195 N 0.34 6.62 1.09 9.88 1.04 -1.25 -1.49 113.70 129.93 1qxs s SER 195 Ca 0.38 1.90 -0.14 0.00 0.48 0.00 0.00 55.95 58.58 1qxs s SER 195 Cb -0.19 -2.56 0.19 0.00 0.10 0.00 0.00 66.02 63.55 1qxs s SER 195 CO 0.21 -0.58 0.70 0.00 0.98 0.00 0.00 173.24 174.54 1qxs n TYR 196 N -0.58 -0.97 -4.28 5.02 0.18 -0.85 -4.85 117.16 110.82 1qxs n TYR 196 Ca 0.07 0.07 -0.19 0.00 1.88 0.00 0.00 57.90 59.73 1qxs n TYR 196 Cb 0.52 -1.73 -0.08 0.00 -0.38 0.00 0.00 39.34 37.67 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 -2.40 0.03 0.63 -3.48 -4.23 -1.26 -4.65 115.64 100.28 1qxs s THR 197 Ca 0.64 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.45 1qxs s THR 197 Cb -0.21 -2.49 0.35 0.00 1.34 0.00 0.00 72.50 71.49 1qxs s THR 197 CO 0.65 0.00 2.00 0.00 -0.54 0.00 0.00 174.62 176.73 1qxs h ALA 198 N 2.19 1.64 -0.00 3.99 0.00 -1.97 -1.22 119.26 123.89 1qxs h ALA 198 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1qxs h ALA 198 Cb 1.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1qxs h ALA 198 CO 0.40 -0.39 -0.00 0.25 0.00 0.00 0.00 179.25 179.51 1qxs n THR 199 N -3.35 0.00 -2.96 0.00 -2.24 -1.26 -4.85 114.28 99.62 1qxs n THR 199 Ca 0.01 -0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.55 1qxs n THR 199 Cb 0.41 -0.49 0.01 0.00 -2.10 0.00 0.00 70.33 68.16 1qxs n THR 199 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1qxs s GLN 200 N -2.62 3.19 -0.10 -0.78 -0.21 -0.46 -4.97 119.66 113.71 1qxs s GLN 200 Ca 0.27 -0.33 -0.02 0.00 0.02 0.00 0.00 55.36 55.30 1qxs s GLN 200 Cb 0.20 -2.53 -0.03 0.00 1.00 0.00 0.00 33.01 31.65 1qxs s GLN 200 CO 0.47 -0.23 -0.01 0.15 -2.12 0.00 0.00 175.29 173.56 1qxs s LYS 201 N -4.58 3.12 0.18 2.91 3.01 -1.26 -4.99 119.74 118.12 1qxs s LYS 201 Ca 0.47 -0.43 -0.13 0.00 -1.01 0.00 0.00 55.97 54.87 1qxs s LYS 201 Cb -0.10 -2.82 0.08 0.00 -1.01 0.00 0.00 37.83 33.99 1qxs s LYS 201 CO 0.39 0.61 1.79 1.79 0.51 0.00 0.00 175.35 180.44 1qxs h THR 202 N 4.34 1.19 -2.59 2.17 1.35 -1.91 0.28 112.91 117.75 1qxs h THR 202 Ca -0.47 -0.48 -0.51 0.00 -0.55 0.00 0.00 66.41 64.39 1qxs h THR 202 Cb 1.19 0.43 -0.14 0.00 -1.73 0.00 0.00 68.15 67.90 1qxs h THR 202 CO 0.56 0.21 -0.73 0.68 -0.25 0.00 0.00 175.52 175.99 1qxs s VAL 203 N -5.86 1.96 -0.48 6.82 -7.23 -1.26 -3.96 120.40 110.39 1qxs s VAL 203 Ca -0.13 -2.25 -0.33 0.00 -1.81 0.00 0.00 61.98 57.45 1qxs s VAL 203 Cb 0.13 -2.23 -0.13 0.00 0.56 0.00 0.00 36.38 34.72 1qxs s VAL 203 CO 0.77 -0.46 2.30 0.47 -0.31 0.00 0.00 175.10 177.87 1qxs n ASP 204 N -0.51 1.81 -3.17 4.85 8.00 -1.26 -4.34 116.55 121.93 1qxs n ASP 204 Ca -0.06 0.24 -0.16 0.00 0.71 0.00 0.00 54.79 55.51 1qxs n ASP 204 Cb 0.61 -1.25 -0.04 0.00 -0.02 0.00 0.00 41.12 40.43 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 6.50 3.73 3.70 0.44 0.00 0.21 -4.93 105.19 114.85 1qxs n GLY 205 Ca 0.45 -2.17 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 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 -2.21 4.19 -0.46 1.61 1.01 -1.26 -4.54 120.40 118.74 1qxs s VAL 206 Ca 0.06 1.56 0.07 0.00 0.00 0.00 0.00 61.98 63.67 1qxs s VAL 206 Cb 0.00 -4.00 0.18 0.00 0.00 0.00 0.00 36.38 32.57 1qxs s VAL 206 CO 0.04 0.08 0.68 -0.55 0.00 0.00 0.00 175.10 175.35 1qxs s SER 207 N 1.19 -1.49 0.19 3.32 0.15 -1.26 -4.91 113.70 110.89 1qxs s SER 207 Ca 0.57 -1.21 -0.04 0.00 0.70 0.00 0.00 55.95 55.98 1qxs s SER 207 Cb -0.27 1.93 0.11 0.00 -1.71 0.00 0.00 66.02 66.07 1qxs s SER 207 CO 0.27 -0.11 1.52 -0.37 1.20 0.00 0.00 173.24 175.74 1qxs h VAL 208 N 4.98 1.31 0.00 4.45 -1.51 -1.94 -3.03 116.25 120.51 1qxs h VAL 208 Ca 0.05 -1.72 0.00 0.00 -1.23 0.00 0.00 66.70 63.80 1qxs h VAL 208 Cb 1.15 1.68 0.00 0.00 -2.13 0.00 0.00 31.29 31.99 1qxs h VAL 208 CO 0.06 0.54 0.00 0.29 -1.23 0.00 0.00 177.57 177.23 1qxs n LYS 209 N -3.99 0.08 -3.05 5.19 4.76 -1.26 -4.38 118.16 115.51 1qxs n LYS 209 Ca -0.03 0.11 -0.08 0.00 -2.87 0.00 0.00 58.31 55.44 1qxs n LYS 209 Cb 0.58 -1.60 -0.02 0.00 -1.84 0.00 0.00 35.03 32.15 1qxs n LYS 209 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1qxs s ASP 210 N -3.46 -0.63 0.12 4.39 -1.08 -1.20 -5.06 116.67 109.74 1qxs s ASP 210 Ca 0.12 -1.71 -0.33 0.00 -0.52 0.00 0.00 52.55 50.10 1qxs s ASP 210 Cb 0.16 1.35 -0.11 0.00 -1.46 0.00 0.00 42.92 42.85 1qxs s ASP 210 CO 0.51 -0.13 1.56 -0.50 0.52 0.00 0.00 175.17 177.13 1qxs h TRP 211 N 5.85 -1.54 -0.14 -5.34 4.06 -1.73 0.10 115.95 117.20 1qxs h TRP 211 Ca 0.09 0.06 0.04 0.00 2.06 0.00 0.00 58.89 61.14 1qxs h TRP 211 Cb 1.09 0.69 -0.01 0.00 -1.00 0.00 0.00 29.16 29.93 1qxs h TRP 211 CO 0.17 -0.54 0.13 0.00 -3.56 0.00 0.00 178.44 174.64 1qxs h ARG 212 N -0.57 0.00 0.00 0.49 3.08 -1.90 0.14 114.38 115.62 1qxs h ARG 212 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1qxs h ARG 212 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1qxs h ARG 212 CO -0.43 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 178.88 1qxs n GLY 213 N -1.47 -0.74 0.01 0.04 0.00 0.34 -2.28 105.19 101.09 1qxs n GLY 213 Ca 0.00 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.03 -0.92 3.75 -0.02 0.00 0.48 -4.21 105.19 104.24 1qxs n GLY 214 Ca 0.07 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.27 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 -3.23 2.00 -0.14 1.61 1.81 -0.97 -0.62 118.95 119.41 1qxs s ARG 215 Ca -0.02 1.28 -0.41 0.00 -1.72 0.00 0.00 55.73 54.86 1qxs s ARG 215 Cb 0.14 -1.86 -0.19 0.00 -0.45 0.00 0.00 34.95 32.59 1qxs s ARG 215 CO 0.84 -1.85 1.36 0.00 -0.68 0.00 0.00 175.30 174.97 1qxs n ALA 216 N -3.61 -2.00 0.11 2.13 0.00 -1.26 -4.45 120.51 111.43 1qxs n ALA 216 Ca 0.10 0.53 0.01 0.00 0.00 0.00 0.00 53.44 54.07 1qxs n ALA 216 Cb 0.53 -1.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.03 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 4.45 0.64 -0.49 0.00 0.00 -0.56 -3.35 119.26 119.94 1qxs h ALA 217 Ca -0.48 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 53.85 1qxs h ALA 217 Cb 1.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1qxs h ALA 217 CO 0.80 0.75 0.00 0.00 0.00 0.00 0.00 179.25 180.81 1qxs n ALA 218 N -2.27 2.82 -2.24 0.00 0.00 -1.26 -4.29 120.51 113.26 1qxs n ALA 218 Ca -0.01 -1.63 0.01 0.00 0.00 0.00 0.00 53.44 51.82 1qxs n ALA 218 Cb 0.78 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 19.43 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 0.64 0.00 -3.73 0.00 0.24 -1.26 -4.78 118.33 109.44 1qxs n VAL 219 Ca 0.21 -0.48 -0.14 0.00 -2.04 0.00 0.00 64.34 61.90 1qxs n VAL 219 Cb 0.77 0.71 -0.09 0.00 -1.47 0.00 0.00 33.84 33.76 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 -1.42 -0.33 -0.56 -1.34 0.01 -1.25 -5.04 114.94 105.01 1qxs s ASN 220 Ca 0.16 0.47 -0.19 0.00 -0.71 0.00 0.00 52.86 52.60 1qxs s ASN 220 Cb 0.19 0.57 0.09 0.00 0.41 0.00 0.00 41.25 42.50 1qxs s ASN 220 CO -0.08 -0.31 0.66 -0.63 -1.51 0.00 0.00 177.10 175.23 1qxs s ILE 221 N -0.57 4.87 -0.35 0.60 1.01 -1.26 -4.26 121.20 121.24 1qxs s ILE 221 Ca -0.07 -0.86 -0.15 0.00 0.00 0.00 0.00 60.65 59.58 1qxs s ILE 221 Cb -0.04 -4.41 -0.01 0.00 0.01 0.00 0.00 42.46 38.02 1qxs s ILE 221 CO 0.03 -0.99 0.32 -0.63 0.00 0.00 0.00 174.94 173.66 1qxs s ILE 222 N 2.58 5.21 0.83 2.92 1.01 -0.70 -4.91 121.20 128.13 1qxs s ILE 222 Ca 0.12 -0.14 -0.11 0.00 0.00 0.00 0.00 60.65 60.52 1qxs s ILE 222 Cb -0.23 -3.81 0.09 0.00 0.01 0.00 0.00 42.46 38.52 1qxs s ILE 222 CO 0.08 -0.11 1.09 -2.84 0.00 0.00 0.00 174.94 173.16 1qxs s PRO 223 N 1.89 1.83 -0.18 2.79 0.02 -1.26 -0.23 135.00 139.85 1qxs s PRO 223 Ca 0.09 0.95 -0.30 0.00 0.02 0.00 0.00 61.00 61.77 1qxs s PRO 223 Cb -0.17 -1.86 0.14 0.00 0.02 0.00 0.00 34.50 32.62 1qxs s PRO 223 CO 0.11 -1.88 1.06 0.45 -0.33 0.00 0.00 177.00 176.41 1qxs s SER 224 N -3.47 -0.32 0.38 2.53 0.15 0.14 -4.76 113.70 108.34 1qxs s SER 224 Ca 0.62 0.36 -0.11 0.00 0.70 0.00 0.00 55.95 57.52 1qxs s SER 224 Cb -0.17 0.28 -0.07 0.00 -1.71 0.00 0.00 66.02 64.35 1qxs s SER 224 CO 0.56 -0.29 0.76 0.42 1.20 0.00 0.00 173.24 175.90 1qxs s THR 225 N -1.03 4.76 0.04 6.45 -4.23 -1.26 0.05 115.64 120.42 1qxs s THR 225 Ca 0.00 0.69 -0.04 0.00 -1.18 0.00 0.00 61.69 61.16 1qxs s THR 225 Cb -0.01 -3.70 -0.02 0.00 1.34 0.00 0.00 72.50 70.11 1qxs s THR 225 CO -0.00 -0.44 0.07 0.28 -0.54 0.00 0.00 174.62 173.99 1qxs s THR 226 N -2.27 0.15 -0.07 3.99 -1.32 -1.24 -4.70 115.64 110.17 1qxs s THR 226 Ca 0.52 -1.21 0.20 0.00 -1.21 0.00 0.00 61.69 59.99 1qxs s THR 226 Cb -0.10 -0.97 -0.30 0.00 -1.51 0.00 0.00 72.50 69.62 1qxs s THR 226 CO 0.28 -0.67 0.35 0.61 -2.21 0.00 0.00 174.62 172.99 1qxs n GLY 227 N 0.69 -0.96 0.22 6.08 0.00 -1.26 -4.47 105.19 105.49 1qxs n GLY 227 Ca -0.18 -0.45 -0.03 0.00 0.00 0.00 0.00 46.02 45.36 1qxs n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qxs n ALA 228 N -2.36 -0.19 -0.19 4.61 0.00 -1.26 0.04 120.51 121.16 1qxs n ALA 228 Ca -0.11 0.52 -0.07 0.00 0.00 0.00 0.00 53.44 53.77 1qxs n ALA 228 Cb 0.70 -0.18 0.02 0.00 0.00 0.00 0.00 19.45 20.00 1qxs n ALA 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qxs h ALA 229 N 0.56 0.71 -0.32 0.00 0.00 -1.91 -2.87 119.26 115.43 1qxs h ALA 229 Ca 0.15 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1qxs h ALA 229 Cb 0.29 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1qxs h ALA 229 CO -0.54 0.25 0.09 -0.22 0.00 0.00 0.00 179.25 178.83 1qxs h LYS 230 N 0.74 0.50 -0.46 0.00 3.64 -0.56 -2.73 116.57 117.69 1qxs h LYS 230 Ca 0.19 -0.11 0.13 0.00 -1.27 0.00 0.00 60.65 59.59 1qxs h LYS 230 Cb 0.08 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 1qxs h LYS 230 CO -0.03 0.55 0.66 0.00 -2.27 0.00 0.00 179.45 178.37 1qxs h ALA 231 N 0.92 2.18 0.00 5.00 0.00 -0.63 0.50 119.26 127.23 1qxs h ALA 231 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1qxs h ALA 231 Cb 0.27 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1qxs h ALA 231 CO -0.00 -0.90 0.00 0.28 0.00 0.00 0.00 179.25 178.63 1qxs n VAL 232 N -3.36 1.02 0.13 0.00 0.31 -1.03 -0.54 118.33 114.86 1qxs n VAL 232 Ca 0.09 0.57 -0.00 0.00 -0.01 0.00 0.00 64.34 64.98 1qxs n VAL 232 Cb 0.83 -1.54 0.08 0.00 -0.91 0.00 0.00 33.84 32.30 1qxs n VAL 232 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1qxs h GLY 233 N 0.72 0.00 2.00 2.92 0.00 -0.18 -1.47 103.07 107.07 1qxs h GLY 233 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 1qxs h GLY 233 CO 0.00 0.00 -0.53 -0.33 0.00 0.00 0.00 176.54 175.68 1qxs h MET 234 N 0.00 0.00 0.00 4.80 2.86 -0.98 -2.53 114.93 119.08 1qxs h MET 234 Ca -0.01 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.38 1qxs h MET 234 Cb 1.34 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.95 1qxs h MET 234 CO 0.08 0.53 -1.73 0.28 1.06 0.00 0.00 176.91 177.13 1qxs n VAL 235 N -3.30 1.40 -3.40 -2.22 0.31 -1.18 -4.59 118.33 105.34 1qxs n VAL 235 Ca 0.01 -0.77 -0.27 0.00 -0.01 0.00 0.00 64.34 63.31 1qxs n VAL 235 Cb 0.71 -0.82 -0.10 0.00 -0.91 0.00 0.00 33.84 32.72 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 -2.93 -0.78 -0.51 2.52 5.41 -0.56 -4.70 119.36 117.82 1qxs n ILE 236 Ca -0.17 -3.71 0.41 0.00 1.00 0.00 0.00 62.75 60.28 1qxs n ILE 236 Cb 0.99 -1.77 0.65 0.00 -0.71 0.00 0.00 39.64 38.80 1qxs n ILE 236 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1qxs n PRO 237 N 2.44 -0.02 0.00 0.38 -0.02 -0.95 -0.65 135.00 136.19 1qxs n PRO 237 Ca 0.27 1.04 0.06 0.00 -2.02 0.00 0.00 63.50 62.85 1qxs n PRO 237 Cb 0.48 -2.19 0.26 0.00 -0.02 0.00 0.00 33.50 32.02 1qxs n PRO 237 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1qxs n SER 238 N -4.14 0.00 -0.20 2.55 3.41 -1.26 -1.77 113.62 112.21 1qxs n SER 238 Ca 0.37 0.43 0.08 0.00 -0.26 0.00 0.00 58.87 59.50 1qxs n SER 238 Cb 1.56 -0.46 -0.05 0.00 -0.26 0.00 0.00 64.21 65.00 1qxs n SER 238 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1qxs n THR 239 N -1.46 0.00 -1.66 6.66 -2.24 0.18 -4.94 114.28 110.82 1qxs n THR 239 Ca 0.03 -0.20 -0.53 0.00 -2.27 0.00 0.00 64.05 61.08 1qxs n THR 239 Cb 0.13 1.10 -0.06 0.00 -2.10 0.00 0.00 70.33 69.40 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 -0.76 1.52 -0.37 -0.78 7.27 -0.73 -0.01 117.38 123.53 1qxs n GLN 240 Ca 0.05 0.54 0.00 0.00 0.07 0.00 0.00 57.00 57.67 1qxs n GLN 240 Cb 0.32 -2.36 0.00 0.00 2.41 0.00 0.00 30.24 30.62 1qxs n GLN 240 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1qxs n GLY 241 N 4.63 0.87 0.02 1.69 0.00 -1.26 -4.92 105.19 106.22 1qxs n GLY 241 Ca 0.27 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.40 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 -2.00 0.57 -4.37 1.61 5.02 0.98 -5.01 118.16 114.96 1qxs n LYS 242 Ca 0.00 -0.14 -0.19 0.00 -2.02 0.00 0.00 58.31 55.96 1qxs n LYS 242 Cb 0.00 -1.55 -0.10 0.00 -0.02 0.00 0.00 35.03 33.36 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 -4.42 2.21 0.00 -0.35 1.43 -1.25 -1.36 118.68 114.94 1qxs s LEU 243 Ca -0.05 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.79 1qxs s LEU 243 Cb 0.14 -0.34 0.00 0.00 0.03 0.00 0.00 46.19 46.01 1qxs s LEU 243 CO 0.89 -0.51 0.00 1.07 0.23 0.00 0.00 176.35 178.03 1qxs n THR 244 N -0.51 0.00 -2.68 5.49 5.66 -1.19 -4.20 114.28 116.85 1qxs n THR 244 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 1qxs n THR 244 Cb 0.64 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.42 1qxs n THR 244 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1qxs n GLY 245 N -0.12 2.18 3.39 1.09 0.00 -1.26 -2.10 105.19 108.38 1qxs n GLY 245 Ca 0.00 -0.86 -0.11 0.00 0.00 0.00 0.00 46.02 45.05 1qxs n GLY 245 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1qxs s MET 246 N -0.58 1.40 0.04 1.61 0.23 -0.79 -3.68 119.30 117.52 1qxs s MET 246 Ca 0.00 -1.46 0.05 0.00 -1.03 0.00 0.00 55.69 53.25 1qxs s MET 246 Cb 0.00 0.37 -0.02 0.00 -1.53 0.00 0.00 34.83 33.65 1qxs s MET 246 CO 0.00 -0.53 -0.15 0.45 -2.03 0.00 0.00 175.02 172.77 1qxs s SER 247 N -3.10 1.72 -0.31 -1.18 0.15 0.11 -1.50 113.70 109.58 1qxs s SER 247 Ca 0.31 -0.47 0.04 0.00 0.70 0.00 0.00 55.95 56.52 1qxs s SER 247 Cb 0.03 -0.11 0.09 0.00 -1.71 0.00 0.00 66.02 64.32 1qxs s SER 247 CO 0.11 0.03 0.00 -0.36 1.20 0.00 0.00 173.24 174.23 1qxs s PHE 248 N -0.87 3.57 -0.66 3.44 0.08 -0.58 0.23 117.98 123.20 1qxs s PHE 248 Ca 0.02 -2.77 -0.27 0.00 0.12 0.00 0.00 56.93 54.02 1qxs s PHE 248 Cb -0.08 -2.60 0.02 0.00 -0.57 0.00 0.00 43.02 39.79 1qxs s PHE 248 CO 0.01 -0.93 1.32 1.03 -0.10 0.00 0.00 175.22 176.55 1qxs s ARG 249 N 0.98 3.27 0.39 0.44 1.81 0.68 -2.02 118.95 124.49 1qxs s ARG 249 Ca 0.05 0.07 0.07 0.00 -1.72 0.00 0.00 55.73 54.20 1qxs s ARG 249 Cb -0.19 -4.14 0.00 0.00 -0.45 0.00 0.00 34.95 30.17 1qxs s ARG 249 CO -0.07 -2.02 0.54 0.14 -0.68 0.00 0.00 175.30 173.21 1qxs s VAL 250 N 5.79 3.47 -0.70 3.52 -7.23 -0.56 -1.73 120.40 122.96 1qxs s VAL 250 Ca 0.42 -0.96 -0.24 0.00 -1.81 0.00 0.00 61.98 59.39 1qxs s VAL 250 Cb -0.09 -3.19 -0.20 0.00 0.56 0.00 0.00 36.38 33.47 1qxs s VAL 250 CO 0.20 -0.08 1.87 -2.65 -0.31 0.00 0.00 175.10 174.13 1qxs n PRO 251 N -1.80 1.14 -3.72 4.82 -0.02 -1.26 -2.88 135.00 131.27 1qxs n PRO 251 Ca 0.04 -1.78 -0.12 0.00 -2.02 0.00 0.00 63.50 59.62 1qxs n PRO 251 Cb 0.59 -3.03 -0.13 0.00 -0.02 0.00 0.00 33.50 30.91 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 7.15 -0.04 -0.24 3.45 -4.23 -1.26 -5.01 115.64 115.46 1qxs s THR 252 Ca 0.63 0.14 0.27 0.00 -1.18 0.00 0.00 61.69 61.54 1qxs s THR 252 Cb 0.11 -0.41 0.28 0.00 1.34 0.00 0.00 72.50 73.82 1qxs s THR 252 CO 0.17 0.06 1.80 1.55 -0.54 0.00 0.00 174.62 177.66 1qxs h PRO 253 N 7.15 0.00 -1.69 3.99 0.13 -1.89 -2.27 132.00 137.42 1qxs h PRO 253 Ca -0.40 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.81 1qxs h PRO 253 Cb 1.16 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.08 1qxs h PRO 253 CO 0.36 0.00 0.52 0.34 -0.23 0.00 0.00 178.00 178.99 1qxs s ASP 254 N -4.55 -0.39 0.00 1.44 2.15 -1.26 -4.80 116.67 109.27 1qxs s ASP 254 Ca 0.02 0.36 0.00 0.00 0.43 0.00 0.00 52.55 53.36 1qxs s ASP 254 Cb 0.09 0.33 0.00 0.00 -0.30 0.00 0.00 42.92 43.04 1qxs s ASP 254 CO 0.39 -0.40 0.00 0.52 -0.17 0.00 0.00 175.17 175.51 1qxs n VAL 255 N 0.59 -0.61 -4.55 1.11 0.31 -1.26 -4.89 118.33 109.03 1qxs n VAL 255 Ca -0.10 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 63.97 1qxs n VAL 255 Cb 0.58 -0.61 -0.10 0.00 -0.91 0.00 0.00 33.84 32.81 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 -0.22 3.05 -0.07 4.52 0.01 0.67 -3.89 113.70 117.77 1qxs s SER 256 Ca 0.00 -1.50 -0.03 0.00 1.31 0.00 0.00 55.95 55.73 1qxs s SER 256 Cb 0.00 0.11 0.04 0.00 0.21 0.00 0.00 66.02 66.38 1qxs s SER 256 CO 0.00 -0.70 0.14 0.54 0.41 0.00 0.00 173.24 173.63 1qxs s VAL 257 N -3.10 -0.08 -0.09 3.43 0.11 -1.14 -1.84 120.40 117.69 1qxs s VAL 257 Ca 0.28 0.21 -0.19 0.00 -2.93 0.00 0.00 61.98 59.35 1qxs s VAL 257 Cb 0.06 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.63 1qxs s VAL 257 CO 0.14 0.09 0.53 -0.69 -3.33 0.00 0.00 175.10 171.83 1qxs s VAL 258 N 1.35 5.12 -0.70 2.04 1.01 0.30 -0.90 120.40 128.61 1qxs s VAL 258 Ca -0.07 1.08 0.01 0.00 0.00 0.00 0.00 61.98 63.00 1qxs s VAL 258 Cb -0.12 -3.87 0.17 0.00 0.00 0.00 0.00 36.38 32.57 1qxs s VAL 258 CO -0.06 0.34 0.51 -0.62 0.00 0.00 0.00 175.10 175.27 1qxs s ASP 259 N 0.47 5.13 -0.21 3.32 3.68 0.17 -1.90 116.67 127.33 1qxs s ASP 259 Ca 0.29 -3.42 -0.22 0.00 2.13 0.00 0.00 52.55 51.33 1qxs s ASP 259 Cb -0.16 -1.76 -0.02 0.00 -1.45 0.00 0.00 42.92 39.53 1qxs s ASP 259 CO 0.13 -0.21 0.69 -0.22 0.13 0.00 0.00 175.17 175.69 1qxs s LEU 260 N -0.87 4.13 -0.07 -1.34 2.96 -0.26 -2.45 118.68 120.79 1qxs s LEU 260 Ca 0.22 0.90 0.02 0.00 -0.22 0.00 0.00 54.13 55.05 1qxs s LEU 260 Cb -0.13 -2.98 -0.02 0.00 0.50 0.00 0.00 46.19 43.55 1qxs s LEU 260 CO -0.09 -0.34 -0.12 -0.89 -1.32 0.00 0.00 176.35 173.60 1qxs s THR 261 N 2.15 3.26 0.17 3.68 2.01 -0.46 0.03 115.64 126.48 1qxs s THR 261 Ca 0.31 -0.63 -0.24 0.00 0.31 0.00 0.00 61.69 61.43 1qxs s THR 261 Cb -0.16 -2.31 0.06 0.00 0.01 0.00 0.00 72.50 70.09 1qxs s THR 261 CO 0.10 0.58 0.87 0.72 -0.69 0.00 0.00 174.62 176.20 1qxs s PHE 262 N -0.51 -0.18 -0.14 4.92 -0.71 -0.36 -0.47 117.98 120.52 1qxs s PHE 262 Ca 0.07 -0.15 0.01 0.00 -1.04 0.00 0.00 56.93 55.82 1qxs s PHE 262 Cb -0.12 0.65 -0.00 0.00 -1.21 0.00 0.00 43.02 42.34 1qxs s PHE 262 CO 0.02 -0.92 -0.17 0.95 -1.34 0.00 0.00 175.22 173.76 1qxs s THR 263 N -3.46 2.56 0.84 -4.49 -4.23 -0.32 -0.45 115.64 106.08 1qxs s THR 263 Ca 0.11 -0.82 -0.11 0.00 -1.18 0.00 0.00 61.69 59.69 1qxs s THR 263 Cb -0.03 -2.06 0.09 0.00 1.34 0.00 0.00 72.50 71.85 1qxs s THR 263 CO 0.02 0.53 1.09 0.00 -0.54 0.00 0.00 174.62 175.72 1qxs s ALA 264 N 0.66 1.89 -0.53 3.99 0.00 0.75 -1.43 121.76 127.09 1qxs s ALA 264 Ca -0.09 0.09 0.25 0.00 0.00 0.00 0.00 51.96 52.21 1qxs s ALA 264 Cb -0.16 -3.23 0.61 0.00 0.00 0.00 0.00 23.12 20.34 1qxs s ALA 264 CO 0.02 -2.07 1.70 0.00 0.00 0.00 0.00 175.76 175.41 1qxs h ALA 265 N -1.35 1.00 -2.54 0.00 0.00 -1.09 -3.40 119.26 111.88 1qxs h ALA 265 Ca -0.47 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.17 1qxs h ALA 265 Cb 1.26 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.90 1qxs h ALA 265 CO 0.53 0.00 -0.61 -0.98 0.00 0.00 0.00 179.25 178.19 1qxs s ARG 266 N -3.19 1.28 -0.23 0.00 1.70 -1.22 -5.02 118.95 112.26 1qxs s ARG 266 Ca 0.08 -1.68 -0.29 0.00 -0.47 0.00 0.00 55.73 53.37 1qxs s ARG 266 Cb 0.08 0.15 -0.01 0.00 -0.57 0.00 0.00 34.95 34.60 1qxs s ARG 266 CO 0.62 -0.38 1.33 -0.51 -1.08 0.00 0.00 175.30 175.28 1qxs s ASP 267 N -3.21 6.74 0.00 -2.89 1.11 -1.26 -4.69 116.67 112.48 1qxs s ASP 267 Ca 0.39 1.47 0.00 0.00 0.18 0.00 0.00 52.55 54.59 1qxs s ASP 267 Cb 0.07 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.52 1qxs s ASP 267 CO 0.13 -0.97 0.00 1.07 1.18 0.00 0.00 175.17 176.58 1qxs n THR 268 N 5.89 0.00 -3.88 -1.27 5.66 -0.07 -5.04 114.28 115.58 1qxs n THR 268 Ca 0.15 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 61.04 1qxs n THR 268 Cb 0.46 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.14 1qxs n THR 268 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1qxs s SER 269 N 0.58 0.06 0.54 1.09 1.04 -1.26 -4.00 113.70 111.74 1qxs s SER 269 Ca 0.00 -0.30 0.19 0.00 0.48 0.00 0.00 55.95 56.32 1qxs s SER 269 Cb 0.00 0.22 1.41 0.00 0.10 0.00 0.00 66.02 67.75 1qxs s SER 269 CO 0.00 -0.43 2.18 -0.29 0.98 0.00 0.00 173.24 175.68 1qxs h ILE 270 N 4.02 0.88 -0.19 -1.02 6.09 -1.94 -0.95 117.51 124.41 1qxs h ILE 270 Ca -0.31 0.00 -0.05 0.00 -1.37 0.00 0.00 64.86 63.13 1qxs h ILE 270 Cb 1.19 1.00 -0.01 0.00 0.47 0.00 0.00 36.82 39.47 1qxs h ILE 270 CO 0.44 0.00 -0.06 1.56 -3.07 0.00 0.00 178.15 177.01 1qxs h GLN 271 N 0.00 0.37 -0.59 2.19 7.50 -1.97 0.32 115.11 122.93 1qxs h GLN 271 Ca 0.00 -0.15 -0.02 0.00 0.50 0.00 0.00 58.65 58.98 1qxs h GLN 271 Cb 0.00 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.49 1qxs h GLN 271 CO -0.00 0.65 0.29 1.49 -1.50 0.00 0.00 178.83 179.76 1qxs h GLU 272 N 0.07 0.83 -0.07 1.46 4.81 -1.64 -0.23 114.58 119.81 1qxs h GLU 272 Ca 0.04 -0.10 -0.17 0.00 -0.13 0.00 0.00 59.36 59.00 1qxs h GLU 272 Cb 0.52 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.75 1qxs h GLU 272 CO 0.02 0.64 -0.63 0.82 -0.73 0.00 0.00 179.01 179.14 1qxs h ILE 273 N 0.83 1.36 0.08 2.32 2.04 -1.05 -1.78 117.51 121.31 1qxs h ILE 273 Ca 0.21 -1.96 0.02 0.00 1.00 0.00 0.00 64.86 64.13 1qxs h ILE 273 Cb 0.08 2.29 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 1qxs h ILE 273 CO -0.03 0.59 -0.27 -0.78 0.00 0.00 0.00 178.15 177.66 1qxs h ASP 274 N 0.15 -0.78 0.32 1.72 3.58 0.04 -0.44 116.42 121.01 1qxs h ASP 274 Ca -0.06 0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.47 1qxs h ASP 274 Cb 1.29 0.31 -0.00 0.00 1.72 0.00 0.00 39.33 42.64 1qxs h ASP 274 CO 0.13 -0.35 -0.11 0.00 -2.88 0.00 0.00 179.24 176.03 1qxs h ALA 275 N 0.29 1.32 -0.00 -0.78 0.00 -1.10 -2.10 119.26 116.88 1qxs h ALA 275 Ca 0.04 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.64 1qxs h ALA 275 Cb 0.51 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1qxs h ALA 275 CO -0.18 0.13 -0.90 0.00 0.00 0.00 0.00 179.25 178.30 1qxs h ALA 276 N 1.89 0.44 -0.14 0.00 0.00 -0.35 -2.84 119.26 118.26 1qxs h ALA 276 Ca -0.00 -0.71 -0.11 0.00 0.00 0.00 0.00 54.91 54.09 1qxs h ALA 276 Cb 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1qxs h ALA 276 CO 0.01 0.85 -0.36 -0.07 0.00 0.00 0.00 179.25 179.69 1qxs h LEU 277 N 0.19 0.56 -0.26 0.00 3.38 -0.44 -2.17 115.31 116.56 1qxs h LEU 277 Ca -0.06 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.30 1qxs h LEU 277 Cb 1.53 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 1qxs h LEU 277 CO 0.15 1.04 0.05 0.11 0.09 0.00 0.00 178.44 179.87 1qxs h LYS 278 N 0.10 0.43 -0.84 1.13 1.57 -1.59 -1.47 116.57 115.90 1qxs h LYS 278 Ca -0.00 -0.11 0.09 0.00 -1.87 0.00 0.00 60.65 58.75 1qxs h LYS 278 Cb 0.97 -0.05 -0.07 0.00 0.08 0.00 0.00 32.23 33.16 1qxs h LYS 278 CO 0.08 0.55 0.50 -0.09 -0.57 0.00 0.00 179.45 179.91 1qxs h ARG 279 N 0.24 0.83 -0.29 3.15 2.43 -1.56 -1.83 114.38 117.35 1qxs h ARG 279 Ca 0.08 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 1qxs h ARG 279 Cb 0.32 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 1qxs h ARG 279 CO 0.00 0.55 -0.26 0.00 -1.51 0.00 0.00 179.97 178.75 1qxs h ALA 280 N 1.44 1.00 0.00 2.80 0.00 -1.08 -2.59 119.26 120.82 1qxs h ALA 280 Ca 0.40 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1qxs h ALA 280 Cb 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1qxs h ALA 280 CO -0.23 0.59 0.00 0.66 0.00 0.00 0.00 179.25 180.28 1qxs h SER 281 N 0.51 0.00 0.45 0.00 4.64 -0.47 0.99 113.55 119.67 1qxs h SER 281 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1qxs h SER 281 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1qxs h SER 281 CO 0.06 0.00 -0.77 0.29 -0.87 0.00 0.00 176.83 175.53 1qxs n LYS 282 N -2.99 0.14 0.00 4.77 5.02 -0.88 -3.38 118.16 120.84 1qxs n LYS 282 Ca 0.01 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1qxs n LYS 282 Cb 0.33 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 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 -1.73 0.00 0.45 -0.18 -2.24 -0.84 -4.80 114.28 104.93 1qxs n THR 283 Ca 0.04 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.92 1qxs n THR 283 Cb 0.38 0.00 0.42 0.00 -2.10 0.00 0.00 70.33 69.03 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 0.50 -0.00 4.78 4.11 -1.19 -2.29 117.16 123.06 1qxs n TYR 284 Ca 0.00 0.19 0.07 0.00 -0.00 0.00 0.00 57.90 58.16 1qxs n TYR 284 Cb 0.00 -0.81 0.16 0.00 -0.00 0.00 0.00 39.34 38.69 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 -1.95 2.33 -1.66 -3.48 2.81 0.28 -4.98 117.12 110.48 1qxs n MET 285 Ca 0.03 -1.97 -0.45 0.00 -1.81 0.00 0.00 57.70 53.51 1qxs n MET 285 Cb 0.21 -1.32 -0.02 0.00 -0.71 0.00 0.00 33.22 31.38 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 0.79 1.90 0.00 0.03 4.81 -0.97 0.59 118.16 125.31 1qxs n LYS 286 Ca 0.13 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.24 1qxs n LYS 286 Cb 0.44 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.22 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 1.72 2.47 0.13 3.14 0.00 -1.26 -4.68 105.19 106.71 1qxs n GLY 287 Ca 0.10 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 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 1.53 -4.21 -0.61 2.08 0.02 -4.36 119.36 113.82 1qxs n ILE 288 Ca 0.00 -0.38 -0.34 0.00 0.56 0.00 0.00 62.75 62.59 1qxs n ILE 288 Cb 0.00 -1.84 -0.12 0.00 -0.75 0.00 0.00 39.64 36.93 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 -7.42 3.37 0.00 1.39 2.96 0.20 -0.97 118.68 118.21 1qxs s LEU 289 Ca -0.37 -0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.44 1qxs s LEU 289 Cb 0.13 -1.83 -0.00 0.00 0.50 0.00 0.00 46.19 44.98 1qxs s LEU 289 CO 0.52 0.13 0.04 0.61 -1.32 0.00 0.00 176.35 176.34 1qxs n GLY 290 N 3.79 3.53 3.53 7.98 0.00 0.14 -4.46 105.19 119.70 1qxs n GLY 290 Ca -0.17 -2.27 -0.12 0.00 0.00 0.00 0.00 46.02 43.46 1qxs n GLY 290 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1qxs s TYR 291 N -2.73 -0.46 0.14 1.61 1.13 -1.26 -0.69 117.35 115.09 1qxs s TYR 291 Ca 0.06 0.63 0.04 0.00 -1.41 0.00 0.00 57.07 56.39 1qxs s TYR 291 Cb 0.00 0.47 -0.04 0.00 -1.10 0.00 0.00 41.96 41.29 1qxs s TYR 291 CO 0.04 -0.52 -0.10 -0.08 -2.51 0.00 0.00 175.55 172.38 1qxs s THR 292 N -1.93 1.16 -0.01 -3.49 -1.32 0.12 -4.86 115.64 105.31 1qxs s THR 292 Ca -0.02 -1.99 0.02 0.00 -1.21 0.00 0.00 61.69 58.49 1qxs s THR 292 Cb -0.01 -1.77 0.03 0.00 -1.51 0.00 0.00 72.50 69.25 1qxs s THR 292 CO -0.00 -0.70 0.81 -0.90 -2.21 0.00 0.00 174.62 171.61 1qxs n ASP 293 N -0.06 0.96 -4.97 8.08 5.68 -1.26 -0.45 116.55 124.53 1qxs n ASP 293 Ca -0.11 -1.70 -0.21 0.00 -0.50 0.00 0.00 54.79 52.27 1qxs n ASP 293 Cb 0.60 -0.07 -0.01 0.00 -1.14 0.00 0.00 41.12 40.51 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 -0.66 3.23 -1.36 0.11 2.02 -1.26 -4.66 118.70 116.13 1qxs s GLU 294 Ca 0.03 -0.77 -0.14 0.00 0.02 0.00 0.00 54.97 54.11 1qxs s GLU 294 Cb 0.03 -2.77 -0.01 0.00 0.10 0.00 0.00 34.13 31.48 1qxs s GLU 294 CO 0.00 0.10 2.28 0.39 0.02 0.00 0.00 175.26 178.06 1qxs n GLU 295 N -1.68 2.74 -3.11 1.61 -0.58 -1.26 -4.86 120.64 113.50 1qxs n GLU 295 Ca -0.03 -2.39 -0.29 0.00 -0.42 0.00 0.00 57.16 54.02 1qxs n GLU 295 Cb 0.57 -3.14 -0.03 0.00 -0.57 0.00 0.00 31.44 28.27 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 1.70 3.95 0.30 -4.62 1.43 -1.26 -5.11 118.68 115.07 1qxs s LEU 296 Ca 0.51 0.92 0.08 0.00 -1.03 0.00 0.00 54.13 54.62 1qxs s LEU 296 Cb 0.14 -3.77 -0.06 0.00 0.03 0.00 0.00 46.19 42.54 1qxs s LEU 296 CO -0.05 -0.29 -0.09 0.68 0.23 0.00 0.00 176.35 176.83 1qxs s VAL 297 N -2.21 1.95 0.30 -1.59 -7.23 -1.26 -5.04 120.40 105.31 1qxs s VAL 297 Ca 0.48 -2.18 -0.00 0.00 -1.81 0.00 0.00 61.98 58.46 1qxs s VAL 297 Cb -0.10 -2.51 0.40 0.00 0.56 0.00 0.00 36.38 34.73 1qxs s VAL 297 CO 0.30 -0.28 1.58 0.77 -0.31 0.00 0.00 175.10 177.17 1qxs h SER 298 N 2.18 -0.49 -0.16 4.85 4.64 -1.97 0.53 113.55 123.14 1qxs h SER 298 Ca -0.41 0.27 0.05 0.00 -0.47 0.00 0.00 61.79 61.23 1qxs h SER 298 Cb 1.24 0.47 -0.01 0.00 -0.31 0.00 0.00 62.40 63.80 1qxs h SER 298 CO 0.68 -0.32 0.12 0.00 -0.87 0.00 0.00 176.83 176.43 1qxs h ALA 299 N 1.94 2.12 0.00 5.18 0.00 -1.97 -0.07 119.26 126.46 1qxs h ALA 299 Ca 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1qxs h ALA 299 Cb 1.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1qxs h ALA 299 CO -0.89 -0.20 0.00 -0.44 0.00 0.00 0.00 179.25 177.72 1qxs h ASP 300 N 0.00 0.00 0.03 0.00 3.32 -1.29 -1.97 116.42 116.51 1qxs h ASP 300 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1qxs h ASP 300 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1qxs h ASP 300 CO -0.00 0.00 -0.15 0.49 -1.72 0.00 0.00 179.24 177.86 1qxs n PHE 301 N -2.67 0.00 -1.83 4.55 3.01 -0.04 -4.87 117.46 115.61 1qxs n PHE 301 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.04 1qxs n PHE 301 Cb 0.20 -0.02 -0.03 0.00 -0.01 0.00 0.00 39.48 39.62 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 -2.20 2.65 0.00 4.37 1.01 -0.74 -1.94 121.20 124.35 1qxs s ILE 302 Ca 0.28 0.26 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1qxs s ILE 302 Cb 0.20 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.50 1qxs s ILE 302 CO 0.41 0.01 0.00 0.59 0.00 0.00 0.00 174.94 175.95 1qxs n ASN 303 N 5.12 -2.33 -4.71 3.58 3.02 -1.26 -5.01 115.26 113.66 1qxs n ASN 303 Ca 0.16 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 1qxs n ASN 303 Cb 0.39 -0.69 -0.03 0.00 -0.61 0.00 0.00 39.78 38.83 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 -2.27 7.20 0.00 6.41 -1.08 -0.82 -4.94 116.67 121.18 1qxs s ASP 304 Ca 0.00 1.88 0.25 0.00 -0.52 0.00 0.00 52.55 54.17 1qxs s ASP 304 Cb 0.00 -2.58 0.73 0.00 -1.46 0.00 0.00 42.92 39.61 1qxs s ASP 304 CO 0.00 -0.38 1.56 -0.46 0.52 0.00 0.00 175.17 176.41 1qxs n ASN 305 N 3.83 2.08 -4.76 -0.34 2.04 -1.26 -3.72 115.26 113.13 1qxs n ASN 305 Ca 0.07 -1.70 -0.31 0.00 -0.44 0.00 0.00 54.58 52.20 1qxs n ASN 305 Cb 0.48 -0.04 0.10 0.00 -2.53 0.00 0.00 39.78 37.79 1qxs n ASN 305 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1qxs s ARG 306 N -1.93 2.07 0.23 -3.83 3.00 -1.26 -4.35 118.95 112.88 1qxs s ARG 306 Ca 0.35 1.01 0.24 0.00 0.00 0.00 0.00 55.73 57.33 1qxs s ARG 306 Cb 0.20 -1.89 0.45 0.00 0.00 0.00 0.00 34.95 33.72 1qxs s ARG 306 CO 0.31 -1.73 1.50 0.77 0.00 0.00 0.00 175.30 176.15 1qxs h SER 307 N -1.19 0.00 -2.99 0.23 0.02 -1.25 -3.40 113.55 104.97 1qxs h SER 307 Ca -0.45 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 60.44 1qxs h SER 307 Cb 1.24 0.00 -0.22 0.00 0.14 0.00 0.00 62.40 63.57 1qxs h SER 307 CO 0.53 0.03 -0.02 -0.55 -1.14 0.00 0.00 176.83 175.69 1qxs s SER 308 N -4.91 -0.91 -0.46 3.07 0.15 -1.02 -3.57 113.70 106.05 1qxs s SER 308 Ca 0.07 1.45 0.03 0.00 0.70 0.00 0.00 55.95 58.21 1qxs s SER 308 Cb 0.11 1.36 0.12 0.00 -1.71 0.00 0.00 66.02 65.89 1qxs s SER 308 CO 0.68 -0.23 0.19 -0.63 1.20 0.00 0.00 173.24 174.45 1qxs s ILE 309 N 1.66 2.57 0.08 6.45 -1.09 0.08 0.25 121.20 131.21 1qxs s ILE 309 Ca -0.10 -2.90 -0.34 0.00 -2.23 0.00 0.00 60.65 55.09 1qxs s ILE 309 Cb -0.06 -2.81 -0.13 0.00 -1.58 0.00 0.00 42.46 37.88 1qxs s ILE 309 CO -0.19 -0.73 1.70 0.00 -1.23 0.00 0.00 174.94 174.50 1qxs n TYR 310 N 3.60 2.33 -3.09 3.97 9.36 0.14 -1.46 117.16 132.01 1qxs n TYR 310 Ca 0.05 0.13 -0.45 0.00 3.32 0.00 0.00 57.90 60.95 1qxs n TYR 310 Cb 0.36 -2.60 -0.03 0.00 -0.63 0.00 0.00 39.34 36.44 1qxs n TYR 310 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1qxs s ASP 311 N 2.13 6.62 0.06 2.98 -1.08 -0.40 0.16 116.67 127.14 1qxs s ASP 311 Ca 0.84 -2.20 -0.16 0.00 -0.52 0.00 0.00 52.55 50.50 1qxs s ASP 311 Cb -0.66 -2.32 -0.06 0.00 -1.46 0.00 0.00 42.92 38.42 1qxs s ASP 311 CO 0.42 -0.89 1.27 -1.28 0.52 0.00 0.00 175.17 175.20 1qxs h SER 312 N 8.50 -0.83 -0.71 -0.34 0.87 -1.06 -2.08 113.55 117.91 1qxs h SER 312 Ca 0.08 0.10 0.12 0.00 -1.23 0.00 0.00 61.79 60.86 1qxs h SER 312 Cb 1.04 0.32 -0.09 0.00 -0.44 0.00 0.00 62.40 63.23 1qxs h SER 312 CO 0.98 -0.24 0.28 0.11 -0.53 0.00 0.00 176.83 177.43 1qxs h LYS 313 N -0.29 0.44 -0.57 2.24 1.79 -1.83 -0.50 116.57 117.85 1qxs h LYS 313 Ca 0.01 -0.03 0.01 0.00 -2.18 0.00 0.00 60.65 58.47 1qxs h LYS 313 Cb 0.33 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.85 1qxs h LYS 313 CO -0.20 0.29 0.36 0.00 -1.08 0.00 0.00 179.45 178.82 1qxs h ALA 314 N 1.50 0.73 0.51 3.86 0.00 -1.89 -0.85 119.26 123.11 1qxs h ALA 314 Ca 0.38 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.23 1qxs h ALA 314 Cb 0.52 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.11 1qxs h ALA 314 CO -0.36 0.12 -0.25 1.15 0.00 0.00 0.00 179.25 179.91 1qxs h THR 315 N 0.73 0.00 -0.52 0.00 2.02 -0.64 -2.83 112.91 111.67 1qxs h THR 315 Ca 0.22 -0.29 0.10 0.00 0.77 0.00 0.00 66.41 67.20 1qxs h THR 315 Cb -0.04 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.29 1qxs h THR 315 CO -0.07 0.00 0.03 -0.07 0.37 0.00 0.00 175.52 175.78 1qxs h LEU 316 N -0.98 -0.16 -1.91 2.58 3.38 -1.15 -1.66 115.31 115.42 1qxs h LEU 316 Ca -0.07 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1qxs h LEU 316 Cb 0.53 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1qxs h LEU 316 CO 0.12 -0.05 0.00 1.56 0.09 0.00 0.00 178.44 180.15 1qxs h GLN 317 N 0.15 0.00 -0.88 1.13 4.20 -1.24 -3.30 115.11 115.16 1qxs h GLN 317 Ca 0.26 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.41 1qxs h GLN 317 Cb 0.39 0.00 -0.42 0.00 0.30 0.00 0.00 27.48 27.75 1qxs h GLN 317 CO -0.41 0.00 -0.74 0.09 -0.67 0.00 0.00 178.83 177.10 1qxs n ASN 318 N -3.00 4.99 -4.54 1.46 3.02 -0.62 -5.04 115.26 111.53 1qxs n ASN 318 Ca -0.01 -3.75 -0.25 0.00 -0.03 0.00 0.00 54.58 50.55 1qxs n ASN 318 Cb 0.22 -0.38 -0.11 0.00 -0.61 0.00 0.00 39.78 38.90 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 -3.52 3.30 0.08 6.41 -0.87 -1.22 -4.85 114.94 114.26 1qxs s ASN 319 Ca 0.51 -1.34 -0.30 0.00 -1.57 0.00 0.00 52.86 50.16 1qxs s ASN 319 Cb 0.41 -0.28 -0.06 0.00 -0.02 0.00 0.00 41.25 41.30 1qxs s ASN 319 CO 0.00 -0.46 1.18 -0.76 -2.57 0.00 0.00 177.10 174.49 1qxs s LEU 320 N -3.61 4.39 0.08 0.60 1.43 -1.26 -4.98 118.68 115.34 1qxs s LEU 320 Ca 0.35 2.03 -0.31 0.00 -1.03 0.00 0.00 54.13 55.17 1qxs s LEU 320 Cb 0.08 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.63 1qxs s LEU 320 CO 0.16 -0.42 1.62 -2.16 0.23 0.00 0.00 176.35 175.78 1qxs s PRO 321 N 0.78 4.21 0.00 1.29 0.04 -1.26 -2.69 135.00 137.37 1qxs s PRO 321 Ca 0.57 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.92 1qxs s PRO 321 Cb -0.29 -3.53 0.00 0.00 0.04 0.00 0.00 34.50 30.72 1qxs s PRO 321 CO 0.30 -0.70 0.00 1.63 0.04 0.00 0.00 177.00 178.27 1qxs n LYS 322 N 5.32 0.00 -1.49 4.56 5.02 -1.26 -5.00 118.16 125.32 1qxs n LYS 322 Ca 0.15 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.08 1qxs n LYS 322 Cb 0.40 -2.68 0.07 0.00 -0.02 0.00 0.00 35.03 32.80 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 -2.00 0.67 -0.00 1.97 4.07 -1.09 -4.93 120.64 119.32 1qxs n GLU 323 Ca 0.00 0.27 0.00 0.00 -0.06 0.00 0.00 57.16 57.38 1qxs n GLU 323 Cb 0.00 -2.14 0.00 0.00 -0.06 0.00 0.00 31.44 29.24 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 -1.28 1.28 0.00 5.31 1.74 -1.26 -4.56 116.66 117.91 1qxs n ARG 324 Ca 0.13 -0.93 0.00 0.00 -0.77 0.00 0.00 57.85 56.28 1qxs n ARG 324 Cb 0.49 -0.71 0.00 0.00 -1.02 0.00 0.00 32.46 31.21 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 -0.21 0.00 -3.15 5.56 5.12 -1.26 -0.89 116.66 121.83 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 0.39 -0.28 -0.07 0.00 -1.16 0.00 0.00 32.46 31.34 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 -1.23 3.07 0.13 -1.55 5.36 -1.26 -0.18 117.98 122.32 1qxs s PHE 326 Ca 0.00 -0.18 0.03 0.00 -0.96 0.00 0.00 56.93 55.83 1qxs s PHE 326 Cb 0.00 -3.31 -0.04 0.00 -0.34 0.00 0.00 43.02 39.32 1qxs s PHE 326 CO 0.00 -0.88 -0.09 -0.06 -1.46 0.00 0.00 175.22 172.74 1qxs s PHE 327 N 2.70 1.13 -0.08 10.12 0.08 0.41 -4.72 117.98 127.62 1qxs s PHE 327 Ca 0.20 -0.81 0.04 0.00 0.12 0.00 0.00 56.93 56.48 1qxs s PHE 327 Cb -0.15 -0.60 -0.00 0.00 -0.57 0.00 0.00 43.02 41.70 1qxs s PHE 327 CO 0.17 -0.00 -0.22 0.21 -0.10 0.00 0.00 175.22 175.28 1qxs s LYS 328 N -3.75 2.65 -0.15 0.44 2.20 -1.26 -1.23 119.74 118.64 1qxs s LYS 328 Ca 0.15 -0.80 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 1qxs s LYS 328 Cb 0.03 -2.08 0.02 0.00 -1.51 0.00 0.00 37.83 34.29 1qxs s LYS 328 CO -0.01 0.21 -0.15 0.42 -0.36 0.00 0.00 175.35 175.45 1qxs s ILE 329 N 0.25 1.63 -0.17 5.43 1.01 0.10 -4.82 121.20 124.63 1qxs s ILE 329 Ca -0.14 -0.67 -0.08 0.00 0.00 0.00 0.00 60.65 59.76 1qxs s ILE 329 Cb -0.16 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 1qxs s ILE 329 CO 0.07 0.47 0.11 -0.69 0.00 0.00 0.00 174.94 174.89 1qxs s VAL 330 N 1.44 5.22 -0.14 2.92 1.01 -1.26 -1.10 120.40 128.50 1qxs s VAL 330 Ca 0.05 0.12 -0.06 0.00 0.00 0.00 0.00 61.98 62.08 1qxs s VAL 330 Cb -0.13 -3.35 0.06 0.00 0.00 0.00 0.00 36.38 32.96 1qxs s VAL 330 CO -0.11 0.49 0.30 -0.55 0.00 0.00 0.00 175.10 175.23 1qxs s SER 331 N 0.04 -0.09 0.82 3.32 0.15 -0.80 -1.27 113.70 115.87 1qxs s SER 331 Ca 0.08 0.67 -0.08 0.00 0.70 0.00 0.00 55.95 57.32 1qxs s SER 331 Cb -0.12 0.68 0.15 0.00 -1.71 0.00 0.00 66.02 65.02 1qxs s SER 331 CO -0.00 -0.20 1.13 0.26 1.20 0.00 0.00 173.24 175.63 1qxs s TRP 332 N 1.84 1.74 -0.30 3.44 0.52 -0.54 -0.54 118.94 125.10 1qxs s TRP 332 Ca -0.05 0.05 -0.26 0.00 0.02 0.00 0.00 56.10 55.86 1qxs s TRP 332 Cb -0.11 -3.48 0.20 0.00 -1.15 0.00 0.00 33.47 28.93 1qxs s TRP 332 CO -0.10 -2.07 1.46 1.52 0.02 0.00 0.00 176.95 177.79 1qxs s TYR 333 N -3.46 -0.02 -0.88 -1.98 1.13 -0.76 -0.74 117.35 110.64 1qxs s TYR 333 Ca 0.69 0.04 -0.21 0.00 -1.41 0.00 0.00 57.07 56.18 1qxs s TYR 333 Cb -0.05 0.50 0.09 0.00 -1.10 0.00 0.00 41.96 41.40 1qxs s TYR 333 CO 0.48 -0.01 1.17 0.34 -2.51 0.00 0.00 175.55 175.02 1qxs s ASP 334 N -0.19 6.48 0.57 -0.18 -1.08 -1.26 -0.24 116.67 120.77 1qxs s ASP 334 Ca 0.08 -1.60 0.37 0.00 -0.52 0.00 0.00 52.55 50.89 1qxs s ASP 334 Cb -0.04 -2.45 1.44 0.00 -1.46 0.00 0.00 42.92 40.40 1qxs s ASP 334 CO -0.15 -1.29 1.62 -0.55 0.52 0.00 0.00 175.17 175.32 1qxs h ASN 335 N 9.28 0.00 0.00 -0.34 -1.07 -1.89 -2.58 115.58 118.97 1qxs h ASN 335 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.42 1qxs h ASN 335 Cb 1.03 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.28 1qxs h ASN 335 CO 1.21 0.00 -0.15 -0.33 0.07 0.00 0.00 177.43 178.23 1qxs h GLU 336 N 0.00 0.00 0.22 4.14 5.08 -1.97 -3.40 114.58 118.65 1qxs h GLU 336 Ca 0.61 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.97 1qxs h GLU 336 Cb 2.75 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.97 1qxs h GLU 336 CO -0.01 0.00 -0.41 2.35 -1.00 0.00 0.00 179.01 179.94 1qxs h TRP 337 N -0.45 -1.18 0.41 4.33 2.91 -1.79 -2.88 115.95 117.31 1qxs h TRP 337 Ca 0.00 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.03 1qxs h TRP 337 Cb 0.15 0.48 -0.02 0.00 -0.51 0.00 0.00 29.16 29.27 1qxs h TRP 337 CO -0.06 -0.50 -0.34 0.78 -1.03 0.00 0.00 178.44 177.28 1qxs h GLY 338 N -0.68 -0.84 -0.22 2.65 0.00 -1.59 -2.33 103.07 100.05 1qxs h GLY 338 Ca -0.02 0.39 0.30 0.00 0.00 0.00 0.00 47.33 48.00 1qxs h GLY 338 CO -0.16 -0.30 0.75 -1.82 0.00 0.00 0.00 176.54 175.01 1qxs h TYR 339 N -0.76 0.29 -0.21 5.60 5.03 -1.73 0.42 116.97 125.61 1qxs h TYR 339 Ca -0.04 0.01 -0.17 0.00 2.58 0.00 0.00 58.73 61.11 1qxs h TYR 339 Cb 0.66 -0.08 -0.00 0.00 1.55 0.00 0.00 36.73 38.85 1qxs h TYR 339 CO -0.17 0.02 -0.56 0.77 -1.32 0.00 0.00 178.16 176.91 1qxs h SER 340 N 0.17 0.73 -0.08 -2.11 0.02 -1.20 -1.82 113.55 109.26 1qxs h SER 340 Ca 0.57 -0.40 -0.10 0.00 -0.84 0.00 0.00 61.79 61.02 1qxs h SER 340 Cb 1.88 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 64.19 1qxs h SER 340 CO -0.14 1.14 -0.26 0.45 -1.14 0.00 0.00 176.83 176.88 1qxs h HIS 341 N 0.50 0.60 -0.64 3.45 3.86 0.22 -2.78 115.15 120.36 1qxs h HIS 341 Ca 0.01 -0.13 -0.08 0.00 -1.16 0.00 0.00 60.37 59.01 1qxs h HIS 341 Cb 1.13 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 29.43 1qxs h HIS 341 CO 0.05 0.74 0.08 0.00 0.86 0.00 0.00 177.93 179.67 1qxs h ARG 342 N 0.46 1.06 -0.88 2.45 2.47 -0.75 0.87 114.38 120.07 1qxs h ARG 342 Ca 0.07 -0.29 0.06 0.00 -1.26 0.00 0.00 59.98 58.56 1qxs h ARG 342 Cb 0.70 -0.12 -0.06 0.00 -1.65 0.00 0.00 29.97 28.83 1qxs h ARG 342 CO 0.05 0.99 0.55 0.28 0.56 0.00 0.00 179.97 182.40 1qxs h VAL 343 N 0.99 1.04 -0.19 2.04 2.07 -1.07 0.63 116.25 121.76 1qxs h VAL 343 Ca 0.19 -0.34 -0.17 0.00 0.82 0.00 0.00 66.70 67.20 1qxs h VAL 343 Cb 0.45 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1qxs h VAL 343 CO 0.02 0.18 -0.56 0.58 0.02 0.00 0.00 177.57 177.81 1qxs h VAL 344 N 1.00 1.31 -0.56 2.57 2.07 -1.27 -2.07 116.25 119.30 1qxs h VAL 344 Ca 0.39 -1.78 0.04 0.00 0.82 0.00 0.00 66.70 66.17 1qxs h VAL 344 Cb 0.18 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1qxs h VAL 344 CO -0.18 0.56 0.31 0.44 0.02 0.00 0.00 177.57 178.73 1qxs h ASP 345 N 0.42 0.48 0.10 0.57 5.19 0.20 -0.85 116.42 122.53 1qxs h ASP 345 Ca -0.02 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1qxs h ASP 345 Cb 1.18 -0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.61 1qxs h ASP 345 CO 0.12 0.33 -0.05 0.25 -3.12 0.00 0.00 179.24 176.77 1qxs h LEU 346 N 0.61 -0.11 -0.30 1.55 5.85 0.26 -1.82 115.31 121.35 1qxs h LEU 346 Ca 0.24 -0.17 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1qxs h LEU 346 Cb 0.10 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1qxs h LEU 346 CO -0.14 0.10 -0.04 0.58 -0.34 0.00 0.00 178.44 178.60 1qxs h VAL 347 N -0.33 0.74 -0.61 1.05 2.07 -1.16 0.34 116.25 118.35 1qxs h VAL 347 Ca -0.01 -0.01 0.09 0.00 0.82 0.00 0.00 66.70 67.58 1qxs h VAL 347 Cb 0.27 0.69 -0.07 0.00 -1.52 0.00 0.00 31.29 30.67 1qxs h VAL 347 CO 0.02 0.01 0.25 0.03 0.02 0.00 0.00 177.57 177.90 1qxs h ARG 348 N 0.04 0.43 0.17 1.57 3.08 -1.11 0.26 114.38 118.82 1qxs h ARG 348 Ca 0.14 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.16 1qxs h ARG 348 Cb 0.21 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1qxs h ARG 348 CO -0.28 0.29 -0.09 1.25 -1.07 0.00 0.00 179.97 180.07 1qxs h HIS 349 N 0.44 -0.24 -0.93 3.04 2.76 -0.49 -2.07 115.15 117.67 1qxs h HIS 349 Ca 0.30 -0.00 0.11 0.00 -2.20 0.00 0.00 60.37 58.58 1qxs h HIS 349 Cb 0.35 0.08 -0.07 0.00 1.55 0.00 0.00 27.41 29.32 1qxs h HIS 349 CO -0.15 -0.15 0.60 0.52 -1.30 0.00 0.00 177.93 177.45 1qxs h MET 350 N -0.24 0.88 -0.21 5.26 2.86 -0.00 -1.14 114.93 122.33 1qxs h MET 350 Ca -0.02 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1qxs h MET 350 Cb 0.20 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1qxs h MET 350 CO 0.03 0.58 0.12 0.00 1.06 0.00 0.00 176.91 178.70 1qxs h ALA 351 N 1.55 0.27 -0.44 6.32 0.00 0.00 0.10 119.26 127.06 1qxs h ALA 351 Ca 0.45 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 1qxs h ALA 351 Cb 0.47 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1qxs h ALA 351 CO -0.21 -0.21 0.17 0.66 0.00 0.00 0.00 179.25 179.66 1qxs h SER 352 N 0.24 0.62 0.66 0.00 4.64 -0.65 -0.40 113.55 118.67 1qxs h SER 352 Ca 0.07 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.20 1qxs h SER 352 Cb 0.04 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1qxs h SER 352 CO -0.01 0.62 -0.08 0.11 -0.87 0.00 0.00 176.83 176.60 1qxs h LYS 353 N 0.57 0.00 0.00 4.77 1.79 -1.02 -0.80 116.57 121.88 1qxs h LYS 353 Ca 0.15 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.44 1qxs h LYS 353 Cb 0.20 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 1qxs h LYS 353 CO -0.01 0.08 -1.22 -0.44 -1.08 0.00 0.00 179.45 176.79 1qxs h ASP 354 N 0.00 0.00 1.21 0.86 3.45 -0.31 -3.13 116.42 118.49 1qxs h ASP 354 Ca -0.00 0.00 -0.13 0.00 0.43 0.00 0.00 57.03 57.33 1qxs h ASP 354 Cb 0.44 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.19 1qxs h ASP 354 CO 0.01 0.68 -0.61 0.03 -1.57 0.00 0.00 179.24 177.78 1qxs h ARG 355 N 0.00 0.00 -0.01 3.56 -0.00 -0.34 -3.25 114.38 114.34 1qxs h ARG 355 Ca -0.13 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.35 1qxs h ARG 355 Cb 1.63 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.60 1qxs h ARG 355 CO 0.07 0.61 -0.25 0.43 0.00 0.00 0.00 179.97 180.83 1qxs n SER 356 N -3.34 1.64 0.07 7.04 7.64 -0.38 -3.21 113.62 123.09 1qxs n SER 356 Ca 0.01 -1.32 -0.22 0.00 1.01 0.00 0.00 58.87 58.35 1qxs n SER 356 Cb 0.74 0.20 -0.15 0.00 -1.01 0.00 0.00 64.21 63.99 1qxs n SER 356 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1qxs h ALA 357 N 3.99 -0.04 -0.55 -0.43 0.00 -1.57 -3.30 119.26 117.36 1qxs h ALA 357 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 54.05 1qxs h ALA 357 Cb 0.64 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1qxs h ALA 357 CO 0.00 0.61 0.00 2.89 0.00 0.00 0.00 179.25 182.75 1qxs n ARG 358 N -3.93 2.56 0.00 0.00 1.85 -1.25 -5.13 116.66 110.76 1qxs n ARG 358 Ca -0.18 -2.40 0.00 0.00 -1.00 0.00 0.00 57.85 54.27 1qxs n ARG 358 Cb 0.94 -1.53 0.00 0.00 -1.05 0.00 0.00 32.46 30.81 1qxs n ARG 358 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09