#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h9f n GLN 2 N 0.00 0.14 -3.64 -0.14 1.13 -1.26 -5.10 117.38 108.51 1h9f n GLN 2 Ca 0.00 0.00 -0.06 0.00 -1.94 0.00 0.00 57.00 55.00 1h9f n GLN 2 Cb 0.00 -0.67 -0.07 0.00 0.11 0.00 0.00 30.24 29.61 1h9f n GLN 2 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1h9f s GLU 3 N -1.35 0.60 0.56 -1.09 0.41 -1.26 -5.13 118.70 111.44 1h9f s GLU 3 Ca 0.00 0.99 0.00 0.00 -0.41 0.00 0.00 54.97 55.55 1h9f s GLU 3 Cb 0.00 0.14 0.00 0.00 -1.78 0.00 0.00 34.13 32.49 1h9f s GLU 3 CO 0.00 -0.12 0.00 -0.25 -0.49 0.00 0.00 175.26 174.40 1h9f n ASP 4 N 3.89 -1.56 0.08 -0.19 8.00 -1.26 -4.69 116.55 120.82 1h9f n ASP 4 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.31 1h9f n ASP 4 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 1h9f n ASP 4 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1h9f n LYS 5 N -0.50 0.00 -0.69 -1.24 3.00 -1.26 -4.23 118.16 113.23 1h9f n LYS 5 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.24 1h9f n LYS 5 Cb 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 35.03 34.72 1h9f n LYS 5 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1h9f n ASP 6 N -3.44 5.69 -0.08 3.14 5.75 -1.18 -4.32 116.55 122.11 1h9f n ASP 6 Ca 0.00 -2.63 -0.15 0.00 -0.01 0.00 0.00 54.79 52.01 1h9f n ASP 6 Cb 0.03 -1.14 -0.10 0.00 -1.03 0.00 0.00 41.12 38.87 1h9f n ASP 6 CO 0.00 0.00 0.00 -2.24 -0.11 0.00 0.00 177.20 174.85 1h9f h ASP 7 N 1.40 0.00 -1.37 -1.12 2.03 -1.86 -3.47 116.42 112.03 1h9f h ASP 7 Ca 0.11 -0.66 -0.11 0.00 -0.73 0.00 0.00 57.03 55.65 1h9f h ASP 7 Cb 1.01 0.00 0.07 0.00 -0.83 0.00 0.00 39.33 39.58 1h9f h ASP 7 CO 0.27 1.10 -0.05 0.00 -1.03 0.00 0.00 179.24 179.53 1h9f n LEU 8 N -4.57 0.00 -4.47 0.15 -0.00 -1.26 -4.78 117.00 102.08 1h9f n LEU 8 Ca -0.17 -0.26 -0.44 0.00 -0.00 0.00 0.00 56.01 55.14 1h9f n LEU 8 Cb 0.49 -0.44 -0.02 0.00 -0.00 0.00 0.00 43.42 43.44 1h9f n LEU 8 CO 0.24 -1.95 1.11 -1.81 -0.00 0.00 0.00 177.39 174.98 1h9f s ASP 9 N -1.84 6.69 0.00 1.45 1.11 -1.26 -4.81 116.67 118.01 1h9f s ASP 9 Ca 0.20 -2.15 0.11 0.00 0.18 0.00 0.00 52.55 50.89 1h9f s ASP 9 Cb -0.04 -2.42 0.52 0.00 1.07 0.00 0.00 42.92 42.06 1h9f s ASP 9 CO 0.17 -1.06 1.29 0.55 1.18 0.00 0.00 175.17 177.30 1h9f n VAL 10 N 5.51 0.93 -0.08 -1.27 3.14 -1.26 -1.19 118.33 124.09 1h9f n VAL 10 Ca 0.27 0.23 -0.17 0.00 -2.96 0.00 0.00 64.34 61.72 1h9f n VAL 10 Cb 0.48 -1.05 -0.06 0.00 -1.06 0.00 0.00 33.84 32.15 1h9f n VAL 10 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 1h9f n THR 11 N -1.37 0.93 0.21 1.55 5.66 -1.26 -4.11 114.28 115.89 1h9f n THR 11 Ca 0.04 -0.26 0.08 0.00 -3.05 0.00 0.00 64.05 60.86 1h9f n THR 11 Cb 0.10 -1.60 0.43 0.00 -1.55 0.00 0.00 70.33 67.72 1h9f n THR 11 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 1h9f h GLU 12 N -0.49 0.00 -4.15 1.09 -0.00 -1.92 -3.42 114.58 105.69 1h9f h GLU 12 Ca -0.42 0.00 -0.40 0.00 -0.00 0.00 0.00 59.36 58.54 1h9f h GLU 12 Cb 1.42 0.00 0.14 0.00 -0.00 0.00 0.00 28.75 30.31 1h9f h GLU 12 CO -0.22 0.29 -1.02 1.47 -0.00 0.00 0.00 179.01 179.53 1h9f n LEU 13 N -3.53 -3.27 0.00 3.06 -0.00 -0.34 -4.92 117.00 108.00 1h9f n LEU 13 Ca -0.00 0.31 -0.16 0.00 -0.00 0.00 0.00 56.01 56.15 1h9f n LEU 13 Cb 0.44 -0.56 0.12 0.00 -0.00 0.00 0.00 43.42 43.41 1h9f n LEU 13 CO 0.35 -3.70 0.46 0.35 -0.00 0.00 0.00 177.39 174.84 1h9f n THR 14 N -1.35 0.00 -0.10 1.47 -2.24 -1.26 -4.96 114.28 105.84 1h9f n THR 14 Ca 0.02 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.18 1h9f n THR 14 Cb 0.35 -1.64 -0.05 0.00 -2.10 0.00 0.00 70.33 66.90 1h9f n THR 14 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1h9f n ASN 15 N -3.56 1.92 0.07 3.42 0.23 -1.26 -3.43 115.26 112.65 1h9f n ASN 15 Ca 0.09 0.38 0.06 0.00 -0.53 0.00 0.00 54.58 54.58 1h9f n ASN 15 Cb 0.32 -0.78 0.30 0.00 -2.08 0.00 0.00 39.78 37.53 1h9f n ASN 15 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 1h9f n GLU 16 N -4.44 0.07 -0.05 -3.83 2.13 -1.26 -2.48 120.64 110.79 1h9f n GLU 16 Ca -0.22 0.51 -0.02 0.00 0.66 0.00 0.00 57.16 58.09 1h9f n GLU 16 Cb 0.56 -1.70 -0.11 0.00 0.27 0.00 0.00 31.44 30.46 1h9f n GLU 16 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1h9f n ASP 17 N -1.85 1.65 0.14 4.31 8.00 -1.26 -4.40 116.55 123.14 1h9f n ASP 17 Ca 0.00 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.63 1h9f n ASP 17 Cb 0.06 1.13 0.35 0.00 -0.02 0.00 0.00 41.12 42.64 1h9f n ASP 17 CO 0.00 0.00 0.00 0.17 -0.39 0.00 0.00 177.20 176.98 1h9f h LEU 18 N 0.00 0.00 -0.29 0.64 8.10 -1.50 -3.28 115.31 118.98 1h9f h LEU 18 Ca -0.24 0.00 0.07 0.00 0.11 0.00 0.00 57.88 57.82 1h9f h LEU 18 Cb 1.43 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 41.57 1h9f h LEU 18 CO 0.01 0.00 -0.28 -0.07 -4.11 0.00 0.00 178.44 173.99 1h9f h LEU 19 N 0.00 -0.92 -1.32 0.17 3.38 -1.73 0.87 115.31 115.76 1h9f h LEU 19 Ca 0.00 0.16 0.16 0.00 0.09 0.00 0.00 57.88 58.29 1h9f h LEU 19 Cb 0.79 0.43 -0.07 0.00 0.09 0.00 0.00 40.66 41.90 1h9f h LEU 19 CO 0.00 -0.31 0.58 -0.78 0.09 0.00 0.00 178.44 178.02 1h9f h ASP 20 N -0.27 0.60 -0.73 -0.43 1.82 -1.85 0.59 116.42 116.16 1h9f h ASP 20 Ca 0.15 0.04 0.03 0.00 -0.39 0.00 0.00 57.03 56.86 1h9f h ASP 20 Cb 0.50 -0.07 -0.04 0.00 0.68 0.00 0.00 39.33 40.40 1h9f h ASP 20 CO -0.44 0.29 0.48 -0.61 -1.61 0.00 0.00 179.24 177.35 1h9f h GLN 21 N 0.63 0.90 0.00 0.28 -0.00 0.54 -1.14 115.11 116.32 1h9f h GLN 21 Ca 0.46 -0.05 0.00 0.00 -0.00 0.00 0.00 58.65 59.06 1h9f h GLN 21 Cb 0.83 -0.20 0.00 0.00 0.00 0.00 0.00 27.48 28.11 1h9f h GLN 21 CO -0.21 0.59 -0.41 1.28 0.00 0.00 0.00 178.83 180.08 1h9f n LEU 22 N -4.44 1.19 0.29 -2.39 4.32 0.66 -3.72 117.00 112.90 1h9f n LEU 22 Ca 0.09 0.42 0.04 0.00 -0.02 0.00 0.00 56.01 56.54 1h9f n LEU 22 Cb 0.09 -0.72 0.23 0.00 -1.62 0.00 0.00 43.42 41.41 1h9f n LEU 22 CO 0.35 -0.45 0.97 0.58 -1.22 0.00 0.00 177.39 177.62 1h9f h VAL 23 N -0.65 0.00 0.00 4.08 2.07 0.18 0.75 116.25 122.68 1h9f h VAL 23 Ca 0.00 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.18 1h9f h VAL 23 Cb 0.41 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.31 1h9f h VAL 23 CO 0.00 0.00 -2.26 2.29 0.02 0.00 0.00 177.57 177.62 1h9f n LYS 24 N -2.43 0.91 0.00 1.57 -0.00 -0.43 -4.05 118.16 113.73 1h9f n LYS 24 Ca -0.01 0.03 0.07 0.00 -0.00 0.00 0.00 58.31 58.41 1h9f n LYS 24 Cb 0.74 -1.46 0.42 0.00 -0.00 0.00 0.00 35.03 34.73 1h9f n LYS 24 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1h9f n TYR 25 N -2.82 0.00 -0.13 5.58 4.01 -0.46 -4.68 117.16 118.66 1h9f n TYR 25 Ca -0.33 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 1h9f n TYR 25 Cb 1.04 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 40.01 1h9f n TYR 25 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h9f n GLY 26 N -0.07 1.87 3.30 2.72 0.00 -1.15 -5.06 105.19 106.79 1h9f n GLY 26 Ca 0.10 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 1h9f n GLY 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h9f s VAL 27 N -2.00 2.47 -0.48 1.61 1.01 0.13 -4.99 120.40 118.14 1h9f s VAL 27 Ca 0.00 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.12 1h9f s VAL 27 Cb 0.00 -1.97 0.14 0.00 0.00 0.00 0.00 36.38 34.55 1h9f s VAL 27 CO 0.00 0.55 0.26 0.21 0.00 0.00 0.00 175.10 176.12 1h9f s ASN 28 N 0.17 3.88 -0.08 3.32 3.04 -1.26 -1.01 114.94 123.00 1h9f s ASN 28 Ca -0.11 -2.84 -0.27 0.00 0.04 0.00 0.00 52.86 49.68 1h9f s ASN 28 Cb -0.16 -1.26 -0.23 0.00 -1.54 0.00 0.00 41.25 38.06 1h9f s ASN 28 CO 0.06 -0.24 1.00 1.55 -3.04 0.00 0.00 177.10 176.43 1h9f h PRO 29 N 6.55 0.03 0.00 0.43 0.13 -1.97 -3.49 132.00 133.68 1h9f h PRO 29 Ca -0.02 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1h9f h PRO 29 Cb 0.90 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1h9f h PRO 29 CO 0.56 0.80 0.00 0.41 -0.23 0.00 0.00 178.00 179.54 1h9f n GLY 30 N 1.00 1.08 3.55 1.56 0.00 -1.26 -4.82 105.19 106.29 1h9f n GLY 30 Ca -0.09 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 1h9f n GLY 30 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h9f s PRO 31 N 0.00 3.39 -0.64 1.61 0.04 -1.26 -4.89 135.00 133.25 1h9f s PRO 31 Ca 0.00 -0.75 -0.05 0.00 0.04 0.00 0.00 61.00 60.24 1h9f s PRO 31 Cb 0.00 -4.77 -0.00 0.00 0.04 0.00 0.00 34.50 29.77 1h9f s PRO 31 CO 0.00 -2.15 2.88 -0.89 0.04 0.00 0.00 177.00 176.88 1h9f n ILE 32 N 6.56 3.76 -0.60 0.56 2.08 -1.26 -4.82 119.36 125.64 1h9f n ILE 32 Ca 0.18 -2.96 -0.23 0.00 0.56 0.00 0.00 62.75 60.30 1h9f n ILE 32 Cb 0.50 -1.86 0.14 0.00 -0.75 0.00 0.00 39.64 37.67 1h9f n ILE 32 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 1h9f n VAL 33 N 1.60 0.00 0.69 1.39 0.24 -1.26 -4.53 118.33 116.46 1h9f n VAL 33 Ca 0.53 -0.10 0.07 0.00 -2.04 0.00 0.00 64.34 62.80 1h9f n VAL 33 Cb 0.53 -0.48 0.37 0.00 -1.47 0.00 0.00 33.84 32.79 1h9f n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h9f n GLY 34 N 2.42 -0.76 0.82 7.63 0.00 -1.26 -1.71 105.19 112.34 1h9f n GLY 34 Ca 0.04 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.09 1h9f n GLY 34 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h9f n THR 35 N -1.28 0.16 -0.11 2.61 -2.24 -1.26 -4.60 114.28 107.56 1h9f n THR 35 Ca 0.07 -0.58 -0.21 0.00 -2.27 0.00 0.00 64.05 61.05 1h9f n THR 35 Cb 0.11 1.25 -0.07 0.00 -2.10 0.00 0.00 70.33 69.53 1h9f n THR 35 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1h9f n THR 36 N 1.10 1.33 -0.20 4.28 -2.24 -0.69 -4.35 114.28 113.52 1h9f n THR 36 Ca 0.13 -0.22 0.16 0.00 -2.27 0.00 0.00 64.05 61.85 1h9f n THR 36 Cb 0.49 -1.91 0.30 0.00 -2.10 0.00 0.00 70.33 67.10 1h9f n THR 36 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1h9f n ARG 37 N -4.12 -0.04 0.29 -0.78 3.00 -1.23 0.27 116.66 114.05 1h9f n ARG 37 Ca -0.39 0.85 -0.16 0.00 -0.01 0.00 0.00 57.85 58.14 1h9f n ARG 37 Cb 0.74 -1.47 -0.08 0.00 0.00 0.00 0.00 32.46 31.65 1h9f n ARG 37 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1h9f h LYS 38 N 0.00 -0.66 0.23 5.56 1.57 -1.81 0.73 116.57 122.19 1h9f h LYS 38 Ca 0.46 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.29 1h9f h LYS 38 Cb 1.16 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.58 1h9f h LYS 38 CO -0.49 -0.43 -0.49 1.25 -0.57 0.00 0.00 179.45 178.72 1h9f h LEU 39 N -0.72 -1.44 -0.84 2.94 6.46 0.35 0.93 115.31 122.99 1h9f h LEU 39 Ca -0.07 0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.83 1h9f h LEU 39 Cb 0.54 0.52 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 1h9f h LEU 39 CO 0.12 -0.56 0.00 -1.22 -0.62 0.00 0.00 178.44 176.16 1h9f n TYR 40 N -5.30 0.57 0.33 1.25 4.01 -0.19 -1.61 117.16 116.21 1h9f n TYR 40 Ca -0.09 0.26 0.20 0.00 -0.16 0.00 0.00 57.90 58.11 1h9f n TYR 40 Cb 0.40 -0.92 1.07 0.00 -0.31 0.00 0.00 39.34 39.58 1h9f n TYR 40 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 1h9f h GLU 41 N 0.00 0.00 0.00 -0.72 4.11 0.31 -2.56 114.58 115.72 1h9f h GLU 41 Ca 0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.36 1h9f h GLU 41 Cb 0.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1h9f h GLU 41 CO 0.00 0.00 -1.25 1.17 0.07 0.00 0.00 179.01 179.00 1h9f n LYS 42 N -2.98 0.10 -0.33 1.06 3.00 -0.63 -4.04 118.16 114.32 1h9f n LYS 42 Ca -0.03 0.04 0.18 0.00 -0.00 0.00 0.00 58.31 58.50 1h9f n LYS 42 Cb 0.17 -0.71 0.35 0.00 0.00 0.00 0.00 35.03 34.83 1h9f n LYS 42 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.40 177.18 1h9f h LYS 43 N -0.14 0.03 0.18 1.64 1.63 -1.44 0.30 116.57 118.77 1h9f h LYS 43 Ca -0.11 -0.00 -0.35 0.00 -0.85 0.00 0.00 60.65 59.34 1h9f h LYS 43 Cb 1.10 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.74 1h9f h LYS 43 CO -0.06 0.02 -1.70 1.25 -3.45 0.00 0.00 179.45 175.50 1h9f h LEU 44 N 0.03 0.61 -1.93 5.20 5.85 -1.73 -3.29 115.31 120.05 1h9f h LEU 44 Ca 0.64 -0.88 0.18 0.00 0.84 0.00 0.00 57.88 58.66 1h9f h LEU 44 Cb 1.41 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 1h9f h LEU 44 CO -0.87 1.73 0.55 0.25 -0.34 0.00 0.00 178.44 179.77 1h9f h LEU 45 N 0.11 0.00 -0.04 2.25 5.85 -0.67 0.27 115.31 123.07 1h9f h LEU 45 Ca -0.32 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.38 1h9f h LEU 45 Cb 2.10 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 43.13 1h9f h LEU 45 CO 0.18 0.00 -0.03 0.50 -0.34 0.00 0.00 178.44 178.75 1h9f h LYS 46 N 0.00 0.10 0.00 1.25 1.63 -0.98 2.76 116.57 121.33 1h9f h LYS 46 Ca 0.29 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.04 1h9f h LYS 46 Cb 1.39 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.02 1h9f h LYS 46 CO -0.00 0.53 0.00 1.28 -3.45 0.00 0.00 179.45 177.81 1h9f n LEU 47 N -4.79 0.00 0.00 5.20 4.77 -0.01 -2.51 117.00 119.66 1h9f n LEU 47 Ca -0.08 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 1h9f n LEU 47 Cb 0.27 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1h9f n LEU 47 CO 0.35 -0.22 0.32 -1.14 -1.33 0.00 0.00 177.39 175.37 1h9f n ARG 48 N -1.39 1.02 -1.98 3.23 0.00 -0.62 -4.90 116.66 112.02 1h9f n ARG 48 Ca 0.05 -0.83 -0.42 0.00 -0.00 0.00 0.00 57.85 56.65 1h9f n ARG 48 Cb 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 32.46 31.82 1h9f n ARG 48 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 1h9f n GLU 49 N -0.19 3.29 -1.91 -0.14 2.13 0.92 -3.09 120.64 121.64 1h9f n GLU 49 Ca 0.00 -3.02 -0.39 0.00 0.66 0.00 0.00 57.16 54.41 1h9f n GLU 49 Cb 0.30 -3.09 0.01 0.00 0.27 0.00 0.00 31.44 28.94 1h9f n GLU 49 CO 0.00 0.00 0.00 -1.14 -0.41 0.00 0.00 177.13 175.58 1h9f s GLN 50 N 1.77 3.66 -0.02 5.31 0.74 -1.26 -4.32 119.66 125.54 1h9f s GLN 50 Ca 0.45 2.25 -0.01 0.00 0.05 0.00 0.00 55.36 58.09 1h9f s GLN 50 Cb 0.12 -2.58 0.01 0.00 1.10 0.00 0.00 33.01 31.66 1h9f s GLN 50 CO -0.05 -0.77 0.03 0.41 -0.55 0.00 0.00 175.29 174.36 1h9f n GLY 51 N 0.63 -0.58 3.64 2.59 0.00 -1.26 -4.66 105.19 105.55 1h9f n GLY 51 Ca 0.06 0.20 -0.06 0.00 0.00 0.00 0.00 46.02 46.21 1h9f n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1h9f s THR 52 N -0.07 0.00 0.31 2.61 -4.23 -1.26 -5.00 115.64 108.00 1h9f s THR 52 Ca -0.03 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.57 1h9f s THR 52 Cb 0.00 -1.00 0.03 0.00 1.34 0.00 0.00 72.50 72.87 1h9f s THR 52 CO 0.08 0.00 1.71 1.05 -0.54 0.00 0.00 174.62 176.92 1h9f h GLU 53 N 6.82 0.10 -2.82 3.99 4.11 -1.97 -3.47 114.58 121.34 1h9f h GLU 53 Ca -0.30 -0.05 -0.05 0.00 0.07 0.00 0.00 59.36 59.03 1h9f h GLU 53 Cb 1.22 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.50 1h9f h GLU 53 CO 0.16 0.55 -0.14 0.45 0.07 0.00 0.00 179.01 180.11 1h9f n SER 54 N -3.98 -2.20 -4.15 3.06 2.88 -1.26 -4.98 113.62 102.98 1h9f n SER 54 Ca -0.02 -0.11 -0.42 0.00 -1.33 0.00 0.00 58.87 57.00 1h9f n SER 54 Cb 0.50 -1.30 -0.02 0.00 -0.75 0.00 0.00 64.21 62.64 1h9f n SER 54 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1h9f n ARG 55 N -1.60 3.55 -1.85 -1.46 5.12 -1.26 -4.92 116.66 114.23 1h9f n ARG 55 Ca -0.04 -4.50 -0.41 0.00 -1.93 0.00 0.00 57.85 50.97 1h9f n ARG 55 Cb 0.53 -2.49 -0.01 0.00 -1.16 0.00 0.00 32.46 29.33 1h9f n ARG 55 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1h9f n SER 56 N 2.14 6.56 -0.39 0.55 3.41 -1.26 -5.31 113.62 119.32 1h9f n SER 56 Ca 0.24 -2.92 0.14 0.00 -0.26 0.00 0.00 58.87 56.07 1h9f n SER 56 Cb 0.37 -1.51 0.61 0.00 -0.26 0.00 0.00 64.21 63.42 1h9f n SER 56 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68