#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgu s ARG 3 N 0.00 3.22 -0.25 -0.52 1.81 -0.61 -1.16 118.95 121.44 2hgu s ARG 3 Ca 0.00 -2.21 -0.08 0.00 -1.72 0.00 0.00 55.73 51.72 2hgu s ARG 3 Cb 0.00 -4.27 -0.03 0.00 -0.45 0.00 0.00 34.95 30.20 2hgu s ARG 3 CO 0.00 -1.28 0.09 -1.17 -0.68 0.00 0.00 175.30 172.26 2hgu s LEU 4 N 0.62 3.56 0.48 2.53 0.20 -0.29 -0.70 118.68 125.09 2hgu s LEU 4 Ca 0.13 -0.16 0.06 0.00 0.69 0.00 0.00 54.13 54.85 2hgu s LEU 4 Cb -0.18 -1.96 -0.01 0.00 -0.43 0.00 0.00 46.19 43.61 2hgu s LEU 4 CO -0.04 -0.03 0.25 -1.59 -0.29 0.00 0.00 176.35 174.65 2hgu s LYS 5 N 1.58 2.25 0.34 1.98 0.00 -0.41 -0.54 119.74 124.94 2hgu s LYS 5 Ca 0.06 -1.99 -0.11 0.00 0.00 0.00 0.00 55.97 53.93 2hgu s LYS 5 Cb -0.15 -1.98 0.03 0.00 0.00 0.00 0.00 37.83 35.73 2hgu s LYS 5 CO 0.05 -0.35 0.64 0.14 0.00 0.00 0.00 175.35 175.82 2hgu s VAL 6 N -2.70 0.00 -0.03 1.79 -7.23 -0.12 -0.96 120.40 111.15 2hgu s VAL 6 Ca 0.33 -1.26 -0.12 0.00 -1.81 0.00 0.00 61.98 59.13 2hgu s VAL 6 Cb 0.01 -2.62 0.02 0.00 0.56 0.00 0.00 36.38 34.34 2hgu s VAL 6 CO 0.19 0.00 0.25 -0.75 -0.31 0.00 0.00 175.10 174.48 2hgu s LYS 7 N -2.95 0.55 -0.39 4.82 2.47 -0.14 -0.77 119.74 123.34 2hgu s LYS 7 Ca 0.21 -0.14 -0.28 0.00 -1.56 0.00 0.00 55.97 54.20 2hgu s LYS 7 Cb -0.03 0.24 -0.01 0.00 -1.46 0.00 0.00 37.83 36.57 2hgu s LYS 7 CO 0.14 -0.13 1.65 -1.17 0.16 0.00 0.00 175.35 175.99 2hgu s LEU 8 N -1.05 3.52 0.00 5.43 1.98 -0.36 -1.20 118.68 127.00 2hgu s LEU 8 Ca -0.11 1.03 0.00 0.00 -2.89 0.00 0.00 54.13 52.16 2hgu s LEU 8 Cb -0.05 -3.44 0.00 0.00 0.66 0.00 0.00 46.19 43.36 2hgu s LEU 8 CO 0.03 -1.65 0.00 1.33 -1.89 0.00 0.00 176.35 174.16 2hgu n VAL 9 N 7.26 0.00 -3.60 1.68 0.24 0.32 -4.57 118.33 119.67 2hgu n VAL 9 Ca 0.20 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.27 2hgu n VAL 9 Cb 0.48 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.68 2hgu n VAL 9 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2hgu s LYS 10 N 0.08 0.07 -0.01 7.34 1.02 -1.26 -4.91 119.74 122.07 2hgu s LYS 10 Ca 0.00 0.06 0.04 0.00 0.02 0.00 0.00 55.97 56.09 2hgu s LYS 10 Cb 0.00 -1.47 0.07 0.00 -0.52 0.00 0.00 37.83 35.91 2hgu s LYS 10 CO 0.00 -0.61 1.04 0.43 -0.92 0.00 0.00 175.35 175.29 2hgu n SER 11 N 5.29 -0.72 0.39 2.83 7.64 -1.26 -5.02 113.62 122.77 2hgu n SER 11 Ca -0.06 -2.00 -0.18 0.00 1.01 0.00 0.00 58.87 57.64 2hgu n SER 11 Cb 0.49 0.22 -0.09 0.00 -1.01 0.00 0.00 64.21 63.82 2hgu n SER 11 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2hgu h PRO 12 N 0.17 -0.93 0.00 1.43 0.13 -1.98 -3.41 132.00 127.41 2hgu h PRO 12 Ca -0.52 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2hgu h PRO 12 Cb 1.48 0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.82 2hgu h PRO 12 CO -0.23 -0.61 0.00 1.51 -0.23 0.00 0.00 178.00 178.44 2hgu n ILE 13 N -5.49 0.00 -3.75 -3.56 3.06 -1.26 -4.11 119.36 104.26 2hgu n ILE 13 Ca -0.14 0.00 -0.06 0.00 -2.50 0.00 0.00 62.75 60.05 2hgu n ILE 13 Cb 0.39 0.00 -0.02 0.00 0.54 0.00 0.00 39.64 40.56 2hgu n ILE 13 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 2hgu s GLY 14 N 0.00 -0.23 -0.11 4.50 0.00 -1.26 -5.20 107.32 105.02 2hgu s GLY 14 Ca 0.00 0.05 -0.33 0.00 0.00 0.00 0.00 44.72 44.43 2hgu s GLY 14 CO 0.00 0.00 1.34 -2.52 0.00 0.00 0.00 173.10 171.92 2hgu s TYR 15 N -3.58 -0.04 -0.01 1.90 -0.85 -1.26 -5.08 117.35 108.43 2hgu s TYR 15 Ca 0.10 -0.01 -0.36 0.00 -0.52 0.00 0.00 57.07 56.28 2hgu s TYR 15 Cb -0.03 0.52 -0.15 0.00 0.38 0.00 0.00 41.96 42.68 2hgu s TYR 15 CO 0.02 -0.15 1.57 -0.35 -1.52 0.00 0.00 175.55 175.13 2hgu n PRO 16 N -0.36 1.53 0.00 -3.49 -0.04 -1.26 -4.72 135.00 126.66 2hgu n PRO 16 Ca -0.06 0.56 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 2hgu n PRO 16 Cb 0.61 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.81 2hgu n PRO 16 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2hgu n LYS 17 N 4.02 0.00 -0.20 0.54 4.81 -1.26 -1.05 118.16 125.02 2hgu n LYS 17 Ca 0.21 0.47 0.18 0.00 -0.87 0.00 0.00 58.31 58.29 2hgu n LYS 17 Cb 0.21 -1.00 0.30 0.00 0.02 0.00 0.00 35.03 34.56 2hgu n LYS 17 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2hgu n ASP 18 N -0.98 0.11 0.07 3.14 5.68 -1.26 0.32 116.55 123.64 2hgu n ASP 18 Ca 0.00 0.66 -0.21 0.00 -0.50 0.00 0.00 54.79 54.74 2hgu n ASP 18 Cb 0.00 -0.33 -0.14 0.00 -1.14 0.00 0.00 41.12 39.51 2hgu n ASP 18 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2hgu h GLN 19 N 0.00 0.39 -0.98 0.11 5.75 -1.46 -0.20 115.11 118.71 2hgu h GLN 19 Ca 0.40 -0.61 0.22 0.00 -0.15 0.00 0.00 58.65 58.50 2hgu h GLN 19 Cb 1.24 0.22 -0.09 0.00 1.07 0.00 0.00 27.48 29.92 2hgu h GLN 19 CO -0.24 1.28 0.62 0.87 -2.65 0.00 0.00 178.83 178.71 2hgu h LYS 20 N -0.19 0.54 0.93 1.69 1.57 0.68 -0.39 116.57 121.40 2hgu h LYS 20 Ca -0.16 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.54 2hgu h LYS 20 Cb 1.73 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 33.93 2hgu h LYS 20 CO 0.18 0.36 -0.45 0.00 -0.57 0.00 0.00 179.45 178.97 2hgu h ALA 21 N 1.63 -1.25 -0.93 3.86 0.00 -0.85 -0.81 119.26 120.91 2hgu h ALA 21 Ca 0.55 -0.27 0.26 0.00 0.00 0.00 0.00 54.91 55.45 2hgu h ALA 21 Cb 1.15 0.48 -0.14 0.00 0.00 0.00 0.00 17.79 19.28 2hgu h ALA 21 CO -0.30 -1.17 0.40 0.00 0.00 0.00 0.00 179.25 178.18 2hgu h ALA 22 N -1.30 1.56 0.25 0.00 0.00 -0.57 -0.10 119.26 119.10 2hgu h ALA 22 Ca -0.13 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2hgu h ALA 22 Cb 0.96 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2hgu h ALA 22 CO 0.21 -0.46 -0.19 -0.07 0.00 0.00 0.00 179.25 178.74 2hgu h LEU 23 N 0.31 -0.50 -1.27 0.00 4.07 -0.73 0.17 115.31 117.36 2hgu h LEU 23 Ca 0.62 0.03 0.39 0.00 0.08 0.00 0.00 57.88 59.00 2hgu h LEU 23 Cb 1.29 0.16 -0.13 0.00 1.08 0.00 0.00 40.66 43.05 2hgu h LEU 23 CO -0.60 -0.27 0.73 0.11 -1.08 0.00 0.00 178.44 177.33 2hgu h LYS 24 N -0.42 0.16 0.00 1.13 1.57 -0.28 -0.15 116.57 118.58 2hgu h LYS 24 Ca -0.03 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2hgu h LYS 24 Cb 0.35 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2hgu h LYS 24 CO 0.01 0.11 0.00 0.00 -0.57 0.00 0.00 179.45 178.99 2hgu n ALA 25 N -2.44 -0.38 -0.48 3.86 0.00 -0.13 -1.64 120.51 119.30 2hgu n ALA 25 Ca 0.35 0.00 0.42 0.00 0.00 0.00 0.00 53.44 54.21 2hgu n ALA 25 Cb 1.25 0.05 0.69 0.00 0.00 0.00 0.00 19.45 21.44 2hgu n ALA 25 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2hgu h LEU 26 N 0.00 0.00 0.00 0.00 -0.00 0.16 -3.43 115.31 112.04 2hgu h LEU 26 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2hgu h LEU 26 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2hgu h LEU 26 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 178.44 179.05 2hgu n GLY 27 N -1.83 1.39 1.07 0.83 0.00 -0.18 -5.02 105.19 101.45 2hgu n GLY 27 Ca 0.34 -0.58 0.11 0.00 0.00 0.00 0.00 46.02 45.89 2hgu n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hgu n LEU 28 N 0.00 -0.56 0.00 0.99 4.77 -1.25 -3.60 117.00 117.34 2hgu n LEU 28 Ca 0.00 1.30 0.00 0.00 -0.03 0.00 0.00 56.01 57.28 2hgu n LEU 28 Cb 0.00 -2.99 0.00 0.00 -2.33 0.00 0.00 43.42 38.10 2hgu n LEU 28 CO 0.00 -1.56 0.00 0.54 -1.33 0.00 0.00 177.39 175.04 2hgu n ARG 29 N -3.56 0.00 -0.63 3.23 5.12 -1.26 -4.78 116.66 114.78 2hgu n ARG 29 Ca -0.04 0.00 -0.25 0.00 -1.93 0.00 0.00 57.85 55.64 2hgu n ARG 29 Cb 0.52 0.00 -0.03 0.00 -1.16 0.00 0.00 32.46 31.79 2hgu n ARG 29 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2hgu n ARG 30 N 0.00 0.00 -0.09 5.56 3.00 -1.26 -4.65 116.66 119.22 2hgu n ARG 30 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.85 57.88 2hgu n ARG 30 Cb 0.00 -0.62 0.37 0.00 0.00 0.00 0.00 32.46 32.21 2hgu n ARG 30 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 2hgu h LEU 31 N 1.22 0.60 -8.44 0.55 7.12 -1.93 -3.35 115.31 111.08 2hgu h LEU 31 Ca -0.21 -0.01 -0.72 0.00 0.13 0.00 0.00 57.88 57.07 2hgu h LEU 31 Cb 0.60 -0.14 -0.21 0.00 -0.53 0.00 0.00 40.66 40.37 2hgu h LEU 31 CO 0.27 0.42 -0.37 -1.10 -0.13 0.00 0.00 178.44 177.53 2hgu s GLN 32 N -5.61 2.99 -0.27 1.25 1.11 -1.26 -4.52 119.66 113.34 2hgu s GLN 32 Ca -0.09 -1.10 -0.13 0.00 0.01 0.00 0.00 55.36 54.05 2hgu s GLN 32 Cb 0.18 -4.03 0.10 0.00 -1.01 0.00 0.00 33.01 28.25 2hgu s GLN 32 CO 0.75 -0.86 0.63 1.14 0.01 0.00 0.00 175.29 176.97 2hgu s GLN 33 N 1.73 0.61 -0.05 2.91 -2.07 -1.26 -5.01 119.66 116.51 2hgu s GLN 33 Ca 0.05 1.26 -0.18 0.00 -1.82 0.00 0.00 55.36 54.68 2hgu s GLN 33 Cb -0.20 0.41 -0.05 0.00 -1.09 0.00 0.00 33.01 32.08 2hgu s GLN 33 CO 0.09 -0.18 0.49 -2.00 -1.32 0.00 0.00 175.29 172.38 2hgu s GLU 34 N 2.16 4.23 0.03 9.60 2.12 -1.26 -1.22 118.70 134.35 2hgu s GLU 34 Ca -0.08 0.52 0.06 0.00 0.36 0.00 0.00 54.97 55.84 2hgu s GLU 34 Cb -0.08 -3.35 -0.02 0.00 0.26 0.00 0.00 34.13 30.93 2hgu s GLU 34 CO -0.18 0.37 -0.18 -0.98 -0.54 0.00 0.00 175.26 173.74 2hgu s ARG 35 N -0.09 1.27 -0.22 4.30 1.70 0.05 -4.99 118.95 120.97 2hgu s ARG 35 Ca 0.27 -0.84 -0.03 0.00 -0.47 0.00 0.00 55.73 54.66 2hgu s ARG 35 Cb -0.16 -1.33 0.01 0.00 -0.57 0.00 0.00 34.95 32.89 2hgu s ARG 35 CO 0.13 0.34 -0.07 0.14 -1.08 0.00 0.00 175.30 174.77 2hgu s VAL 36 N -0.75 3.06 -0.21 4.99 -7.23 -1.26 -0.94 120.40 118.06 2hgu s VAL 36 Ca 0.06 -0.70 -0.02 0.00 -1.81 0.00 0.00 61.98 59.50 2hgu s VAL 36 Cb -0.08 -2.43 -0.00 0.00 0.56 0.00 0.00 36.38 34.43 2hgu s VAL 36 CO 0.01 0.37 -0.09 -0.22 -0.31 0.00 0.00 175.10 174.86 2hgu s LEU 37 N 1.41 2.67 -0.18 1.32 0.20 0.30 -4.98 118.68 119.43 2hgu s LEU 37 Ca 0.04 -0.46 -0.29 0.00 0.69 0.00 0.00 54.13 54.11 2hgu s LEU 37 Cb -0.15 -1.66 -0.02 0.00 -0.43 0.00 0.00 46.19 43.93 2hgu s LEU 37 CO -0.05 -0.01 1.35 -1.83 -0.29 0.00 0.00 176.35 175.52 2hgu s GLU 38 N 1.39 4.13 0.00 1.98 1.03 -1.26 -1.14 118.70 124.83 2hgu s GLU 38 Ca 0.05 1.65 0.00 0.00 0.03 0.00 0.00 54.97 56.70 2hgu s GLU 38 Cb -0.14 -3.84 0.00 0.00 -0.80 0.00 0.00 34.13 29.35 2hgu s GLU 38 CO -0.06 -0.85 0.41 -3.47 -1.33 0.00 0.00 175.26 169.96 2hgu n ASP 39 N 7.02 0.00 -4.77 0.83 2.03 -0.31 -4.80 116.55 116.55 2hgu n ASP 39 Ca 0.15 -1.09 -0.41 0.00 0.52 0.00 0.00 54.79 53.96 2hgu n ASP 39 Cb 0.45 -0.10 -0.01 0.00 -0.72 0.00 0.00 41.12 40.73 2hgu n ASP 39 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2hgu s THR 40 N 2.38 2.50 0.63 5.18 2.01 -1.26 -4.84 115.64 122.25 2hgu s THR 40 Ca 0.00 0.50 0.39 0.00 0.31 0.00 0.00 61.69 62.89 2hgu s THR 40 Cb 0.00 -3.32 0.41 0.00 0.01 0.00 0.00 72.50 69.61 2hgu s THR 40 CO 0.00 0.12 2.33 -0.65 -0.69 0.00 0.00 174.62 175.73 2hgu h PRO 41 N 3.20 0.00 0.00 4.92 0.11 -1.99 0.05 132.00 138.30 2hgu h PRO 41 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2hgu h PRO 41 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2hgu h PRO 41 CO 0.65 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.44 2hgu n ALA 42 N -2.17 -0.11 -0.30 -0.75 0.00 -1.26 -0.81 120.51 115.12 2hgu n ALA 42 Ca -0.03 0.00 0.23 0.00 0.00 0.00 0.00 53.44 53.64 2hgu n ALA 42 Cb 0.08 0.00 0.43 0.00 0.00 0.00 0.00 19.45 19.95 2hgu n ALA 42 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2hgu n ILE 43 N -1.21 -0.38 0.12 0.00 2.08 -1.18 0.11 119.36 118.91 2hgu n ILE 43 Ca 0.00 1.91 -0.05 0.00 0.56 0.00 0.00 62.75 65.17 2hgu n ILE 43 Cb 0.00 -2.97 -0.03 0.00 -0.75 0.00 0.00 39.64 35.90 2hgu n ILE 43 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2hgu h ARG 44 N 0.00 -0.31 -0.60 0.38 3.08 -1.05 -1.68 114.38 114.19 2hgu h ARG 44 Ca 0.68 0.02 0.11 0.00 0.07 0.00 0.00 59.98 60.87 2hgu h ARG 44 Cb 1.67 0.07 -0.11 0.00 0.08 0.00 0.00 29.97 31.68 2hgu h ARG 44 CO -0.76 -0.21 -0.18 0.41 -1.07 0.00 0.00 179.97 178.16 2hgu n GLY 45 N -1.17 -1.08 0.37 0.04 0.00 0.31 0.15 105.19 103.81 2hgu n GLY 45 Ca -0.04 0.65 -0.16 0.00 0.00 0.00 0.00 46.02 46.48 2hgu n GLY 45 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2hgu h ASN 46 N 0.00 -0.92 -0.35 1.61 -0.73 -1.07 -0.64 115.58 113.48 2hgu h ASN 46 Ca 0.27 0.08 0.01 0.00 1.87 0.00 0.00 56.30 58.52 2hgu h ASN 46 Cb 0.42 0.30 -0.02 0.00 0.27 0.00 0.00 38.32 39.29 2hgu h ASN 46 CO -0.61 -0.49 0.23 0.58 -0.37 0.00 0.00 177.43 176.77 2hgu h VAL 47 N -0.74 1.07 -0.38 2.57 2.07 0.23 -1.49 116.25 119.58 2hgu h VAL 47 Ca -0.03 -0.16 -0.15 0.00 0.82 0.00 0.00 66.70 67.18 2hgu h VAL 47 Cb 0.65 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 2hgu h VAL 47 CO -0.04 0.08 -0.35 1.05 0.02 0.00 0.00 177.57 178.33 2hgu h GLU 48 N 0.45 0.90 0.06 1.57 4.11 -0.66 -0.85 114.58 120.16 2hgu h GLU 48 Ca 0.13 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 59.12 2hgu h GLU 48 Cb -0.02 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2hgu h GLU 48 CO -0.03 1.10 -0.23 -0.22 0.07 0.00 0.00 179.01 179.70 2hgu h LYS 49 N 0.74 -0.32 -0.70 1.06 3.64 -0.44 -3.01 116.57 117.53 2hgu h LYS 49 Ca 0.07 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2hgu h LYS 49 Cb 0.93 0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 32.74 2hgu h LYS 49 CO 0.09 -0.21 -0.42 0.28 -2.27 0.00 0.00 179.45 176.92 2hgu n VAL 50 N -3.74 -0.48 0.00 2.00 0.31 -0.63 -4.71 118.33 111.08 2hgu n VAL 50 Ca -0.04 2.13 0.00 0.00 -0.01 0.00 0.00 64.34 66.42 2hgu n VAL 50 Cb 0.18 -2.67 0.00 0.00 -0.91 0.00 0.00 33.84 30.44 2hgu n VAL 50 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hgu n ALA 51 N -3.18 0.00 0.00 3.52 0.00 -0.34 -3.70 120.51 116.81 2hgu n ALA 51 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2hgu n ALA 51 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.63 2hgu n ALA 51 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2hgu n HIS 52 N 0.00 0.00 -0.06 0.00 1.44 -1.26 -0.65 115.22 114.69 2hgu n HIS 52 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2hgu n HIS 52 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2hgu n HIS 52 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2hgu n LEU 53 N 0.32 0.22 -4.05 2.39 4.77 -1.24 -4.74 117.00 114.67 2hgu n LEU 53 Ca 0.00 -0.50 -0.10 0.00 -0.03 0.00 0.00 56.01 55.38 2hgu n LEU 53 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 2hgu n LEU 53 CO 0.00 0.06 -0.09 0.54 -1.33 0.00 0.00 177.39 176.57 2hgu s VAL 54 N -0.55 0.05 -0.23 4.08 0.11 0.18 -0.52 120.40 123.52 2hgu s VAL 54 Ca 0.00 -1.61 -0.09 0.00 -2.93 0.00 0.00 61.98 57.35 2hgu s VAL 54 Cb 0.00 -2.06 -0.04 0.00 -1.53 0.00 0.00 36.38 32.74 2hgu s VAL 54 CO 0.00 -0.23 0.12 -0.60 -3.33 0.00 0.00 175.10 171.06 2hgu s ARG 55 N -4.03 3.94 -0.28 1.54 6.06 -0.34 -4.88 118.95 120.96 2hgu s ARG 55 Ca 0.23 -0.34 -0.04 0.00 -2.50 0.00 0.00 55.73 53.08 2hgu s ARG 55 Cb 0.04 -3.41 0.02 0.00 0.06 0.00 0.00 34.95 31.66 2hgu s ARG 55 CO 0.04 0.05 0.02 0.54 -2.50 0.00 0.00 175.30 173.45 2hgu s VAL 56 N 1.05 3.41 -0.03 7.11 0.11 -1.26 -0.97 120.40 129.82 2hgu s VAL 56 Ca 0.06 -0.96 0.03 0.00 -2.93 0.00 0.00 61.98 58.17 2hgu s VAL 56 Cb -0.14 -2.80 0.01 0.00 -1.53 0.00 0.00 36.38 31.92 2hgu s VAL 56 CO 0.04 0.07 -0.10 -1.61 -3.33 0.00 0.00 175.10 170.16 2hgu s GLU 57 N 1.39 1.15 -1.06 1.54 2.02 -0.13 -5.01 118.70 118.60 2hgu s GLU 57 Ca 0.00 -0.34 -0.24 0.00 0.02 0.00 0.00 54.97 54.41 2hgu s GLU 57 Cb -0.18 -1.04 -0.10 0.00 0.10 0.00 0.00 34.13 32.91 2hgu s GLU 57 CO -0.00 0.10 2.01 0.08 0.02 0.00 0.00 175.26 177.46 2hgu s VAL 58 N 0.31 3.40 -0.82 2.63 1.01 -1.26 -1.29 120.40 124.37 2hgu s VAL 58 Ca -0.06 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.22 2hgu s VAL 58 Cb -0.10 -4.19 0.19 0.00 0.00 0.00 0.00 36.38 32.27 2hgu s VAL 58 CO 0.01 -0.76 0.81 -0.69 0.00 0.00 0.00 175.10 174.48 2hgu s VAL 59 N 11.99 5.39 -0.39 2.92 1.01 0.13 -5.01 120.40 136.44 2hgu s VAL 59 Ca 0.73 -2.18 0.03 0.00 0.00 0.00 0.00 61.98 60.56 2hgu s VAL 59 Cb -0.04 -4.52 0.02 0.00 0.00 0.00 0.00 36.38 31.84 2hgu s VAL 59 CO 0.10 -1.11 0.60 1.21 0.00 0.00 0.00 175.10 175.89