#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgq s ARG 3 N 0.00 3.35 -0.15 -0.52 3.00 -0.33 -1.07 118.95 123.24 2hgq s ARG 3 Ca 0.00 -2.26 -0.02 0.00 -1.00 0.00 0.00 55.73 52.44 2hgq s ARG 3 Cb 0.00 -4.34 -0.02 0.00 0.00 0.00 0.00 34.95 30.59 2hgq s ARG 3 CO 0.00 -1.29 -0.07 -1.17 0.00 0.00 0.00 175.30 172.77 2hgq s LEU 4 N 0.53 3.06 0.49 -0.88 0.20 -0.24 -0.70 118.68 121.14 2hgq s LEU 4 Ca 0.14 -0.20 0.03 0.00 0.69 0.00 0.00 54.13 54.79 2hgq s LEU 4 Cb -0.16 -1.72 -0.03 0.00 -0.43 0.00 0.00 46.19 43.85 2hgq s LEU 4 CO -0.05 0.17 0.05 -1.59 -0.29 0.00 0.00 176.35 174.63 2hgq s LYS 5 N 0.36 2.15 0.09 1.98 0.00 -0.28 -0.60 119.74 123.45 2hgq s LYS 5 Ca -0.06 -2.28 -0.17 0.00 0.00 0.00 0.00 55.97 53.46 2hgq s LYS 5 Cb -0.15 -1.63 0.03 0.00 0.00 0.00 0.00 37.83 36.09 2hgq s LYS 5 CO 0.04 -0.30 0.40 0.14 0.00 0.00 0.00 175.35 175.63 2hgq s VAL 6 N -2.82 0.07 -0.16 1.79 -7.23 -0.15 -0.93 120.40 110.96 2hgq s VAL 6 Ca 0.16 -0.54 -0.01 0.00 -1.81 0.00 0.00 61.98 59.78 2hgq s VAL 6 Cb 0.03 -1.09 -0.00 0.00 0.56 0.00 0.00 36.38 35.88 2hgq s VAL 6 CO 0.09 -0.30 -0.13 -0.75 -0.31 0.00 0.00 175.10 173.70 2hgq s LYS 7 N -3.29 3.27 -0.48 4.82 2.47 0.25 -0.51 119.74 126.27 2hgq s LYS 7 Ca -0.00 -0.72 -0.26 0.00 -1.56 0.00 0.00 55.97 53.43 2hgq s LYS 7 Cb 0.01 -2.69 -0.06 0.00 -1.46 0.00 0.00 37.83 33.63 2hgq s LYS 7 CO -0.08 0.01 2.28 -1.17 0.16 0.00 0.00 175.35 176.54 2hgq s LEU 8 N 0.86 3.39 0.00 5.43 1.98 -0.13 -1.16 118.68 129.06 2hgq s LEU 8 Ca -0.04 1.04 0.00 0.00 -2.89 0.00 0.00 54.13 52.24 2hgq s LEU 8 Cb -0.15 -2.64 0.00 0.00 0.66 0.00 0.00 46.19 44.06 2hgq s LEU 8 CO -0.00 -2.67 0.00 1.33 -1.89 0.00 0.00 176.35 173.11 2hgq n VAL 9 N 7.82 0.00 -3.51 1.68 0.24 0.15 -4.11 118.33 120.61 2hgq n VAL 9 Ca 0.33 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.47 2hgq n VAL 9 Cb 0.53 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.85 2hgq n VAL 9 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2hgq s LYS 10 N 0.56 1.03 0.00 7.34 2.20 -1.23 -4.86 119.74 124.77 2hgq s LYS 10 Ca 0.00 0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.71 2hgq s LYS 10 Cb 0.00 0.48 0.00 0.00 -1.51 0.00 0.00 37.83 36.80 2hgq s LYS 10 CO 0.00 -0.35 0.00 0.43 -0.36 0.00 0.00 175.35 175.07 2hgq n SER 11 N 0.62 0.00 0.00 1.43 7.64 -1.26 -4.66 113.62 117.39 2hgq n SER 11 Ca -0.17 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.77 2hgq n SER 11 Cb 0.59 0.00 0.35 0.00 -1.01 0.00 0.00 64.21 64.14 2hgq n SER 11 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2hgq n PRO 12 N 0.00 0.95 0.00 1.43 -0.04 -1.26 -4.52 135.00 131.56 2hgq n PRO 12 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2hgq n PRO 12 Cb 0.00 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.26 2hgq n PRO 12 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 2hgq n ILE 13 N -0.70 0.00 -4.06 0.52 3.06 -1.26 -4.87 119.36 112.05 2hgq n ILE 13 Ca 0.09 0.00 -0.22 0.00 -2.50 0.00 0.00 62.75 60.12 2hgq n ILE 13 Cb 0.04 -0.68 -0.05 0.00 0.54 0.00 0.00 39.64 39.49 2hgq n ILE 13 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 2hgq s GLY 14 N 0.00 1.61 -0.04 4.50 0.00 -1.26 -5.13 107.32 107.00 2hgq s GLY 14 Ca 0.00 -1.57 -0.30 0.00 0.00 0.00 0.00 44.72 42.86 2hgq s GLY 14 CO 0.00 -1.57 0.94 -2.52 0.00 0.00 0.00 173.10 169.95 2hgq s TYR 15 N -2.24 -0.32 -0.32 1.90 -0.85 -1.26 -5.05 117.35 109.19 2hgq s TYR 15 Ca 0.35 0.24 -0.33 0.00 -0.52 0.00 0.00 57.07 56.81 2hgq s TYR 15 Cb -0.06 0.53 -0.10 0.00 0.38 0.00 0.00 41.96 42.70 2hgq s TYR 15 CO 0.24 -0.48 2.21 -0.35 -1.52 0.00 0.00 175.55 175.64 2hgq n PRO 16 N -0.13 1.28 0.00 -3.49 -0.04 -1.26 -4.75 135.00 126.61 2hgq n PRO 16 Ca -0.08 0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 2hgq n PRO 16 Cb 0.61 -2.65 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 2hgq n PRO 16 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2hgq n LYS 17 N 8.35 0.00 -0.45 0.54 4.81 -1.26 0.21 118.16 130.37 2hgq n LYS 17 Ca 0.39 0.54 0.38 0.00 -0.87 0.00 0.00 58.31 58.74 2hgq n LYS 17 Cb 0.28 -0.88 0.63 0.00 0.02 0.00 0.00 35.03 35.08 2hgq n LYS 17 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2hgq n ASP 18 N -1.92 0.18 0.00 3.14 5.68 -1.26 0.15 116.55 122.52 2hgq n ASP 18 Ca 0.00 1.25 -0.19 0.00 -0.50 0.00 0.00 54.79 55.36 2hgq n ASP 18 Cb 0.00 -0.62 -0.09 0.00 -1.14 0.00 0.00 41.12 39.28 2hgq n ASP 18 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 2hgq h GLN 19 N 0.00 0.75 -0.86 0.11 5.75 0.22 -0.47 115.11 120.61 2hgq h GLN 19 Ca 0.81 -0.69 0.15 0.00 -0.15 0.00 0.00 58.65 58.77 2hgq h GLN 19 Cb 2.66 0.17 -0.07 0.00 1.07 0.00 0.00 27.48 31.31 2hgq h GLN 19 CO -0.40 1.28 0.56 0.87 -2.65 0.00 0.00 178.83 178.49 2hgq h LYS 20 N 0.47 0.59 0.67 1.69 6.56 0.32 0.21 116.57 127.08 2hgq h LYS 20 Ca -0.08 -0.04 -0.03 0.00 -1.06 0.00 0.00 60.65 59.44 2hgq h LYS 20 Cb 1.52 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 33.03 2hgq h LYS 20 CO 0.18 0.39 -0.47 0.00 -2.06 0.00 0.00 179.45 177.48 2hgq h ALA 21 N 1.61 -1.22 -0.74 3.86 0.00 -0.40 -0.43 119.26 121.93 2hgq h ALA 21 Ca 0.43 -0.22 0.17 0.00 0.00 0.00 0.00 54.91 55.29 2hgq h ALA 21 Cb 0.79 0.63 -0.12 0.00 0.00 0.00 0.00 17.79 19.09 2hgq h ALA 21 CO -0.19 -1.20 0.15 0.00 0.00 0.00 0.00 179.25 178.01 2hgq h ALA 22 N -1.14 0.94 -1.24 0.00 0.00 -0.37 0.52 119.26 117.97 2hgq h ALA 22 Ca -0.09 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2hgq h ALA 22 Cb 0.89 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2hgq h ALA 22 CO 0.05 -0.37 0.00 1.28 0.00 0.00 0.00 179.25 180.21 2hgq n LEU 23 N -5.20 0.00 -0.31 0.00 4.32 -0.01 -0.89 117.00 114.92 2hgq n LEU 23 Ca 0.14 0.79 0.26 0.00 -0.02 0.00 0.00 56.01 57.18 2hgq n LEU 23 Cb 0.48 -0.29 0.57 0.00 -1.62 0.00 0.00 43.42 42.55 2hgq n LEU 23 CO 0.11 -0.29 1.24 0.50 -1.22 0.00 0.00 177.39 177.73 2hgq h LYS 24 N 0.00 0.28 0.10 3.23 3.64 -0.73 0.64 116.57 123.73 2hgq h LYS 24 Ca 0.00 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2hgq h LYS 24 Cb 0.00 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 2hgq h LYS 24 CO 0.00 0.18 -0.36 0.00 -2.27 0.00 0.00 179.45 177.00 2hgq h ALA 25 N 1.57 -0.62 -0.75 5.00 0.00 0.04 0.17 119.26 124.67 2hgq h ALA 25 Ca 0.58 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.54 2hgq h ALA 25 Cb 1.68 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 20.03 2hgq h ALA 25 CO -0.22 -0.91 0.49 -0.07 0.00 0.00 0.00 179.25 178.54 2hgq h LEU 26 N -0.58 0.57 0.00 0.00 -0.00 0.21 -3.47 115.31 112.04 2hgq h LEU 26 Ca 0.03 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 2hgq h LEU 26 Cb 0.62 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.18 2hgq h LEU 26 CO -0.22 0.33 0.00 0.61 -0.00 0.00 0.00 178.44 179.16 2hgq n GLY 27 N -1.47 1.10 1.56 0.83 0.00 0.60 -5.04 105.19 102.78 2hgq n GLY 27 Ca 0.13 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2hgq n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hgq n LEU 28 N 0.00 -2.22 0.00 0.99 4.77 -1.26 -3.39 117.00 115.90 2hgq n LEU 28 Ca 0.00 2.27 0.00 0.00 -0.03 0.00 0.00 56.01 58.25 2hgq n LEU 28 Cb 0.00 -2.71 0.00 0.00 -2.33 0.00 0.00 43.42 38.38 2hgq n LEU 28 CO 0.00 0.13 0.00 0.54 -1.33 0.00 0.00 177.39 176.73 2hgq n ARG 29 N -0.56 0.00 -0.16 3.23 5.12 -1.26 -4.68 116.66 118.35 2hgq n ARG 29 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2hgq n ARG 29 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2hgq n ARG 29 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 2hgq n ARG 30 N 0.00 0.00 -0.04 5.56 3.00 -1.26 -4.36 116.66 119.57 2hgq n ARG 30 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.85 57.87 2hgq n ARG 30 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 32.46 32.52 2hgq n ARG 30 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2hgq n LEU 31 N 0.65 0.03 -4.26 0.55 -0.00 -1.26 -3.25 117.00 109.46 2hgq n LEU 31 Ca 0.00 0.20 -0.41 0.00 -0.00 0.00 0.00 56.01 55.81 2hgq n LEU 31 Cb 0.00 -0.09 -0.09 0.00 -0.00 0.00 0.00 43.42 43.23 2hgq n LEU 31 CO 0.00 -0.22 -0.07 -1.10 -0.00 0.00 0.00 177.39 176.00 2hgq s GLN 32 N -4.32 2.59 -0.09 1.96 1.11 -1.26 -4.43 119.66 115.21 2hgq s GLN 32 Ca -0.01 -1.55 0.01 0.00 0.01 0.00 0.00 55.36 53.83 2hgq s GLN 32 Cb 0.04 -3.84 0.02 0.00 -1.01 0.00 0.00 33.01 28.21 2hgq s GLN 32 CO 0.09 -1.03 -0.12 -1.14 0.01 0.00 0.00 175.29 173.10 2hgq s GLN 33 N 1.42 1.81 -0.58 2.91 0.74 -1.20 -4.93 119.66 119.83 2hgq s GLN 33 Ca 0.04 -0.42 -0.18 0.00 0.05 0.00 0.00 55.36 54.85 2hgq s GLN 33 Cb -0.24 -1.59 0.11 0.00 1.10 0.00 0.00 33.01 32.39 2hgq s GLN 33 CO 0.01 -0.08 0.64 -2.00 -0.55 0.00 0.00 175.29 173.32 2hgq s GLU 34 N 1.03 3.03 -0.18 1.67 2.12 -1.26 -0.95 118.70 124.15 2hgq s GLU 34 Ca -0.07 -1.43 -0.09 0.00 0.36 0.00 0.00 54.97 53.74 2hgq s GLU 34 Cb -0.15 -4.27 -0.05 0.00 0.26 0.00 0.00 34.13 29.92 2hgq s GLU 34 CO -0.01 -1.47 0.12 -0.98 -0.54 0.00 0.00 175.26 172.38 2hgq s ARG 35 N 2.37 4.01 -0.53 4.30 1.70 0.33 -4.94 118.95 126.18 2hgq s ARG 35 Ca 0.09 -0.22 -0.21 0.00 -0.47 0.00 0.00 55.73 54.92 2hgq s ARG 35 Cb -0.26 -3.34 0.05 0.00 -0.57 0.00 0.00 34.95 30.84 2hgq s ARG 35 CO 0.05 0.39 0.75 0.14 -1.08 0.00 0.00 175.30 175.56 2hgq s VAL 36 N 0.09 4.68 -0.33 4.99 -7.23 -1.26 -0.98 120.40 120.36 2hgq s VAL 36 Ca 0.09 -0.23 -0.11 0.00 -1.81 0.00 0.00 61.98 59.92 2hgq s VAL 36 Cb -0.11 -4.40 -0.00 0.00 0.56 0.00 0.00 36.38 32.42 2hgq s VAL 36 CO -0.01 -0.95 0.19 -0.22 -0.31 0.00 0.00 175.10 173.80 2hgq s LEU 37 N 3.15 4.32 -0.27 1.32 2.96 0.24 -4.99 118.68 125.41 2hgq s LEU 37 Ca 0.21 -0.57 -0.29 0.00 -0.22 0.00 0.00 54.13 53.26 2hgq s LEU 37 Cb -0.17 -2.05 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 2hgq s LEU 37 CO 0.14 -0.24 1.44 -1.83 -1.32 0.00 0.00 176.35 174.54 2hgq s GLU 38 N 1.64 3.85 -0.88 1.98 1.03 -1.26 -1.08 118.70 123.97 2hgq s GLU 38 Ca 0.05 1.40 -0.23 0.00 0.03 0.00 0.00 54.97 56.22 2hgq s GLU 38 Cb -0.17 -3.95 -0.19 0.00 -0.80 0.00 0.00 34.13 29.01 2hgq s GLU 38 CO 0.08 -1.21 2.07 -3.47 -1.33 0.00 0.00 175.26 171.39 2hgq n ASP 39 N 8.02 0.92 -4.63 0.83 2.03 -0.23 -4.71 116.55 118.79 2hgq n ASP 39 Ca 0.16 -2.02 -0.38 0.00 0.52 0.00 0.00 54.79 53.07 2hgq n ASP 39 Cb 0.46 -1.53 -0.09 0.00 -0.72 0.00 0.00 41.12 39.24 2hgq n ASP 39 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2hgq s THR 40 N 14.02 5.22 0.52 5.18 2.01 -1.26 -4.55 115.64 136.78 2hgq s THR 40 Ca 0.78 0.51 0.34 0.00 0.31 0.00 0.00 61.69 63.63 2hgq s THR 40 Cb -0.10 -3.66 0.53 0.00 0.01 0.00 0.00 72.50 69.27 2hgq s THR 40 CO 0.16 0.22 1.80 -0.65 -0.69 0.00 0.00 174.62 175.45 2hgq h PRO 41 N 7.91 0.06 0.00 4.92 0.11 -1.98 0.65 132.00 143.67 2hgq h PRO 41 Ca -0.34 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2hgq h PRO 41 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2hgq h PRO 41 CO 0.65 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.48 2hgq n ALA 42 N -2.72 0.00 -0.19 -0.75 0.00 -1.26 -0.78 120.51 114.81 2hgq n ALA 42 Ca 0.25 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.76 2hgq n ALA 42 Cb 1.19 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.76 2hgq n ALA 42 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2hgq n ILE 43 N -0.25 -0.23 0.00 0.00 2.08 -1.15 0.11 119.36 119.92 2hgq n ILE 43 Ca 0.00 1.20 0.00 0.00 0.56 0.00 0.00 62.75 64.51 2hgq n ILE 43 Cb 0.00 -1.72 0.00 0.00 -0.75 0.00 0.00 39.64 37.17 2hgq n ILE 43 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2hgq n ARG 44 N -4.74 0.00 -0.14 0.38 1.74 0.21 -1.42 116.66 112.69 2hgq n ARG 44 Ca 0.11 0.47 0.03 0.00 -0.77 0.00 0.00 57.85 57.69 2hgq n ARG 44 Cb 0.36 -1.45 0.06 0.00 -1.02 0.00 0.00 32.46 30.40 2hgq n ARG 44 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hgq n GLY 45 N -0.86 -0.63 0.28 -0.13 0.00 0.29 0.29 105.19 104.43 2hgq n GLY 45 Ca 0.00 0.40 -0.16 0.00 0.00 0.00 0.00 46.02 46.27 2hgq n GLY 45 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2hgq h ASN 46 N 0.00 -0.56 -0.50 1.61 -0.73 -0.93 -0.34 115.58 114.13 2hgq h ASN 46 Ca 0.19 -0.04 0.08 0.00 1.87 0.00 0.00 56.30 58.40 2hgq h ASN 46 Cb 0.29 0.14 -0.03 0.00 0.27 0.00 0.00 38.32 39.00 2hgq h ASN 46 CO -0.39 -0.30 0.34 0.58 -0.37 0.00 0.00 177.43 177.28 2hgq h VAL 47 N -0.79 0.92 -0.25 2.57 2.07 0.54 -1.10 116.25 120.22 2hgq h VAL 47 Ca -0.07 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 2hgq h VAL 47 Cb 0.56 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2hgq h VAL 47 CO 0.11 0.06 -0.04 1.05 0.02 0.00 0.00 177.57 178.78 2hgq h GLU 48 N 0.35 0.46 -0.04 1.57 4.11 -0.51 -0.39 114.58 120.13 2hgq h GLU 48 Ca 0.23 -0.17 0.01 0.00 0.07 0.00 0.00 59.36 59.50 2hgq h GLU 48 Cb 0.44 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2hgq h GLU 48 CO -0.05 0.67 -0.21 -0.22 0.07 0.00 0.00 179.01 179.27 2hgq h LYS 49 N 0.22 -0.22 -0.87 1.06 3.64 -0.23 -2.30 116.57 117.86 2hgq h LYS 49 Ca 0.07 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.54 2hgq h LYS 49 Cb 0.49 0.05 -0.10 0.00 -0.41 0.00 0.00 32.23 32.25 2hgq h LYS 49 CO 0.02 -0.15 -0.51 0.28 -2.27 0.00 0.00 179.45 176.82 2hgq n VAL 50 N -3.64 -0.59 -3.58 2.00 0.31 -0.49 -4.80 118.33 107.54 2hgq n VAL 50 Ca -0.02 2.10 0.00 0.00 -0.01 0.00 0.00 64.34 66.40 2hgq n VAL 50 Cb 0.15 -2.59 0.00 0.00 -0.91 0.00 0.00 33.84 30.48 2hgq n VAL 50 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hgq n ALA 51 N -3.35 0.00 0.00 3.52 0.00 -0.18 -3.94 120.51 116.56 2hgq n ALA 51 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2hgq n ALA 51 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 2hgq n ALA 51 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2hgq n HIS 52 N 0.00 0.00 0.00 0.00 1.44 -1.26 -1.02 115.22 114.38 2hgq n HIS 52 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2hgq n HIS 52 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2hgq n HIS 52 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2hgq n LEU 53 N 0.00 0.00 -4.10 2.39 4.77 -1.25 -4.60 117.00 114.20 2hgq n LEU 53 Ca 0.00 0.04 -0.12 0.00 -0.03 0.00 0.00 56.01 55.90 2hgq n LEU 53 Cb 0.00 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2hgq n LEU 53 CO 0.00 -0.04 0.03 0.54 -1.33 0.00 0.00 177.39 176.59 2hgq s VAL 54 N -1.96 0.00 -0.31 4.08 0.11 -0.19 -0.68 120.40 121.46 2hgq s VAL 54 Ca 0.00 -1.67 -0.07 0.00 -2.93 0.00 0.00 61.98 57.31 2hgq s VAL 54 Cb 0.00 -2.43 0.02 0.00 -1.53 0.00 0.00 36.38 32.43 2hgq s VAL 54 CO 0.00 0.00 0.10 -0.60 -3.33 0.00 0.00 175.10 171.27 2hgq s ARG 55 N -3.74 2.97 -0.19 1.54 6.06 -0.31 -4.85 118.95 120.44 2hgq s ARG 55 Ca 0.31 -0.94 -0.02 0.00 -2.50 0.00 0.00 55.73 52.57 2hgq s ARG 55 Cb 0.02 -3.43 -0.01 0.00 0.06 0.00 0.00 34.95 31.59 2hgq s ARG 55 CO 0.14 -0.51 -0.08 0.54 -2.50 0.00 0.00 175.30 172.89 2hgq s VAL 56 N 1.49 3.24 0.01 7.11 0.11 -1.26 -0.58 120.40 130.50 2hgq s VAL 56 Ca 0.02 -0.56 0.01 0.00 -2.93 0.00 0.00 61.98 58.52 2hgq s VAL 56 Cb -0.18 -2.43 -0.01 0.00 -1.53 0.00 0.00 36.38 32.23 2hgq s VAL 56 CO 0.03 0.46 -0.04 -1.61 -3.33 0.00 0.00 175.10 170.62 2hgq s GLU 57 N 1.07 0.29 -0.67 1.54 2.02 -0.11 -5.00 118.70 117.84 2hgq s GLU 57 Ca 0.00 -0.26 -0.26 0.00 0.02 0.00 0.00 54.97 54.47 2hgq s GLU 57 Cb -0.15 -0.20 0.04 0.00 0.10 0.00 0.00 34.13 33.92 2hgq s GLU 57 CO -0.01 0.05 1.17 0.08 0.02 0.00 0.00 175.26 176.57 2hgq s VAL 58 N -0.42 3.96 -0.35 2.63 1.01 -1.26 -1.13 120.40 124.84 2hgq s VAL 58 Ca -0.03 0.40 -0.04 0.00 0.00 0.00 0.00 61.98 62.32 2hgq s VAL 58 Cb -0.03 -4.79 0.07 0.00 0.00 0.00 0.00 36.38 31.62 2hgq s VAL 58 CO -0.00 -1.58 0.11 -0.69 0.00 0.00 0.00 175.10 172.94 2hgq s VAL 59 N 5.08 3.33 0.00 2.92 1.01 0.12 -5.01 120.40 127.84 2hgq s VAL 59 Ca 0.34 -1.58 0.00 0.00 0.00 0.00 0.00 61.98 60.75 2hgq s VAL 59 Cb -0.10 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2hgq s VAL 59 CO 0.17 -0.36 0.00 1.21 0.00 0.00 0.00 175.10 176.13