#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hb8 h GLN 2 N 0.00 1.24 -0.32 4.33 5.75 -2.01 -1.32 115.11 122.77 1hb8 h GLN 2 Ca 0.00 -0.09 0.02 0.00 -0.15 0.00 0.00 58.65 58.43 1hb8 h GLN 2 Cb 0.00 -0.27 -0.02 0.00 1.07 0.00 0.00 27.48 28.26 1hb8 h GLN 2 CO 0.00 0.84 0.17 0.00 -2.65 0.00 0.00 178.83 177.19 1hb8 h ALA 3 N 1.32 0.40 -0.41 3.38 0.00 -2.05 0.64 119.26 122.54 1hb8 h ALA 3 Ca 0.34 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.17 1hb8 h ALA 3 Cb -0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1hb8 h ALA 3 CO -0.07 -0.20 -0.09 1.49 0.00 0.00 0.00 179.25 180.38 1hb8 h GLU 4 N 0.35 0.71 -0.10 0.00 4.81 -1.92 -2.09 114.58 116.35 1hb8 h GLU 4 Ca 0.13 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1hb8 h GLU 4 Cb 0.03 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1hb8 h GLU 4 CO -0.08 0.79 0.02 0.35 -0.73 0.00 0.00 179.01 179.36 1hb8 h PHE 5 N 0.65 0.16 -0.50 0.92 3.57 -0.74 -1.21 116.94 119.80 1hb8 h PHE 5 Ca 0.12 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1hb8 h PHE 5 Cb 0.54 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 1hb8 h PHE 5 CO 0.03 0.33 0.33 -0.44 -2.23 0.00 0.00 178.31 176.32 1hb8 h ASP 6 N -0.05 0.57 -0.18 0.41 3.32 -0.73 -0.26 116.42 119.49 1hb8 h ASP 6 Ca 0.03 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 1hb8 h ASP 6 Cb 0.25 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1hb8 h ASP 6 CO 0.00 0.42 -0.25 0.50 -1.72 0.00 0.00 179.24 178.18 1hb8 h LYS 7 N 0.67 0.49 -0.74 3.56 3.64 -1.18 -2.72 116.57 120.30 1hb8 h LYS 7 Ca 0.18 -0.29 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 1hb8 h LYS 7 Cb -0.07 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 1hb8 h LYS 7 CO -0.04 0.88 0.41 0.00 -2.27 0.00 0.00 179.45 178.43 1hb8 h ALA 8 N 0.61 1.32 0.00 5.00 0.00 -0.66 -0.54 119.26 124.99 1hb8 h ALA 8 Ca 0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1hb8 h ALA 8 Cb 0.82 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1hb8 h ALA 8 CO 0.06 0.56 -0.13 0.00 0.00 0.00 0.00 179.25 179.74 1hb8 h ALA 9 N 1.41 1.54 0.14 0.00 0.00 -0.98 -1.25 119.26 120.12 1hb8 h ALA 9 Ca 0.26 -0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.82 1hb8 h ALA 9 Cb 0.02 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.80 1hb8 h ALA 9 CO -0.04 0.16 -1.11 0.93 0.00 0.00 0.00 179.25 179.18 1hb8 h GLU 10 N 0.00 0.29 -0.45 0.00 4.39 -0.91 -3.37 114.58 114.53 1hb8 h GLU 10 Ca -0.00 -0.49 -0.07 0.00 0.34 0.00 0.00 59.36 59.14 1hb8 h GLU 10 Cb 0.27 0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 1hb8 h GLU 10 CO 0.02 1.23 -0.02 0.93 -1.16 0.00 0.00 179.01 180.01 1hb8 h GLU 11 N -0.32 0.74 0.00 2.33 5.08 -0.92 -2.73 114.58 118.76 1hb8 h GLU 11 Ca -0.22 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1hb8 h GLU 11 Cb 1.72 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.88 1hb8 h GLU 11 CO 0.12 0.77 0.00 -0.24 -1.00 0.00 0.00 179.01 178.65 1hb8 h VAL 12 N 0.69 0.00 0.00 3.13 3.04 -1.38 0.00 116.25 121.73 1hb8 h VAL 12 Ca 0.13 -0.10 0.00 0.00 -1.01 0.00 0.00 66.70 65.72 1hb8 h VAL 12 Cb 0.46 1.07 0.00 0.00 -2.01 0.00 0.00 31.29 30.81 1hb8 h VAL 12 CO 0.02 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 176.87 1hb8 n LYS 13 N -3.03 0.21 -0.39 4.17 5.02 -1.03 -3.27 118.16 119.85 1hb8 n LYS 13 Ca -0.02 0.36 0.09 0.00 -2.02 0.00 0.00 58.31 56.72 1hb8 n LYS 13 Cb 0.12 -1.85 0.28 0.00 -0.02 0.00 0.00 35.03 33.55 1hb8 n LYS 13 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1hb8 n HIS 14 N -2.24 0.97 -1.68 2.13 8.25 -0.01 -5.00 115.22 117.64 1hb8 n HIS 14 Ca 0.03 -0.57 -0.44 0.00 -0.26 0.00 0.00 57.72 56.48 1hb8 n HIS 14 Cb 0.28 -0.11 -0.02 0.00 1.12 0.00 0.00 29.99 31.26 1hb8 n HIS 14 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1hb8 n LEU 15 N 0.96 3.22 0.23 2.41 4.77 -1.20 -4.50 117.00 122.90 1hb8 n LEU 15 Ca 0.21 1.15 0.10 0.00 -0.03 0.00 0.00 56.01 57.43 1hb8 n LEU 15 Cb 0.67 -1.44 0.56 0.00 -2.33 0.00 0.00 43.42 40.88 1hb8 n LEU 15 CO 0.16 -0.44 0.86 0.11 -1.33 0.00 0.00 177.39 176.75 1hb8 h LYS 16 N 4.18 0.00 -4.09 3.23 1.57 -1.30 -3.45 116.57 116.70 1hb8 h LYS 16 Ca -0.45 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.21 1hb8 h LYS 16 Cb 1.27 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.44 1hb8 h LYS 16 CO 0.75 0.20 -0.54 0.95 -0.57 0.00 0.00 179.45 180.25 1hb8 s THR 17 N -3.94 0.17 0.01 -0.16 -4.23 -1.26 -5.11 115.64 101.11 1hb8 s THR 17 Ca -0.01 -1.58 -0.30 0.00 -1.18 0.00 0.00 61.69 58.62 1hb8 s THR 17 Cb 0.12 -1.55 -0.06 0.00 1.34 0.00 0.00 72.50 72.35 1hb8 s THR 17 CO 0.62 -0.76 1.52 -0.75 -0.54 0.00 0.00 174.62 174.72 1hb8 s LYS 18 N -3.92 4.23 1.00 3.99 2.20 -1.26 -5.01 119.74 120.97 1hb8 s LYS 18 Ca 0.09 2.11 -0.15 0.00 -0.36 0.00 0.00 55.97 57.66 1hb8 s LYS 18 Cb 0.06 -3.66 0.19 0.00 -1.51 0.00 0.00 37.83 32.91 1hb8 s LYS 18 CO -0.08 -0.68 1.19 -1.25 -0.36 0.00 0.00 175.35 174.16 1hb8 s PRO 19 N 2.81 0.40 0.73 4.03 0.04 -1.26 -5.02 135.00 136.74 1hb8 s PRO 19 Ca 0.68 -0.01 -0.13 0.00 0.04 0.00 0.00 61.00 61.58 1hb8 s PRO 19 Cb -0.34 -1.78 0.04 0.00 0.04 0.00 0.00 34.50 32.46 1hb8 s PRO 19 CO 0.28 -2.64 1.13 0.00 0.04 0.00 0.00 177.00 175.82 1hb8 s ALA 20 N -3.39 2.23 0.23 8.56 0.00 -1.26 -4.79 121.76 123.34 1hb8 s ALA 20 Ca 0.69 0.55 -0.06 0.00 0.00 0.00 0.00 51.96 53.14 1hb8 s ALA 20 Cb -0.10 -3.35 0.35 0.00 0.00 0.00 0.00 23.12 20.02 1hb8 s ALA 20 CO 0.54 -1.69 1.80 0.22 0.00 0.00 0.00 175.76 176.63 1hb8 h ASP 21 N -0.55 0.61 0.22 0.00 3.58 -1.99 -0.76 116.42 117.53 1hb8 h ASP 21 Ca -0.46 0.05 -0.08 0.00 0.42 0.00 0.00 57.03 56.96 1hb8 h ASP 21 Cb 1.26 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 42.22 1hb8 h ASP 21 CO 0.51 0.36 -0.32 1.05 -2.88 0.00 0.00 179.24 177.96 1hb8 h GLU 22 N 0.74 0.17 -0.22 0.28 9.09 -1.99 -0.63 114.58 122.01 1hb8 h GLU 22 Ca 0.37 -0.06 -0.21 0.00 0.05 0.00 0.00 59.36 59.51 1hb8 h GLU 22 Cb 0.33 -0.01 0.01 0.00 -1.65 0.00 0.00 28.75 27.42 1hb8 h GLU 22 CO -0.24 0.47 -0.68 0.93 0.05 0.00 0.00 179.01 179.55 1hb8 h GLU 23 N 0.15 0.84 -0.45 1.06 5.08 -1.67 -1.91 114.58 117.68 1hb8 h GLU 23 Ca 0.02 -0.62 -0.00 0.00 -1.00 0.00 0.00 59.36 57.76 1hb8 h GLU 23 Cb 0.64 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1hb8 h GLU 23 CO 0.05 1.23 0.26 1.98 -1.00 0.00 0.00 179.01 181.53 1hb8 h MET 24 N 0.61 0.62 -0.14 2.33 4.05 -0.83 -1.51 114.93 120.06 1hb8 h MET 24 Ca -0.02 -0.06 -0.08 0.00 -0.28 0.00 0.00 59.70 59.25 1hb8 h MET 24 Cb 1.30 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.96 1hb8 h MET 24 CO 0.14 0.47 -0.29 -0.07 0.23 0.00 0.00 176.91 177.40 1hb8 h LEU 25 N 0.60 0.26 -0.28 3.39 3.38 -1.08 -0.34 115.31 121.24 1hb8 h LEU 25 Ca 0.16 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1hb8 h LEU 25 Cb 0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1hb8 h LEU 25 CO -0.03 0.55 0.04 0.15 0.09 0.00 0.00 178.44 179.24 1hb8 h PHE 26 N 0.23 0.50 -0.28 1.13 3.04 -0.92 -0.50 116.94 120.14 1hb8 h PHE 26 Ca 0.03 -0.07 -0.01 0.00 3.98 0.00 0.00 57.97 61.90 1hb8 h PHE 26 Cb 0.63 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 39.00 1hb8 h PHE 26 CO 0.01 0.58 0.12 0.82 -2.02 0.00 0.00 178.31 177.82 1hb8 h ILE 27 N 0.28 1.16 0.38 1.41 1.08 -0.97 -2.17 117.51 118.68 1hb8 h ILE 27 Ca 0.08 -0.48 -0.02 0.00 -0.39 0.00 0.00 64.86 64.06 1hb8 h ILE 27 Cb 0.35 0.96 0.00 0.00 -3.07 0.00 0.00 36.82 35.07 1hb8 h ILE 27 CO 0.01 0.17 -0.18 0.22 -0.69 0.00 0.00 178.15 177.67 1hb8 h TYR 28 N 0.31 -0.48 -0.57 1.37 3.20 -0.94 -0.80 116.97 119.07 1hb8 h TYR 28 Ca 0.09 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.01 1hb8 h TYR 28 Cb 0.15 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.53 1hb8 h TYR 28 CO -0.01 -0.24 0.30 0.66 -1.64 0.00 0.00 178.16 177.22 1hb8 h SER 29 N -0.61 0.43 0.62 -2.11 4.64 -1.12 -1.70 113.55 113.70 1hb8 h SER 29 Ca -0.05 0.03 -0.11 0.00 -0.47 0.00 0.00 61.79 61.19 1hb8 h SER 29 Cb 0.45 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1hb8 h SER 29 CO 0.09 0.29 -0.54 0.45 -0.87 0.00 0.00 176.83 176.24 1hb8 h HIS 30 N 0.56 0.00 -0.32 4.77 3.86 -1.37 -0.69 115.15 121.97 1hb8 h HIS 30 Ca 0.26 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.43 1hb8 h HIS 30 Cb 0.17 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1hb8 h HIS 30 CO -0.10 0.54 0.05 -0.92 0.86 0.00 0.00 177.93 178.36 1hb8 h TYR 31 N 0.00 0.56 -0.49 2.45 3.20 -0.51 -0.37 116.97 121.82 1hb8 h TYR 31 Ca -0.01 -0.08 -0.10 0.00 3.14 0.00 0.00 58.73 61.68 1hb8 h TYR 31 Cb 0.99 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 1hb8 h TYR 31 CO 0.00 0.61 -0.10 0.87 -1.64 0.00 0.00 178.16 177.90 1hb8 h LYS 32 N 0.36 0.93 -0.23 1.82 1.79 -1.18 -1.67 116.57 118.39 1hb8 h LYS 32 Ca 0.10 -0.35 -0.05 0.00 -2.18 0.00 0.00 60.65 58.17 1hb8 h LYS 32 Cb 0.35 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 1hb8 h LYS 32 CO 0.01 1.00 -0.10 0.37 -1.08 0.00 0.00 179.45 179.65 1hb8 h GLN 33 N 0.79 0.36 0.00 3.15 5.75 -0.99 0.22 115.11 124.39 1hb8 h GLN 33 Ca 0.13 -0.09 0.00 0.00 -0.15 0.00 0.00 58.65 58.54 1hb8 h GLN 33 Cb 0.65 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.15 1hb8 h GLN 33 CO 0.04 0.47 -0.40 0.00 -2.65 0.00 0.00 178.83 176.30 1hb8 h ALA 34 N 1.56 0.79 0.00 3.38 0.00 -0.86 -2.83 119.26 121.29 1hb8 h ALA 34 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.65 1hb8 h ALA 34 Cb 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1hb8 h ALA 34 CO 0.02 0.00 -2.15 0.25 0.00 0.00 0.00 179.25 177.38 1hb8 n THR 35 N -2.73 1.13 -0.06 0.00 -2.24 -0.65 -4.78 114.28 104.96 1hb8 n THR 35 Ca 0.03 -0.34 -0.21 0.00 -2.27 0.00 0.00 64.05 61.25 1hb8 n THR 35 Cb 0.51 -1.56 -0.13 0.00 -2.10 0.00 0.00 70.33 67.05 1hb8 n THR 35 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1hb8 n VAL 36 N -3.61 1.65 0.00 2.28 0.31 0.72 -5.09 118.33 114.60 1hb8 n VAL 36 Ca -0.39 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 63.43 1hb8 n VAL 36 Cb 0.82 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.03 1hb8 n VAL 36 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1hb8 n GLY 37 N 1.91 0.19 3.71 2.92 0.00 -0.94 -5.00 105.19 107.98 1hb8 n GLY 37 Ca -0.37 -1.93 -0.40 0.00 0.00 0.00 0.00 46.02 43.32 1hb8 n GLY 37 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1hb8 n ASP 38 N 0.00 2.50 -4.64 1.61 8.00 -1.26 -4.21 116.55 118.55 1hb8 n ASP 38 Ca 0.00 1.04 -0.47 0.00 0.71 0.00 0.00 54.79 56.07 1hb8 n ASP 38 Cb 0.00 -1.52 -0.04 0.00 -0.02 0.00 0.00 41.12 39.53 1hb8 n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hb8 n ILE 39 N -0.60 0.31 -2.12 0.53 3.06 -1.26 -4.90 119.36 114.38 1hb8 n ILE 39 Ca 0.08 -0.08 0.04 0.00 -2.50 0.00 0.00 62.75 60.30 1hb8 n ILE 39 Cb 0.42 -1.28 0.07 0.00 0.54 0.00 0.00 39.64 39.39 1hb8 n ILE 39 CO 0.00 0.00 0.00 -0.46 -2.50 0.00 0.00 176.55 173.59 1hb8 n ASN 40 N 2.77 1.10 -4.53 9.51 6.94 -1.26 -5.09 115.26 124.70 1hb8 n ASN 40 Ca 0.16 -2.52 -0.25 0.00 -0.02 0.00 0.00 54.58 51.95 1hb8 n ASN 40 Cb 0.27 -0.35 -0.11 0.00 -2.36 0.00 0.00 39.78 37.23 1hb8 n ASN 40 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1hb8 s THR 41 N -0.95 1.64 0.05 5.53 -4.23 -1.26 -5.13 115.64 111.29 1hb8 s THR 41 Ca 0.30 -2.01 -0.24 0.00 -1.18 0.00 0.00 61.69 58.55 1hb8 s THR 41 Cb 0.32 -2.87 -0.06 0.00 1.34 0.00 0.00 72.50 71.23 1hb8 s THR 41 CO -0.11 -0.02 0.75 -1.61 -0.54 0.00 0.00 174.62 173.09 1hb8 s GLU 42 N -3.79 4.48 0.24 3.99 0.41 -1.26 -5.02 118.70 117.76 1hb8 s GLU 42 Ca 0.35 1.04 -0.30 0.00 -0.41 0.00 0.00 54.97 55.65 1hb8 s GLU 42 Cb 0.09 -3.35 -0.10 0.00 -1.78 0.00 0.00 34.13 28.98 1hb8 s GLU 42 CO 0.17 0.31 1.50 0.50 -0.49 0.00 0.00 175.26 177.25 1hb8 s ARG 43 N -0.15 4.22 0.91 1.61 3.52 -1.26 -4.96 118.95 122.84 1hb8 s ARG 43 Ca 0.37 2.38 -0.10 0.00 -0.13 0.00 0.00 55.73 58.25 1hb8 s ARG 43 Cb -0.20 -3.10 0.14 0.00 -1.56 0.00 0.00 34.95 30.23 1hb8 s ARG 43 CO 0.23 -0.51 1.12 -2.30 -0.81 0.00 0.00 175.30 173.03 1hb8 n PRO 44 N 2.61 -0.39 -0.78 5.12 -0.02 -1.26 -5.03 135.00 135.24 1hb8 n PRO 44 Ca 0.08 -0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1hb8 n PRO 44 Cb 0.39 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1hb8 n PRO 44 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1hb8 n GLY 45 N 0.36 6.13 7.00 -1.23 0.00 -1.26 -4.83 105.19 111.37 1hb8 n GLY 45 Ca 0.12 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1hb8 n GLY 45 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1hb8 n MET 46 N 0.00 0.00 -0.63 1.61 2.81 -1.26 -2.36 117.12 117.29 1hb8 n MET 46 Ca 0.00 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 55.92 1hb8 n MET 46 Cb 0.00 0.00 0.26 0.00 -0.71 0.00 0.00 33.22 32.77 1hb8 n MET 46 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1hb8 n LEU 47 N 0.00 4.35 -3.88 4.03 4.77 -1.26 -4.72 117.00 120.29 1hb8 n LEU 47 Ca 0.00 -2.22 -0.42 0.00 -0.03 0.00 0.00 56.01 53.34 1hb8 n LEU 47 Cb 0.00 -0.64 0.00 0.00 -2.33 0.00 0.00 43.42 40.46 1hb8 n LEU 47 CO 0.00 0.54 2.15 -0.67 -1.33 0.00 0.00 177.39 178.08 1hb8 n ASP 48 N 0.32 4.72 0.19 -1.43 2.03 -1.00 -4.70 116.55 116.69 1hb8 n ASP 48 Ca 0.21 -3.02 0.06 0.00 0.52 0.00 0.00 54.79 52.56 1hb8 n ASP 48 Cb 0.93 -1.55 0.36 0.00 -0.72 0.00 0.00 41.12 40.14 1hb8 n ASP 48 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 1hb8 h PHE 49 N 5.95 0.00 -0.12 -0.67 0.04 -1.87 -0.67 116.94 119.60 1hb8 h PHE 49 Ca 0.45 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.20 1hb8 h PHE 49 Cb 0.65 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.80 1hb8 h PHE 49 CO 1.31 0.37 0.03 -0.22 -0.60 0.00 0.00 178.31 179.20 1hb8 h LYS 50 N 0.00 0.19 -0.34 1.51 3.64 -2.00 -1.07 116.57 118.49 1hb8 h LYS 50 Ca -0.00 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 1hb8 h LYS 50 Cb 0.85 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.63 1hb8 h LYS 50 CO 0.05 0.35 -0.22 0.78 -2.27 0.00 0.00 179.45 178.14 1hb8 h GLY 51 N -0.02 0.71 1.37 5.01 0.00 -1.88 -2.87 103.07 105.39 1hb8 h GLY 51 Ca 0.04 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.68 1hb8 h GLY 51 CO 0.00 0.54 -0.19 0.50 0.00 0.00 0.00 176.54 177.39 1hb8 h LYS 52 N 0.58 0.74 -0.63 4.80 1.57 -0.99 -1.30 116.57 121.34 1hb8 h LYS 52 Ca 0.08 -0.27 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1hb8 h LYS 52 Cb 0.69 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 1hb8 h LYS 52 CO 0.05 0.87 0.17 0.00 -0.57 0.00 0.00 179.45 179.98 1hb8 h ALA 53 N 1.14 0.83 -0.30 3.86 0.00 -1.07 -1.26 119.26 122.46 1hb8 h ALA 53 Ca 0.10 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1hb8 h ALA 53 Cb 0.67 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1hb8 h ALA 53 CO 0.05 0.52 -0.14 0.87 0.00 0.00 0.00 179.25 180.55 1hb8 h LYS 54 N 0.92 0.63 -0.40 0.00 1.57 -1.38 -2.30 116.57 115.62 1hb8 h LYS 54 Ca 0.20 -0.28 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1hb8 h LYS 54 Cb 0.33 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 1hb8 h LYS 54 CO -0.00 0.86 0.25 2.35 -0.57 0.00 0.00 179.45 182.34 1hb8 h TRP 55 N 0.39 0.51 -0.74 -1.35 7.01 -1.13 -1.83 115.95 118.80 1hb8 h TRP 55 Ca 0.07 0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.03 1hb8 h TRP 55 Cb 0.67 -0.17 -0.03 0.00 -2.10 0.00 0.00 29.16 27.52 1hb8 h TRP 55 CO 0.06 0.34 0.30 -0.44 -2.79 0.00 0.00 178.44 175.91 1hb8 h ASP 56 N 0.53 1.01 -0.68 2.65 3.32 -1.21 -0.01 116.42 122.02 1hb8 h ASP 56 Ca 0.14 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 1hb8 h ASP 56 Cb -0.03 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 1hb8 h ASP 56 CO -0.03 0.89 0.15 0.00 -1.72 0.00 0.00 179.24 178.52 1hb8 h ALA 57 N 1.26 0.90 -0.27 3.45 0.00 -1.04 -1.30 119.26 122.25 1hb8 h ALA 57 Ca 0.25 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1hb8 h ALA 57 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1hb8 h ALA 57 CO -0.02 0.64 -0.14 2.35 0.00 0.00 0.00 179.25 182.07 1hb8 h TRP 58 N 1.03 0.67 -0.72 0.00 7.01 -1.04 -2.92 115.95 119.99 1hb8 h TRP 58 Ca 0.21 -0.17 0.09 0.00 2.11 0.00 0.00 58.89 61.13 1hb8 h TRP 58 Cb 0.40 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.26 1hb8 h TRP 58 CO 0.03 0.83 0.47 -0.97 -2.79 0.00 0.00 178.44 176.01 1hb8 h ASN 59 N 0.32 0.56 0.47 2.65 -1.24 -0.74 -0.33 115.58 117.26 1hb8 h ASN 59 Ca 0.06 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.08 1hb8 h ASN 59 Cb 0.66 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.61 1hb8 h ASN 59 CO 0.04 0.34 0.00 -0.33 -1.29 0.00 0.00 177.43 176.19 1hb8 h GLU 60 N 0.62 0.00 -0.07 6.67 4.39 -1.04 -2.32 114.58 122.83 1hb8 h GLU 60 Ca 0.33 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.03 1hb8 h GLU 60 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1hb8 h GLU 60 CO -0.11 0.00 0.00 1.28 -1.16 0.00 0.00 179.01 179.02 1hb8 n LEU 61 N -3.08 1.81 -4.58 1.33 4.77 -0.14 -4.96 117.00 112.16 1hb8 n LEU 61 Ca -0.01 -0.65 -0.52 0.00 -0.03 0.00 0.00 56.01 54.79 1hb8 n LEU 61 Cb 0.18 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1hb8 n LEU 61 CO 0.23 0.33 0.87 1.17 -1.33 0.00 0.00 177.39 178.66 1hb8 n LYS 62 N 0.41 1.08 0.00 3.23 4.81 -0.88 -0.81 118.16 126.00 1hb8 n LYS 62 Ca 0.18 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 1hb8 n LYS 62 Cb 0.39 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.43 1hb8 n LYS 62 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1hb8 n GLY 63 N 2.43 1.32 3.73 3.14 0.00 -1.26 -5.06 105.19 109.50 1hb8 n GLY 63 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1hb8 n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hb8 s THR 64 N -2.36 4.04 0.56 2.61 2.01 0.01 -5.01 115.64 117.50 1hb8 s THR 64 Ca 0.00 1.67 -0.18 0.00 0.31 0.00 0.00 61.69 63.49 1hb8 s THR 64 Cb 0.00 -4.07 -0.05 0.00 0.01 0.00 0.00 72.50 68.39 1hb8 s THR 64 CO 0.00 0.24 1.08 -0.94 -0.69 0.00 0.00 174.62 174.32 1hb8 s SER 65 N 0.21 5.78 0.25 3.53 1.04 -1.26 -4.83 113.70 118.42 1hb8 s SER 65 Ca 0.51 1.99 -0.05 0.00 0.48 0.00 0.00 55.95 58.88 1hb8 s SER 65 Cb -0.28 -2.56 0.34 0.00 0.10 0.00 0.00 66.02 63.62 1hb8 s SER 65 CO 0.33 -1.17 1.87 0.11 0.98 0.00 0.00 173.24 175.36 1hb8 h LYS 66 N 0.89 1.03 -0.46 4.02 1.79 -1.93 0.98 116.57 122.89 1hb8 h LYS 66 Ca -0.48 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 57.92 1hb8 h LYS 66 Cb 1.24 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 31.63 1hb8 h LYS 66 CO 0.57 0.68 0.28 0.93 -1.08 0.00 0.00 179.45 180.83 1hb8 h GLU 67 N 1.07 0.63 -0.34 3.15 4.39 -1.94 0.60 114.58 122.13 1hb8 h GLU 67 Ca 0.38 -0.06 -0.13 0.00 0.34 0.00 0.00 59.36 59.89 1hb8 h GLU 67 Cb 0.12 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1hb8 h GLU 67 CO -0.16 0.46 -0.33 -0.44 -1.16 0.00 0.00 179.01 177.38 1hb8 h ASP 68 N 0.61 0.80 -0.45 1.42 3.32 -1.78 -1.99 116.42 118.36 1hb8 h ASP 68 Ca 0.17 -0.33 -0.01 0.00 0.02 0.00 0.00 57.03 56.87 1hb8 h ASP 68 Cb -0.00 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 1hb8 h ASP 68 CO -0.03 1.06 0.24 0.00 -1.72 0.00 0.00 179.24 178.79 1hb8 h ALA 69 N 0.98 0.57 -0.35 3.45 0.00 -0.48 -1.21 119.26 122.22 1hb8 h ALA 69 Ca 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1hb8 h ALA 69 Cb 0.87 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1hb8 h ALA 69 CO 0.08 0.10 0.20 0.52 0.00 0.00 0.00 179.25 180.14 1hb8 h MET 70 N 0.58 0.48 -0.46 0.00 2.86 -0.77 -1.09 114.93 116.54 1hb8 h MET 70 Ca 0.16 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1hb8 h MET 70 Cb 0.06 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 1hb8 h MET 70 CO -0.02 0.39 0.29 -0.22 1.06 0.00 0.00 176.91 178.41 1hb8 h LYS 71 N 0.44 0.61 -0.55 1.72 3.64 -1.11 -0.05 116.57 121.27 1hb8 h LYS 71 Ca 0.12 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.38 1hb8 h LYS 71 Cb 0.05 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1hb8 h LYS 71 CO -0.02 0.42 0.03 0.00 -2.27 0.00 0.00 179.45 177.61 1hb8 h ALA 72 N 1.15 1.01 0.01 5.00 0.00 -1.10 -0.72 119.26 124.61 1hb8 h ALA 72 Ca 0.17 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1hb8 h ALA 72 Cb -0.04 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.53 1hb8 h ALA 72 CO -0.03 0.62 -0.00 -0.92 0.00 0.00 0.00 179.25 178.91 1hb8 h TYR 73 N 0.86 -0.01 -0.52 0.00 3.20 -0.81 -0.08 116.97 119.61 1hb8 h TYR 73 Ca 0.17 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.05 1hb8 h TYR 73 Cb 0.46 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 1hb8 h TYR 73 CO 0.03 0.15 0.34 0.82 -1.64 0.00 0.00 178.16 177.86 1hb8 h ILE 74 N -0.17 1.12 -0.55 1.81 2.04 -0.88 0.06 117.51 120.94 1hb8 h ILE 74 Ca -0.00 -0.24 -0.07 0.00 1.00 0.00 0.00 64.86 65.56 1hb8 h ILE 74 Cb 0.17 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1hb8 h ILE 74 CO 0.00 0.13 0.08 0.44 0.00 0.00 0.00 178.15 178.79 1hb8 h ASP 75 N 0.69 0.84 -0.40 1.72 3.32 -1.00 -1.70 116.42 119.89 1hb8 h ASP 75 Ca 0.20 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 1hb8 h ASP 75 Cb -0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.25 1hb8 h ASP 75 CO -0.05 0.86 -0.14 0.50 -1.72 0.00 0.00 179.24 178.69 1hb8 h LYS 76 N 0.84 0.80 -0.85 3.56 1.63 -0.54 -1.49 116.57 120.52 1hb8 h LYS 76 Ca 0.17 -0.33 -0.00 0.00 -0.85 0.00 0.00 60.65 59.64 1hb8 h LYS 76 Cb 0.39 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.94 1hb8 h LYS 76 CO 0.01 0.95 0.52 0.28 -3.45 0.00 0.00 179.45 177.75 1hb8 h VAL 77 N 0.61 1.23 -0.70 2.00 2.07 -0.75 0.90 116.25 121.62 1hb8 h VAL 77 Ca 0.10 -0.51 -0.07 0.00 0.82 0.00 0.00 66.70 67.04 1hb8 h VAL 77 Cb 0.67 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1hb8 h VAL 77 CO 0.05 0.24 0.17 -0.33 0.02 0.00 0.00 177.57 177.72 1hb8 h GLU 78 N 1.17 1.13 -0.49 1.57 4.39 -1.11 0.73 114.58 121.98 1hb8 h GLU 78 Ca 0.31 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1hb8 h GLU 78 Cb -0.06 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.43 1hb8 h GLU 78 CO -0.06 1.00 0.24 1.49 -1.16 0.00 0.00 179.01 180.52 1hb8 h GLU 79 N 1.06 0.71 -0.29 2.33 4.81 -0.25 -2.54 114.58 120.41 1hb8 h GLU 79 Ca 0.22 -0.10 -0.14 0.00 -0.13 0.00 0.00 59.36 59.20 1hb8 h GLU 79 Cb 0.38 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1hb8 h GLU 79 CO 0.00 0.59 -0.40 -0.07 -0.73 0.00 0.00 179.01 178.40 1hb8 h LEU 80 N 0.65 0.73 -0.64 1.64 3.38 -0.53 -1.91 115.31 118.63 1hb8 h LEU 80 Ca 0.17 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1hb8 h LEU 80 Cb 0.12 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 1hb8 h LEU 80 CO -0.02 1.05 0.40 0.11 0.09 0.00 0.00 178.44 180.06 1hb8 h LYS 81 N 0.57 0.76 -0.32 1.13 1.57 -0.69 0.15 116.57 119.74 1hb8 h LYS 81 Ca 0.05 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1hb8 h LYS 81 Cb 0.93 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 1hb8 h LYS 81 CO 0.08 0.50 -0.19 0.87 -0.57 0.00 0.00 179.45 180.15 1hb8 h LYS 82 N 0.78 0.69 -0.26 3.15 1.57 -1.34 0.45 116.57 121.60 1hb8 h LYS 82 Ca 0.26 -0.32 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 1hb8 h LYS 82 Cb 0.02 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1hb8 h LYS 82 CO -0.10 0.92 -0.21 -0.22 -0.57 0.00 0.00 179.45 179.26 1hb8 h LYS 83 N 0.45 0.61 0.00 3.15 3.64 -1.01 -3.37 116.57 120.04 1hb8 h LYS 83 Ca 0.07 -0.30 -0.00 0.00 -1.27 0.00 0.00 60.65 59.14 1hb8 h LYS 83 Cb 0.73 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1hb8 h LYS 83 CO 0.05 0.90 -1.55 0.66 -2.27 0.00 0.00 179.45 177.24 1hb8 n TYR 84 N -4.36 0.00 0.00 1.91 4.01 0.50 -5.09 117.16 114.13 1hb8 n TYR 84 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 1hb8 n TYR 84 Cb 0.42 -0.28 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1hb8 n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1hb8 n GLY 85 N 1.83 -2.60 0.00 2.72 0.00 0.16 -4.11 105.19 103.20 1hb8 n GLY 85 Ca -0.02 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1hb8 n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71