#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ww9 n VAL 22 N 0.00 0.00 -0.25 4.08 0.24 -1.26 -5.01 118.33 116.12 2ww9 n VAL 22 Ca 0.00 -0.98 -0.06 0.00 -2.04 0.00 0.00 64.34 61.27 2ww9 n VAL 22 Cb 0.00 0.26 0.05 0.00 -1.47 0.00 0.00 33.84 32.68 2ww9 n VAL 22 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2ww9 h GLU 23 N 0.00 0.97 -0.26 7.34 4.81 -2.05 -2.79 114.58 122.60 2ww9 h GLU 23 Ca -0.16 -0.10 -0.05 0.00 -0.13 0.00 0.00 59.36 58.92 2ww9 h GLU 23 Cb 0.51 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 2ww9 h GLU 23 CO 0.26 0.71 -0.05 0.00 -0.73 0.00 0.00 179.01 179.20 2ww9 h ALA 24 N 1.21 0.35 0.00 2.92 0.00 -1.99 -2.58 119.26 119.17 2ww9 h ALA 24 Ca 0.25 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2ww9 h ALA 24 Cb 0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2ww9 h ALA 24 CO -0.04 0.14 -0.21 -1.00 0.00 0.00 0.00 179.25 178.13 2ww9 h PRO 25 N 0.24 0.00 -0.18 0.00 0.13 -1.98 -2.52 132.00 127.70 2ww9 h PRO 25 Ca 0.07 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.01 2ww9 h PRO 25 Cb 0.51 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 2ww9 h PRO 25 CO 0.02 0.04 -0.64 -0.24 -0.23 0.00 0.00 178.00 176.95 2ww9 h VAL 26 N 0.00 1.31 -0.53 1.56 3.04 -1.53 -2.19 116.25 117.91 2ww9 h VAL 26 Ca -0.00 -1.89 -0.06 0.00 -1.01 0.00 0.00 66.70 63.73 2ww9 h VAL 26 Cb 1.03 1.86 -0.02 0.00 -2.01 0.00 0.00 31.29 32.15 2ww9 h VAL 26 CO 0.00 0.59 0.09 -0.08 -1.01 0.00 0.00 177.57 177.17 2ww9 h GLU 27 N 0.47 0.87 -0.35 4.17 4.57 -1.39 -2.47 114.58 120.44 2ww9 h GLU 27 Ca -0.01 -0.23 -0.15 0.00 -1.18 0.00 0.00 59.36 57.79 2ww9 h GLU 27 Cb 1.22 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.70 2ww9 h GLU 27 CO 0.12 0.84 -0.37 0.35 -1.18 0.00 0.00 179.01 178.77 2ww9 h PHE 28 N 0.75 0.98 -0.20 0.92 3.57 -1.45 -2.64 116.94 118.87 2ww9 h PHE 28 Ca 0.16 -0.28 -0.19 0.00 3.53 0.00 0.00 57.97 61.19 2ww9 h PHE 28 Cb 0.39 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.92 2ww9 h PHE 28 CO 0.03 1.07 -0.63 -0.24 -2.23 0.00 0.00 178.31 176.30 2ww9 h VAL 29 N 0.68 1.30 0.00 1.41 3.04 -1.35 -1.57 116.25 119.76 2ww9 h VAL 29 Ca 0.06 -1.87 0.00 0.00 -1.01 0.00 0.00 66.70 63.88 2ww9 h VAL 29 Cb 0.94 1.82 0.00 0.00 -2.01 0.00 0.00 31.29 32.04 2ww9 h VAL 29 CO 0.09 0.59 0.00 0.08 -1.01 0.00 0.00 177.57 177.32 2ww9 h ARG 30 N 0.52 0.00 -0.27 4.17 -0.00 -1.46 -1.59 114.38 115.74 2ww9 h ARG 30 Ca -0.01 0.00 -0.14 0.00 -0.00 0.00 0.00 59.98 59.83 2ww9 h ARG 30 Cb 1.23 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.19 2ww9 h ARG 30 CO 0.13 0.00 -0.38 0.93 -0.00 0.00 0.00 179.97 180.65 2ww9 h GLU 31 N 0.00 0.74 -0.00 0.08 4.39 -1.38 -3.33 114.58 115.07 2ww9 h GLU 31 Ca 0.00 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.27 2ww9 h GLU 31 Cb 0.81 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2ww9 h GLU 31 CO 0.00 1.05 -0.10 0.41 -1.16 0.00 0.00 179.01 179.21 2ww9 n GLY 32 N 0.27 -1.15 0.01 -3.84 0.00 -0.60 -2.49 105.19 97.39 2ww9 n GLY 32 Ca -0.04 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 45.88 2ww9 n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ww9 n THR 33 N -1.18 0.07 0.14 2.61 -2.24 -0.65 -3.69 114.28 109.35 2ww9 n THR 33 Ca 0.12 -0.07 0.03 0.00 -2.27 0.00 0.00 64.05 61.86 2ww9 n THR 33 Cb 0.28 0.21 0.06 0.00 -2.10 0.00 0.00 70.33 68.79 2ww9 n THR 33 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2ww9 h GLN 34 N 0.00 0.00 -0.28 -0.78 4.20 -1.61 -1.45 115.11 115.19 2ww9 h GLN 34 Ca 0.00 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 2ww9 h GLN 34 Cb 0.56 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.34 2ww9 h GLN 34 CO 0.00 0.49 -0.25 0.35 -0.67 0.00 0.00 178.83 178.75 2ww9 h PHE 35 N 0.00 0.79 0.00 2.96 3.57 -1.68 -1.82 116.94 120.76 2ww9 h PHE 35 Ca -0.00 -0.23 -0.10 0.00 3.53 0.00 0.00 57.97 61.16 2ww9 h PHE 35 Cb 1.34 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.89 2ww9 h PHE 35 CO 0.00 0.96 -0.50 1.25 -2.23 0.00 0.00 178.31 177.79 2ww9 h LEU 36 N 0.40 0.00 -0.21 0.59 5.85 -1.64 -2.63 115.31 117.67 2ww9 h LEU 36 Ca 0.05 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.59 2ww9 h LEU 36 Cb 0.81 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.85 2ww9 h LEU 36 CO 0.06 0.50 -0.55 0.00 -0.34 0.00 0.00 178.44 178.11 2ww9 h ALA 37 N 1.50 0.35 -0.58 1.25 0.00 -1.31 -3.36 119.26 117.12 2ww9 h ALA 37 Ca -0.00 -0.51 -0.71 0.00 0.00 0.00 0.00 54.91 53.68 2ww9 h ALA 37 Cb 1.20 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.86 2ww9 h ALA 37 CO 0.06 0.56 2.50 1.63 0.00 0.00 0.00 179.25 184.01 2ww9 n LYS 38 N -4.09 3.13 -3.86 0.00 4.76 -0.69 -4.93 118.16 112.48 2ww9 n LYS 38 Ca -0.06 -3.08 -0.37 0.00 -2.87 0.00 0.00 58.31 51.93 2ww9 n LYS 38 Cb 0.62 -3.28 -0.06 0.00 -1.84 0.00 0.00 35.03 30.48 2ww9 n LYS 38 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ww9 s LYS 40 N -1.00 4.03 0.09 0.00 2.47 -1.26 -5.03 119.74 119.05 2ww9 s LYS 40 Ca 0.15 1.17 0.01 0.00 -1.56 0.00 0.00 55.97 55.74 2ww9 s LYS 40 Cb -0.12 -3.78 -0.04 0.00 -1.46 0.00 0.00 37.83 32.42 2ww9 s LYS 40 CO 0.04 -0.96 0.24 0.15 0.16 0.00 0.00 175.35 174.99 2ww9 s LYS 41 N 3.81 3.45 0.11 4.03 1.02 -1.26 -4.99 119.74 125.90 2ww9 s LYS 41 Ca 0.50 -0.47 -0.35 0.00 0.02 0.00 0.00 55.97 55.66 2ww9 s LYS 41 Cb -0.14 -3.00 -0.18 0.00 -0.52 0.00 0.00 37.83 33.99 2ww9 s LYS 41 CO 0.18 0.57 1.04 -2.30 -0.92 0.00 0.00 175.35 173.92 2ww9 n PRO 42 N 0.00 0.55 -4.87 -1.68 -0.02 -1.26 -5.02 135.00 122.70 2ww9 n PRO 42 Ca -0.05 0.20 -0.30 0.00 -2.02 0.00 0.00 63.50 61.32 2ww9 n PRO 42 Cb 0.52 -1.63 -0.14 0.00 -0.02 0.00 0.00 33.50 32.23 2ww9 n PRO 42 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2ww9 s ASP 43 N -0.12 3.26 0.35 2.55 2.15 -1.26 -5.05 116.67 118.56 2ww9 s ASP 43 Ca 0.79 -0.57 0.08 0.00 0.43 0.00 0.00 52.55 53.29 2ww9 s ASP 43 Cb -1.03 -0.34 0.65 0.00 -0.30 0.00 0.00 42.92 41.91 2ww9 s ASP 43 CO 0.54 0.26 1.83 -0.07 -0.17 0.00 0.00 175.17 177.56 2ww9 h LEU 44 N 4.76 0.23 0.00 -1.34 3.38 -1.98 -1.66 115.31 118.70 2ww9 h LEU 44 Ca -0.47 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2ww9 h LEU 44 Cb 1.14 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2ww9 h LEU 44 CO 0.44 0.48 -0.03 0.11 0.09 0.00 0.00 178.44 179.54 2ww9 h LYS 45 N 0.21 0.00 0.00 1.13 1.79 -1.99 -1.65 116.57 116.06 2ww9 h LYS 45 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2ww9 h LYS 45 Cb 0.55 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2ww9 h LYS 45 CO 0.04 0.00 -1.02 0.39 -1.08 0.00 0.00 179.45 177.78 2ww9 n GLU 46 N -2.96 0.25 0.13 3.15 1.02 -1.07 -2.92 120.64 118.25 2ww9 n GLU 46 Ca 0.04 -0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.19 2ww9 n GLU 46 Cb 0.52 -1.58 0.01 0.00 -0.02 0.00 0.00 31.44 30.37 2ww9 n GLU 46 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2ww9 h TYR 47 N 0.00 0.00 -0.25 -0.32 3.20 -1.08 -2.55 116.97 115.96 2ww9 h TYR 47 Ca 0.00 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.71 2ww9 h TYR 47 Cb 0.70 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 2ww9 h TYR 47 CO 0.00 0.53 -0.48 1.15 -1.64 0.00 0.00 178.16 177.72 2ww9 h THR 48 N 0.00 1.30 -0.74 1.81 2.02 -1.32 -1.10 112.91 114.88 2ww9 h THR 48 Ca -0.01 -1.68 -0.05 0.00 0.77 0.00 0.00 66.41 65.43 2ww9 h THR 48 Cb 1.41 1.61 -0.03 0.00 -1.74 0.00 0.00 68.15 69.40 2ww9 h THR 48 CO 0.07 0.53 0.25 0.11 0.37 0.00 0.00 175.52 176.85 2ww9 h LYS 49 N 0.54 1.13 -0.38 6.66 1.57 -1.49 -2.22 116.57 122.37 2ww9 h LYS 49 Ca 0.03 -0.23 -0.06 0.00 -1.87 0.00 0.00 60.65 58.52 2ww9 h LYS 49 Cb 1.03 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 2ww9 h LYS 49 CO 0.10 0.95 0.00 0.82 -0.57 0.00 0.00 179.45 180.75 2ww9 h ILE 50 N 1.09 1.26 -0.52 1.86 2.04 -1.28 -1.48 117.51 120.48 2ww9 h ILE 50 Ca 0.24 -0.99 -0.07 0.00 1.00 0.00 0.00 64.86 65.04 2ww9 h ILE 50 Cb 0.28 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2ww9 h ILE 50 CO -0.01 0.33 0.05 0.58 0.00 0.00 0.00 178.15 179.11 2ww9 h VAL 51 N 0.50 1.26 -0.10 1.67 2.07 -1.07 -0.82 116.25 119.75 2ww9 h VAL 51 Ca 0.11 -1.00 -0.19 0.00 0.82 0.00 0.00 66.70 66.44 2ww9 h VAL 51 Cb 0.46 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2ww9 h VAL 51 CO 0.02 0.36 -0.72 0.07 0.02 0.00 0.00 177.57 177.32 2ww9 h LYS 52 N 0.76 0.47 -0.43 1.57 2.10 -1.43 -1.76 116.57 117.86 2ww9 h LYS 52 Ca 0.15 -0.38 -0.12 0.00 -2.00 0.00 0.00 60.65 58.31 2ww9 h LYS 52 Cb 0.45 0.08 -0.01 0.00 -0.90 0.00 0.00 32.23 31.84 2ww9 h LYS 52 CO 0.02 1.01 -0.20 0.00 -2.00 0.00 0.00 179.45 178.27 2ww9 h ALA 53 N 0.89 0.60 0.00 0.07 0.00 -1.08 -0.13 119.26 119.61 2ww9 h ALA 53 Ca -0.03 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.38 2ww9 h ALA 53 Cb 1.29 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2ww9 h ALA 53 CO 0.13 0.57 -0.56 0.28 0.00 0.00 0.00 179.25 179.67 2ww9 h VAL 54 N 0.72 1.39 0.00 0.00 2.07 -1.21 -2.18 116.25 117.04 2ww9 h VAL 54 Ca 0.10 -1.95 -0.07 0.00 0.82 0.00 0.00 66.70 65.60 2ww9 h VAL 54 Cb 0.77 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 2ww9 h VAL 54 CO 0.06 0.55 -0.74 1.23 0.02 0.00 0.00 177.57 178.70 2ww9 h GLY 55 N 1.74 0.00 1.58 2.17 0.00 -1.04 0.35 103.07 107.86 2ww9 h GLY 55 Ca -0.01 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 2ww9 h GLY 55 CO 0.07 0.00 -0.75 -2.22 0.00 0.00 0.00 176.54 173.64 2ww9 h ILE 56 N 0.00 1.38 -0.02 2.60 2.04 -1.00 -2.77 117.51 119.74 2ww9 h ILE 56 Ca -0.04 -2.17 -0.11 0.00 1.00 0.00 0.00 64.86 63.53 2ww9 h ILE 56 Cb 1.26 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 39.46 2ww9 h ILE 56 CO 0.03 0.65 -0.51 1.23 0.00 0.00 0.00 178.15 179.55 2ww9 h GLY 57 N 1.27 0.06 1.53 5.37 0.00 -1.21 -3.04 103.07 107.05 2ww9 h GLY 57 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2ww9 h GLY 57 CO 0.13 0.06 -0.46 -2.75 0.00 0.00 0.00 176.54 173.52 2ww9 h PHE 58 N 0.04 0.00 0.00 5.60 3.57 -0.74 -0.76 116.94 124.65 2ww9 h PHE 58 Ca -0.00 0.00 -0.21 0.00 3.53 0.00 0.00 57.97 61.29 2ww9 h PHE 58 Cb 0.93 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.63 2ww9 h PHE 58 CO 0.00 0.00 -1.36 0.97 -2.23 0.00 0.00 178.31 175.69 2ww9 h ILE 59 N 0.00 0.83 -0.28 1.41 2.10 -1.55 -2.24 117.51 117.78 2ww9 h ILE 59 Ca 0.00 -2.46 -0.16 0.00 1.08 0.00 0.00 64.86 63.32 2ww9 h ILE 59 Cb 0.97 2.32 -0.01 0.00 -1.09 0.00 0.00 36.82 39.02 2ww9 h ILE 59 CO 0.00 0.47 -0.47 0.00 -1.08 0.00 0.00 178.15 177.07 2ww9 h ALA 60 N 1.22 0.65 -0.96 0.18 0.00 -1.45 -2.37 119.26 116.55 2ww9 h ALA 60 Ca -0.17 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.26 2ww9 h ALA 60 Cb 1.74 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 19.39 2ww9 h ALA 60 CO 0.07 0.67 0.58 0.28 0.00 0.00 0.00 179.25 180.86 2ww9 h VAL 61 N 0.58 1.26 -0.14 0.00 2.07 -1.20 -2.85 116.25 115.97 2ww9 h VAL 61 Ca 0.03 -0.55 -0.13 0.00 0.82 0.00 0.00 66.70 66.87 2ww9 h VAL 61 Cb 1.03 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2ww9 h VAL 61 CO 0.10 0.27 -0.40 1.23 0.02 0.00 0.00 177.57 178.78 2ww9 h GLY 62 N 1.32 0.57 1.17 2.17 0.00 -1.09 -2.41 103.07 104.79 2ww9 h GLY 62 Ca 0.34 -0.73 -0.21 0.00 0.00 0.00 0.00 47.33 46.73 2ww9 h GLY 62 CO -0.07 0.65 -0.72 1.19 0.00 0.00 0.00 176.54 177.60 2ww9 h ILE 63 N 0.14 1.27 -0.24 2.60 2.10 -1.48 -2.99 117.51 118.91 2ww9 h ILE 63 Ca -0.01 -1.90 -0.08 0.00 1.08 0.00 0.00 64.86 63.94 2ww9 h ILE 63 Cb 1.02 1.89 -0.01 0.00 -1.09 0.00 0.00 36.82 38.63 2ww9 h ILE 63 CO 0.09 0.61 -0.17 0.40 -1.08 0.00 0.00 178.15 178.00 2ww9 h ILE 64 N 0.58 1.31 0.00 2.19 2.04 -1.55 -2.65 117.51 119.43 2ww9 h ILE 64 Ca -0.04 -1.29 -0.12 0.00 1.00 0.00 0.00 64.86 64.41 2ww9 h ILE 64 Cb 1.34 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 39.02 2ww9 h ILE 64 CO 0.15 0.40 -0.91 1.23 0.00 0.00 0.00 178.15 179.02 2ww9 h GLY 65 N 0.26 0.00 1.01 5.37 0.00 -1.54 -3.06 103.07 105.11 2ww9 h GLY 65 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.22 2ww9 h GLY 65 CO 0.05 0.00 -0.51 -1.82 0.00 0.00 0.00 176.54 174.26 2ww9 h TYR 66 N 0.00 0.89 -0.61 5.60 3.20 -1.60 -3.15 116.97 121.30 2ww9 h TYR 66 Ca -0.07 -0.34 -0.05 0.00 3.14 0.00 0.00 58.73 61.41 2ww9 h TYR 66 Cb 1.43 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.52 2ww9 h TYR 66 CO 0.00 1.13 0.19 0.00 -1.64 0.00 0.00 178.16 177.85 2ww9 h ALA 67 N 0.59 0.79 -0.32 1.82 0.00 -1.50 -2.51 119.26 118.14 2ww9 h ALA 67 Ca -0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 2ww9 h ALA 67 Cb 1.12 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 2ww9 h ALA 67 CO 0.11 0.46 0.04 0.82 0.00 0.00 0.00 179.25 180.67 2ww9 h ILE 68 N 0.86 1.24 -0.18 0.00 2.04 -1.61 -3.28 117.51 116.57 2ww9 h ILE 68 Ca 0.20 -0.85 -0.17 0.00 1.00 0.00 0.00 64.86 65.04 2ww9 h ILE 68 Cb 0.28 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2ww9 h ILE 68 CO -0.01 0.28 -0.54 0.50 0.00 0.00 0.00 178.15 178.38 2ww9 h LYS 69 N 0.35 0.69 -0.62 2.37 3.64 -1.50 -3.28 116.57 118.22 2ww9 h LYS 69 Ca 0.09 -0.50 -0.01 0.00 -1.27 0.00 0.00 60.65 58.97 2ww9 h LYS 69 Cb 0.37 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2ww9 h LYS 69 CO 0.01 1.12 0.35 -0.07 -2.27 0.00 0.00 179.45 178.58 2ww9 h LEU 70 N 0.38 0.78 0.00 5.20 3.38 -1.51 -2.65 115.31 120.88 2ww9 h LEU 70 Ca -0.02 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2ww9 h LEU 70 Cb 1.16 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2ww9 h LEU 70 CO 0.12 0.64 -0.36 -0.29 0.09 0.00 0.00 178.44 178.63 2ww9 h ILE 71 N 0.85 0.00 -0.47 1.22 2.10 -1.71 -3.16 117.51 116.34 2ww9 h ILE 71 Ca 0.22 -0.64 -0.09 0.00 1.08 0.00 0.00 64.86 65.43 2ww9 h ILE 71 Cb 0.04 1.42 -0.02 0.00 -1.09 0.00 0.00 36.82 37.16 2ww9 h ILE 71 CO -0.04 0.00 -0.05 -0.74 -1.08 0.00 0.00 178.15 176.24 2ww9 h HIS 72 N 0.00 0.88 -0.49 2.19 2.76 -1.53 -3.22 115.15 115.75 2ww9 h HIS 72 Ca 0.00 -0.14 -0.02 0.00 -2.20 0.00 0.00 60.37 58.00 2ww9 h HIS 72 Cb 0.82 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.52 2ww9 h HIS 72 CO 0.00 0.84 0.21 0.82 -1.30 0.00 0.00 177.93 178.50 2ww9 h ILE 73 N 0.75 1.20 0.00 6.26 2.04 -1.50 -1.93 117.51 124.34 2ww9 h ILE 73 Ca 0.14 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 2ww9 h ILE 73 Cb 0.53 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 2ww9 h ILE 73 CO 0.03 0.23 -0.02 -0.65 0.00 0.00 0.00 178.15 177.74 2ww9 h PRO 74 N 0.64 0.00 -0.42 2.37 0.11 -1.71 -1.92 132.00 131.07 2ww9 h PRO 74 Ca 0.16 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.18 2ww9 h PRO 74 Cb 0.17 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.26 2ww9 h PRO 74 CO -0.02 0.02 -0.09 0.82 -0.21 0.00 0.00 178.00 178.52 2ww9 h ILE 75 N 0.00 1.27 -0.34 4.15 2.04 -1.36 -1.15 117.51 122.12 2ww9 h ILE 75 Ca -0.00 -1.19 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 2ww9 h ILE 75 Cb 0.14 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2ww9 h ILE 75 CO 0.00 0.40 -0.15 -0.09 0.00 0.00 0.00 178.15 178.32 2ww9 h ARG 76 N 0.64 0.60 -0.12 2.37 9.65 -1.31 -2.62 114.38 123.59 2ww9 h ARG 76 Ca 0.11 -0.20 -0.08 0.00 -1.10 0.00 0.00 59.98 58.72 2ww9 h ARG 76 Cb 0.62 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.15 2ww9 h ARG 76 CO 0.04 0.73 -0.22 -0.92 2.80 0.00 0.00 179.97 182.40 2ww9 h TYR 77 N 0.55 0.46 -0.32 2.20 -0.00 -1.21 -3.34 116.97 115.30 2ww9 h TYR 77 Ca 0.09 -0.16 -0.08 0.00 -0.00 0.00 0.00 58.73 58.58 2ww9 h TYR 77 Cb 0.57 -0.09 -0.01 0.00 -0.00 0.00 0.00 36.73 37.21 2ww9 h TYR 77 CO 0.02 0.84 -0.10 0.28 -0.00 0.00 0.00 178.16 179.20 2ww9 h VAL 78 N -0.05 1.28 -3.47 1.81 2.07 -1.21 -3.41 116.25 113.26 2ww9 h VAL 78 Ca 0.01 -1.17 -0.64 0.00 0.82 0.00 0.00 66.70 65.71 2ww9 h VAL 78 Cb 0.80 1.39 -0.22 0.00 -1.52 0.00 0.00 31.29 31.75 2ww9 h VAL 78 CO 0.05 0.38 -0.63 -0.63 0.02 0.00 0.00 177.57 176.75 2ww9 s ILE 79 N -4.71 4.20 -2.00 4.57 1.01 -0.99 -5.11 121.20 118.17 2ww9 s ILE 79 Ca -0.13 -0.23 0.17 0.00 0.00 0.00 0.00 60.65 60.47 2ww9 s ILE 79 Cb 0.09 -2.92 0.48 0.00 0.01 0.00 0.00 42.46 40.13 2ww9 s ILE 79 CO 0.79 0.41 1.42 0.55 0.00 0.00 0.00 174.94 178.11