#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kw9 n GLY 2 N 0.00 0.77 5.49 -5.12 0.00 -1.26 -4.78 105.19 100.30 2kw9 n GLY 2 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2kw9 n GLY 2 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2kw9 n HIS 3 N -1.20 0.00 -3.92 1.61 -0.00 -1.26 -4.30 115.22 106.16 2kw9 n HIS 3 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 57.72 57.47 2kw9 n HIS 3 Cb 0.44 0.00 -0.17 0.00 -0.00 0.00 0.00 29.99 30.26 2kw9 n HIS 3 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2kw9 s HIS 4 N 0.00 1.15 -0.41 -1.40 5.65 -1.26 -5.07 115.29 113.96 2kw9 s HIS 4 Ca 0.00 -0.50 0.06 0.00 0.25 0.00 0.00 55.06 54.88 2kw9 s HIS 4 Cb 0.00 -1.04 0.21 0.00 -1.18 0.00 0.00 32.58 30.58 2kw9 s HIS 4 CO 0.00 -0.42 0.48 0.72 -0.65 0.00 0.00 174.74 174.87 2kw9 n HIS 5 N 4.89 -0.94 0.00 3.88 -0.00 -1.26 -5.06 115.22 116.72 2kw9 n HIS 5 Ca -0.12 -3.25 0.00 0.00 -0.00 0.00 0.00 57.72 54.35 2kw9 n HIS 5 Cb 0.50 0.10 0.00 0.00 -0.00 0.00 0.00 29.99 30.59 2kw9 n HIS 5 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2kw9 n HIS 6 N 2.09 0.00 -3.67 4.41 -0.00 -1.26 -5.20 115.22 111.60 2kw9 n HIS 6 Ca 0.24 0.00 -0.14 0.00 -0.00 0.00 0.00 57.72 57.81 2kw9 n HIS 6 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.51 2kw9 n HIS 6 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2kw9 n HIS 7 N 0.00 -1.09 -3.69 -1.40 -0.00 -1.26 -5.14 115.22 102.64 2kw9 n HIS 7 Ca 0.00 -1.31 -0.24 0.00 -0.00 0.00 0.00 57.72 56.17 2kw9 n HIS 7 Cb 0.00 -0.26 -0.17 0.00 -0.00 0.00 0.00 29.99 29.56 2kw9 n HIS 7 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2kw9 s HIS 8 N -1.50 0.45 0.48 -1.40 0.00 -1.26 -5.16 115.29 106.91 2kw9 s HIS 8 Ca 0.19 -0.27 0.08 0.00 -3.00 0.00 0.00 55.06 52.06 2kw9 s HIS 8 Cb -0.01 -0.74 0.04 0.00 -4.00 0.00 0.00 32.58 27.86 2kw9 s HIS 8 CO 0.12 -0.42 0.62 -1.54 -1.00 0.00 0.00 174.74 172.51 2kw9 s SER 9 N 2.05 5.31 -0.37 7.38 1.04 -1.26 -5.11 113.70 122.74 2kw9 s SER 9 Ca 0.03 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.78 2kw9 s SER 9 Cb -0.14 -0.22 0.13 0.00 0.10 0.00 0.00 66.02 65.88 2kw9 s SER 9 CO -0.07 -0.98 0.19 -1.38 0.98 0.00 0.00 173.24 171.98 2kw9 s HIS 10 N -2.51 1.27 0.03 5.02 0.00 -1.26 -5.12 115.29 112.71 2kw9 s HIS 10 Ca 0.55 -1.83 -0.16 0.00 -3.00 0.00 0.00 55.06 50.63 2kw9 s HIS 10 Cb -0.07 -1.38 -0.06 0.00 -4.00 0.00 0.00 32.58 27.07 2kw9 s HIS 10 CO 0.34 -0.82 0.46 -1.64 -1.00 0.00 0.00 174.74 172.07 2kw9 s MET 11 N 1.04 3.99 -0.08 -0.38 1.00 -1.26 -5.01 119.30 118.60 2kw9 s MET 11 Ca 0.15 0.49 0.06 0.00 0.00 0.00 0.00 55.69 56.39 2kw9 s MET 11 Cb -0.22 -3.21 -0.24 0.00 0.00 0.00 0.00 34.83 31.16 2kw9 s MET 11 CO -0.08 0.67 0.51 0.45 0.00 0.00 0.00 175.02 176.57 2kw9 n SER 12 N 1.72 1.32 -1.45 3.03 2.88 -1.26 -5.10 113.62 114.76 2kw9 n SER 12 Ca -0.12 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 2kw9 n SER 12 Cb 0.52 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.66 2kw9 n SER 12 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2kw9 n THR 13 N -3.20 -4.13 -0.67 2.46 -2.24 -1.26 -4.95 114.28 100.29 2kw9 n THR 13 Ca -0.24 1.89 -0.31 0.00 -2.27 0.00 0.00 64.05 63.12 2kw9 n THR 13 Cb 1.05 -2.74 0.17 0.00 -2.10 0.00 0.00 70.33 66.71 2kw9 n THR 13 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2kw9 n PRO 14 N -1.49 -1.08 -4.51 -0.78 -0.02 -1.26 -5.05 135.00 120.81 2kw9 n PRO 14 Ca 0.00 -0.27 -0.25 0.00 -2.02 0.00 0.00 63.50 60.96 2kw9 n PRO 14 Cb 0.16 -2.00 -0.10 0.00 -0.02 0.00 0.00 33.50 31.53 2kw9 n PRO 14 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 2kw9 s LEU 15 N -3.65 2.67 -0.24 2.45 2.34 -1.26 -5.09 118.68 115.91 2kw9 s LEU 15 Ca 0.61 -1.17 -0.29 0.00 0.06 0.00 0.00 54.13 53.35 2kw9 s LEU 15 Cb -0.20 -0.96 -0.03 0.00 -0.56 0.00 0.00 46.19 44.44 2kw9 s LEU 15 CO 0.65 -0.18 1.68 0.42 -1.06 0.00 0.00 176.35 177.85 2kw9 s THR 16 N -2.65 3.61 -0.01 5.48 -4.23 -1.26 -4.98 115.64 111.60 2kw9 s THR 16 Ca 0.32 0.68 -0.30 0.00 -1.18 0.00 0.00 61.69 61.20 2kw9 s THR 16 Cb 0.01 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 70.15 2kw9 s THR 16 CO 0.15 -0.31 1.30 -0.83 -0.54 0.00 0.00 174.62 174.39 2kw9 s GLY 17 N 4.72 2.02 -0.12 3.99 0.00 -1.26 -5.01 107.32 111.66 2kw9 s GLY 17 Ca 0.74 0.79 -0.29 0.00 0.00 0.00 0.00 44.72 45.96 2kw9 s GLY 17 CO 0.31 2.33 0.71 -1.59 0.00 0.00 0.00 173.10 174.86 2kw9 s LYS 18 N 2.12 0.97 -0.25 2.90 -2.85 -1.26 -5.14 119.74 116.24 2kw9 s LYS 18 Ca 0.60 0.49 -0.29 0.00 -1.00 0.00 0.00 55.97 55.77 2kw9 s LYS 18 Cb -0.29 0.46 0.00 0.00 -2.06 0.00 0.00 37.83 35.95 2kw9 s LYS 18 CO 0.25 -0.25 1.19 -1.25 0.10 0.00 0.00 175.35 175.39 2kw9 s PRO 19 N -0.69 4.12 0.38 1.78 0.04 -1.26 -4.94 135.00 134.43 2kw9 s PRO 19 Ca -0.07 1.37 0.12 0.00 0.04 0.00 0.00 61.00 62.46 2kw9 s PRO 19 Cb -0.02 -3.76 0.92 0.00 0.04 0.00 0.00 34.50 31.68 2kw9 s PRO 19 CO 0.07 -0.84 1.86 0.78 0.04 0.00 0.00 177.00 178.91 2kw9 h GLY 20 N 10.05 1.10 -2.44 0.56 0.00 -2.02 -3.43 103.07 106.89 2kw9 h GLY 20 Ca -0.24 -0.26 -0.16 0.00 0.00 0.00 0.00 47.33 46.68 2kw9 h GLY 20 CO 1.00 0.04 -0.41 0.00 0.00 0.00 0.00 176.54 177.18 2kw9 s ALA 21 N -5.59 0.56 0.13 3.60 0.00 -1.26 -4.99 121.76 114.22 2kw9 s ALA 21 Ca -0.09 -1.35 -0.00 0.00 0.00 0.00 0.00 51.96 50.52 2kw9 s ALA 21 Cb 0.22 1.25 -0.04 0.00 0.00 0.00 0.00 23.12 24.55 2kw9 s ALA 21 CO 0.79 -0.70 0.30 -0.51 0.00 0.00 0.00 175.76 175.64 2kw9 s LEU 22 N -3.10 4.30 0.43 0.00 1.43 -1.26 -5.07 118.68 115.41 2kw9 s LEU 22 Ca 0.32 0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 53.49 2kw9 s LEU 22 Cb 0.04 -3.06 -0.09 0.00 0.03 0.00 0.00 46.19 43.10 2kw9 s LEU 22 CO 0.11 0.06 1.41 -0.81 0.23 0.00 0.00 176.35 177.35 2kw9 n PRO 23 N -0.21 2.26 0.19 1.29 -0.04 -1.26 -4.93 135.00 132.30 2kw9 n PRO 23 Ca -0.05 0.80 0.07 0.00 -0.04 0.00 0.00 63.50 64.28 2kw9 n PRO 23 Cb 0.53 -2.59 0.26 0.00 -0.04 0.00 0.00 33.50 31.66 2kw9 n PRO 23 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kw9 h ALA 24 N 2.36 0.89 -0.32 0.55 0.00 -2.06 -3.31 119.26 117.36 2kw9 h ALA 24 Ca -0.50 -0.31 -0.20 0.00 0.00 0.00 0.00 54.91 53.90 2kw9 h ALA 24 Cb 1.27 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 2kw9 h ALA 24 CO 0.61 0.42 0.26 0.09 0.00 0.00 0.00 179.25 180.63 2kw9 n ASN 25 N -3.33 5.16 0.07 0.00 3.02 -1.26 -4.41 115.26 114.51 2kw9 n ASN 25 Ca 0.01 -2.75 0.18 0.00 -0.03 0.00 0.00 54.58 51.99 2kw9 n ASN 25 Cb 0.56 -0.92 0.70 0.00 -0.61 0.00 0.00 39.78 39.51 2kw9 n ASN 25 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2kw9 h LEU 26 N 2.12 0.00 -1.11 3.41 3.38 -1.92 0.19 115.31 121.37 2kw9 h LEU 26 Ca 0.20 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 2kw9 h LEU 26 Cb 1.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2kw9 h LEU 26 CO 0.47 0.00 -0.01 0.44 0.09 0.00 0.00 178.44 179.43 2kw9 h ASP 27 N 0.00 0.58 1.62 -0.43 5.19 -1.94 -2.57 116.42 118.87 2kw9 h ASP 27 Ca 0.19 -0.12 -0.05 0.00 -0.62 0.00 0.00 57.03 56.42 2kw9 h ASP 27 Cb 0.78 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.13 2kw9 h ASP 27 CO -0.00 0.66 -0.39 0.44 -3.12 0.00 0.00 179.24 176.83 2kw9 h ASP 28 N 0.58 0.00 -2.95 6.45 3.32 -1.04 -3.44 116.42 119.34 2kw9 h ASP 28 Ca 0.12 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.62 2kw9 h ASP 28 Cb 0.38 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2kw9 h ASP 28 CO 0.01 0.23 0.81 -0.04 -1.72 0.00 0.00 179.24 178.53 2kw9 s MET 29 N -3.11 4.29 0.97 3.56 -1.94 -0.43 -5.02 119.30 117.63 2kw9 s MET 29 Ca 0.04 1.85 -0.13 0.00 -1.71 0.00 0.00 55.69 55.75 2kw9 s MET 29 Cb 0.07 -3.61 0.17 0.00 2.01 0.00 0.00 34.83 33.47 2kw9 s MET 29 CO 0.72 -0.56 1.12 0.15 -0.01 0.00 0.00 175.02 176.44 2kw9 s LYS 30 N 2.53 0.63 0.20 2.03 1.02 -1.26 -4.69 119.74 120.20 2kw9 s LYS 30 Ca 0.61 0.35 -0.11 0.00 0.02 0.00 0.00 55.97 56.83 2kw9 s LYS 30 Cb -0.28 -1.78 0.24 0.00 -0.52 0.00 0.00 37.83 35.49 2kw9 s LYS 30 CO 0.24 -2.56 1.72 0.28 -0.92 0.00 0.00 175.35 174.11 2kw9 h VAL 31 N -1.76 0.72 -0.87 3.17 2.07 -1.95 -0.95 116.25 116.68 2kw9 h VAL 31 Ca -0.52 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2kw9 h VAL 31 Cb 1.33 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 2kw9 h VAL 31 CO 0.58 0.05 0.49 0.00 0.02 0.00 0.00 177.57 178.71 2kw9 h ALA 32 N 1.42 1.11 -0.27 1.67 0.00 -1.99 -0.26 119.26 120.95 2kw9 h ALA 32 Ca 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2kw9 h ALA 32 Cb 0.38 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2kw9 h ALA 32 CO -0.34 0.61 0.08 0.93 0.00 0.00 0.00 179.25 180.52 2kw9 h GLU 33 N 1.21 0.42 -0.06 0.00 5.08 -1.59 -0.68 114.58 118.96 2kw9 h GLU 33 Ca 0.31 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 2kw9 h GLU 33 Cb 0.01 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 2kw9 h GLU 33 CO -0.05 0.50 0.02 -0.07 -1.00 0.00 0.00 179.01 178.41 2kw9 h LEU 34 N 0.26 0.09 -0.67 1.33 3.38 -1.03 -1.38 115.31 117.30 2kw9 h LEU 34 Ca 0.08 -0.19 0.11 0.00 0.09 0.00 0.00 57.88 57.98 2kw9 h LEU 34 Cb 0.26 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.90 2kw9 h LEU 34 CO -0.00 0.26 0.25 0.11 0.09 0.00 0.00 178.44 179.15 2kw9 h LYS 35 N -0.08 0.41 -0.15 1.13 1.57 -1.02 0.84 116.57 119.27 2kw9 h LYS 35 Ca 0.02 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2kw9 h LYS 35 Cb 0.20 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2kw9 h LYS 35 CO -0.00 0.27 -0.00 0.37 -0.57 0.00 0.00 179.45 179.52 2kw9 h GLN 36 N 0.42 0.05 -0.44 3.15 -0.00 -0.92 -0.79 115.11 116.58 2kw9 h GLN 36 Ca 0.35 -0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.97 2kw9 h GLN 36 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 27.48 27.92 2kw9 h GLN 36 CO -0.35 0.03 0.15 0.93 0.00 0.00 0.00 178.83 179.59 2kw9 h GLU 37 N 0.05 0.63 0.32 1.69 4.39 -0.51 -2.60 114.58 118.55 2kw9 h GLU 37 Ca 0.07 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 2kw9 h GLU 37 Cb 0.08 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2kw9 h GLU 37 CO -0.12 0.55 -0.15 -0.07 -1.16 0.00 0.00 179.01 178.06 2kw9 h LEU 38 N 0.63 -0.36 -2.08 1.33 3.38 -0.43 -3.27 115.31 114.51 2kw9 h LEU 38 Ca 0.15 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2kw9 h LEU 38 Cb 0.17 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 2kw9 h LEU 38 CO -0.01 -0.01 -0.08 0.07 0.09 0.00 0.00 178.44 178.50 2kw9 h LYS 39 N -0.75 0.00 -0.89 1.13 2.10 -1.06 0.30 116.57 117.41 2kw9 h LYS 39 Ca -0.04 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.66 2kw9 h LYS 39 Cb 0.50 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 31.78 2kw9 h LYS 39 CO 0.07 0.08 0.58 -0.07 -2.00 0.00 0.00 179.45 178.11 2kw9 h LEU 40 N 0.00 0.92 -3.45 7.07 3.38 -1.51 -2.86 115.31 118.86 2kw9 h LEU 40 Ca -0.00 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 2kw9 h LEU 40 Cb 0.26 -0.20 -0.09 0.00 0.09 0.00 0.00 40.66 40.71 2kw9 h LEU 40 CO 0.01 0.61 0.08 0.54 0.09 0.00 0.00 178.44 179.77 2kw9 n ARG 41 N -4.47 2.62 -1.27 1.13 1.74 -0.10 -4.94 116.66 111.38 2kw9 n ARG 41 Ca 0.13 -3.04 -0.09 0.00 -0.77 0.00 0.00 57.85 54.08 2kw9 n ARG 41 Cb 0.16 -1.94 -0.04 0.00 -1.02 0.00 0.00 32.46 29.62 2kw9 n ARG 41 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2kw9 n SER 42 N -0.73 -5.06 -4.75 0.55 7.64 -0.96 -4.98 113.62 105.33 2kw9 n SER 42 Ca 0.33 0.23 -0.40 0.00 1.01 0.00 0.00 58.87 60.04 2kw9 n SER 42 Cb 1.11 -3.37 -0.06 0.00 -1.01 0.00 0.00 64.21 60.88 2kw9 n SER 42 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2kw9 s LEU 43 N -2.09 4.61 0.07 -3.43 1.43 -0.10 -4.94 118.68 114.23 2kw9 s LEU 43 Ca 0.00 1.96 -0.31 0.00 -1.03 0.00 0.00 54.13 54.75 2kw9 s LEU 43 Cb 0.00 -3.66 -0.08 0.00 0.03 0.00 0.00 46.19 42.48 2kw9 s LEU 43 CO 0.00 0.11 1.58 -2.16 0.23 0.00 0.00 176.35 176.11 2kw9 s PRO 44 N -1.30 4.22 0.00 1.29 0.04 -1.26 -3.69 135.00 134.30 2kw9 s PRO 44 Ca 0.42 2.26 0.24 0.00 0.04 0.00 0.00 61.00 63.96 2kw9 s PRO 44 Cb -0.26 -3.51 0.30 0.00 0.04 0.00 0.00 34.50 31.07 2kw9 s PRO 44 CO 0.32 -0.67 1.27 1.33 0.04 0.00 0.00 177.00 179.28 2kw9 n VAL 45 N 4.56 0.00 -1.96 -0.36 0.24 -1.26 -4.72 118.33 114.83 2kw9 n VAL 45 Ca 0.15 -0.06 -0.40 0.00 -2.04 0.00 0.00 64.34 61.98 2kw9 n VAL 45 Cb 0.41 0.62 -0.02 0.00 -1.47 0.00 0.00 33.84 33.37 2kw9 n VAL 45 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2kw9 n SER 46 N -1.12 3.85 -3.38 -1.34 7.64 -1.26 -4.84 113.62 113.18 2kw9 n SER 46 Ca 0.07 -2.82 -0.04 0.00 1.01 0.00 0.00 58.87 57.10 2kw9 n SER 46 Cb 0.35 -1.60 0.01 0.00 -1.01 0.00 0.00 64.21 61.96 2kw9 n SER 46 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2kw9 s GLY 47 N 4.37 0.08 0.72 0.23 0.00 -1.26 -5.11 107.32 106.36 2kw9 s GLY 47 Ca 0.55 -0.30 -0.11 0.00 0.00 0.00 0.00 44.72 44.85 2kw9 s GLY 47 CO 0.04 1.61 1.08 -0.51 0.00 0.00 0.00 173.10 175.32 2kw9 s THR 48 N -2.40 3.61 0.41 0.90 -4.23 -1.26 -4.78 115.64 107.89 2kw9 s THR 48 Ca 0.19 0.56 0.20 0.00 -1.18 0.00 0.00 61.69 61.46 2kw9 s THR 48 Cb -0.03 -3.15 0.40 0.00 1.34 0.00 0.00 72.50 71.07 2kw9 s THR 48 CO 0.06 -0.65 1.77 0.50 -0.54 0.00 0.00 174.62 175.76 2kw9 h LYS 49 N -0.73 0.35 0.27 3.99 3.64 -1.97 0.80 116.57 122.92 2kw9 h LYS 49 Ca -0.44 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2kw9 h LYS 49 Cb 1.22 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 2kw9 h LYS 49 CO 0.54 0.23 -0.21 1.15 -2.27 0.00 0.00 179.45 178.90 2kw9 h THR 50 N 0.36 0.56 -0.97 1.00 2.02 -2.00 -1.67 112.91 112.21 2kw9 h THR 50 Ca 0.59 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.82 2kw9 h THR 50 Cb 1.57 0.56 -0.06 0.00 -1.74 0.00 0.00 68.15 68.47 2kw9 h THR 50 CO -0.28 0.00 0.63 -0.33 0.37 0.00 0.00 175.52 175.91 2kw9 h GLU 51 N -0.48 1.16 -0.63 6.66 5.08 -1.25 -1.00 114.58 124.12 2kw9 h GLU 51 Ca -0.02 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2kw9 h GLU 51 Cb 0.42 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 2kw9 h GLU 51 CO -0.01 0.77 0.39 -0.07 -1.00 0.00 0.00 179.01 179.09 2kw9 h LEU 52 N 1.20 0.75 0.15 1.33 3.38 -0.94 0.13 115.31 121.31 2kw9 h LEU 52 Ca 0.40 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 2kw9 h LEU 52 Cb 0.06 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2kw9 h LEU 52 CO -0.14 0.58 -0.07 0.40 0.09 0.00 0.00 178.44 179.29 2kw9 h ILE 53 N 0.85 0.97 -0.80 1.22 2.04 -0.85 -2.26 117.51 118.68 2kw9 h ILE 53 Ca 0.23 -0.57 0.08 0.00 1.00 0.00 0.00 64.86 65.60 2kw9 h ILE 53 Cb -0.04 1.32 -0.07 0.00 -0.74 0.00 0.00 36.82 37.30 2kw9 h ILE 53 CO -0.04 0.13 0.47 -0.33 0.00 0.00 0.00 178.15 178.38 2kw9 h GLU 54 N -0.48 0.79 -0.41 2.37 5.08 -1.06 -1.75 114.58 119.11 2kw9 h GLU 54 Ca -0.02 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2kw9 h GLU 54 Cb 0.37 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2kw9 h GLU 54 CO 0.03 0.52 0.06 -0.09 -1.00 0.00 0.00 179.01 178.54 2kw9 h ARG 55 N 0.81 0.69 -0.23 2.33 2.43 -0.71 0.10 114.38 119.80 2kw9 h ARG 55 Ca 0.37 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.35 2kw9 h ARG 55 Cb 0.29 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2kw9 h ARG 55 CO -0.22 0.73 0.11 -0.07 -1.51 0.00 0.00 179.97 179.01 2kw9 h LEU 56 N 0.54 0.31 0.03 3.80 3.38 -1.13 -0.09 115.31 122.14 2kw9 h LEU 56 Ca 0.13 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2kw9 h LEU 56 Cb 0.38 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2kw9 h LEU 56 CO 0.01 0.34 -0.10 0.03 0.09 0.00 0.00 178.44 178.82 2kw9 h ARG 57 N 0.25 -0.17 -0.73 1.13 3.08 -1.18 -1.03 114.38 115.73 2kw9 h ARG 57 Ca 0.08 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 2kw9 h ARG 57 Cb 0.12 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2kw9 h ARG 57 CO -0.01 -0.12 0.40 0.00 -1.07 0.00 0.00 179.97 179.17 2kw9 h ALA 58 N 0.77 1.33 -0.25 0.04 0.00 -0.73 0.11 119.26 120.53 2kw9 h ALA 58 Ca 0.03 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 2kw9 h ALA 58 Cb 0.21 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2kw9 h ALA 58 CO -0.08 0.55 -0.17 -0.92 0.00 0.00 0.00 179.25 178.63 2kw9 h TYR 59 N 1.01 0.65 -0.53 0.00 3.20 -0.81 -2.53 116.97 117.97 2kw9 h TYR 59 Ca 0.26 -0.18 -0.07 0.00 3.14 0.00 0.00 58.73 61.88 2kw9 h TYR 59 Cb 0.02 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 2kw9 h TYR 59 CO 0.01 0.84 0.05 0.37 -1.64 0.00 0.00 178.16 177.79 2kw9 h GLN 60 N 0.27 0.90 0.00 1.82 -0.00 -0.95 -2.97 115.11 114.18 2kw9 h GLN 60 Ca 0.05 -0.26 -0.00 0.00 -0.00 0.00 0.00 58.65 58.44 2kw9 h GLN 60 Cb 0.70 -0.09 -0.00 0.00 0.00 0.00 0.00 27.48 28.08 2kw9 h GLN 60 CO 0.05 0.89 -0.01 0.22 0.00 0.00 0.00 178.83 179.98 2kw9 h ASP 61 N 0.78 0.00 -0.10 -0.69 3.58 -0.74 0.17 116.42 119.42 2kw9 h ASP 61 Ca 0.16 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.61 2kw9 h ASP 61 Cb 0.46 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2kw9 h ASP 61 CO 0.02 0.01 0.00 0.00 -2.88 0.00 0.00 179.24 176.38 2kw9 n GLN 62 N -4.52 1.92 0.00 0.28 10.64 -0.96 -3.84 117.38 120.90 2kw9 n GLN 62 Ca -0.03 -1.35 0.00 0.00 -1.83 0.00 0.00 57.00 53.79 2kw9 n GLN 62 Cb 0.10 -1.46 0.00 0.00 -0.86 0.00 0.00 30.24 28.02 2kw9 n GLN 62 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.06 175.67 2kw9 n ILE 63 N 0.61 0.00 -4.41 -0.39 -5.35 -0.64 -5.05 119.36 104.12 2kw9 n ILE 63 Ca 0.17 -0.43 -0.30 0.00 -0.27 0.00 0.00 62.75 61.92 2kw9 n ILE 63 Cb 0.43 1.09 -0.11 0.00 -1.74 0.00 0.00 39.64 39.31 2kw9 n ILE 63 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2kw9 s SER 64 N -0.28 4.04 0.38 7.28 0.15 -0.04 -5.08 113.70 120.14 2kw9 s SER 64 Ca 0.00 -0.44 -0.28 0.00 0.70 0.00 0.00 55.95 55.93 2kw9 s SER 64 Cb 0.00 -0.68 -0.10 0.00 -1.71 0.00 0.00 66.02 63.53 2kw9 s SER 64 CO 0.00 0.21 1.43 -2.16 1.20 0.00 0.00 173.24 173.93 2kw9 s PRO 65 N -1.87 4.07 0.79 5.44 0.04 -1.26 -4.84 135.00 137.37 2kw9 s PRO 65 Ca 0.18 2.46 -0.14 0.00 0.04 0.00 0.00 61.00 63.54 2kw9 s PRO 65 Cb -0.11 -2.92 0.07 0.00 0.04 0.00 0.00 34.50 31.59 2kw9 s PRO 65 CO 0.09 -0.52 1.20 0.14 0.04 0.00 0.00 177.00 177.96 2kw9 s VAL 66 N -1.15 2.12 0.44 -0.36 -7.23 -1.26 -4.84 120.40 108.12 2kw9 s VAL 66 Ca 0.54 0.05 0.23 0.00 -1.81 0.00 0.00 61.98 61.00 2kw9 s VAL 66 Cb -0.44 -2.50 0.43 0.00 0.56 0.00 0.00 36.38 34.43 2kw9 s VAL 66 CO 0.59 -0.04 1.79 -0.65 -0.31 0.00 0.00 175.10 176.49 2kw9 h PRO 67 N -0.78 0.27 0.00 4.82 0.11 -2.00 0.12 132.00 134.54 2kw9 h PRO 67 Ca -0.46 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2kw9 h PRO 67 Cb 1.29 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2kw9 h PRO 67 CO 0.47 0.18 -0.01 0.78 -0.21 0.00 0.00 178.00 179.21 2kw9 h GLY 68 N 0.27 0.00 -4.67 -0.55 0.00 -2.03 -3.42 103.07 92.67 2kw9 h GLY 68 Ca 0.57 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.34 2kw9 h GLY 68 CO -0.20 0.00 0.04 0.00 0.00 0.00 0.00 176.54 176.37 2kw9 s ALA 69 N -4.06 3.49 -0.78 3.60 0.00 0.43 -4.99 121.76 119.44 2kw9 s ALA 69 Ca -0.03 0.12 -0.25 0.00 0.00 0.00 0.00 51.96 51.79 2kw9 s ALA 69 Cb 0.12 -2.79 -0.08 0.00 0.00 0.00 0.00 23.12 20.37 2kw9 s ALA 69 CO 0.46 0.23 2.17 -2.14 0.00 0.00 0.00 175.76 176.47 2kw9 s PRO 70 N -0.53 2.15 -0.44 0.00 0.02 -1.26 -4.87 135.00 130.06 2kw9 s PRO 70 Ca 0.32 0.30 -0.28 0.00 0.02 0.00 0.00 61.00 61.37 2kw9 s PRO 70 Cb -0.20 -4.82 0.03 0.00 0.02 0.00 0.00 34.50 29.53 2kw9 s PRO 70 CO 0.20 -3.70 1.08 0.21 -0.33 0.00 0.00 177.00 174.45 2kw9 s LYS 71 N 7.87 3.77 0.00 5.54 2.47 -1.26 -5.02 119.74 133.12 2kw9 s LYS 71 Ca 0.81 0.60 -0.30 0.00 -1.56 0.00 0.00 55.97 55.52 2kw9 s LYS 71 Cb -0.11 -3.87 -0.06 0.00 -1.46 0.00 0.00 37.83 32.33 2kw9 s LYS 71 CO 0.08 -1.24 1.40 0.00 0.16 0.00 0.00 175.35 175.75 2kw9 s ALA 72 N 4.13 3.58 0.60 3.13 0.00 -1.26 -5.01 121.76 126.93 2kw9 s ALA 72 Ca 0.45 0.88 -0.16 0.00 0.00 0.00 0.00 51.96 53.13 2kw9 s ALA 72 Cb -0.09 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 2kw9 s ALA 72 CO 0.27 -0.90 1.08 -1.25 0.00 0.00 0.00 175.76 174.96 2kw9 s PRO 73 N 2.36 3.17 -0.39 0.00 0.04 -1.26 -5.01 135.00 133.90 2kw9 s PRO 73 Ca 0.64 1.33 -0.20 0.00 0.04 0.00 0.00 61.00 62.81 2kw9 s PRO 73 Cb -0.31 -2.00 0.01 0.00 0.04 0.00 0.00 34.50 32.23 2kw9 s PRO 73 CO 0.26 -0.95 0.59 0.00 0.04 0.00 0.00 177.00 176.95 2kw9 s ALA 74 N -2.30 3.42 -2.64 8.56 0.00 -1.26 -5.34 121.76 122.19 2kw9 s ALA 74 Ca 0.66 -1.09 0.27 0.00 0.00 0.00 0.00 51.96 51.80 2kw9 s ALA 74 Cb -0.19 -3.17 0.81 0.00 0.00 0.00 0.00 23.12 20.57 2kw9 s ALA 74 CO 0.36 -1.50 1.61 0.00 0.00 0.00 0.00 175.76 176.23