#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 -0.15 3.46 3.03 0.00 -1.26 -5.11 105.19 105.16 2kw9 n GLY 2 Ca 0.00 0.76 -0.43 0.00 0.00 0.00 0.00 46.02 46.35 2kw9 n GLY 2 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kw9 s HIS 3 N 0.00 2.69 -0.12 1.61 4.02 -1.26 -4.99 115.29 117.23 2kw9 s HIS 3 Ca 0.00 -0.59 -0.05 0.00 1.02 0.00 0.00 55.06 55.43 2kw9 s HIS 3 Cb 0.00 -4.30 0.06 0.00 -1.02 0.00 0.00 32.58 27.32 2kw9 s HIS 3 CO 0.00 -1.65 0.27 -1.58 1.02 0.00 0.00 174.74 172.80 2kw9 s HIS 4 N 4.02 -0.41 -0.00 1.40 2.46 -1.26 -5.16 115.29 116.34 2kw9 s HIS 4 Ca 0.23 0.94 -0.12 0.00 0.47 0.00 0.00 55.06 56.57 2kw9 s HIS 4 Cb -0.16 0.03 0.02 0.00 -0.13 0.00 0.00 32.58 32.34 2kw9 s HIS 4 CO 0.09 -0.31 0.25 -1.58 -2.47 0.00 0.00 174.74 170.73 2kw9 s HIS 5 N 1.88 -0.10 0.16 3.88 5.65 -1.26 -5.18 115.29 120.32 2kw9 s HIS 5 Ca -0.04 0.09 0.07 0.00 0.25 0.00 0.00 55.06 55.43 2kw9 s HIS 5 Cb -0.11 0.05 -0.04 0.00 -1.18 0.00 0.00 32.58 31.29 2kw9 s HIS 5 CO -0.09 -0.38 -0.14 -3.38 -0.65 0.00 0.00 174.74 170.10 2kw9 s HIS 6 N -1.54 1.56 -0.30 3.88 0.00 -1.26 -5.14 115.29 112.49 2kw9 s HIS 6 Ca -0.13 -0.58 -0.02 0.00 -3.00 0.00 0.00 55.06 51.34 2kw9 s HIS 6 Cb -0.05 -0.77 0.19 0.00 -4.00 0.00 0.00 32.58 27.95 2kw9 s HIS 6 CO 0.02 0.24 0.62 -3.38 -1.00 0.00 0.00 174.74 171.24 2kw9 s HIS 7 N -2.58 -1.56 -0.15 0.38 0.00 -1.26 -5.15 115.29 104.98 2kw9 s HIS 7 Ca 0.16 1.70 0.00 0.00 -3.00 0.00 0.00 55.06 53.92 2kw9 s HIS 7 Cb -0.03 0.56 0.03 0.00 -4.00 0.00 0.00 32.58 29.15 2kw9 s HIS 7 CO 0.05 -0.85 -0.10 -1.58 -1.00 0.00 0.00 174.74 171.26 2kw9 s HIS 8 N 2.86 1.93 -0.04 0.38 2.46 -1.26 -5.13 115.29 116.50 2kw9 s HIS 8 Ca 0.19 -1.12 -0.08 0.00 0.47 0.00 0.00 55.06 54.52 2kw9 s HIS 8 Cb -0.15 -1.45 0.01 0.00 -0.13 0.00 0.00 32.58 30.87 2kw9 s HIS 8 CO -0.21 -0.63 0.19 0.45 -2.47 0.00 0.00 174.74 172.08 2kw9 s SER 9 N 1.56 -0.11 -0.42 9.88 0.15 -1.26 -5.12 113.70 118.39 2kw9 s SER 9 Ca 0.03 0.12 0.04 0.00 0.70 0.00 0.00 55.95 56.84 2kw9 s SER 9 Cb -0.14 0.32 0.19 0.00 -1.71 0.00 0.00 66.02 64.68 2kw9 s SER 9 CO -0.09 -0.24 0.74 -2.28 1.20 0.00 0.00 173.24 172.57 2kw9 s HIS 10 N -0.67 -1.42 0.03 3.44 2.46 -1.26 -5.16 115.29 112.71 2kw9 s HIS 10 Ca -0.08 0.03 -0.17 0.00 0.47 0.00 0.00 55.06 55.31 2kw9 s HIS 10 Cb -0.04 0.27 -0.06 0.00 -0.13 0.00 0.00 32.58 32.61 2kw9 s HIS 10 CO 0.01 -1.00 0.48 1.41 -2.47 0.00 0.00 174.74 173.17 2kw9 s MET 11 N 1.61 4.07 -0.06 2.88 -2.45 -1.26 -5.09 119.30 118.99 2kw9 s MET 11 Ca 0.19 0.56 0.04 0.00 -1.25 0.00 0.00 55.69 55.23 2kw9 s MET 11 Cb -0.01 -3.24 -0.02 0.00 1.25 0.00 0.00 34.83 32.81 2kw9 s MET 11 CO -0.08 0.64 -0.17 -1.12 1.05 0.00 0.00 175.02 175.34 2kw9 s SER 12 N -1.00 3.76 0.39 1.11 0.01 -1.26 -5.14 113.70 111.58 2kw9 s SER 12 Ca 0.26 -0.30 -0.05 0.00 1.31 0.00 0.00 55.95 57.17 2kw9 s SER 12 Cb -0.18 -0.92 -0.05 0.00 0.21 0.00 0.00 66.02 65.09 2kw9 s SER 12 CO 0.16 0.30 0.67 0.42 0.41 0.00 0.00 173.24 175.20 2kw9 s THR 13 N -0.45 4.95 0.44 1.44 -4.23 -1.26 -5.05 115.64 111.48 2kw9 s THR 13 Ca 0.05 0.12 -0.24 0.00 -1.18 0.00 0.00 61.69 60.44 2kw9 s THR 13 Cb -0.12 -3.80 -0.10 0.00 1.34 0.00 0.00 72.50 69.82 2kw9 s THR 13 CO 0.02 -0.59 1.06 -2.65 -0.54 0.00 0.00 174.62 171.92 2kw9 n PRO 14 N -1.62 1.43 -3.35 3.99 -0.02 -1.26 -4.97 135.00 129.20 2kw9 n PRO 14 Ca -0.01 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 2kw9 n PRO 14 Cb 0.55 -2.12 -0.09 0.00 -0.02 0.00 0.00 33.50 31.81 2kw9 n PRO 14 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2kw9 s LEU 15 N -0.90 4.72 0.63 2.45 1.43 -1.26 -5.07 118.68 120.67 2kw9 s LEU 15 Ca 0.64 -0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 53.20 2kw9 s LEU 15 Cb -0.54 -2.36 0.05 0.00 0.03 0.00 0.00 46.19 43.38 2kw9 s LEU 15 CO 0.56 -0.49 0.89 0.28 0.23 0.00 0.00 176.35 177.83 2kw9 s THR 16 N 2.07 2.47 0.31 5.49 -1.32 -1.26 -5.09 115.64 118.30 2kw9 s THR 16 Ca 0.12 -0.51 -0.09 0.00 -1.21 0.00 0.00 61.69 60.00 2kw9 s THR 16 Cb -0.17 -2.96 -0.07 0.00 -1.51 0.00 0.00 72.50 67.80 2kw9 s THR 16 CO 0.13 0.00 0.63 -0.83 -2.21 0.00 0.00 174.62 172.34 2kw9 s GLY 17 N -4.49 2.06 0.05 6.08 0.00 -1.26 -5.10 107.32 104.65 2kw9 s GLY 17 Ca 0.59 -0.31 -0.21 0.00 0.00 0.00 0.00 44.72 44.80 2kw9 s GLY 17 CO 0.41 -0.16 0.48 -1.59 0.00 0.00 0.00 173.10 172.25 2kw9 s LYS 18 N -3.35 1.01 1.40 2.90 0.00 -1.26 -4.60 119.74 115.84 2kw9 s LYS 18 Ca 0.48 -0.31 -0.23 0.00 0.00 0.00 0.00 55.97 55.91 2kw9 s LYS 18 Cb -0.11 0.46 0.36 0.00 0.00 0.00 0.00 37.83 38.54 2kw9 s LYS 18 CO 0.26 -0.36 0.97 -2.14 0.00 0.00 0.00 175.35 174.08 2kw9 s PRO 19 N -2.59 -2.74 0.00 1.78 0.02 -1.26 -5.05 135.00 125.15 2kw9 s PRO 19 Ca -0.05 -0.01 0.00 0.00 0.02 0.00 0.00 61.00 60.96 2kw9 s PRO 19 Cb -0.01 -1.41 0.00 0.00 0.02 0.00 0.00 34.50 33.10 2kw9 s PRO 19 CO -0.03 -4.72 0.00 0.41 -0.33 0.00 0.00 177.00 172.33 2kw9 n GLY 20 N 0.79 0.89 3.62 0.52 0.00 -1.26 -5.10 105.19 104.65 2kw9 n GLY 20 Ca 0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.11 2kw9 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kw9 s ALA 21 N -4.29 -2.06 0.55 4.61 0.00 -1.26 -5.16 121.76 114.15 2kw9 s ALA 21 Ca 0.00 1.76 -0.22 0.00 0.00 0.00 0.00 51.96 53.51 2kw9 s ALA 21 Cb 0.00 -1.31 -0.05 0.00 0.00 0.00 0.00 23.12 21.76 2kw9 s ALA 21 CO 0.00 -0.24 1.37 -0.51 0.00 0.00 0.00 175.76 176.39 2kw9 s LEU 22 N -0.77 3.85 0.24 0.00 1.43 -1.26 -4.90 118.68 117.27 2kw9 s LEU 22 Ca 0.05 2.80 -0.30 0.00 -1.03 0.00 0.00 54.13 55.65 2kw9 s LEU 22 Cb -0.02 -4.26 -0.14 0.00 0.03 0.00 0.00 46.19 41.79 2kw9 s LEU 22 CO -0.06 -1.61 1.17 -2.65 0.23 0.00 0.00 176.35 173.44 2kw9 n PRO 23 N -1.04 1.50 0.11 1.29 -0.02 -1.26 -4.89 135.00 130.68 2kw9 n PRO 23 Ca 0.10 0.53 0.13 0.00 -2.02 0.00 0.00 63.50 62.24 2kw9 n PRO 23 Cb 0.45 -2.02 0.39 0.00 -0.02 0.00 0.00 33.50 32.29 2kw9 n PRO 23 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kw9 h ALA 24 N 3.02 0.99 -0.56 3.55 0.00 -2.06 -3.30 119.26 120.91 2kw9 h ALA 24 Ca -0.42 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.25 2kw9 h ALA 24 Cb 1.32 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.97 2kw9 h ALA 24 CO 0.68 0.00 0.30 0.09 0.00 0.00 0.00 179.25 180.31 2kw9 n ASN 25 N -2.32 3.65 -0.32 0.00 4.13 -1.26 -4.62 115.26 114.52 2kw9 n ASN 25 Ca 0.05 -2.90 0.16 0.00 1.68 0.00 0.00 54.58 53.57 2kw9 n ASN 25 Cb 0.44 -0.69 0.39 0.00 -1.54 0.00 0.00 39.78 38.38 2kw9 n ASN 25 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 2kw9 h LEU 26 N 1.46 0.65 -0.39 3.41 3.38 -1.95 0.22 115.31 122.09 2kw9 h LEU 26 Ca 0.29 0.08 -0.18 0.00 0.09 0.00 0.00 57.88 58.17 2kw9 h LEU 26 Cb 1.98 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.68 2kw9 h LEU 26 CO 0.59 0.22 -0.80 -0.78 0.09 0.00 0.00 178.44 177.76 2kw9 h ASP 27 N 0.63 0.12 1.10 -0.43 3.58 -1.93 -2.95 116.42 116.53 2kw9 h ASP 27 Ca 0.56 -0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.87 2kw9 h ASP 27 Cb 1.05 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.06 2kw9 h ASP 27 CO -0.32 0.87 -0.22 -0.78 -2.88 0.00 0.00 179.24 175.91 2kw9 h ASP 28 N 0.05 0.00 -4.29 2.28 3.58 -1.06 -3.45 116.42 113.54 2kw9 h ASP 28 Ca -0.02 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 56.92 2kw9 h ASP 28 Cb 1.41 0.00 0.13 0.00 1.72 0.00 0.00 39.33 42.59 2kw9 h ASP 28 CO 0.11 0.22 0.32 -0.04 -2.88 0.00 0.00 179.24 176.97 2kw9 s MET 29 N -3.53 2.26 0.33 0.28 -1.94 0.41 -5.06 119.30 112.06 2kw9 s MET 29 Ca 0.02 1.08 -0.02 0.00 -1.71 0.00 0.00 55.69 55.05 2kw9 s MET 29 Cb 0.09 -1.90 -0.04 0.00 2.01 0.00 0.00 34.83 34.99 2kw9 s MET 29 CO 0.64 -1.61 0.57 0.15 -0.01 0.00 0.00 175.02 174.76 2kw9 s LYS 30 N -4.94 3.55 0.19 2.03 1.02 -1.26 -4.94 119.74 115.39 2kw9 s LYS 30 Ca 0.61 -0.15 -0.12 0.00 0.02 0.00 0.00 55.97 56.33 2kw9 s LYS 30 Cb -0.17 -2.63 0.22 0.00 -0.52 0.00 0.00 37.83 34.73 2kw9 s LYS 30 CO 0.56 0.15 1.70 0.28 -0.92 0.00 0.00 175.35 177.11 2kw9 h VAL 31 N 0.96 0.64 -0.54 3.17 2.07 -1.96 -0.61 116.25 119.98 2kw9 h VAL 31 Ca -0.49 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 2kw9 h VAL 31 Cb 1.20 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2kw9 h VAL 31 CO 0.64 0.03 0.25 0.00 0.02 0.00 0.00 177.57 178.51 2kw9 h ALA 32 N 1.44 1.44 -0.14 1.67 0.00 -1.99 -1.27 119.26 120.41 2kw9 h ALA 32 Ca 0.27 -0.11 -0.17 0.00 0.00 0.00 0.00 54.91 54.90 2kw9 h ALA 32 Cb 0.39 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2kw9 h ALA 32 CO -0.39 0.44 -0.62 0.93 0.00 0.00 0.00 179.25 179.62 2kw9 h GLU 33 N 0.75 0.47 0.03 0.00 5.08 -1.56 -0.60 114.58 118.76 2kw9 h GLU 33 Ca 0.19 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 2kw9 h GLU 33 Cb 0.09 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2kw9 h GLU 33 CO -0.02 0.94 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.84 2kw9 h LEU 34 N 0.35 -0.04 -0.87 1.33 3.38 -0.88 -2.76 115.31 115.82 2kw9 h LEU 34 Ca -0.01 -0.28 0.10 0.00 0.09 0.00 0.00 57.88 57.79 2kw9 h LEU 34 Cb 1.16 0.01 -0.08 0.00 0.09 0.00 0.00 40.66 41.85 2kw9 h LEU 34 CO 0.11 0.26 0.51 0.11 0.09 0.00 0.00 178.44 179.52 2kw9 h LYS 35 N -0.33 0.82 -0.37 1.13 1.57 -1.19 -0.70 116.57 117.49 2kw9 h LYS 35 Ca -0.00 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2kw9 h LYS 35 Cb 0.31 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 2kw9 h LYS 35 CO 0.01 0.54 0.10 0.37 -0.57 0.00 0.00 179.45 179.90 2kw9 h GLN 36 N 0.84 0.24 -0.30 3.15 -0.00 -1.02 -0.36 115.11 117.66 2kw9 h GLN 36 Ca 0.42 -0.01 -0.17 0.00 -0.00 0.00 0.00 58.65 58.89 2kw9 h GLN 36 Cb 0.40 -0.05 -0.00 0.00 0.00 0.00 0.00 27.48 27.82 2kw9 h GLN 36 CO -0.25 0.16 -0.50 0.93 0.00 0.00 0.00 178.83 179.16 2kw9 h GLU 37 N 0.24 0.83 0.14 1.69 5.08 -1.17 -3.08 114.58 118.32 2kw9 h GLU 37 Ca 0.17 -0.50 0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2kw9 h GLU 37 Cb 0.18 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2kw9 h GLU 37 CO -0.20 1.13 -0.25 -0.07 -1.00 0.00 0.00 179.01 178.62 2kw9 h LEU 38 N 0.65 -0.70 -2.01 1.33 3.38 -0.72 -2.75 115.31 114.50 2kw9 h LEU 38 Ca 0.03 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2kw9 h LEU 38 Cb 1.09 0.26 -0.00 0.00 0.09 0.00 0.00 40.66 42.10 2kw9 h LEU 38 CO 0.11 -0.34 -0.10 0.07 0.09 0.00 0.00 178.44 178.27 2kw9 h LYS 39 N -0.47 0.00 -0.00 1.13 2.10 -1.12 0.16 116.57 118.37 2kw9 h LYS 39 Ca 0.02 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.55 2kw9 h LYS 39 Cb 0.48 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.79 2kw9 h LYS 39 CO -0.13 0.10 -0.60 -0.07 -2.00 0.00 0.00 179.45 176.75 2kw9 h LEU 40 N 0.00 0.00 -3.01 7.07 3.38 -1.41 -2.64 115.31 118.70 2kw9 h LEU 40 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2kw9 h LEU 40 Cb 0.25 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2kw9 h LEU 40 CO 0.01 0.61 0.00 0.54 0.09 0.00 0.00 178.44 179.69 2kw9 n ARG 41 N -3.82 3.89 -1.33 1.13 3.00 -0.10 -4.93 116.66 114.50 2kw9 n ARG 41 Ca -0.01 -2.66 -0.11 0.00 -0.01 0.00 0.00 57.85 55.05 2kw9 n ARG 41 Cb 0.60 -1.99 -0.05 0.00 0.00 0.00 0.00 32.46 31.03 2kw9 n ARG 41 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2kw9 n SER 42 N 0.81 -5.25 -4.74 0.55 2.88 -0.56 -4.97 113.62 102.34 2kw9 n SER 42 Ca 0.24 0.28 -0.41 0.00 -1.33 0.00 0.00 58.87 57.65 2kw9 n SER 42 Cb 0.93 -3.75 -0.05 0.00 -0.75 0.00 0.00 64.21 60.60 2kw9 n SER 42 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2kw9 s LEU 43 N -2.58 4.54 -0.04 2.46 1.43 0.36 -4.94 118.68 119.90 2kw9 s LEU 43 Ca 0.00 1.86 -0.33 0.00 -1.03 0.00 0.00 54.13 54.63 2kw9 s LEU 43 Cb 0.00 -3.60 -0.11 0.00 0.03 0.00 0.00 46.19 42.51 2kw9 s LEU 43 CO 0.00 -0.02 1.88 -2.65 0.23 0.00 0.00 176.35 175.80 2kw9 n PRO 44 N 2.39 2.34 -0.29 1.29 -0.02 -1.26 -3.94 135.00 135.52 2kw9 n PRO 44 Ca 0.01 0.86 0.09 0.00 -2.02 0.00 0.00 63.50 62.44 2kw9 n PRO 44 Cb 0.48 -2.72 0.25 0.00 -0.02 0.00 0.00 33.50 31.49 2kw9 n PRO 44 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2kw9 n VAL 45 N 5.13 0.77 0.23 -1.45 0.24 -1.26 -4.35 118.33 117.63 2kw9 n VAL 45 Ca 0.22 -0.75 0.11 0.00 -2.04 0.00 0.00 64.34 61.88 2kw9 n VAL 45 Cb 0.32 0.36 0.41 0.00 -1.47 0.00 0.00 33.84 33.46 2kw9 n VAL 45 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2kw9 h SER 46 N 3.24 0.00 -3.79 -1.34 0.87 -2.01 -3.46 113.55 107.06 2kw9 h SER 46 Ca 0.00 0.00 -0.45 0.00 -1.23 0.00 0.00 61.79 60.11 2kw9 h SER 46 Cb 0.76 0.00 0.17 0.00 -0.44 0.00 0.00 62.40 62.89 2kw9 h SER 46 CO 0.01 0.15 0.17 -0.83 -0.53 0.00 0.00 176.83 175.80 2kw9 s GLY 47 N -4.26 1.57 0.93 5.77 0.00 -1.26 -5.04 107.32 105.02 2kw9 s GLY 47 Ca 0.02 -0.29 -0.13 0.00 0.00 0.00 0.00 44.72 44.33 2kw9 s GLY 47 CO 0.63 0.33 1.13 -0.51 0.00 0.00 0.00 173.10 174.68 2kw9 s THR 48 N -2.88 1.99 0.26 0.90 -4.23 -1.26 -4.63 115.64 105.80 2kw9 s THR 48 Ca 0.66 0.00 -0.02 0.00 -1.18 0.00 0.00 61.69 61.15 2kw9 s THR 48 Cb -0.20 -2.71 0.26 0.00 1.34 0.00 0.00 72.50 71.19 2kw9 s THR 48 CO 0.59 0.00 1.68 0.50 -0.54 0.00 0.00 174.62 176.84 2kw9 h LYS 49 N -1.58 0.27 -0.44 3.99 3.64 -1.97 0.24 116.57 120.71 2kw9 h LYS 49 Ca -0.51 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.81 2kw9 h LYS 49 Cb 1.33 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.07 2kw9 h LYS 49 CO 0.60 0.18 0.11 1.15 -2.27 0.00 0.00 179.45 179.22 2kw9 h THR 50 N 0.28 1.23 -0.34 1.00 2.02 -1.99 -2.60 112.91 112.51 2kw9 h THR 50 Ca 0.47 -0.80 -0.06 0.00 0.77 0.00 0.00 66.41 66.79 2kw9 h THR 50 Cb 0.86 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 2kw9 h THR 50 CO -0.55 0.28 -0.04 -0.33 0.37 0.00 0.00 175.52 175.25 2kw9 h GLU 51 N 0.59 0.54 -0.48 6.66 5.08 -1.18 -0.71 114.58 125.07 2kw9 h GLU 51 Ca 0.14 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2kw9 h GLU 51 Cb 0.31 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2kw9 h GLU 51 CO 0.00 0.60 0.25 -0.07 -1.00 0.00 0.00 179.01 178.79 2kw9 h LEU 52 N 0.51 0.62 0.23 1.33 3.38 -0.52 0.16 115.31 121.03 2kw9 h LEU 52 Ca 0.11 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2kw9 h LEU 52 Cb 0.39 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2kw9 h LEU 52 CO 0.02 0.56 -0.11 0.40 0.09 0.00 0.00 178.44 179.39 2kw9 h ILE 53 N 0.64 0.79 -0.01 1.22 2.04 -1.06 -2.25 117.51 118.88 2kw9 h ILE 53 Ca 0.17 -0.09 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2kw9 h ILE 53 Cb 0.09 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.01 2kw9 h ILE 53 CO -0.02 0.02 -0.06 -0.33 0.00 0.00 0.00 178.15 177.75 2kw9 h GLU 54 N -0.36 0.02 0.00 2.37 4.39 -1.02 -1.31 114.58 118.67 2kw9 h GLU 54 Ca -0.03 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.67 2kw9 h GLU 54 Cb 0.27 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 2kw9 h GLU 54 CO 0.05 0.09 -0.00 -0.09 -1.16 0.00 0.00 179.01 177.90 2kw9 h ARG 55 N 0.02 -0.00 0.12 2.33 9.65 -0.44 -0.02 114.38 126.05 2kw9 h ARG 55 Ca 0.00 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2kw9 h ARG 55 Cb 0.13 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.71 2kw9 h ARG 55 CO 0.01 0.36 -0.07 -0.07 2.80 0.00 0.00 179.97 183.00 2kw9 h LEU 56 N -0.37 -0.17 -1.10 3.80 3.38 -1.18 -1.65 115.31 118.02 2kw9 h LEU 56 Ca -0.00 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.05 2kw9 h LEU 56 Cb 0.37 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 2kw9 h LEU 56 CO 0.00 -0.11 0.61 0.03 0.09 0.00 0.00 178.44 179.06 2kw9 h ARG 57 N -0.18 1.03 -0.58 1.13 3.08 -1.26 -1.04 114.38 116.56 2kw9 h ARG 57 Ca -0.01 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.87 2kw9 h ARG 57 Cb 0.15 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2kw9 h ARG 57 CO 0.02 0.68 -0.06 0.00 -1.07 0.00 0.00 179.97 179.54 2kw9 h ALA 58 N 1.50 0.79 -0.64 0.04 0.00 -0.84 0.45 119.26 120.55 2kw9 h ALA 58 Ca 0.42 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2kw9 h ALA 58 Cb 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2kw9 h ALA 58 CO -0.17 0.67 0.21 -0.92 0.00 0.00 0.00 179.25 179.04 2kw9 h TYR 59 N 0.95 0.99 0.02 0.00 3.20 -0.30 -2.92 116.97 118.91 2kw9 h TYR 59 Ca 0.16 -0.08 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 2kw9 h TYR 59 Cb 0.63 -0.29 0.01 0.00 1.54 0.00 0.00 36.73 38.62 2kw9 h TYR 59 CO 0.04 0.79 -0.48 0.37 -1.64 0.00 0.00 178.16 177.24 2kw9 h GLN 60 N 0.94 0.29 -0.61 1.82 -0.00 -1.13 -3.30 115.11 113.12 2kw9 h GLN 60 Ca 0.21 -0.34 0.18 0.00 -0.00 0.00 0.00 58.65 58.70 2kw9 h GLN 60 Cb 0.25 0.10 -0.02 0.00 0.00 0.00 0.00 27.48 27.81 2kw9 h GLN 60 CO -0.01 1.06 0.48 0.22 0.00 0.00 0.00 178.83 180.57 2kw9 h ASP 61 N -0.32 0.00 1.13 -0.69 3.58 -0.83 0.15 116.42 119.45 2kw9 h ASP 61 Ca -0.07 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.28 2kw9 h ASP 61 Cb 1.24 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.27 2kw9 h ASP 61 CO 0.09 0.00 -0.91 0.06 -2.88 0.00 0.00 179.24 175.60 2kw9 h GLN 62 N 0.00 0.00 0.00 0.28 3.07 -1.61 -3.35 115.11 113.50 2kw9 h GLN 62 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.03 2kw9 h GLN 62 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.80 2kw9 h GLN 62 CO -0.00 0.28 -1.59 0.44 0.09 0.00 0.00 178.83 178.05 2kw9 n ILE 63 N -2.98 0.00 -2.09 1.86 -5.35 -0.09 -4.96 119.36 105.75 2kw9 n ILE 63 Ca -0.03 -0.30 -0.41 0.00 -0.27 0.00 0.00 62.75 61.74 2kw9 n ILE 63 Cb 0.72 0.40 -0.03 0.00 -1.74 0.00 0.00 39.64 38.99 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 -3.88 6.74 -0.92 7.28 0.15 0.34 -4.52 113.70 118.90 2kw9 s SER 64 Ca -0.02 2.57 -0.24 0.00 0.70 0.00 0.00 55.95 58.96 2kw9 s SER 64 Cb 0.14 -2.62 -0.01 0.00 -1.71 0.00 0.00 66.02 61.83 2kw9 s SER 64 CO 0.88 -0.64 1.72 -2.84 1.20 0.00 0.00 173.24 173.56 2kw9 s PRO 65 N -0.23 2.98 0.65 5.44 0.02 -1.26 -4.97 135.00 137.64 2kw9 s PRO 65 Ca 0.59 -0.55 -0.13 0.00 0.02 0.00 0.00 61.00 60.93 2kw9 s PRO 65 Cb -0.40 -5.09 -0.01 0.00 0.02 0.00 0.00 34.50 29.02 2kw9 s PRO 65 CO 0.41 -2.84 1.06 0.14 -0.33 0.00 0.00 177.00 175.45 2kw9 s VAL 66 N 7.88 3.83 0.15 3.83 -7.23 -1.26 -4.96 120.40 122.63 2kw9 s VAL 66 Ca 0.59 0.74 -0.21 0.00 -1.81 0.00 0.00 61.98 61.29 2kw9 s VAL 66 Cb -0.05 -3.34 0.03 0.00 0.56 0.00 0.00 36.38 33.59 2kw9 s VAL 66 CO -0.02 -0.64 1.24 -2.65 -0.31 0.00 0.00 175.10 172.72 2kw9 n PRO 67 N -2.59 -0.29 -3.11 4.82 -0.02 -1.26 -2.97 135.00 129.57 2kw9 n PRO 67 Ca 0.08 1.22 -0.27 0.00 -2.02 0.00 0.00 63.50 62.51 2kw9 n PRO 67 Cb 0.53 -1.80 -0.05 0.00 -0.02 0.00 0.00 33.50 32.16 2kw9 n PRO 67 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2kw9 n GLY 68 N -1.26 5.34 3.56 -1.23 0.00 -1.26 -5.03 105.19 105.31 2kw9 n GLY 68 Ca 0.04 -2.78 -0.15 0.00 0.00 0.00 0.00 46.02 43.12 2kw9 n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kw9 s ALA 69 N -3.13 -1.82 0.80 4.61 0.00 -1.16 -5.18 121.76 115.88 2kw9 s ALA 69 Ca 0.46 1.56 -0.11 0.00 0.00 0.00 0.00 51.96 53.86 2kw9 s ALA 69 Cb 0.23 -0.48 0.07 0.00 0.00 0.00 0.00 23.12 22.94 2kw9 s ALA 69 CO -0.09 -0.34 1.09 -1.25 0.00 0.00 0.00 175.76 175.16 2kw9 s PRO 70 N -0.75 2.04 0.23 0.00 0.04 -1.26 -4.51 135.00 130.80 2kw9 s PRO 70 Ca -0.06 0.78 -0.13 0.00 0.04 0.00 0.00 61.00 61.62 2kw9 s PRO 70 Cb -0.01 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.62 2kw9 s PRO 70 CO 0.05 -1.68 0.47 -1.59 0.04 0.00 0.00 177.00 174.29 2kw9 s LYS 71 N -5.06 1.49 -0.22 4.56 0.00 -1.26 -4.91 119.74 114.34 2kw9 s LYS 71 Ca 0.61 -1.17 -0.03 0.00 0.00 0.00 0.00 55.97 55.38 2kw9 s LYS 71 Cb -0.15 0.47 0.07 0.00 0.00 0.00 0.00 37.83 38.22 2kw9 s LYS 71 CO 0.55 -0.62 0.06 0.00 0.00 0.00 0.00 175.35 175.34 2kw9 s ALA 72 N -3.99 0.98 0.07 0.59 0.00 -1.26 -5.11 121.76 113.03 2kw9 s ALA 72 Ca 0.19 -0.83 -0.30 0.00 0.00 0.00 0.00 51.96 51.02 2kw9 s ALA 72 Cb -0.01 -1.25 -0.06 0.00 0.00 0.00 0.00 23.12 21.81 2kw9 s ALA 72 CO 0.06 -1.29 1.18 -1.25 0.00 0.00 0.00 175.76 174.46 2kw9 s PRO 73 N 1.88 4.45 -0.64 0.00 0.04 -1.26 -4.97 135.00 134.50 2kw9 s PRO 73 Ca 0.02 1.76 -0.17 0.00 0.04 0.00 0.00 61.00 62.64 2kw9 s PRO 73 Cb -0.17 -3.34 0.13 0.00 0.04 0.00 0.00 34.50 31.16 2kw9 s PRO 73 CO -0.13 -0.22 0.69 0.00 0.04 0.00 0.00 177.00 177.38 2kw9 s ALA 74 N 0.93 3.58 0.00 8.56 0.00 -1.26 -5.01 121.76 128.56 2kw9 s ALA 74 Ca 0.58 -2.52 0.00 0.00 0.00 0.00 0.00 51.96 50.01 2kw9 s ALA 74 Cb -0.29 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.33 2kw9 s ALA 74 CO 0.30 -2.30 0.00 0.00 0.00 0.00 0.00 175.76 173.75