#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 3.47 3.07 3.03 0.00 -1.26 -5.18 105.19 108.31 2kw9 n GLY 2 Ca 0.00 -1.43 -0.14 0.00 0.00 0.00 0.00 46.02 44.44 2kw9 n GLY 2 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2kw9 n HIS 3 N -1.71 -1.24 -3.66 1.61 -0.00 -1.26 -5.17 115.22 103.79 2kw9 n HIS 3 Ca 0.00 -2.25 -0.09 0.00 -0.00 0.00 0.00 57.72 55.38 2kw9 n HIS 3 Cb 0.00 0.46 -0.10 0.00 -0.00 0.00 0.00 29.99 30.35 2kw9 n HIS 3 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2kw9 s HIS 4 N -3.11 -0.71 -0.06 4.41 0.00 -1.26 -5.17 115.29 109.39 2kw9 s HIS 4 Ca 0.29 1.41 -0.05 0.00 -3.00 0.00 0.00 55.06 53.70 2kw9 s HIS 4 Cb -0.00 0.24 0.02 0.00 -4.00 0.00 0.00 32.58 28.84 2kw9 s HIS 4 CO 0.21 -0.44 0.15 -1.58 -1.00 0.00 0.00 174.74 172.07 2kw9 s HIS 5 N 2.44 -0.17 0.53 0.38 5.65 -1.26 -5.17 115.29 117.69 2kw9 s HIS 5 Ca -0.02 0.43 0.03 0.00 0.25 0.00 0.00 55.06 55.75 2kw9 s HIS 5 Cb -0.12 0.04 0.01 0.00 -1.18 0.00 0.00 32.58 31.34 2kw9 s HIS 5 CO -0.12 -0.09 0.20 -1.01 -0.65 0.00 0.00 174.74 173.06 2kw9 s HIS 6 N 0.23 1.74 0.23 3.88 0.09 -1.26 -5.17 115.29 115.04 2kw9 s HIS 6 Ca -0.01 -0.90 0.07 0.00 -0.00 0.00 0.00 55.06 54.22 2kw9 s HIS 6 Cb -0.02 -1.76 -0.05 0.00 -0.00 0.00 0.00 32.58 30.75 2kw9 s HIS 6 CO -0.01 -0.11 -0.12 -3.38 -0.00 0.00 0.00 174.74 171.12 2kw9 s HIS 7 N -2.83 1.81 0.80 1.40 0.00 -1.26 -5.15 115.29 110.05 2kw9 s HIS 7 Ca 0.19 -0.61 -0.12 0.00 -3.00 0.00 0.00 55.06 51.52 2kw9 s HIS 7 Cb -0.00 -0.91 0.07 0.00 -4.00 0.00 0.00 32.58 27.74 2kw9 s HIS 7 CO 0.12 0.34 1.13 -1.01 -1.00 0.00 0.00 174.74 174.31 2kw9 s HIS 8 N -2.98 2.94 0.58 0.38 4.02 -1.26 -5.09 115.29 113.88 2kw9 s HIS 8 Ca 0.25 0.96 -0.00 0.00 1.02 0.00 0.00 55.06 57.29 2kw9 s HIS 8 Cb 0.01 -3.26 0.04 0.00 -1.02 0.00 0.00 32.58 28.35 2kw9 s HIS 8 CO 0.09 -1.73 0.82 -1.54 1.02 0.00 0.00 174.74 173.40 2kw9 s SER 9 N -4.23 5.21 -0.79 1.40 1.04 -1.26 -5.06 113.70 110.00 2kw9 s SER 9 Ca 0.61 0.09 -0.08 0.00 0.48 0.00 0.00 55.95 57.05 2kw9 s SER 9 Cb -0.13 -0.94 0.20 0.00 0.10 0.00 0.00 66.02 65.25 2kw9 s SER 9 CO 0.52 -1.21 0.69 -1.00 0.98 0.00 0.00 173.24 173.21 2kw9 s HIS 10 N -2.85 3.70 -0.25 5.02 4.02 -1.26 -5.04 115.29 118.63 2kw9 s HIS 10 Ca 0.57 -2.48 -0.09 0.00 1.02 0.00 0.00 55.06 54.09 2kw9 s HIS 10 Cb -0.10 -3.51 -0.04 0.00 -1.02 0.00 0.00 32.58 27.90 2kw9 s HIS 10 CO 0.40 -0.89 0.12 -1.64 1.02 0.00 0.00 174.74 173.75 2kw9 s MET 11 N -0.29 3.83 0.50 1.40 1.00 -1.26 -5.09 119.30 119.39 2kw9 s MET 11 Ca 0.20 -0.39 0.04 0.00 0.00 0.00 0.00 55.69 55.55 2kw9 s MET 11 Cb -0.13 -3.46 -0.00 0.00 0.00 0.00 0.00 34.83 31.23 2kw9 s MET 11 CO -0.07 -0.12 0.20 0.45 0.00 0.00 0.00 175.02 175.47 2kw9 s SER 12 N 1.51 4.38 -0.01 3.03 0.15 -1.26 -5.15 113.70 116.35 2kw9 s SER 12 Ca 0.06 -1.38 0.02 0.00 0.70 0.00 0.00 55.95 55.36 2kw9 s SER 12 Cb -0.15 0.27 -0.03 0.00 -1.71 0.00 0.00 66.02 64.39 2kw9 s SER 12 CO 0.06 -0.88 -0.05 0.42 1.20 0.00 0.00 173.24 173.99 2kw9 s THR 13 N -2.78 3.82 1.06 6.45 -4.23 -1.26 -5.13 115.64 113.57 2kw9 s THR 13 Ca 0.24 -0.66 -0.14 0.00 -1.18 0.00 0.00 61.69 59.95 2kw9 s THR 13 Cb 0.01 -2.66 0.22 0.00 1.34 0.00 0.00 72.50 71.41 2kw9 s THR 13 CO 0.14 0.43 1.10 -2.84 -0.54 0.00 0.00 174.62 172.91 2kw9 s PRO 14 N -1.34 -0.09 0.40 3.99 0.02 -1.26 -5.03 135.00 131.68 2kw9 s PRO 14 Ca 0.17 0.32 -0.23 0.00 0.02 0.00 0.00 61.00 61.28 2kw9 s PRO 14 Cb -0.11 -1.69 -0.10 0.00 0.02 0.00 0.00 34.50 32.61 2kw9 s PRO 14 CO 0.07 -3.04 0.96 -0.51 -0.33 0.00 0.00 177.00 174.14 2kw9 s LEU 15 N -6.61 4.08 0.19 -5.54 1.43 -1.26 -4.98 118.68 105.99 2kw9 s LEU 15 Ca 0.67 1.76 -0.13 0.00 -1.03 0.00 0.00 54.13 55.40 2kw9 s LEU 15 Cb -0.16 -4.35 0.21 0.00 0.03 0.00 0.00 46.19 41.91 2kw9 s LEU 15 CO 0.57 -0.28 1.69 0.74 0.23 0.00 0.00 176.35 179.30 2kw9 h THR 16 N 2.14 0.64 0.00 5.49 2.02 -2.04 -3.42 112.91 117.74 2kw9 h THR 16 Ca -0.48 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.64 2kw9 h THR 16 Cb 1.19 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 2kw9 h THR 16 CO 0.62 0.03 0.00 0.61 0.37 0.00 0.00 175.52 177.15 2kw9 n GLY 17 N -1.31 -1.81 3.77 2.16 0.00 -1.26 -5.16 105.19 101.58 2kw9 n GLY 17 Ca 0.06 0.81 -0.37 0.00 0.00 0.00 0.00 46.02 46.52 2kw9 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kw9 s LYS 18 N 0.00 4.09 -0.22 1.61 3.01 -1.26 -5.06 119.74 121.91 2kw9 s LYS 18 Ca 0.00 0.12 -0.29 0.00 -1.01 0.00 0.00 55.97 54.79 2kw9 s LYS 18 Cb 0.00 -3.36 -0.01 0.00 -1.01 0.00 0.00 37.83 33.45 2kw9 s LYS 18 CO 0.00 0.39 1.30 -1.25 0.51 0.00 0.00 175.35 176.29 2kw9 s PRO 19 N 0.01 4.08 -0.24 -1.68 0.04 -1.26 -4.21 135.00 131.74 2kw9 s PRO 19 Ca 0.18 1.49 -0.10 0.00 0.04 0.00 0.00 61.00 62.60 2kw9 s PRO 19 Cb -0.13 -3.82 -0.05 0.00 0.04 0.00 0.00 34.50 30.53 2kw9 s PRO 19 CO 0.06 -0.90 0.15 0.20 0.04 0.00 0.00 177.00 176.54 2kw9 s GLY 20 N 2.42 1.97 0.31 0.56 0.00 -1.06 -1.07 107.32 110.44 2kw9 s GLY 20 Ca 0.56 -0.91 -0.13 0.00 0.00 0.00 0.00 44.72 44.24 2kw9 s GLY 20 CO 0.19 0.41 0.66 0.00 0.00 0.00 0.00 173.10 174.36 2kw9 n ALA 21 N 4.35 -1.52 -1.60 3.20 0.00 0.01 -2.22 120.51 122.73 2kw9 n ALA 21 Ca -0.15 -1.02 -0.33 0.00 0.00 0.00 0.00 53.44 51.94 2kw9 n ALA 21 Cb 0.52 0.80 0.03 0.00 0.00 0.00 0.00 19.45 20.80 2kw9 n ALA 21 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kw9 s LEU 22 N 0.00 3.41 0.12 0.00 1.43 -1.26 -4.51 118.68 117.87 2kw9 s LEU 22 Ca 0.13 1.85 -0.35 0.00 -1.03 0.00 0.00 54.13 54.73 2kw9 s LEU 22 Cb -0.04 -4.53 -0.16 0.00 0.03 0.00 0.00 46.19 41.49 2kw9 s LEU 22 CO 0.09 -1.36 1.41 -2.65 0.23 0.00 0.00 176.35 174.07 2kw9 n PRO 23 N -2.32 1.51 -0.25 1.29 -0.02 -1.26 -4.88 135.00 129.07 2kw9 n PRO 23 Ca 0.09 0.54 0.01 0.00 -2.02 0.00 0.00 63.50 62.12 2kw9 n PRO 23 Cb 0.53 -2.22 0.13 0.00 -0.02 0.00 0.00 33.50 31.91 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 4.94 0.98 -1.58 3.55 0.00 -1.91 -3.10 119.26 122.14 2kw9 h ALA 24 Ca -0.46 0.04 -0.80 0.00 0.00 0.00 0.00 54.91 53.69 2kw9 h ALA 24 Cb 1.31 -0.08 -0.25 0.00 0.00 0.00 0.00 17.79 18.77 2kw9 h ALA 24 CO 0.81 -0.00 1.11 0.09 0.00 0.00 0.00 179.25 181.26 2kw9 n ASN 25 N -4.83 6.44 0.24 0.00 5.03 -1.26 -4.70 115.26 116.18 2kw9 n ASN 25 Ca 0.11 -3.40 0.08 0.00 0.87 0.00 0.00 54.58 52.23 2kw9 n ASN 25 Cb 0.24 -1.29 0.58 0.00 -1.02 0.00 0.00 39.78 38.29 2kw9 n ASN 25 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 2kw9 h LEU 26 N 5.64 0.00 -1.89 3.41 3.38 -1.94 -2.37 115.31 121.55 2kw9 h LEU 26 Ca 0.31 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.25 2kw9 h LEU 26 Cb 0.55 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2kw9 h LEU 26 CO 1.37 0.16 -0.12 -2.24 0.09 0.00 0.00 178.44 177.69 2kw9 h ASP 27 N 0.00 0.00 0.53 -0.43 2.03 -1.91 -2.03 116.42 114.62 2kw9 h ASP 27 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2kw9 h ASP 27 Cb 0.30 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.80 2kw9 h ASP 27 CO 0.02 0.12 -0.14 -0.67 -1.03 0.00 0.00 179.24 177.54 2kw9 n ASP 28 N -3.69 0.35 -4.93 4.15 2.03 -0.89 -4.89 116.55 108.68 2kw9 n ASP 28 Ca -0.02 -0.27 -0.25 0.00 0.52 0.00 0.00 54.79 54.77 2kw9 n ASP 28 Cb 0.24 -0.12 0.04 0.00 -0.72 0.00 0.00 41.12 40.55 2kw9 n ASP 28 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 2kw9 s MET 29 N -2.68 2.69 0.41 -0.67 -1.94 -0.76 -5.09 119.30 111.27 2kw9 s MET 29 Ca 0.23 -0.22 -0.14 0.00 -1.71 0.00 0.00 55.69 53.85 2kw9 s MET 29 Cb 0.19 -2.30 -0.08 0.00 2.01 0.00 0.00 34.83 34.65 2kw9 s MET 29 CO 0.52 -0.80 0.82 0.15 -0.01 0.00 0.00 175.02 175.71 2kw9 s LYS 30 N -4.98 3.91 0.11 2.03 1.02 -1.26 -4.94 119.74 115.62 2kw9 s LYS 30 Ca 0.55 0.68 -0.31 0.00 0.02 0.00 0.00 55.97 56.92 2kw9 s LYS 30 Cb -0.10 -2.33 -0.10 0.00 -0.52 0.00 0.00 37.83 34.78 2kw9 s LYS 30 CO 0.43 -0.04 1.60 0.28 -0.92 0.00 0.00 175.35 176.70 2kw9 h VAL 31 N 1.34 0.20 -0.15 3.17 2.07 -1.97 -1.23 116.25 119.67 2kw9 h VAL 31 Ca -0.47 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.09 2kw9 h VAL 31 Cb 1.18 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 2kw9 h VAL 31 CO 0.63 0.00 0.11 0.00 0.02 0.00 0.00 177.57 178.34 2kw9 h ALA 32 N -0.15 2.08 -0.09 1.67 0.00 -1.99 0.03 119.26 120.82 2kw9 h ALA 32 Ca 0.02 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.69 2kw9 h ALA 32 Cb 0.67 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.48 2kw9 h ALA 32 CO -0.21 -0.19 -0.87 0.93 0.00 0.00 0.00 179.25 178.91 2kw9 h GLU 33 N 0.00 0.69 -0.46 0.00 4.39 -1.77 -1.77 114.58 115.66 2kw9 h GLU 33 Ca 0.07 -0.63 -0.03 0.00 0.34 0.00 0.00 59.36 59.11 2kw9 h GLU 33 Cb 0.30 0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 2kw9 h GLU 33 CO -0.00 1.23 0.16 -0.07 -1.16 0.00 0.00 179.01 179.17 2kw9 h LEU 34 N 0.44 0.65 -0.91 1.33 3.38 -0.29 -2.71 115.31 117.20 2kw9 h LEU 34 Ca -0.08 -0.19 0.09 0.00 0.09 0.00 0.00 57.88 57.80 2kw9 h LEU 34 Cb 1.50 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 42.01 2kw9 h LEU 34 CO 0.17 0.66 0.56 0.11 0.09 0.00 0.00 178.44 180.03 2kw9 h LYS 35 N 0.60 0.92 0.08 1.13 1.57 -0.97 -0.47 116.57 119.43 2kw9 h LYS 35 Ca 0.15 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.89 2kw9 h LYS 35 Cb 0.23 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2kw9 h LYS 35 CO -0.01 0.61 -0.17 0.37 -0.57 0.00 0.00 179.45 179.68 2kw9 h GLN 36 N 0.95 -0.31 -0.72 3.15 5.75 -1.12 0.16 115.11 122.96 2kw9 h GLN 36 Ca 0.42 0.02 0.06 0.00 -0.15 0.00 0.00 58.65 59.00 2kw9 h GLN 36 Cb 0.32 0.07 -0.04 0.00 1.07 0.00 0.00 27.48 28.89 2kw9 h GLN 36 CO -0.22 -0.21 0.48 0.93 -2.65 0.00 0.00 178.83 177.15 2kw9 h GLU 37 N -0.33 0.77 0.58 1.69 4.39 -1.09 -1.44 114.58 119.15 2kw9 h GLU 37 Ca 0.03 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 2kw9 h GLU 37 Cb 0.36 -0.17 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2kw9 h GLU 37 CO -0.11 0.51 -0.28 -0.07 -1.16 0.00 0.00 179.01 177.89 2kw9 h LEU 38 N 0.79 -0.66 -1.85 1.33 3.38 -0.66 -3.14 115.31 114.49 2kw9 h LEU 38 Ca 0.31 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 2kw9 h LEU 38 Cb 0.20 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2kw9 h LEU 38 CO -0.10 -0.29 -0.05 0.07 0.09 0.00 0.00 178.44 178.16 2kw9 h LYS 39 N -1.10 0.03 0.00 1.13 2.10 -0.80 0.50 116.57 118.43 2kw9 h LYS 39 Ca -0.08 -0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.52 2kw9 h LYS 39 Cb 0.65 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.97 2kw9 h LYS 39 CO 0.13 0.08 -0.24 -0.07 -2.00 0.00 0.00 179.45 177.35 2kw9 h LEU 40 N 0.03 0.00 -3.37 7.07 3.38 -1.33 -2.98 115.31 118.10 2kw9 h LEU 40 Ca 0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 2kw9 h LEU 40 Cb 0.11 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 2kw9 h LEU 40 CO 0.01 0.24 0.02 0.54 0.09 0.00 0.00 178.44 179.34 2kw9 n ARG 41 N -3.66 2.38 -2.79 1.13 1.74 -0.06 -4.96 116.66 110.44 2kw9 n ARG 41 Ca -0.01 -3.03 -0.19 0.00 -0.77 0.00 0.00 57.85 53.85 2kw9 n ARG 41 Cb 0.37 -1.87 0.02 0.00 -1.02 0.00 0.00 32.46 29.96 2kw9 n ARG 41 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2kw9 n SER 42 N -0.84 -5.41 -4.71 0.55 2.88 -0.92 -5.01 113.62 100.15 2kw9 n SER 42 Ca 0.31 -0.20 -0.35 0.00 -1.33 0.00 0.00 58.87 57.29 2kw9 n SER 42 Cb 1.04 -4.30 -0.09 0.00 -0.75 0.00 0.00 64.21 60.11 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 -5.62 3.77 0.17 2.46 1.43 -0.03 -4.99 118.68 115.86 2kw9 s LEU 43 Ca 0.21 0.20 -0.31 0.00 -1.03 0.00 0.00 54.13 53.20 2kw9 s LEU 43 Cb -0.09 -1.89 -0.09 0.00 0.03 0.00 0.00 46.19 44.15 2kw9 s LEU 43 CO 0.26 0.36 1.45 -2.16 0.23 0.00 0.00 176.35 176.48 2kw9 s PRO 44 N -0.74 4.28 -0.16 1.29 0.04 -1.26 -3.68 135.00 134.77 2kw9 s PRO 44 Ca 0.12 2.21 0.16 0.00 0.04 0.00 0.00 61.00 63.53 2kw9 s PRO 44 Cb -0.12 -3.18 0.71 0.00 0.04 0.00 0.00 34.50 31.95 2kw9 s PRO 44 CO 0.02 -0.46 1.63 1.33 0.04 0.00 0.00 177.00 179.56 2kw9 n VAL 45 N 3.44 2.21 1.52 -0.36 0.24 -1.26 -4.57 118.33 119.55 2kw9 n VAL 45 Ca 0.11 -1.37 0.01 0.00 -2.04 0.00 0.00 64.34 61.04 2kw9 n VAL 45 Cb 0.41 -0.06 0.02 0.00 -1.47 0.00 0.00 33.84 32.74 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 0.66 0.62 -4.94 -1.34 7.64 -1.26 -4.88 113.62 110.13 2kw9 n SER 46 Ca 0.25 -2.02 -0.20 0.00 1.01 0.00 0.00 58.87 57.91 2kw9 n SER 46 Cb 0.99 -0.19 -0.00 0.00 -1.01 0.00 0.00 64.21 63.99 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 -0.68 2.06 0.85 0.23 0.00 -1.26 -5.12 107.32 103.40 2kw9 s GLY 47 Ca 0.04 -1.79 -0.12 0.00 0.00 0.00 0.00 44.72 42.84 2kw9 s GLY 47 CO 0.02 -1.67 1.15 -0.51 0.00 0.00 0.00 173.10 172.08 2kw9 s THR 48 N -2.51 2.18 0.25 0.90 -4.23 -1.26 -4.69 115.64 106.28 2kw9 s THR 48 Ca 0.50 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.95 2kw9 s THR 48 Cb -0.05 -2.91 0.34 0.00 1.34 0.00 0.00 72.50 71.22 2kw9 s THR 48 CO 0.30 -0.08 1.58 0.50 -0.54 0.00 0.00 174.62 176.38 2kw9 h LYS 49 N -1.26 -0.02 -0.28 3.99 1.63 -1.99 0.44 116.57 119.08 2kw9 h LYS 49 Ca -0.48 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.32 2kw9 h LYS 49 Cb 1.32 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.94 2kw9 h LYS 49 CO 0.63 -0.01 0.17 1.15 -3.45 0.00 0.00 179.45 177.94 2kw9 h THR 50 N -0.02 1.10 -0.59 1.00 2.02 -2.00 -2.54 112.91 111.88 2kw9 h THR 50 Ca 0.39 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 67.27 2kw9 h THR 50 Cb 0.63 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.77 2kw9 h THR 50 CO -0.90 0.10 0.11 -0.33 0.37 0.00 0.00 175.52 174.87 2kw9 h GLU 51 N 0.35 0.94 -0.54 6.66 5.08 -1.39 -0.60 114.58 125.09 2kw9 h GLU 51 Ca 0.10 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2kw9 h GLU 51 Cb 0.01 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 2kw9 h GLU 51 CO -0.02 0.86 0.31 -0.07 -1.00 0.00 0.00 179.01 179.09 2kw9 h LEU 52 N 0.89 0.66 0.57 1.33 3.38 -0.88 -0.34 115.31 120.92 2kw9 h LEU 52 Ca 0.19 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2kw9 h LEU 52 Cb 0.37 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 40.95 2kw9 h LEU 52 CO 0.01 0.54 -0.27 0.40 0.09 0.00 0.00 178.44 179.20 2kw9 h ILE 53 N 0.72 0.43 -0.92 1.22 2.04 -1.04 -2.32 117.51 117.64 2kw9 h ILE 53 Ca 0.19 -0.06 0.11 0.00 1.00 0.00 0.00 64.86 66.10 2kw9 h ILE 53 Cb 0.02 0.46 -0.08 0.00 -0.74 0.00 0.00 36.82 36.48 2kw9 h ILE 53 CO -0.03 0.01 0.56 -0.33 0.00 0.00 0.00 178.15 178.36 2kw9 h GLU 54 N -0.80 0.89 -0.65 2.37 4.39 -1.02 0.31 114.58 120.06 2kw9 h GLU 54 Ca -0.08 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.52 2kw9 h GLU 54 Cb 0.60 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 29.02 2kw9 h GLU 54 CO 0.13 0.59 0.22 -0.09 -1.16 0.00 0.00 179.01 178.69 2kw9 h ARG 55 N 0.91 0.97 -0.15 2.33 2.43 -0.99 -0.18 114.38 119.71 2kw9 h ARG 55 Ca 0.45 -0.18 -0.05 0.00 -0.81 0.00 0.00 59.98 59.39 2kw9 h ARG 55 Cb 0.41 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2kw9 h ARG 55 CO -0.25 0.82 -0.09 -0.07 -1.51 0.00 0.00 179.97 178.87 2kw9 h LEU 56 N 0.95 0.33 -0.52 3.80 3.38 -0.69 -1.36 115.31 121.20 2kw9 h LEU 56 Ca 0.21 -0.43 0.06 0.00 0.09 0.00 0.00 57.88 57.82 2kw9 h LEU 56 Cb 0.25 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 2kw9 h LEU 56 CO -0.01 0.69 0.21 0.03 0.09 0.00 0.00 178.44 179.45 2kw9 h ARG 57 N -0.03 0.40 -0.39 1.13 3.08 -0.71 -0.36 114.38 117.50 2kw9 h ARG 57 Ca 0.03 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.92 2kw9 h ARG 57 Cb 0.57 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 2kw9 h ARG 57 CO 0.02 0.27 -0.29 0.00 -1.07 0.00 0.00 179.97 178.90 2kw9 h ALA 58 N 1.32 0.56 0.00 0.04 0.00 -1.07 -0.28 119.26 119.83 2kw9 h ALA 58 Ca 0.24 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2kw9 h ALA 58 Cb 0.23 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2kw9 h ALA 58 CO -0.22 0.59 -0.16 -0.92 0.00 0.00 0.00 179.25 178.53 2kw9 h TYR 59 N 0.69 0.00 0.08 0.00 3.20 -0.90 -1.93 116.97 118.12 2kw9 h TYR 59 Ca 0.07 0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.78 2kw9 h TYR 59 Cb 0.86 0.00 0.02 0.00 1.54 0.00 0.00 36.73 39.15 2kw9 h TYR 59 CO 0.06 0.16 -0.68 0.37 -1.64 0.00 0.00 178.16 176.43 2kw9 h GLN 60 N 0.00 0.32 -0.55 1.82 -0.00 -0.84 -3.31 115.11 112.55 2kw9 h GLN 60 Ca -0.00 -0.45 0.07 0.00 -0.00 0.00 0.00 58.65 58.27 2kw9 h GLN 60 Cb 0.32 0.15 -0.06 0.00 0.00 0.00 0.00 27.48 27.89 2kw9 h GLN 60 CO 0.02 1.17 0.22 0.22 0.00 0.00 0.00 178.83 180.46 2kw9 h ASP 61 N -0.31 0.25 0.47 -0.69 3.58 -0.71 0.28 116.42 119.28 2kw9 h ASP 61 Ca -0.11 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.39 2kw9 h ASP 61 Cb 1.47 0.03 -0.00 0.00 1.72 0.00 0.00 39.33 42.55 2kw9 h ASP 61 CO 0.13 0.17 -0.06 0.06 -2.88 0.00 0.00 179.24 176.65 2kw9 h GLN 62 N 0.42 0.00 0.00 0.28 3.07 -1.49 -2.50 115.11 114.89 2kw9 h GLN 62 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.00 2kw9 h GLN 62 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.84 2kw9 h GLN 62 CO -0.25 0.06 -1.59 0.44 0.09 0.00 0.00 178.83 177.58 2kw9 n ILE 63 N -3.35 0.00 -0.73 1.86 -5.35 -0.79 -5.12 119.36 105.88 2kw9 n ILE 63 Ca -0.01 -0.33 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 2kw9 n ILE 63 Cb 0.22 0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.45 2kw9 n ILE 63 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2kw9 n SER 64 N -1.96 -4.07 -4.57 7.28 2.88 0.90 -4.72 113.62 109.36 2kw9 n SER 64 Ca -0.01 0.79 -0.39 0.00 -1.33 0.00 0.00 58.87 57.93 2kw9 n SER 64 Cb 0.44 -1.78 -0.03 0.00 -0.75 0.00 0.00 64.21 62.09 2kw9 n SER 64 CO 0.00 0.00 0.00 -2.84 -1.23 0.00 0.00 175.04 170.97 2kw9 s PRO 65 N -4.72 2.46 0.00 -1.46 0.02 -1.26 -4.96 135.00 125.08 2kw9 s PRO 65 Ca 0.00 1.61 -0.08 0.00 0.02 0.00 0.00 61.00 62.55 2kw9 s PRO 65 Cb 0.00 -4.51 -0.05 0.00 0.02 0.00 0.00 34.50 29.96 2kw9 s PRO 65 CO 0.00 -2.87 0.29 0.14 -0.33 0.00 0.00 177.00 174.23 2kw9 s VAL 66 N 10.83 5.26 -0.00 3.83 -7.23 -0.94 -4.57 120.40 127.58 2kw9 s VAL 66 Ca 0.98 0.29 -0.30 0.00 -1.81 0.00 0.00 61.98 61.14 2kw9 s VAL 66 Cb -0.22 -3.58 -0.07 0.00 0.56 0.00 0.00 36.38 33.07 2kw9 s VAL 66 CO 0.29 0.41 1.65 -2.16 -0.31 0.00 0.00 175.10 174.98 2kw9 s PRO 67 N -1.63 4.19 0.00 4.82 0.04 -1.26 -2.57 135.00 138.59 2kw9 s PRO 67 Ca 0.27 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.55 2kw9 s PRO 67 Cb -0.14 -3.84 0.00 0.00 0.04 0.00 0.00 34.50 30.56 2kw9 s PRO 67 CO 0.15 -0.79 0.00 0.41 0.04 0.00 0.00 177.00 176.80 2kw9 n GLY 68 N 4.07 1.37 3.71 0.56 0.00 -1.26 -4.97 105.19 108.68 2kw9 n GLY 68 Ca 0.17 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.58 1.40 -0.40 4.61 0.00 -1.17 -4.90 121.76 120.71 2kw9 s ALA 69 Ca 0.00 -0.22 -0.43 0.00 0.00 0.00 0.00 51.96 51.31 2kw9 s ALA 69 Cb 0.00 -3.15 -0.17 0.00 0.00 0.00 0.00 23.12 19.80 2kw9 s ALA 69 CO 0.00 -2.48 1.75 -2.30 0.00 0.00 0.00 175.76 172.73 2kw9 n PRO 70 N -3.95 0.57 -1.58 0.00 -0.02 -1.26 -4.15 135.00 124.61 2kw9 n PRO 70 Ca 0.06 0.20 -0.42 0.00 -2.02 0.00 0.00 63.50 61.33 2kw9 n PRO 70 Cb 0.56 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 32.19 2kw9 n PRO 70 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2kw9 n LYS 71 N 5.19 1.65 -3.17 -0.52 2.85 -1.26 -0.81 118.16 122.09 2kw9 n LYS 71 Ca 0.32 0.38 0.03 0.00 -1.05 0.00 0.00 58.31 57.98 2kw9 n LYS 71 Cb 0.04 -3.22 -0.01 0.00 -0.65 0.00 0.00 35.03 31.18 2kw9 n LYS 71 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2kw9 s ALA 72 N 9.27 -2.20 0.85 0.58 0.00 -0.23 -4.90 121.76 125.13 2kw9 s ALA 72 Ca 1.01 1.53 -0.12 0.00 0.00 0.00 0.00 51.96 54.38 2kw9 s ALA 72 Cb -0.34 -2.24 0.10 0.00 0.00 0.00 0.00 23.12 20.64 2kw9 s ALA 72 CO 0.34 -1.48 1.12 -1.25 0.00 0.00 0.00 175.76 174.49 2kw9 s PRO 73 N 2.82 1.63 0.80 0.00 0.04 -1.26 -4.03 135.00 135.00 2kw9 s PRO 73 Ca 0.17 0.44 -0.12 0.00 0.04 0.00 0.00 61.00 61.52 2kw9 s PRO 73 Cb -0.14 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 32.60 2kw9 s PRO 73 CO -0.22 -1.89 1.16 0.00 0.04 0.00 0.00 177.00 176.08 2kw9 s ALA 74 N -3.24 1.94 -2.00 8.56 0.00 -1.26 -4.56 121.76 121.20 2kw9 s ALA 74 Ca 0.62 0.65 0.10 0.00 0.00 0.00 0.00 51.96 53.33 2kw9 s ALA 74 Cb -0.14 -3.42 0.62 0.00 0.00 0.00 0.00 23.12 20.17 2kw9 s ALA 74 CO 0.53 -2.13 1.06 0.00 0.00 0.00 0.00 175.76 175.22