#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kw9 s GLY 2 N 0.00 2.85 -0.78 3.03 0.00 -1.26 -4.98 107.32 106.19 2kw9 s GLY 2 Ca 0.00 0.27 -0.25 0.00 0.00 0.00 0.00 44.72 44.74 2kw9 s GLY 2 CO 0.00 0.75 2.15 -1.58 0.00 0.00 0.00 173.10 174.42 2kw9 s HIS 3 N -1.15 1.47 -0.10 1.90 2.46 -1.26 -4.93 115.29 113.69 2kw9 s HIS 3 Ca 0.34 1.23 0.03 0.00 0.47 0.00 0.00 55.06 57.14 2kw9 s HIS 3 Cb -0.22 -3.79 -0.01 0.00 -0.13 0.00 0.00 32.58 28.44 2kw9 s HIS 3 CO 0.24 -1.85 -0.20 -3.38 -2.47 0.00 0.00 174.74 167.08 2kw9 s HIS 4 N 11.84 2.62 -0.00 3.88 0.00 -1.26 -5.13 115.29 127.23 2kw9 s HIS 4 Ca 0.81 -0.80 0.02 0.00 -3.00 0.00 0.00 55.06 52.08 2kw9 s HIS 4 Cb -0.11 -1.72 -0.04 0.00 -4.00 0.00 0.00 32.58 26.72 2kw9 s HIS 4 CO 0.08 -0.28 -0.00 -1.58 -1.00 0.00 0.00 174.74 171.96 2kw9 s HIS 5 N 0.16 3.07 -0.01 0.38 2.46 -1.26 -5.12 115.29 114.96 2kw9 s HIS 5 Ca -0.11 0.08 0.02 0.00 0.47 0.00 0.00 55.06 55.51 2kw9 s HIS 5 Cb -0.16 -1.67 0.00 0.00 -0.13 0.00 0.00 32.58 30.62 2kw9 s HIS 5 CO 0.06 0.46 -0.07 -3.38 -2.47 0.00 0.00 174.74 169.35 2kw9 s HIS 6 N -1.08 0.67 0.00 3.88 0.00 -1.26 -5.12 115.29 112.38 2kw9 s HIS 6 Ca 0.19 -0.14 -0.30 0.00 -3.00 0.00 0.00 55.06 51.81 2kw9 s HIS 6 Cb -0.11 -0.47 -0.07 0.00 -4.00 0.00 0.00 32.58 27.92 2kw9 s HIS 6 CO 0.10 -0.05 1.62 -3.38 -1.00 0.00 0.00 174.74 172.03 2kw9 s HIS 7 N 0.09 2.26 0.44 0.38 0.00 -1.26 -5.01 115.29 112.19 2kw9 s HIS 7 Ca -0.01 0.32 -0.13 0.00 -3.00 0.00 0.00 55.06 52.24 2kw9 s HIS 7 Cb -0.06 -3.91 -0.07 0.00 -4.00 0.00 0.00 32.58 24.55 2kw9 s HIS 7 CO -0.00 -3.70 0.84 -3.38 -1.00 0.00 0.00 174.74 167.50 2kw9 s HIS 8 N 3.27 3.46 0.25 0.38 -0.00 -1.26 -5.06 115.29 116.32 2kw9 s HIS 8 Ca 0.73 1.20 -0.27 0.00 -0.00 0.00 0.00 55.06 56.72 2kw9 s HIS 8 Cb -0.36 -2.57 -0.09 0.00 -0.00 0.00 0.00 32.58 29.56 2kw9 s HIS 8 CO 0.30 -0.18 0.90 0.45 -0.00 0.00 0.00 174.74 176.21 2kw9 s SER 9 N -3.06 7.46 -0.64 7.38 0.15 -1.26 -5.01 113.70 118.72 2kw9 s SER 9 Ca 0.54 1.82 -0.28 0.00 0.70 0.00 0.00 55.95 58.73 2kw9 s SER 9 Cb -0.10 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.67 2kw9 s SER 9 CO 0.30 0.09 1.28 -2.28 1.20 0.00 0.00 173.24 173.83 2kw9 s HIS 10 N -1.34 2.39 -0.46 3.44 5.65 -1.26 -4.98 115.29 118.74 2kw9 s HIS 10 Ca 0.43 0.25 -0.00 0.00 0.25 0.00 0.00 55.06 55.99 2kw9 s HIS 10 Cb -0.22 -4.53 0.12 0.00 -1.18 0.00 0.00 32.58 26.77 2kw9 s HIS 10 CO 0.28 -1.87 0.23 -1.64 -0.65 0.00 0.00 174.74 171.09 2kw9 s MET 11 N 5.42 2.01 -0.85 2.88 1.00 -1.26 -5.01 119.30 123.49 2kw9 s MET 11 Ca 0.42 -2.12 -0.04 0.00 0.00 0.00 0.00 55.69 53.95 2kw9 s MET 11 Cb -0.08 -3.49 0.21 0.00 0.00 0.00 0.00 34.83 31.47 2kw9 s MET 11 CO 0.21 -1.07 0.74 -1.54 0.00 0.00 0.00 175.02 173.36 2kw9 s SER 12 N 1.03 6.04 0.16 3.03 1.04 -1.26 -5.08 113.70 118.66 2kw9 s SER 12 Ca 0.12 -3.42 0.02 0.00 0.48 0.00 0.00 55.95 53.15 2kw9 s SER 12 Cb -0.22 -1.96 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 2kw9 s SER 12 CO -0.04 -0.27 0.31 0.42 0.98 0.00 0.00 173.24 174.64 2kw9 s THR 13 N -0.92 5.30 -0.09 2.02 -4.23 -1.26 -5.05 115.64 111.41 2kw9 s THR 13 Ca 0.25 -0.62 -0.29 0.00 -1.18 0.00 0.00 61.69 59.84 2kw9 s THR 13 Cb -0.11 -3.74 -0.06 0.00 1.34 0.00 0.00 72.50 69.92 2kw9 s THR 13 CO -0.10 -0.12 1.96 -2.16 -0.54 0.00 0.00 174.62 173.66 2kw9 s PRO 14 N -3.28 3.78 0.03 3.99 0.04 -1.26 -4.96 135.00 133.34 2kw9 s PRO 14 Ca 0.35 2.24 -0.24 0.00 0.04 0.00 0.00 61.00 63.39 2kw9 s PRO 14 Cb -0.11 -4.19 -0.05 0.00 0.04 0.00 0.00 34.50 30.19 2kw9 s PRO 14 CO 0.29 -1.35 0.73 -0.51 0.04 0.00 0.00 177.00 176.20 2kw9 s LEU 15 N 5.70 4.44 0.02 -3.56 1.43 -1.26 -5.07 118.68 120.38 2kw9 s LEU 15 Ca 0.88 1.38 0.01 0.00 -1.03 0.00 0.00 54.13 55.37 2kw9 s LEU 15 Cb -0.36 -3.16 -0.04 0.00 0.03 0.00 0.00 46.19 42.66 2kw9 s LEU 15 CO 0.37 0.03 0.06 0.42 0.23 0.00 0.00 176.35 177.45 2kw9 s THR 16 N -0.06 4.52 0.36 5.49 -4.23 -1.26 -5.13 115.64 115.32 2kw9 s THR 16 Ca 0.37 -0.58 0.05 0.00 -1.18 0.00 0.00 61.69 60.35 2kw9 s THR 16 Cb -0.20 -3.09 -0.03 0.00 1.34 0.00 0.00 72.50 70.52 2kw9 s THR 16 CO 0.22 0.28 0.20 -0.83 -0.54 0.00 0.00 174.62 173.95 2kw9 s GLY 17 N -1.91 2.40 -0.16 3.99 0.00 -1.26 -5.12 107.32 105.26 2kw9 s GLY 17 Ca 0.24 -1.68 -0.29 0.00 0.00 0.00 0.00 44.72 42.99 2kw9 s GLY 17 CO 0.16 -1.63 1.30 0.54 0.00 0.00 0.00 173.10 173.47 2kw9 s LYS 18 N -3.61 4.22 -0.05 2.90 -0.14 -1.26 -5.02 119.74 116.77 2kw9 s LYS 18 Ca 0.33 1.69 -0.27 0.00 -1.36 0.00 0.00 55.97 56.37 2kw9 s LYS 18 Cb 0.03 -3.79 -0.03 0.00 -1.68 0.00 0.00 37.83 32.36 2kw9 s LYS 18 CO 0.21 -0.73 0.85 -1.25 -0.76 0.00 0.00 175.35 173.66 2kw9 s PRO 19 N 3.57 4.47 -1.28 -1.68 0.04 -1.26 -4.98 135.00 133.88 2kw9 s PRO 19 Ca 0.56 1.14 -0.16 0.00 0.04 0.00 0.00 61.00 62.59 2kw9 s PRO 19 Cb -0.23 -3.47 -0.01 0.00 0.04 0.00 0.00 34.50 30.83 2kw9 s PRO 19 CO 0.16 -0.05 2.13 0.41 0.04 0.00 0.00 177.00 179.69 2kw9 n GLY 20 N 3.06 3.85 3.25 0.56 0.00 -1.26 -4.87 105.19 109.78 2kw9 n GLY 20 Ca 0.03 -1.50 -0.10 0.00 0.00 0.00 0.00 46.02 44.45 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 3.78 0.65 0.20 4.61 0.00 -1.26 -4.82 121.76 124.92 2kw9 s ALA 21 Ca 0.50 -1.35 0.10 0.00 0.00 0.00 0.00 51.96 51.21 2kw9 s ALA 21 Cb 0.13 1.03 -0.04 0.00 0.00 0.00 0.00 23.12 24.24 2kw9 s ALA 21 CO -0.03 -0.59 -0.11 -0.51 0.00 0.00 0.00 175.76 174.52 2kw9 s LEU 22 N -3.06 2.90 0.30 0.00 1.43 -1.26 -5.14 118.68 113.86 2kw9 s LEU 22 Ca 0.27 -0.66 -0.15 0.00 -1.03 0.00 0.00 54.13 52.55 2kw9 s LEU 22 Cb 0.06 -1.56 -0.09 0.00 0.03 0.00 0.00 46.19 44.63 2kw9 s LEU 22 CO 0.05 0.09 0.73 -2.16 0.23 0.00 0.00 176.35 175.28 2kw9 s PRO 23 N -2.98 4.03 0.02 1.29 0.05 -1.26 -4.99 135.00 131.16 2kw9 s PRO 23 Ca 0.26 0.68 0.22 0.00 0.05 0.00 0.00 61.00 62.21 2kw9 s PRO 23 Cb -0.08 -2.51 0.93 0.00 0.05 0.00 0.00 34.50 32.89 2kw9 s PRO 23 CO 0.15 0.20 1.70 0.00 0.05 0.00 0.00 177.00 179.10 2kw9 n ALA 24 N -0.19 1.99 0.46 8.56 0.00 -1.26 -3.63 120.51 126.44 2kw9 n ALA 24 Ca 0.02 -0.07 -0.05 0.00 0.00 0.00 0.00 53.44 53.35 2kw9 n ALA 24 Cb 0.53 -1.36 0.05 0.00 0.00 0.00 0.00 19.45 18.67 2kw9 n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kw9 n ASN 25 N -1.55 3.06 0.34 0.00 4.13 -1.26 -4.58 115.26 115.39 2kw9 n ASN 25 Ca 0.05 -2.38 -0.15 0.00 1.68 0.00 0.00 54.58 53.78 2kw9 n ASN 25 Cb 0.26 -0.58 -0.08 0.00 -1.54 0.00 0.00 39.78 37.84 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 1.00 -0.99 -1.25 3.41 3.38 -1.94 -1.24 115.31 117.69 2kw9 h LEU 26 Ca 0.14 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2kw9 h LEU 26 Cb 1.39 0.29 -0.00 0.00 0.09 0.00 0.00 40.66 42.43 2kw9 h LEU 26 CO 0.26 -0.59 -0.01 -0.78 0.09 0.00 0.00 178.44 177.40 2kw9 h ASP 27 N -0.95 0.00 0.43 -0.43 3.58 -1.94 -2.27 116.42 114.84 2kw9 h ASP 27 Ca -0.08 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.29 2kw9 h ASP 27 Cb 0.76 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.80 2kw9 h ASP 27 CO 0.08 0.01 -0.35 0.44 -2.88 0.00 0.00 179.24 176.54 2kw9 h ASP 28 N 0.00 0.00 -4.05 2.28 5.19 -1.80 -3.43 116.42 114.61 2kw9 h ASP 28 Ca -0.00 0.00 -0.48 0.00 -0.62 0.00 0.00 57.03 55.93 2kw9 h ASP 28 Cb 0.59 0.00 0.07 0.00 0.18 0.00 0.00 39.33 40.17 2kw9 h ASP 28 CO 0.00 0.35 0.29 -0.04 -3.12 0.00 0.00 179.24 176.72 2kw9 s MET 29 N -4.12 2.94 0.61 3.56 -1.94 -0.49 -5.09 119.30 114.77 2kw9 s MET 29 Ca -0.02 0.24 -0.06 0.00 -1.71 0.00 0.00 55.69 54.14 2kw9 s MET 29 Cb 0.14 -2.16 0.02 0.00 2.01 0.00 0.00 34.83 34.85 2kw9 s MET 29 CO 0.71 -0.83 0.92 0.15 -0.01 0.00 0.00 175.02 175.96 2kw9 s LYS 30 N -5.16 2.73 0.18 2.03 1.02 -1.26 -4.90 119.74 114.38 2kw9 s LYS 30 Ca 0.56 -0.10 -0.14 0.00 0.02 0.00 0.00 55.97 56.30 2kw9 s LYS 30 Cb -0.11 -2.26 0.17 0.00 -0.52 0.00 0.00 37.83 35.11 2kw9 s LYS 30 CO 0.48 -0.82 1.71 0.28 -0.92 0.00 0.00 175.35 176.08 2kw9 h VAL 31 N -0.26 0.70 0.00 3.17 2.07 -1.95 -0.71 116.25 119.27 2kw9 h VAL 31 Ca -0.45 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 2kw9 h VAL 31 Cb 1.27 0.50 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 2kw9 h VAL 31 CO 0.60 0.03 -0.05 0.00 0.02 0.00 0.00 177.57 178.18 2kw9 h ALA 32 N 1.38 1.65 0.18 1.67 0.00 -1.99 -1.78 119.26 120.36 2kw9 h ALA 32 Ca 0.24 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.79 2kw9 h ALA 32 Cb 0.33 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.14 2kw9 h ALA 32 CO -0.34 0.06 -1.34 0.93 0.00 0.00 0.00 179.25 178.56 2kw9 h GLU 33 N 0.00 0.57 -0.53 0.00 5.08 -1.53 -3.01 114.58 115.16 2kw9 h GLU 33 Ca -0.00 -0.85 -0.10 0.00 -1.00 0.00 0.00 59.36 57.41 2kw9 h GLU 33 Cb 0.10 0.30 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 2kw9 h GLU 33 CO 0.01 1.40 -0.05 -0.07 -1.00 0.00 0.00 179.01 179.29 2kw9 h LEU 34 N 0.21 0.97 -1.85 1.33 3.38 -0.99 -2.45 115.31 115.92 2kw9 h LEU 34 Ca -0.21 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.41 2kw9 h LEU 34 Cb 2.02 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 42.51 2kw9 h LEU 34 CO 0.25 1.07 -0.04 0.11 0.09 0.00 0.00 178.44 179.91 2kw9 h LYS 35 N 0.85 0.04 0.38 1.13 1.57 -1.43 -0.09 116.57 119.02 2kw9 h LYS 35 Ca 0.14 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 2kw9 h LYS 35 Cb 0.60 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.91 2kw9 h LYS 35 CO 0.04 0.09 -0.18 0.37 -0.57 0.00 0.00 179.45 179.19 2kw9 h GLN 36 N 0.04 -0.50 -0.15 3.15 4.15 -1.32 -1.45 115.11 119.03 2kw9 h GLN 36 Ca 0.01 0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.51 2kw9 h GLN 36 Cb 0.10 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 2kw9 h GLN 36 CO 0.01 -0.28 0.15 0.93 -1.93 0.00 0.00 178.83 177.71 2kw9 h GLU 37 N -0.61 0.00 0.26 1.69 4.39 -0.89 -1.59 114.58 117.83 2kw9 h GLU 37 Ca -0.05 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 2kw9 h GLU 37 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2kw9 h GLU 37 CO 0.09 0.00 -0.13 -0.07 -1.16 0.00 0.00 179.01 177.74 2kw9 h LEU 38 N 0.00 -0.30 -1.80 1.33 3.38 -0.79 -3.34 115.31 113.78 2kw9 h LEU 38 Ca 0.07 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 2kw9 h LEU 38 Cb 0.38 0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2kw9 h LEU 38 CO -0.00 0.19 -0.09 0.07 0.09 0.00 0.00 178.44 178.71 2kw9 h LYS 39 N -0.98 0.02 -0.11 1.13 2.10 -0.83 0.72 116.57 118.62 2kw9 h LYS 39 Ca -0.04 -0.00 0.03 0.00 -2.00 0.00 0.00 60.65 58.64 2kw9 h LYS 39 Cb 0.47 -0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.79 2kw9 h LYS 39 CO 0.06 0.10 0.12 -0.07 -2.00 0.00 0.00 179.45 177.66 2kw9 h LEU 40 N 0.02 0.00 -2.95 7.07 3.38 -1.43 -2.42 115.31 118.97 2kw9 h LEU 40 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2kw9 h LEU 40 Cb 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2kw9 h LEU 40 CO 0.01 0.00 -0.27 0.54 0.09 0.00 0.00 178.44 178.81 2kw9 n ARG 41 N -3.84 1.30 -2.74 1.13 1.74 -0.07 -4.98 116.66 109.20 2kw9 n ARG 41 Ca -0.00 -2.79 -0.19 0.00 -0.77 0.00 0.00 57.85 54.10 2kw9 n ARG 41 Cb 0.23 -1.44 0.02 0.00 -1.02 0.00 0.00 32.46 30.24 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 -1.16 -5.53 -4.89 0.55 2.88 -0.86 -5.01 113.62 99.60 2kw9 n SER 42 Ca 0.16 -0.18 -0.33 0.00 -1.33 0.00 0.00 58.87 57.20 2kw9 n SER 42 Cb 0.68 -4.44 -0.05 0.00 -0.75 0.00 0.00 64.21 59.66 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 -5.74 4.33 0.04 2.46 1.43 0.05 -4.97 118.68 116.27 2kw9 s LEU 43 Ca 0.18 0.53 -0.30 0.00 -1.03 0.00 0.00 54.13 53.51 2kw9 s LEU 43 Cb -0.08 -2.98 -0.08 0.00 0.03 0.00 0.00 46.19 43.08 2kw9 s LEU 43 CO 0.22 0.16 1.73 -2.16 0.23 0.00 0.00 176.35 176.53 2kw9 s PRO 44 N -2.23 4.18 -0.45 1.29 0.04 -1.26 -3.90 135.00 132.67 2kw9 s PRO 44 Ca 0.34 2.37 0.03 0.00 0.04 0.00 0.00 61.00 63.78 2kw9 s PRO 44 Cb -0.13 -3.80 0.61 0.00 0.04 0.00 0.00 34.50 31.22 2kw9 s PRO 44 CO 0.21 -0.81 1.89 1.33 0.04 0.00 0.00 177.00 179.66 2kw9 n VAL 45 N 5.08 3.15 -0.05 -0.36 0.24 -1.26 -4.49 118.33 120.63 2kw9 n VAL 45 Ca 0.17 -1.93 -0.21 0.00 -2.04 0.00 0.00 64.34 60.33 2kw9 n VAL 45 Cb 0.41 -0.58 -0.13 0.00 -1.47 0.00 0.00 33.84 32.07 2kw9 n VAL 45 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2kw9 n SER 46 N -1.03 2.06 -3.41 -1.34 3.41 -1.26 -5.01 113.62 107.04 2kw9 n SER 46 Ca 0.57 0.11 -0.29 0.00 -0.26 0.00 0.00 58.87 59.01 2kw9 n SER 46 Cb 1.50 -0.72 0.25 0.00 -0.26 0.00 0.00 64.21 64.99 2kw9 n SER 46 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2kw9 n GLY 47 N 2.02 -3.14 3.97 5.00 0.00 -1.26 -5.06 105.19 106.71 2kw9 n GLY 47 Ca -0.38 -1.43 -0.27 0.00 0.00 0.00 0.00 46.02 43.94 2kw9 n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kw9 s THR 48 N -2.62 2.01 0.17 2.61 -4.23 -1.26 -4.74 115.64 107.59 2kw9 s THR 48 Ca 0.66 -0.27 -0.29 0.00 -1.18 0.00 0.00 61.69 60.62 2kw9 s THR 48 Cb -0.08 -2.74 -0.02 0.00 1.34 0.00 0.00 72.50 71.00 2kw9 s THR 48 CO 0.52 0.00 1.55 0.50 -0.54 0.00 0.00 174.62 176.65 2kw9 h LYS 49 N -1.25 -0.10 -0.79 3.99 1.63 -1.97 0.15 116.57 118.23 2kw9 h LYS 49 Ca -0.40 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.40 2kw9 h LYS 49 Cb 1.24 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.85 2kw9 h LYS 49 CO 0.35 -0.07 0.46 1.15 -3.45 0.00 0.00 179.45 177.89 2kw9 h THR 50 N -0.11 1.22 -0.72 1.00 2.02 -2.00 -2.28 112.91 112.04 2kw9 h THR 50 Ca 0.17 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 2kw9 h THR 50 Cb 0.49 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2kw9 h THR 50 CO -0.85 0.24 0.43 -0.33 0.37 0.00 0.00 175.52 175.38 2kw9 h GLU 51 N 1.09 0.98 -0.41 6.66 4.39 -1.39 -1.30 114.58 124.61 2kw9 h GLU 51 Ca 0.28 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 2kw9 h GLU 51 Cb -0.03 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.40 2kw9 h GLU 51 CO -0.05 0.70 0.22 -0.07 -1.16 0.00 0.00 179.01 178.65 2kw9 h LEU 52 N 0.98 0.51 0.29 1.33 3.38 -0.58 0.14 115.31 121.36 2kw9 h LEU 52 Ca 0.26 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2kw9 h LEU 52 Cb -0.03 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2kw9 h LEU 52 CO -0.05 0.46 -0.20 0.40 0.09 0.00 0.00 178.44 179.14 2kw9 h ILE 53 N 0.53 0.57 -0.18 1.22 2.04 -1.13 -1.62 117.51 118.94 2kw9 h ILE 53 Ca 0.14 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.94 2kw9 h ILE 53 Cb 0.06 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 2kw9 h ILE 53 CO -0.02 0.00 -0.15 -0.33 0.00 0.00 0.00 178.15 177.64 2kw9 h GLU 54 N -0.49 0.30 0.33 2.37 5.08 -1.16 -1.56 114.58 119.45 2kw9 h GLU 54 Ca -0.02 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2kw9 h GLU 54 Cb 0.42 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2kw9 h GLU 54 CO 0.01 0.46 -0.16 -0.09 -1.00 0.00 0.00 179.01 178.23 2kw9 h ARG 55 N 0.28 -0.42 -0.05 2.33 9.65 -0.44 0.28 114.38 126.01 2kw9 h ARG 55 Ca 0.05 0.03 0.02 0.00 -1.10 0.00 0.00 59.98 58.98 2kw9 h ARG 55 Cb 0.44 0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 29.10 2kw9 h ARG 55 CO 0.03 -0.28 -0.08 -0.07 2.80 0.00 0.00 179.97 182.37 2kw9 h LEU 56 N -0.45 -0.23 -1.58 3.80 3.38 -1.13 -0.87 115.31 118.23 2kw9 h LEU 56 Ca -0.04 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2kw9 h LEU 56 Cb 0.34 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2kw9 h LEU 56 CO 0.07 -0.11 -0.17 0.03 0.09 0.00 0.00 178.44 178.36 2kw9 h ARG 57 N -0.11 0.06 -0.05 1.13 3.08 -1.17 0.85 114.38 118.17 2kw9 h ARG 57 Ca 0.05 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2kw9 h ARG 57 Cb 0.18 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.22 2kw9 h ARG 57 CO -0.12 0.23 -0.11 0.00 -1.07 0.00 0.00 179.97 178.90 2kw9 h ALA 58 N 1.78 0.09 -0.69 0.04 0.00 -0.16 -0.93 119.26 119.39 2kw9 h ALA 58 Ca 0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2kw9 h ALA 58 Cb 0.33 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2kw9 h ALA 58 CO 0.02 -0.04 0.40 -0.92 0.00 0.00 0.00 179.25 178.71 2kw9 h TYR 59 N -0.33 0.92 -0.18 0.00 3.20 -0.84 -2.90 116.97 116.84 2kw9 h TYR 59 Ca 0.00 -0.01 -0.17 0.00 3.14 0.00 0.00 58.73 61.69 2kw9 h TYR 59 Cb 0.69 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2kw9 h TYR 59 CO 0.12 0.64 -0.60 0.37 -1.64 0.00 0.00 178.16 177.04 2kw9 h GLN 60 N 0.94 0.59 -0.94 1.82 -0.00 -0.90 -3.13 115.11 113.49 2kw9 h GLN 60 Ca 0.24 -0.40 0.08 0.00 -0.00 0.00 0.00 58.65 58.57 2kw9 h GLN 60 Cb 0.00 0.06 -0.07 0.00 0.00 0.00 0.00 27.48 27.47 2kw9 h GLN 60 CO -0.04 1.02 0.59 0.22 0.00 0.00 0.00 178.83 180.62 2kw9 h ASP 61 N 0.44 0.91 0.05 -0.69 3.58 -1.00 0.26 116.42 119.97 2kw9 h ASP 61 Ca -0.00 0.03 -0.06 0.00 0.42 0.00 0.00 57.03 57.41 2kw9 h ASP 61 Cb 1.17 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 42.04 2kw9 h ASP 61 CO 0.12 0.55 -0.18 1.56 -2.88 0.00 0.00 179.24 178.41 2kw9 h GLN 62 N 1.03 0.26 -0.53 0.28 4.20 -1.46 -2.67 115.11 116.23 2kw9 h GLN 62 Ca 0.43 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 59.07 2kw9 h GLN 62 Cb 0.27 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2kw9 h GLN 62 CO -0.21 0.44 0.00 0.44 -0.67 0.00 0.00 178.83 178.84 2kw9 n ILE 63 N -4.22 0.90 -3.78 2.54 -5.35 -0.62 -4.59 119.36 104.23 2kw9 n ILE 63 Ca -0.01 -0.95 -0.37 0.00 -0.27 0.00 0.00 62.75 61.15 2kw9 n ILE 63 Cb 0.31 0.59 -0.06 0.00 -1.74 0.00 0.00 39.64 38.74 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 -1.06 6.48 0.21 7.28 0.15 0.81 -5.02 113.70 122.55 2kw9 s SER 64 Ca 0.37 0.58 -0.32 0.00 0.70 0.00 0.00 55.95 57.28 2kw9 s SER 64 Cb 0.20 -2.11 -0.14 0.00 -1.71 0.00 0.00 66.02 62.26 2kw9 s SER 64 CO 0.26 0.38 1.44 -0.81 1.20 0.00 0.00 173.24 175.71 2kw9 n PRO 65 N 2.03 2.01 -4.16 5.44 -0.04 -1.26 -4.94 135.00 134.07 2kw9 n PRO 65 Ca -0.18 0.72 -0.34 0.00 -0.04 0.00 0.00 63.50 63.66 2kw9 n PRO 65 Cb 0.54 -2.40 -0.08 0.00 -0.04 0.00 0.00 33.50 31.52 2kw9 n PRO 65 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2kw9 s VAL 66 N 0.22 4.66 0.00 0.52 -7.23 -1.26 -5.01 120.40 112.31 2kw9 s VAL 66 Ca 0.72 -0.31 0.00 0.00 -1.81 0.00 0.00 61.98 60.58 2kw9 s VAL 66 Cb -0.67 -3.07 0.00 0.00 0.56 0.00 0.00 36.38 33.19 2kw9 s VAL 66 CO 0.46 0.45 1.42 -0.81 -0.31 0.00 0.00 175.10 176.31 2kw9 n PRO 67 N 1.55 0.82 -0.17 4.82 -0.04 -1.26 -4.45 135.00 136.26 2kw9 n PRO 67 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2kw9 n PRO 67 Cb 0.53 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 2kw9 n PRO 67 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2kw9 n GLY 68 N 1.33 0.91 3.68 0.55 0.00 -1.26 -5.08 105.19 105.32 2kw9 n GLY 68 Ca 0.00 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.00 3.47 -0.39 4.61 0.00 -1.26 -4.99 121.76 121.20 2kw9 s ALA 69 Ca 0.00 0.13 -0.28 0.00 0.00 0.00 0.00 51.96 51.81 2kw9 s ALA 69 Cb 0.00 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 19.79 2kw9 s ALA 69 CO 0.00 -0.59 2.33 -2.30 0.00 0.00 0.00 175.76 175.20 2kw9 n PRO 70 N 5.04 1.36 -4.63 0.00 -0.02 -1.26 -4.92 135.00 130.57 2kw9 n PRO 70 Ca 0.05 0.24 -0.29 0.00 -2.02 0.00 0.00 63.50 61.48 2kw9 n PRO 70 Cb 0.49 -3.15 -0.08 0.00 -0.02 0.00 0.00 33.50 30.74 2kw9 n PRO 70 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2kw9 s LYS 71 N 7.32 2.08 0.27 -0.52 -0.14 -1.26 -5.13 119.74 122.36 2kw9 s LYS 71 Ca 1.03 -2.31 -0.29 0.00 -1.36 0.00 0.00 55.97 53.04 2kw9 s LYS 71 Cb -0.37 -1.00 -0.09 0.00 -1.68 0.00 0.00 37.83 34.68 2kw9 s LYS 71 CO 0.34 -0.46 1.19 0.00 -0.76 0.00 0.00 175.35 175.66 2kw9 s ALA 72 N -3.05 3.45 -0.64 5.17 0.00 -1.26 -4.91 121.76 120.51 2kw9 s ALA 72 Ca 0.14 1.03 -0.26 0.00 0.00 0.00 0.00 51.96 52.87 2kw9 s ALA 72 Cb 0.01 -3.40 -0.12 0.00 0.00 0.00 0.00 23.12 19.62 2kw9 s ALA 72 CO 0.09 -0.37 2.44 -2.30 0.00 0.00 0.00 175.76 175.62 2kw9 n PRO 73 N 1.43 0.76 -1.59 0.00 -0.02 -1.26 -4.85 135.00 129.48 2kw9 n PRO 73 Ca 0.01 -0.22 -0.25 0.00 -2.02 0.00 0.00 63.50 61.02 2kw9 n PRO 73 Cb 0.44 -3.20 -0.05 0.00 -0.02 0.00 0.00 33.50 30.67 2kw9 n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kw9 s ALA 74 N 12.04 1.19 0.00 3.55 0.00 -1.26 -5.16 121.76 132.12 2kw9 s ALA 74 Ca 1.02 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2kw9 s ALA 74 Cb -0.31 -4.46 0.00 0.00 0.00 0.00 0.00 23.12 18.35 2kw9 s ALA 74 CO 0.25 -5.17 0.00 0.00 0.00 0.00 0.00 175.76 170.84