#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 3.06 -0.32 3.17 0.00 -1.26 -5.04 107.32 106.93 2kw9 s GLY 2 Ca 0.00 0.65 -0.06 0.00 0.00 0.00 0.00 44.72 45.31 2kw9 s GLY 2 CO 0.00 1.33 0.09 -2.38 0.00 0.00 0.00 173.10 172.14 2kw9 s HIS 3 N -0.81 3.21 0.27 1.90 0.00 -1.26 -5.09 115.29 113.52 2kw9 s HIS 3 Ca 0.44 -1.26 0.03 0.00 -3.00 0.00 0.00 55.06 51.27 2kw9 s HIS 3 Cb -0.26 -2.26 -0.06 0.00 -4.00 0.00 0.00 32.58 26.00 2kw9 s HIS 3 CO 0.33 -0.67 0.05 -1.01 -1.00 0.00 0.00 174.74 172.43 2kw9 s HIS 4 N 1.44 1.68 0.15 0.38 0.09 -1.26 -5.17 115.29 112.60 2kw9 s HIS 4 Ca 0.00 -1.01 0.10 0.00 -0.00 0.00 0.00 55.06 54.14 2kw9 s HIS 4 Cb -0.19 -1.02 -0.04 0.00 -0.00 0.00 0.00 32.58 31.33 2kw9 s HIS 4 CO 0.02 -0.12 -0.18 -1.01 -0.00 0.00 0.00 174.74 173.46 2kw9 s HIS 5 N -3.48 2.49 -0.02 1.40 4.02 -1.26 -5.14 115.29 113.29 2kw9 s HIS 5 Ca 0.34 -0.28 -0.01 0.00 1.02 0.00 0.00 55.06 56.13 2kw9 s HIS 5 Cb 0.07 -1.28 0.02 0.00 -1.02 0.00 0.00 32.58 30.37 2kw9 s HIS 5 CO 0.12 0.44 0.04 -1.58 1.02 0.00 0.00 174.74 174.78 2kw9 s HIS 6 N -1.38 -0.02 0.34 1.40 5.65 -1.26 -5.14 115.29 114.88 2kw9 s HIS 6 Ca 0.20 0.14 -0.29 0.00 0.25 0.00 0.00 55.06 55.36 2kw9 s HIS 6 Cb -0.10 -0.11 -0.11 0.00 -1.18 0.00 0.00 32.58 31.08 2kw9 s HIS 6 CO 0.11 -0.06 1.44 -1.58 -0.65 0.00 0.00 174.74 174.00 2kw9 s HIS 7 N 0.62 2.77 -0.27 3.88 2.46 -1.26 -5.02 115.29 118.47 2kw9 s HIS 7 Ca -0.05 1.19 -0.03 0.00 0.47 0.00 0.00 55.06 56.64 2kw9 s HIS 7 Cb -0.07 -3.91 0.03 0.00 -0.13 0.00 0.00 32.58 28.50 2kw9 s HIS 7 CO -0.02 -2.70 -0.02 -1.01 -2.47 0.00 0.00 174.74 168.52 2kw9 s HIS 8 N -0.91 3.13 0.59 3.88 4.02 -1.26 -5.12 115.29 119.63 2kw9 s HIS 8 Ca 0.53 -1.55 -0.16 0.00 1.02 0.00 0.00 55.06 54.90 2kw9 s HIS 8 Cb -0.44 -2.10 -0.04 0.00 -1.02 0.00 0.00 32.58 28.98 2kw9 s HIS 8 CO 0.57 -0.73 1.07 -1.12 1.02 0.00 0.00 174.74 175.55 2kw9 s SER 9 N 1.33 5.75 -0.28 1.40 0.01 -1.26 -5.07 113.70 115.59 2kw9 s SER 9 Ca -0.01 1.87 -0.16 0.00 1.31 0.00 0.00 55.95 58.96 2kw9 s SER 9 Cb -0.18 -2.54 0.08 0.00 0.21 0.00 0.00 66.02 63.60 2kw9 s SER 9 CO -0.02 -1.19 0.69 -1.38 0.41 0.00 0.00 173.24 171.75 2kw9 s HIS 10 N -2.35 -1.07 0.41 2.43 0.00 -1.26 -5.18 115.29 108.26 2kw9 s HIS 10 Ca 0.65 2.13 0.03 0.00 -3.00 0.00 0.00 55.06 54.88 2kw9 s HIS 10 Cb -0.17 0.64 -0.03 0.00 -4.00 0.00 0.00 32.58 29.02 2kw9 s HIS 10 CO 0.35 -0.53 0.11 -1.64 -1.00 0.00 0.00 174.74 172.03 2kw9 s MET 11 N 1.68 1.92 -0.20 -0.38 1.00 -1.26 -5.17 119.30 116.90 2kw9 s MET 11 Ca -0.10 -2.17 -0.10 0.00 0.00 0.00 0.00 55.69 53.32 2kw9 s MET 11 Cb -0.05 -0.74 0.07 0.00 0.00 0.00 0.00 34.83 34.11 2kw9 s MET 11 CO -0.20 -0.43 0.47 -1.12 0.00 0.00 0.00 175.02 173.74 2kw9 s SER 12 N -3.62 -0.57 0.04 3.03 0.01 -1.26 -5.17 113.70 106.17 2kw9 s SER 12 Ca 0.24 1.05 0.04 0.00 1.31 0.00 0.00 55.95 58.58 2kw9 s SER 12 Cb 0.03 1.05 -0.04 0.00 0.21 0.00 0.00 66.02 67.28 2kw9 s SER 12 CO 0.13 -0.21 -0.05 0.42 0.41 0.00 0.00 173.24 173.95 2kw9 s THR 13 N 1.74 3.75 1.01 1.44 -4.23 -1.26 -5.13 115.64 112.95 2kw9 s THR 13 Ca -0.08 -0.89 -0.15 0.00 -1.18 0.00 0.00 61.69 59.39 2kw9 s THR 13 Cb -0.09 -2.69 0.20 0.00 1.34 0.00 0.00 72.50 71.26 2kw9 s THR 13 CO -0.14 0.28 1.18 -2.16 -0.54 0.00 0.00 174.62 173.23 2kw9 s PRO 14 N -1.78 0.35 0.44 3.99 0.04 -1.26 -5.06 135.00 131.72 2kw9 s PRO 14 Ca 0.20 0.00 -0.07 0.00 0.04 0.00 0.00 61.00 61.18 2kw9 s PRO 14 Cb -0.11 -1.77 -0.05 0.00 0.04 0.00 0.00 34.50 32.61 2kw9 s PRO 14 CO 0.11 -2.68 0.76 -0.51 0.04 0.00 0.00 177.00 174.73 2kw9 s LEU 15 N -6.25 3.72 -0.28 -3.56 1.43 -1.26 -5.04 118.68 107.44 2kw9 s LEU 15 Ca 0.68 0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 54.49 2kw9 s LEU 15 Cb -0.10 -3.89 0.01 0.00 0.03 0.00 0.00 46.19 42.23 2kw9 s LEU 15 CO 0.54 -0.50 0.94 0.42 0.23 0.00 0.00 176.35 177.99 2kw9 s THR 16 N -2.59 4.69 0.00 5.49 -4.23 -1.26 -4.94 115.64 112.80 2kw9 s THR 16 Ca 0.48 1.63 0.00 0.00 -1.18 0.00 0.00 61.69 62.62 2kw9 s THR 16 Cb -0.10 -4.26 0.00 0.00 1.34 0.00 0.00 72.50 69.47 2kw9 s THR 16 CO 0.40 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.82 2kw9 n GLY 17 N 3.80 2.62 3.55 3.99 0.00 -1.26 -5.17 105.19 112.73 2kw9 n GLY 17 Ca 0.09 -1.71 -0.12 0.00 0.00 0.00 0.00 46.02 44.28 2kw9 n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kw9 s LYS 18 N -1.81 0.74 0.24 1.61 -2.85 -1.26 -5.16 119.74 111.25 2kw9 s LYS 18 Ca 0.00 0.11 -0.30 0.00 -1.00 0.00 0.00 55.97 54.78 2kw9 s LYS 18 Cb 0.00 0.35 -0.10 0.00 -2.06 0.00 0.00 37.83 36.01 2kw9 s LYS 18 CO 0.00 -0.24 1.51 -2.14 0.10 0.00 0.00 175.35 174.58 2kw9 s PRO 19 N -1.39 4.22 -0.22 1.78 0.02 -1.26 -4.96 135.00 133.19 2kw9 s PRO 19 Ca -0.03 2.39 -0.11 0.00 0.02 0.00 0.00 61.00 63.27 2kw9 s PRO 19 Cb -0.00 -3.10 -0.18 0.00 0.02 0.00 0.00 34.50 31.24 2kw9 s PRO 19 CO 0.02 -0.52 -0.01 0.41 -0.33 0.00 0.00 177.00 176.57 2kw9 n GLY 20 N 2.55 -0.57 3.40 0.52 0.00 -1.26 -4.97 105.19 104.86 2kw9 n GLY 20 Ca 0.09 -0.10 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 2kw9 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kw9 n ALA 21 N -3.53 -1.40 -2.73 4.61 0.00 -1.26 -4.98 120.51 111.22 2kw9 n ALA 21 Ca -0.42 -1.53 -0.18 0.00 0.00 0.00 0.00 53.44 51.32 2kw9 n ALA 21 Cb 0.89 -0.08 -0.12 0.00 0.00 0.00 0.00 19.45 20.14 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 2.26 0.76 0.00 1.43 -1.26 -5.14 118.68 116.73 2kw9 s LEU 22 Ca 0.67 -0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 53.10 2kw9 s LEU 22 Cb -0.02 -0.46 0.08 0.00 0.03 0.00 0.00 46.19 45.82 2kw9 s LEU 22 CO 0.47 -0.08 1.09 -2.16 0.23 0.00 0.00 176.35 175.90 2kw9 s PRO 23 N -1.61 1.95 0.00 1.29 0.04 -1.26 -5.01 135.00 130.40 2kw9 s PRO 23 Ca -0.03 -0.20 0.26 0.00 0.04 0.00 0.00 61.00 61.07 2kw9 s PRO 23 Cb -0.10 -2.08 0.66 0.00 0.04 0.00 0.00 34.50 33.02 2kw9 s PRO 23 CO 0.02 -1.47 1.51 0.00 0.04 0.00 0.00 177.00 177.09 2kw9 n ALA 24 N -3.12 2.91 0.21 8.56 0.00 -1.26 -4.26 120.51 123.56 2kw9 n ALA 24 Ca 0.09 -0.49 0.03 0.00 0.00 0.00 0.00 53.44 53.07 2kw9 n ALA 24 Cb 0.61 -1.05 0.17 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.02 2.98 -0.02 0.00 4.13 -1.26 -4.57 115.26 116.50 2kw9 n ASN 25 Ca 0.14 -2.39 -0.09 0.00 1.68 0.00 0.00 54.58 53.93 2kw9 n ASN 25 Cb 0.40 -0.57 -0.03 0.00 -1.54 0.00 0.00 39.78 38.04 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 1.68 -0.49 -0.31 3.41 3.38 -1.96 -0.53 115.31 120.50 2kw9 h LEU 26 Ca 0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2kw9 h LEU 26 Cb 1.12 0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2kw9 h LEU 26 CO 0.21 -0.20 0.00 -0.78 0.09 0.00 0.00 178.44 177.76 2kw9 h ASP 27 N -0.18 0.00 1.02 -0.43 3.58 -1.96 -3.15 116.42 115.31 2kw9 h ASP 27 Ca 0.11 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.36 2kw9 h ASP 27 Cb 0.33 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.35 2kw9 h ASP 27 CO -0.27 0.00 -1.00 -0.78 -2.88 0.00 0.00 179.24 174.32 2kw9 h ASP 28 N 0.00 0.00 -4.18 2.28 3.58 -1.54 -3.47 116.42 113.09 2kw9 h ASP 28 Ca 0.00 0.00 -0.46 0.00 0.42 0.00 0.00 57.03 56.99 2kw9 h ASP 28 Cb 0.69 0.00 0.11 0.00 1.72 0.00 0.00 39.33 41.86 2kw9 h ASP 28 CO 0.00 0.91 0.37 -0.04 -2.88 0.00 0.00 179.24 177.60 2kw9 s MET 29 N -2.74 1.61 0.57 0.28 -1.94 -0.33 -5.07 119.30 111.68 2kw9 s MET 29 Ca 0.01 -0.16 -0.15 0.00 -1.71 0.00 0.00 55.69 53.68 2kw9 s MET 29 Cb 0.09 -1.98 -0.05 0.00 2.01 0.00 0.00 34.83 34.90 2kw9 s MET 29 CO 0.81 -1.76 1.02 0.15 -0.01 0.00 0.00 175.02 175.23 2kw9 s LYS 30 N -5.59 3.62 0.39 2.03 1.02 -1.26 -4.95 119.74 115.00 2kw9 s LYS 30 Ca 0.65 0.99 0.08 0.00 0.02 0.00 0.00 55.97 57.71 2kw9 s LYS 30 Cb -0.09 -2.08 0.83 0.00 -0.52 0.00 0.00 37.83 35.97 2kw9 s LYS 30 CO 0.49 -0.55 1.98 0.28 -0.92 0.00 0.00 175.35 176.63 2kw9 h VAL 31 N 0.41 1.01 -0.73 3.17 2.07 -1.97 -0.75 116.25 119.46 2kw9 h VAL 31 Ca -0.46 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 66.85 2kw9 h VAL 31 Cb 1.20 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 2kw9 h VAL 31 CO 0.60 0.12 0.48 0.00 0.02 0.00 0.00 177.57 178.79 2kw9 h ALA 32 N 1.65 1.49 -0.30 1.67 0.00 -1.98 -0.93 119.26 120.86 2kw9 h ALA 32 Ca 0.27 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2kw9 h ALA 32 Cb 0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2kw9 h ALA 32 CO -0.08 0.47 0.07 0.93 0.00 0.00 0.00 179.25 180.64 2kw9 h GLU 33 N 0.98 0.48 0.04 0.00 4.39 -1.51 0.84 114.58 119.79 2kw9 h GLU 33 Ca 0.27 -0.12 0.01 0.00 0.34 0.00 0.00 59.36 59.86 2kw9 h GLU 33 Cb -0.10 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.48 2kw9 h GLU 33 CO -0.06 0.55 -0.08 -0.07 -1.16 0.00 0.00 179.01 178.19 2kw9 h LEU 34 N 0.31 -0.22 -1.80 1.33 3.38 -1.20 -1.29 115.31 115.82 2kw9 h LEU 34 Ca 0.09 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2kw9 h LEU 34 Cb 0.29 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 2kw9 h LEU 34 CO 0.00 -0.12 0.03 0.11 0.09 0.00 0.00 178.44 178.55 2kw9 h LYS 35 N -0.16 0.16 -0.32 1.13 1.57 -1.11 -0.86 116.57 116.98 2kw9 h LYS 35 Ca 0.02 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2kw9 h LYS 35 Cb 0.18 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2kw9 h LYS 35 CO -0.05 0.14 0.08 0.37 -0.57 0.00 0.00 179.45 179.42 2kw9 h GLN 36 N 0.16 0.51 -0.56 3.15 -0.00 -0.14 -1.24 115.11 116.98 2kw9 h GLN 36 Ca 0.04 -0.12 -0.09 0.00 -0.00 0.00 0.00 58.65 58.48 2kw9 h GLN 36 Cb 0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 27.48 27.45 2kw9 h GLN 36 CO -0.00 0.57 0.01 0.93 0.00 0.00 0.00 178.83 180.34 2kw9 h GLU 37 N 0.35 0.99 0.26 1.69 4.39 -0.69 -3.06 114.58 118.50 2kw9 h GLU 37 Ca 0.10 -0.31 -0.00 0.00 0.34 0.00 0.00 59.36 59.48 2kw9 h GLU 37 Cb 0.29 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2kw9 h GLU 37 CO 0.00 0.99 -0.20 -0.07 -1.16 0.00 0.00 179.01 178.57 2kw9 h LEU 38 N 0.88 -0.51 -1.81 1.33 3.38 -1.04 -2.88 115.31 114.67 2kw9 h LEU 38 Ca 0.16 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.18 2kw9 h LEU 38 Cb 0.53 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2kw9 h LEU 38 CO 0.03 -0.30 0.15 0.07 0.09 0.00 0.00 178.44 178.48 2kw9 h LYS 39 N -0.46 0.26 0.00 1.13 2.10 -1.25 0.11 116.57 118.45 2kw9 h LYS 39 Ca -0.02 -0.02 -0.07 0.00 -2.00 0.00 0.00 60.65 58.55 2kw9 h LYS 39 Cb 0.41 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 2kw9 h LYS 39 CO -0.01 0.17 -0.33 -0.07 -2.00 0.00 0.00 179.45 177.21 2kw9 h LEU 40 N 0.26 0.00 -3.22 7.07 3.38 -1.42 -3.04 115.31 118.34 2kw9 h LEU 40 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2kw9 h LEU 40 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2kw9 h LEU 40 CO -0.02 0.33 0.00 0.54 0.09 0.00 0.00 178.44 179.39 2kw9 n ARG 41 N -3.87 3.75 -1.92 1.13 1.74 0.17 -4.92 116.66 112.74 2kw9 n ARG 41 Ca -0.01 -2.86 -0.18 0.00 -0.77 0.00 0.00 57.85 54.02 2kw9 n ARG 41 Cb 0.41 -1.90 -0.05 0.00 -1.02 0.00 0.00 32.46 29.90 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 0.69 -5.28 -4.80 0.55 7.64 -0.89 -4.99 113.62 106.54 2kw9 n SER 42 Ca 0.24 0.23 -0.37 0.00 1.01 0.00 0.00 58.87 59.98 2kw9 n SER 42 Cb 0.91 -4.38 -0.06 0.00 -1.01 0.00 0.00 64.21 59.67 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 -4.72 4.37 0.38 -3.43 1.43 0.04 -5.00 118.68 111.76 2kw9 s LEU 43 Ca 0.00 0.72 -0.26 0.00 -1.03 0.00 0.00 54.13 53.56 2kw9 s LEU 43 Cb 0.00 -2.44 -0.09 0.00 0.03 0.00 0.00 46.19 43.69 2kw9 s LEU 43 CO 0.00 0.23 1.16 -2.16 0.23 0.00 0.00 176.35 175.82 2kw9 s PRO 44 N -0.40 4.14 -0.55 1.29 0.04 -1.26 -3.82 135.00 134.43 2kw9 s PRO 44 Ca 0.20 1.83 0.01 0.00 0.04 0.00 0.00 61.00 63.09 2kw9 s PRO 44 Cb -0.15 -2.74 0.56 0.00 0.04 0.00 0.00 34.50 32.21 2kw9 s PRO 44 CO 0.08 -0.25 1.97 1.33 0.04 0.00 0.00 177.00 180.18 2kw9 n VAL 45 N 0.22 3.41 0.16 -0.36 0.24 -1.26 -4.70 118.33 116.04 2kw9 n VAL 45 Ca 0.04 -2.43 0.03 0.00 -2.04 0.00 0.00 64.34 59.94 2kw9 n VAL 45 Cb 0.46 -0.81 0.21 0.00 -1.47 0.00 0.00 33.84 32.23 2kw9 n VAL 45 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2kw9 h SER 46 N 1.49 0.00 -3.98 -1.34 0.02 -2.01 -3.46 113.55 104.27 2kw9 h SER 46 Ca 0.62 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.47 2kw9 h SER 46 Cb 1.85 0.00 0.01 0.00 0.14 0.00 0.00 62.40 64.41 2kw9 h SER 46 CO 1.34 0.47 0.01 0.61 -1.14 0.00 0.00 176.83 178.12 2kw9 n GLY 47 N 0.59 1.14 3.96 -3.77 0.00 -1.26 -5.11 105.19 100.74 2kw9 n GLY 47 Ca 0.00 -2.03 -0.28 0.00 0.00 0.00 0.00 46.02 43.72 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 -0.20 2.01 0.13 2.61 -4.23 -1.26 -4.72 115.64 109.98 2kw9 s THR 48 Ca 0.13 -0.24 -0.33 0.00 -1.18 0.00 0.00 61.69 60.07 2kw9 s THR 48 Cb -0.01 -2.77 -0.11 0.00 1.34 0.00 0.00 72.50 70.95 2kw9 s THR 48 CO 0.09 0.00 1.55 0.50 -0.54 0.00 0.00 174.62 176.22 2kw9 h LYS 49 N -1.32 -0.41 -1.00 3.99 3.64 -1.99 -0.01 116.57 119.48 2kw9 h LYS 49 Ca -0.40 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.04 2kw9 h LYS 49 Cb 1.23 0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 33.09 2kw9 h LYS 49 CO 0.34 -0.27 0.65 1.15 -2.27 0.00 0.00 179.45 179.05 2kw9 h THR 50 N -0.42 1.17 0.23 1.00 2.02 -1.99 -1.67 112.91 113.25 2kw9 h THR 50 Ca 0.07 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.82 2kw9 h THR 50 Cb 0.61 -0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 2kw9 h THR 50 CO -0.58 0.23 -0.22 -0.08 0.37 0.00 0.00 175.52 175.24 2kw9 h GLU 51 N 1.26 -0.47 -0.90 6.66 4.22 -1.64 0.61 114.58 124.31 2kw9 h GLU 51 Ca 0.40 0.03 0.11 0.00 0.08 0.00 0.00 59.36 59.98 2kw9 h GLU 51 Cb 0.01 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.29 2kw9 h GLU 51 CO -0.13 -0.31 0.54 -0.07 -2.18 0.00 0.00 179.01 176.86 2kw9 h LEU 52 N -0.49 0.77 -0.19 1.64 3.38 -0.63 0.24 115.31 120.03 2kw9 h LEU 52 Ca -0.01 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2kw9 h LEU 52 Cb 0.45 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2kw9 h LEU 52 CO -0.05 0.41 0.10 0.40 0.09 0.00 0.00 178.44 179.40 2kw9 h ILE 53 N 0.86 1.13 -0.47 1.22 2.04 -0.97 -1.22 117.51 120.10 2kw9 h ILE 53 Ca 0.45 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.92 2kw9 h ILE 53 Cb 0.44 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 2kw9 h ILE 53 CO -0.27 0.12 0.17 -0.33 0.00 0.00 0.00 178.15 177.84 2kw9 h GLU 54 N 0.19 0.69 -0.34 2.37 4.39 0.16 -0.99 114.58 121.05 2kw9 h GLU 54 Ca 0.07 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2kw9 h GLU 54 Cb 0.10 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2kw9 h GLU 54 CO -0.01 0.58 0.06 -0.09 -1.16 0.00 0.00 179.01 178.40 2kw9 h ARG 55 N 0.68 0.56 -0.19 2.33 2.43 -0.31 0.28 114.38 120.16 2kw9 h ARG 55 Ca 0.16 -0.15 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2kw9 h ARG 55 Cb 0.17 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 2kw9 h ARG 55 CO -0.01 0.63 0.09 -0.07 -1.51 0.00 0.00 179.97 179.10 2kw9 h LEU 56 N 0.39 0.14 -0.65 3.80 3.38 -0.93 -0.34 115.31 121.10 2kw9 h LEU 56 Ca 0.10 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 2kw9 h LEU 56 Cb 0.34 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2kw9 h LEU 56 CO 0.01 0.11 0.18 0.03 0.09 0.00 0.00 178.44 178.85 2kw9 h ARG 57 N 0.20 1.03 -0.03 1.13 3.08 -1.04 0.12 114.38 118.85 2kw9 h ARG 57 Ca 0.08 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 59.81 2kw9 h ARG 57 Cb 0.02 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2kw9 h ARG 57 CO -0.05 0.91 -0.37 0.00 -1.07 0.00 0.00 179.97 179.39 2kw9 h ALA 58 N 1.07 1.33 -0.03 0.04 0.00 -0.33 0.10 119.26 121.44 2kw9 h ALA 58 Ca 0.21 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 2kw9 h ALA 58 Cb 0.34 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.07 2kw9 h ALA 58 CO -0.00 0.49 -0.52 -0.92 0.00 0.00 0.00 179.25 178.30 2kw9 h TYR 59 N 0.06 0.59 -0.42 0.00 3.20 -0.69 -3.30 116.97 116.41 2kw9 h TYR 59 Ca 0.00 -0.30 -0.08 0.00 3.14 0.00 0.00 58.73 61.50 2kw9 h TYR 59 Cb 0.68 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 2kw9 h TYR 59 CO 0.00 1.09 -0.05 0.37 -1.64 0.00 0.00 178.16 177.94 2kw9 h GLN 60 N -0.08 0.71 -1.06 1.82 5.75 -0.62 -2.42 115.11 119.21 2kw9 h GLN 60 Ca -0.06 -0.20 0.29 0.00 -0.15 0.00 0.00 58.65 58.53 2kw9 h GLN 60 Cb 1.21 -0.08 -0.06 0.00 1.07 0.00 0.00 27.48 29.62 2kw9 h GLN 60 CO 0.10 0.76 0.73 0.22 -2.65 0.00 0.00 178.83 178.00 2kw9 h ASP 61 N 0.66 0.17 1.32 -0.69 1.82 -0.87 0.73 116.42 119.57 2kw9 h ASP 61 Ca 0.12 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 56.80 2kw9 h ASP 61 Cb 0.49 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.50 2kw9 h ASP 61 CO 0.03 0.04 -0.40 1.56 -1.61 0.00 0.00 179.24 178.86 2kw9 h GLN 62 N 0.15 0.00 0.00 0.28 4.20 -1.52 -3.36 115.11 114.86 2kw9 h GLN 62 Ca 0.54 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.25 2kw9 h GLN 62 Cb 1.83 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.61 2kw9 h GLN 62 CO -0.11 0.00 0.00 0.44 -0.67 0.00 0.00 178.83 178.49 2kw9 n ILE 63 N -2.51 0.36 -3.56 2.54 -5.35 0.24 -5.07 119.36 106.01 2kw9 n ILE 63 Ca 0.03 -0.45 -0.37 0.00 -0.27 0.00 0.00 62.75 61.70 2kw9 n ILE 63 Cb 0.48 0.98 -0.06 0.00 -1.74 0.00 0.00 39.64 39.30 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 -0.36 6.71 -0.81 7.28 0.15 0.23 -4.99 113.70 121.91 2kw9 s SER 64 Ca 0.00 0.86 -0.24 0.00 0.70 0.00 0.00 55.95 57.27 2kw9 s SER 64 Cb 0.00 -2.21 -0.17 0.00 -1.71 0.00 0.00 66.02 61.93 2kw9 s SER 64 CO 0.00 0.28 1.89 -2.65 1.20 0.00 0.00 173.24 173.96 2kw9 n PRO 65 N 1.50 1.23 -4.38 5.44 -0.02 -1.26 -4.90 135.00 132.61 2kw9 n PRO 65 Ca -0.12 -1.91 -0.24 0.00 -2.02 0.00 0.00 63.50 59.21 2kw9 n PRO 65 Cb 0.53 -3.18 -0.11 0.00 -0.02 0.00 0.00 33.50 30.72 2kw9 n PRO 65 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2kw9 s VAL 66 N 7.97 2.11 0.20 -1.45 -7.23 -1.26 -5.06 120.40 115.68 2kw9 s VAL 66 Ca 0.64 -2.01 -0.11 0.00 -1.81 0.00 0.00 61.98 58.69 2kw9 s VAL 66 Cb 0.09 -2.00 0.14 0.00 0.56 0.00 0.00 36.38 35.16 2kw9 s VAL 66 CO 0.16 -0.23 1.87 1.55 -0.31 0.00 0.00 175.10 178.14 2kw9 h PRO 67 N 3.15 0.93 0.00 4.82 0.13 -2.01 -3.45 132.00 135.58 2kw9 h PRO 67 Ca -0.44 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2kw9 h PRO 67 Cb 1.21 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2kw9 h PRO 67 CO 0.50 0.61 0.00 0.41 -0.23 0.00 0.00 178.00 179.30 2kw9 n GLY 68 N -1.29 0.00 1.16 1.56 0.00 -1.26 -5.15 105.19 100.20 2kw9 n GLY 68 Ca 0.07 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.17 2kw9 n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kw9 n ALA 69 N 0.00 -2.47 -1.76 4.61 0.00 -1.26 -4.64 120.51 114.98 2kw9 n ALA 69 Ca 0.00 0.61 -0.39 0.00 0.00 0.00 0.00 53.44 53.65 2kw9 n ALA 69 Cb 0.00 -1.24 -0.03 0.00 0.00 0.00 0.00 19.45 18.18 2kw9 n ALA 69 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2kw9 s PRO 70 N -4.42 2.68 -0.29 0.00 0.04 -1.26 -4.96 135.00 126.79 2kw9 s PRO 70 Ca 0.00 1.37 -0.05 0.00 0.04 0.00 0.00 61.00 62.35 2kw9 s PRO 70 Cb 0.00 -4.42 0.02 0.00 0.04 0.00 0.00 34.50 30.14 2kw9 s PRO 70 CO 0.00 -2.63 0.05 0.15 0.04 0.00 0.00 177.00 174.61 2kw9 s LYS 71 N 7.07 2.94 -0.42 4.56 -0.14 -1.26 -5.02 119.74 127.46 2kw9 s LYS 71 Ca 0.88 -0.95 0.05 0.00 -1.36 0.00 0.00 55.97 54.59 2kw9 s LYS 71 Cb -0.21 -3.29 0.18 0.00 -1.68 0.00 0.00 37.83 32.83 2kw9 s LYS 71 CO 0.28 -0.47 0.39 0.00 -0.76 0.00 0.00 175.35 174.79 2kw9 n ALA 72 N 4.80 2.46 0.80 5.17 0.00 -1.26 -4.98 120.51 127.51 2kw9 n ALA 72 Ca -0.15 -2.98 0.06 0.00 0.00 0.00 0.00 53.44 50.38 2kw9 n ALA 72 Cb 0.47 -0.81 0.17 0.00 0.00 0.00 0.00 19.45 19.27 2kw9 n ALA 72 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2kw9 n PRO 73 N 2.68 1.87 0.00 0.00 -0.04 -1.26 -4.96 135.00 133.29 2kw9 n PRO 73 Ca 0.28 -1.35 0.00 0.00 -0.04 0.00 0.00 63.50 62.39 2kw9 n PRO 73 Cb 0.49 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 2kw9 n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kw9 n ALA 74 N 0.59 0.00 -0.63 0.55 0.00 -1.26 -5.39 120.51 114.37 2kw9 n ALA 74 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2kw9 n ALA 74 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 2kw9 n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50