#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hk9 n GLN 5 N 0.00 0.20 -4.43 1.61 6.02 -1.26 -4.96 117.38 114.57 1hk9 n GLN 5 Ca 0.00 -0.03 -0.23 0.00 -0.01 0.00 0.00 57.00 56.73 1hk9 n GLN 5 Cb 0.00 -1.54 -0.08 0.00 1.02 0.00 0.00 30.24 29.64 1hk9 n GLN 5 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1hk9 s SER 6 N -3.57 2.36 -0.17 1.08 1.04 -1.26 -5.03 113.70 108.16 1hk9 s SER 6 Ca 0.04 -1.72 0.05 0.00 0.48 0.00 0.00 55.95 54.80 1hk9 s SER 6 Cb 0.15 0.55 -0.22 0.00 0.10 0.00 0.00 66.02 66.60 1hk9 s SER 6 CO 0.84 -1.00 0.16 0.18 0.98 0.00 0.00 173.24 174.40 1hk9 n LEU 7 N -0.81 1.84 -0.17 2.42 4.32 -1.26 -4.46 117.00 118.88 1hk9 n LEU 7 Ca -0.01 0.09 -0.02 0.00 -0.02 0.00 0.00 56.01 56.05 1hk9 n LEU 7 Cb 0.64 -0.46 0.07 0.00 -1.62 0.00 0.00 43.42 42.05 1hk9 n LEU 7 CO 0.34 0.72 0.96 -0.61 -1.22 0.00 0.00 177.39 177.57 1hk9 h GLN 8 N 0.02 0.33 0.74 3.23 4.15 -1.98 -1.60 115.11 119.99 1hk9 h GLN 8 Ca -0.48 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 58.89 1hk9 h GLN 8 Cb 2.04 -0.07 0.01 0.00 0.21 0.00 0.00 27.48 29.66 1hk9 h GLN 8 CO 0.02 0.22 -0.35 0.22 -1.93 0.00 0.00 178.83 177.00 1hk9 h ASP 9 N 0.34 -0.84 -0.97 -0.69 3.58 -1.99 -0.35 116.42 115.51 1hk9 h ASP 9 Ca 0.25 0.01 0.09 0.00 0.42 0.00 0.00 57.03 57.80 1hk9 h ASP 9 Cb 0.30 0.22 -0.07 0.00 1.72 0.00 0.00 39.33 41.49 1hk9 h ASP 9 CO -0.27 -0.49 0.62 -0.65 -2.88 0.00 0.00 179.24 175.56 1hk9 h PRO 10 N -1.18 1.00 0.14 0.28 0.11 -1.77 0.26 132.00 130.84 1hk9 h PRO 10 Ca -0.10 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.94 1hk9 h PRO 10 Cb 0.78 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1hk9 h PRO 10 CO 0.17 0.66 -0.07 0.35 -0.21 0.00 0.00 178.00 178.90 1hk9 h PHE 11 N 1.03 -0.18 -0.13 0.65 3.04 -1.22 -0.45 116.94 119.69 1hk9 h PHE 11 Ca 0.44 -0.00 -0.12 0.00 3.98 0.00 0.00 57.97 62.27 1hk9 h PHE 11 Cb 0.33 0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.89 1hk9 h PHE 11 CO -0.00 0.05 -0.45 -0.07 -2.02 0.00 0.00 178.31 175.82 1hk9 h LEU 12 N -0.39 0.33 -0.88 0.59 3.38 -0.78 -2.55 115.31 115.01 1hk9 h LEU 12 Ca -0.02 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 1hk9 h LEU 12 Cb 0.31 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1hk9 h LEU 12 CO 0.03 0.74 0.09 0.78 0.09 0.00 0.00 178.44 180.18 1hk9 h ASN 13 N 0.26 0.87 0.05 -0.43 2.35 -0.38 -0.09 115.58 118.20 1hk9 h ASN 13 Ca 0.02 -0.19 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 1hk9 h ASN 13 Cb 0.90 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.04 1hk9 h ASN 13 CO 0.07 0.88 -0.02 0.00 -1.65 0.00 0.00 177.43 176.71 1hk9 h ALA 14 N 1.23 -0.07 -0.47 -0.83 0.00 -0.88 0.99 119.26 119.23 1hk9 h ALA 14 Ca 0.18 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1hk9 h ALA 14 Cb 0.38 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.16 1hk9 h ALA 14 CO 0.01 -0.47 0.25 -0.07 0.00 0.00 0.00 179.25 178.97 1hk9 h LEU 15 N -0.20 0.38 0.69 0.00 4.07 -1.29 0.10 115.31 119.06 1hk9 h LEU 15 Ca -0.01 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 57.94 1hk9 h LEU 15 Cb 0.18 -0.06 0.01 0.00 1.08 0.00 0.00 40.66 41.87 1hk9 h LEU 15 CO 0.01 0.27 -0.33 -0.09 -1.08 0.00 0.00 178.44 177.22 1hk9 h ARG 16 N 0.50 -0.89 -0.51 1.13 2.43 -0.90 -0.35 114.38 115.80 1hk9 h ARG 16 Ca 0.20 0.06 0.10 0.00 -0.81 0.00 0.00 59.98 59.53 1hk9 h ARG 16 Cb 0.08 0.20 -0.09 0.00 -0.42 0.00 0.00 29.97 29.74 1hk9 h ARG 16 CO -0.12 -0.57 -0.05 -0.09 -1.51 0.00 0.00 179.97 177.63 1hk9 h ARG 17 N -1.01 0.07 -0.00 0.20 2.43 -0.64 -0.45 114.38 114.97 1hk9 h ARG 17 Ca -0.09 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1hk9 h ARG 17 Cb 0.73 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 1hk9 h ARG 17 CO 0.16 0.04 -0.01 0.39 -1.51 0.00 0.00 179.97 179.04 1hk9 n GLU 18 N -5.28 0.63 -3.98 0.20 -0.58 0.34 -4.90 120.64 107.05 1hk9 n GLU 18 Ca 0.05 -0.03 -0.31 0.00 -0.42 0.00 0.00 57.16 56.45 1hk9 n GLU 18 Cb 0.28 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.66 1hk9 n GLU 18 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1hk9 n ARG 19 N -1.16 -4.81 -2.29 3.49 1.74 -0.18 -4.90 116.66 108.55 1hk9 n ARG 19 Ca 0.17 0.53 -0.42 0.00 -0.77 0.00 0.00 57.85 57.36 1hk9 n ARG 19 Cb 0.21 -5.33 -0.03 0.00 -1.02 0.00 0.00 32.46 26.29 1hk9 n ARG 19 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1hk9 s VAL 20 N -3.35 3.80 0.31 1.55 1.01 -0.70 -4.98 120.40 118.03 1hk9 s VAL 20 Ca 0.61 1.22 -0.29 0.00 0.00 0.00 0.00 61.98 63.52 1hk9 s VAL 20 Cb -0.32 -3.78 -0.10 0.00 0.00 0.00 0.00 36.38 32.18 1hk9 s VAL 20 CO 0.86 0.03 1.42 -2.84 0.00 0.00 0.00 175.10 174.57 1hk9 s PRO 21 N 1.90 4.25 0.19 2.72 0.02 -1.26 -4.56 135.00 138.26 1hk9 s PRO 21 Ca 0.62 2.35 0.01 0.00 0.02 0.00 0.00 61.00 64.00 1hk9 s PRO 21 Cb -0.31 -3.06 -0.05 0.00 0.02 0.00 0.00 34.50 31.11 1hk9 s PRO 21 CO 0.27 -0.38 0.03 0.14 -0.33 0.00 0.00 177.00 176.72 1hk9 s VAL 22 N -0.62 0.61 -0.10 3.83 -7.23 0.72 -1.59 120.40 116.02 1hk9 s VAL 22 Ca 0.55 -1.98 0.03 0.00 -1.81 0.00 0.00 61.98 58.76 1hk9 s VAL 22 Cb -0.43 -2.22 -0.01 0.00 0.56 0.00 0.00 36.38 34.28 1hk9 s VAL 22 CO 0.51 -0.37 -0.19 -0.44 -0.31 0.00 0.00 175.10 174.29 1hk9 s SER 23 N -3.19 3.50 -0.21 4.85 0.01 -0.55 -2.00 113.70 116.11 1hk9 s SER 23 Ca 0.27 -0.44 -0.00 0.00 1.31 0.00 0.00 55.95 57.09 1hk9 s SER 23 Cb 0.06 -1.33 0.02 0.00 0.21 0.00 0.00 66.02 64.98 1hk9 s SER 23 CO 0.06 0.19 -0.13 -0.63 0.41 0.00 0.00 173.24 173.14 1hk9 s ILE 24 N 0.16 2.51 -0.14 1.44 1.01 0.10 -0.62 121.20 125.66 1hk9 s ILE 24 Ca -0.11 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 1hk9 s ILE 24 Cb -0.16 -2.15 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 1hk9 s ILE 24 CO 0.06 0.41 0.36 -0.31 0.00 0.00 0.00 174.94 175.46 1hk9 s TYR 25 N 1.32 3.49 0.47 3.97 2.02 -0.16 -0.29 117.35 128.18 1hk9 s TYR 25 Ca 0.03 0.71 -0.04 0.00 -0.37 0.00 0.00 57.07 57.41 1hk9 s TYR 25 Cb -0.14 -2.41 -0.02 0.00 -0.40 0.00 0.00 41.96 38.99 1hk9 s TYR 25 CO -0.09 0.24 0.74 -0.51 -1.57 0.00 0.00 175.55 174.37 1hk9 s LEU 26 N 0.43 3.64 0.66 -1.29 1.43 -0.64 0.03 118.68 122.95 1hk9 s LEU 26 Ca 0.20 0.73 0.42 0.00 -1.03 0.00 0.00 54.13 54.45 1hk9 s LEU 26 Cb -0.14 -3.63 2.33 0.00 0.03 0.00 0.00 46.19 44.78 1hk9 s LEU 26 CO 0.06 -0.61 2.34 -0.37 0.23 0.00 0.00 176.35 178.00 1hk9 h VAL 27 N 0.28 0.06 0.01 -1.59 -1.51 -0.97 -1.44 116.25 111.09 1hk9 h VAL 27 Ca -0.47 0.00 -0.22 0.00 -1.23 0.00 0.00 66.70 64.77 1hk9 h VAL 27 Cb 1.22 0.98 -0.03 0.00 -2.13 0.00 0.00 31.29 31.33 1hk9 h VAL 27 CO 0.61 0.00 -1.10 -0.55 -1.23 0.00 0.00 177.57 175.30 1hk9 h ASN 28 N 0.00 0.03 0.00 4.19 7.08 -1.93 -3.48 115.58 121.47 1hk9 h ASN 28 Ca 0.00 -0.04 0.00 0.00 -3.08 0.00 0.00 56.30 53.18 1hk9 h ASN 28 Cb 0.04 -0.01 0.00 0.00 -2.08 0.00 0.00 38.32 36.27 1hk9 h ASN 28 CO -0.00 1.03 0.00 0.61 -2.08 0.00 0.00 177.43 176.99 1hk9 n GLY 29 N 1.39 1.48 3.77 9.14 0.00 -0.54 -5.10 105.19 115.33 1hk9 n GLY 29 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1hk9 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hk9 s ILE 30 N -1.54 2.20 -0.34 -0.61 1.01 -1.26 -4.75 121.20 115.91 1hk9 s ILE 30 Ca 0.00 0.18 -0.06 0.00 0.00 0.00 0.00 60.65 60.77 1hk9 s ILE 30 Cb 0.00 -3.11 0.04 0.00 0.01 0.00 0.00 42.46 39.40 1hk9 s ILE 30 CO 0.00 0.03 0.10 -0.75 0.00 0.00 0.00 174.94 174.32 1hk9 s LYS 31 N -2.28 2.58 0.31 2.79 2.20 -1.26 -1.61 119.74 122.45 1hk9 s LYS 31 Ca 0.57 -1.22 -0.05 0.00 -0.36 0.00 0.00 55.97 54.91 1hk9 s LYS 31 Cb -0.43 -3.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.40 1hk9 s LYS 31 CO 0.57 -0.68 0.58 -0.51 -0.36 0.00 0.00 175.35 174.94 1hk9 s LEU 32 N 1.38 4.02 0.05 5.43 1.43 0.61 -4.90 118.68 126.69 1hk9 s LEU 32 Ca -0.02 0.75 -0.07 0.00 -1.03 0.00 0.00 54.13 53.76 1hk9 s LEU 32 Cb -0.20 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.44 1hk9 s LEU 32 CO 0.02 -0.23 0.14 -1.10 0.23 0.00 0.00 176.35 175.41 1hk9 s GLN 33 N -3.63 0.67 0.00 1.70 -0.21 -1.26 0.03 119.66 116.96 1hk9 s GLN 33 Ca 0.45 -0.78 0.00 0.00 0.02 0.00 0.00 55.36 55.05 1hk9 s GLN 33 Cb -0.11 0.27 0.00 0.00 1.00 0.00 0.00 33.01 34.17 1hk9 s GLN 33 CO 0.31 -0.19 0.00 0.41 -2.12 0.00 0.00 175.29 173.70 1hk9 n GLY 34 N 0.54 0.37 3.33 3.09 0.00 -0.85 -4.78 105.19 106.88 1hk9 n GLY 34 Ca -0.18 -1.41 -0.27 0.00 0.00 0.00 0.00 46.02 44.15 1hk9 n GLY 34 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hk9 s GLN 35 N -2.00 1.43 -0.48 1.61 -0.21 -0.86 -0.20 119.66 118.95 1hk9 s GLN 35 Ca 0.00 -1.16 -0.29 0.00 0.02 0.00 0.00 55.36 53.93 1hk9 s GLN 35 Cb 0.00 -1.72 0.03 0.00 1.00 0.00 0.00 33.01 32.32 1hk9 s GLN 35 CO 0.00 0.42 1.17 0.42 -2.12 0.00 0.00 175.29 175.18 1hk9 s ILE 36 N -0.97 4.17 -0.08 1.08 1.01 -1.26 -0.73 121.20 124.41 1hk9 s ILE 36 Ca 0.10 1.18 -0.26 0.00 0.00 0.00 0.00 60.65 61.68 1hk9 s ILE 36 Cb -0.10 -4.57 -0.26 0.00 0.01 0.00 0.00 42.46 37.54 1hk9 s ILE 36 CO 0.04 -1.00 0.90 -0.08 0.00 0.00 0.00 174.94 174.79 1hk9 h GLU 37 N 9.39 0.13 -2.82 2.79 4.81 -1.38 -3.38 114.58 124.13 1hk9 h GLU 37 Ca -0.23 -0.19 0.06 0.00 -0.13 0.00 0.00 59.36 58.87 1hk9 h GLU 37 Cb 1.06 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 1hk9 h GLU 37 CO 1.13 1.02 0.37 0.45 -0.73 0.00 0.00 179.01 181.25 1hk9 s SER 38 N -6.42 -0.05 -0.17 1.04 0.15 -1.20 -5.00 113.70 102.05 1hk9 s SER 38 Ca -0.17 -0.89 -0.30 0.00 0.70 0.00 0.00 55.95 55.30 1hk9 s SER 38 Cb -0.01 0.71 0.13 0.00 -1.71 0.00 0.00 66.02 65.15 1hk9 s SER 38 CO 0.74 -1.39 1.04 0.72 1.20 0.00 0.00 173.24 175.55 1hk9 s PHE 39 N -2.57 -0.33 0.00 3.44 -0.12 -1.26 -0.76 117.98 116.39 1hk9 s PHE 39 Ca 0.16 0.55 0.00 0.00 -0.05 0.00 0.00 56.93 57.60 1hk9 s PHE 39 Cb -0.04 0.46 0.00 0.00 -0.63 0.00 0.00 43.02 42.81 1hk9 s PHE 39 CO 0.08 -0.31 0.00 -0.40 -0.05 0.00 0.00 175.22 174.54 1hk9 n ASP 40 N 0.68 0.87 0.24 1.98 5.68 -0.50 -5.00 116.55 120.50 1hk9 n ASP 40 Ca -0.09 -0.07 0.07 0.00 -0.50 0.00 0.00 54.79 54.20 1hk9 n ASP 40 Cb 0.58 0.00 0.57 0.00 -1.14 0.00 0.00 41.12 41.13 1hk9 n ASP 40 CO 0.00 0.00 0.00 -0.61 -1.33 0.00 0.00 177.20 175.26 1hk9 h GLN 41 N 0.00 0.00 0.00 0.11 4.15 -2.04 -3.33 115.11 114.00 1hk9 h GLN 41 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1hk9 h GLN 41 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 1hk9 h GLN 41 CO 0.00 0.11 -0.93 1.19 -1.93 0.00 0.00 178.83 177.27 1hk9 n PHE 42 N -4.37 0.00 -4.26 3.99 3.72 -1.26 -4.97 117.46 110.31 1hk9 n PHE 42 Ca -0.03 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.23 1hk9 n PHE 42 Cb 0.18 -0.04 -0.10 0.00 -0.94 0.00 0.00 39.48 38.58 1hk9 n PHE 42 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 1hk9 s VAL 43 N -1.99 0.35 -0.06 -4.37 -7.23 -1.25 -1.43 120.40 104.42 1hk9 s VAL 43 Ca -0.01 -1.99 0.02 0.00 -1.81 0.00 0.00 61.98 58.19 1hk9 s VAL 43 Cb 0.01 -2.52 0.01 0.00 0.56 0.00 0.00 36.38 34.45 1hk9 s VAL 43 CO 0.09 -0.06 -0.10 -0.63 -0.31 0.00 0.00 175.10 174.09 1hk9 s ILE 44 N -3.90 0.98 -0.26 -0.62 1.01 0.19 -1.41 121.20 117.19 1hk9 s ILE 44 Ca 0.36 -0.39 -0.15 0.00 0.00 0.00 0.00 60.65 60.47 1hk9 s ILE 44 Cb 0.07 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.60 1hk9 s ILE 44 CO 0.12 0.32 0.39 -0.76 0.00 0.00 0.00 174.94 175.01 1hk9 s LEU 45 N 0.66 4.06 -0.14 2.97 1.43 0.06 -0.76 118.68 126.97 1hk9 s LEU 45 Ca -0.13 0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1hk9 s LEU 45 Cb -0.15 -2.46 -0.03 0.00 0.03 0.00 0.00 46.19 43.58 1hk9 s LEU 45 CO 0.03 -0.18 -0.05 -0.22 0.23 0.00 0.00 176.35 176.16 1hk9 s LEU 46 N 1.97 3.16 -0.03 1.79 2.96 -0.20 -0.90 118.68 127.43 1hk9 s LEU 46 Ca 0.16 -0.15 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 1hk9 s LEU 46 Cb -0.16 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 1hk9 s LEU 46 CO 0.09 0.19 -0.06 -0.75 -1.32 0.00 0.00 176.35 174.50 1hk9 s LYS 47 N 0.24 2.68 0.00 1.98 2.47 0.09 -0.81 119.74 126.39 1hk9 s LYS 47 Ca -0.04 -0.62 0.00 0.00 -1.56 0.00 0.00 55.97 53.75 1hk9 s LYS 47 Cb -0.14 -2.56 0.00 0.00 -1.46 0.00 0.00 37.83 33.66 1hk9 s LYS 47 CO 0.03 0.64 0.00 -1.71 0.16 0.00 0.00 175.35 174.47 1hk9 n ASN 48 N 1.89 0.00 0.06 1.43 2.85 -1.26 -2.03 115.26 118.19 1hk9 n ASN 48 Ca -0.17 0.00 -0.11 0.00 -0.11 0.00 0.00 54.58 54.19 1hk9 n ASN 48 Cb 0.53 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 41.49 1hk9 n ASN 48 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 1hk9 h THR 49 N 0.00 0.80 -2.21 -0.44 2.02 -1.96 -3.44 112.91 107.67 1hk9 h THR 49 Ca 0.00 0.00 -0.56 0.00 0.77 0.00 0.00 66.41 66.62 1hk9 h THR 49 Cb 0.00 0.80 -0.13 0.00 -1.74 0.00 0.00 68.15 67.07 1hk9 h THR 49 CO 0.00 0.00 -0.61 0.68 0.37 0.00 0.00 175.52 175.96 1hk9 s VAL 50 N -6.17 1.67 -0.21 3.16 -7.23 -1.26 -5.11 120.40 105.26 1hk9 s VAL 50 Ca -0.14 -2.02 -0.22 0.00 -1.81 0.00 0.00 61.98 57.79 1hk9 s VAL 50 Cb 0.07 -2.86 -0.02 0.00 0.56 0.00 0.00 36.38 34.14 1hk9 s VAL 50 CO 0.66 -0.04 0.68 -0.44 -0.31 0.00 0.00 175.10 175.65 1hk9 s SER 51 N -3.60 6.71 0.19 4.85 0.01 -1.26 -4.45 113.70 116.15 1hk9 s SER 51 Ca 0.35 0.87 0.09 0.00 1.31 0.00 0.00 55.95 58.57 1hk9 s SER 51 Cb 0.09 -2.37 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 1hk9 s SER 51 CO 0.16 -0.33 -0.08 0.00 0.41 0.00 0.00 173.24 173.40 1hk9 s GLN 52 N 2.16 2.11 -0.31 12.44 -2.07 0.01 -4.94 119.66 129.06 1hk9 s GLN 52 Ca 0.30 -1.28 -0.09 0.00 -1.82 0.00 0.00 55.36 52.47 1hk9 s GLN 52 Cb -0.16 -2.17 -0.00 0.00 -1.09 0.00 0.00 33.01 29.59 1hk9 s GLN 52 CO 0.10 0.43 0.14 1.41 -1.32 0.00 0.00 175.29 176.05 1hk9 s MET 53 N -2.94 3.30 -0.18 9.60 -2.45 -1.26 -1.03 119.30 124.33 1hk9 s MET 53 Ca 0.26 -0.74 -0.06 0.00 -1.25 0.00 0.00 55.69 53.90 1hk9 s MET 53 Cb -0.08 -3.53 -0.03 0.00 1.25 0.00 0.00 34.83 32.43 1hk9 s MET 53 CO 0.16 -0.42 0.03 0.08 1.05 0.00 0.00 175.02 175.92 1hk9 s VAL 54 N 1.60 4.43 -0.11 10.11 1.01 0.06 -4.95 120.40 132.54 1hk9 s VAL 54 Ca 0.04 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.58 1hk9 s VAL 54 Cb -0.17 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 1hk9 s VAL 54 CO 0.06 0.45 0.96 -0.31 0.00 0.00 0.00 175.10 176.26 1hk9 s TYR 55 N 0.54 3.51 0.53 5.22 2.02 -1.26 -0.64 117.35 127.27 1hk9 s TYR 55 Ca 0.01 1.53 0.22 0.00 -0.37 0.00 0.00 57.07 58.46 1hk9 s TYR 55 Cb -0.13 -3.14 1.36 0.00 -0.40 0.00 0.00 41.96 39.65 1hk9 s TYR 55 CO 0.02 -0.20 2.04 0.87 -1.57 0.00 0.00 175.55 176.71 1hk9 h LYS 56 N 7.10 0.00 0.00 -0.62 1.57 -1.58 -0.05 116.57 123.00 1hk9 h LYS 56 Ca -0.32 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 1hk9 h LYS 56 Cb 1.15 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.46 1hk9 h LYS 56 CO 0.84 0.00 0.00 1.12 -0.57 0.00 0.00 179.45 180.84 1hk9 h HIS 57 N 0.00 0.00 -0.01 -1.35 2.07 -1.92 -1.10 115.15 112.84 1hk9 h HIS 57 Ca 0.18 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.70 1hk9 h HIS 57 Cb 0.72 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.70 1hk9 h HIS 57 CO -0.00 0.00 -0.38 0.00 -3.07 0.00 0.00 177.93 174.48 1hk9 n ALA 58 N -2.03 3.36 -2.32 6.11 0.00 -0.04 -4.94 120.51 120.64 1hk9 n ALA 58 Ca -0.00 -0.54 -0.39 0.00 0.00 0.00 0.00 53.44 52.51 1hk9 n ALA 58 Cb 0.21 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 1hk9 n ALA 58 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1hk9 s ILE 59 N -2.49 4.78 -0.27 0.00 1.01 -0.42 -0.32 121.20 123.48 1hk9 s ILE 59 Ca 0.21 1.23 -0.11 0.00 0.00 0.00 0.00 60.65 61.98 1hk9 s ILE 59 Cb 0.19 -3.91 -0.13 0.00 0.01 0.00 0.00 42.46 38.62 1hk9 s ILE 59 CO 0.55 0.52 -0.33 -1.54 0.00 0.00 0.00 174.94 174.14 1hk9 n SER 60 N 1.97 1.94 -3.85 3.58 3.41 0.10 -4.75 113.62 116.03 1hk9 n SER 60 Ca -0.09 0.25 -0.10 0.00 -0.26 0.00 0.00 58.87 58.67 1hk9 n SER 60 Cb 0.51 -0.74 -0.08 0.00 -0.26 0.00 0.00 64.21 63.64 1hk9 n SER 60 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1hk9 s THR 61 N -2.50 0.11 -0.17 6.66 -4.23 -1.13 -5.00 115.64 109.37 1hk9 s THR 61 Ca -0.38 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 1hk9 s THR 61 Cb 0.14 -0.94 0.03 0.00 1.34 0.00 0.00 72.50 73.06 1hk9 s THR 61 CO 0.50 -0.50 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.23 1hk9 s VAL 62 N -2.65 1.82 -0.25 2.29 1.01 -1.26 -0.99 120.40 120.37 1hk9 s VAL 62 Ca -0.04 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.10 1hk9 s VAL 62 Cb -0.01 -1.71 0.05 0.00 0.00 0.00 0.00 36.38 34.72 1hk9 s VAL 62 CO -0.04 0.44 -0.11 -0.69 0.00 0.00 0.00 175.10 174.70 1hk9 s VAL 63 N 1.37 2.29 0.55 2.92 1.01 0.21 -4.99 120.40 123.76 1hk9 s VAL 63 Ca 0.04 -1.48 -0.20 0.00 0.00 0.00 0.00 61.98 60.34 1hk9 s VAL 63 Cb -0.14 -2.28 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 1hk9 s VAL 63 CO -0.11 0.05 1.19 -2.16 0.00 0.00 0.00 175.10 174.07 1hk9 s PRO 64 N 1.16 3.24 0.39 2.72 0.04 -1.26 -1.48 135.00 139.82 1hk9 s PRO 64 Ca -0.06 1.78 0.27 0.00 0.04 0.00 0.00 61.00 63.03 1hk9 s PRO 64 Cb -0.19 -2.06 0.92 0.00 0.04 0.00 0.00 34.50 33.21 1hk9 s PRO 64 CO -0.06 -0.98 1.79 0.66 0.04 0.00 0.00 177.00 178.46 1hk9 h SER 65 N 1.23 0.00 -5.11 6.66 4.64 -1.64 -3.46 113.55 115.87 1hk9 h SER 65 Ca -0.50 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.76 1hk9 h SER 65 Cb 1.28 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.24 1hk9 h SER 65 CO 0.57 0.00 -0.15 0.00 -0.87 0.00 0.00 176.83 176.38 1hk9 s ARG 66 N -3.37 1.06 0.32 4.77 1.70 -1.26 -5.08 118.95 117.09 1hk9 s ARG 66 Ca 0.05 -0.82 -0.29 0.00 -0.47 0.00 0.00 55.73 54.20 1hk9 s ARG 66 Cb 0.09 0.44 -0.12 0.00 -0.57 0.00 0.00 34.95 34.78 1hk9 s ARG 66 CO 0.55 -0.40 1.37 -2.30 -1.08 0.00 0.00 175.30 173.44 1hk9 n PRO 67 N -0.20 2.22 -3.84 3.89 -0.02 -1.26 -4.99 135.00 130.80 1hk9 n PRO 67 Ca -0.14 0.78 -0.26 0.00 -2.02 0.00 0.00 63.50 61.86 1hk9 n PRO 67 Cb 0.63 -2.42 -0.17 0.00 -0.02 0.00 0.00 33.50 31.52 1hk9 n PRO 67 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1hk9 s VAL 68 N -0.76 0.77 0.60 -1.45 1.01 -1.26 -5.13 120.40 114.18 1hk9 s VAL 68 Ca 0.59 -0.23 -0.10 0.00 0.00 0.00 0.00 61.98 62.24 1hk9 s VAL 68 Cb -0.57 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 1hk9 s VAL 68 CO 0.58 0.24 0.99 -0.94 0.00 0.00 0.00 175.10 175.97 1hk9 s SER 69 N 1.80 6.18 -0.39 3.32 1.04 -1.26 -4.68 113.70 119.71 1hk9 s SER 69 Ca 0.04 1.30 -0.12 0.00 0.48 0.00 0.00 55.95 57.65 1hk9 s SER 69 Cb -0.13 -2.39 0.01 0.00 0.10 0.00 0.00 66.02 63.62 1hk9 s SER 69 CO -0.07 -0.85 0.41 1.41 0.98 0.00 0.00 173.24 175.12 1hk9 n HIS 70 N -2.67 -3.58 0.00 5.02 8.25 -1.26 -5.04 115.22 115.94 1hk9 n HIS 70 Ca 0.05 1.49 0.00 0.00 -0.26 0.00 0.00 57.72 59.00 1hk9 n HIS 70 Cb 0.54 -3.94 0.00 0.00 1.12 0.00 0.00 29.99 27.71 1hk9 n HIS 70 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70