#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfn s GLY 2 N 0.00 0.50 -0.30 -3.96 0.00 -1.26 -5.16 107.32 97.14 1hfn s GLY 2 Ca 0.00 -0.94 -0.16 0.00 0.00 0.00 0.00 44.72 43.62 1hfn s GLY 2 CO 0.00 -0.91 1.09 0.00 0.00 0.00 0.00 173.10 173.27 1hfn s ALA 3 N -3.96 -2.57 0.47 3.20 0.00 -1.26 -5.15 121.76 112.48 1hfn s ALA 3 Ca 0.16 2.07 0.00 0.00 0.00 0.00 0.00 51.96 54.20 1hfn s ALA 3 Cb 0.04 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.25 1hfn s ALA 3 CO -0.01 -0.52 0.00 0.45 0.00 0.00 0.00 175.76 175.68 1hfn n SER 4 N 3.87 -8.57 -0.06 0.00 2.88 -1.26 -4.82 113.62 105.66 1hfn n SER 4 Ca -0.15 0.99 -0.08 0.00 -1.33 0.00 0.00 58.87 58.30 1hfn n SER 4 Cb 0.56 -4.59 -0.08 0.00 -0.75 0.00 0.00 64.21 59.35 1hfn n SER 4 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 1hfn n TRP 5 N -4.29 0.00 -1.73 0.66 8.01 -1.26 -5.01 117.44 113.82 1hfn n TRP 5 Ca -0.04 0.00 -0.38 0.00 -1.31 0.00 0.00 57.50 55.77 1hfn n TRP 5 Cb 0.66 -0.57 0.05 0.00 -2.01 0.00 0.00 31.31 29.45 1hfn n TRP 5 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1hfn n HIS 6 N -2.65 2.15 -3.18 -5.99 8.25 -1.26 -4.98 115.22 107.56 1hfn n HIS 6 Ca -0.22 0.43 -0.22 0.00 -0.26 0.00 0.00 57.72 57.45 1hfn n HIS 6 Cb 0.83 -2.33 -0.05 0.00 1.12 0.00 0.00 29.99 29.56 1hfn n HIS 6 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1hfn n ARG 7 N -1.21 1.32 -2.69 -0.41 1.85 -1.26 -5.04 116.66 109.21 1hfn n ARG 7 Ca 0.12 -3.64 -0.43 0.00 -1.00 0.00 0.00 57.85 52.90 1hfn n ARG 7 Cb 0.45 -1.66 -0.00 0.00 -1.05 0.00 0.00 32.46 30.20 1hfn n ARG 7 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1hfn s PRO 8 N -2.14 4.02 0.30 2.89 0.04 -1.26 -4.89 135.00 133.96 1hfn s PRO 8 Ca 0.39 -2.17 -0.08 0.00 0.04 0.00 0.00 61.00 59.18 1hfn s PRO 8 Cb 0.26 -5.40 0.03 0.00 0.04 0.00 0.00 34.50 29.44 1hfn s PRO 8 CO -0.09 -2.11 0.54 -0.25 0.04 0.00 0.00 177.00 175.12 1hfn n ASP 9 N 7.58 -1.55 0.18 6.66 8.00 -1.26 -5.03 116.55 131.13 1hfn n ASP 9 Ca 0.45 -2.34 0.03 0.00 0.71 0.00 0.00 54.79 53.64 1hfn n ASP 9 Cb 0.45 2.65 0.35 0.00 -0.02 0.00 0.00 41.12 44.55 1hfn n ASP 9 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1hfn h LYS 10 N 0.00 0.00 0.00 -1.24 1.79 -2.01 -3.44 116.57 111.66 1hfn h LYS 10 Ca -0.25 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.12 1hfn h LYS 10 Cb 0.96 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 31.67 1hfn h LYS 10 CO 0.32 0.40 -0.05 0.00 -1.08 0.00 0.00 179.45 179.04 1hfn n LEU 13 N -2.89 0.00 0.00 0.00 7.94 -1.08 -4.70 117.00 116.27 1hfn n LEU 13 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1hfn n LEU 13 Cb 0.42 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.37 1hfn n LEU 13 CO 0.00 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 1hfn n GLY 14 N 0.00 2.36 3.69 -3.96 0.00 -1.26 -4.89 105.19 101.12 1hfn n GLY 14 Ca 0.00 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.86 1hfn n GLY 14 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hfn s TYR 15 N 1.72 0.45 0.25 1.61 2.02 -1.26 -4.68 117.35 117.47 1hfn s TYR 15 Ca 0.00 -0.94 -0.04 0.00 -0.37 0.00 0.00 57.07 55.72 1hfn s TYR 15 Cb 0.00 0.47 0.37 0.00 -0.40 0.00 0.00 41.96 42.40 1hfn s TYR 15 CO 0.00 -1.37 1.86 0.37 -1.57 0.00 0.00 175.55 174.85 1hfn h GLN 16 N 2.05 1.03 -1.22 -0.62 5.75 0.33 -3.46 115.11 118.97 1hfn h GLN 16 Ca -0.30 -0.06 -0.36 0.00 -0.15 0.00 0.00 58.65 57.78 1hfn h GLN 16 Cb 1.25 -0.23 -0.12 0.00 1.07 0.00 0.00 27.48 29.45 1hfn h GLN 16 CO 0.39 0.68 -0.36 1.17 -2.65 0.00 0.00 178.83 178.06 1hfn n LYS 17 N -4.57 -1.28 -3.62 1.69 4.81 -1.26 -4.93 118.16 109.00 1hfn n LYS 17 Ca 0.14 1.07 -0.06 0.00 -0.87 0.00 0.00 58.31 58.58 1hfn n LYS 17 Cb 0.19 -5.37 -0.06 0.00 0.02 0.00 0.00 35.03 29.81 1hfn n LYS 17 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1hfn s ARG 18 N -3.81 0.32 -0.07 1.64 1.70 -1.26 -5.15 118.95 112.31 1hfn s ARG 18 Ca 0.00 0.18 -0.26 0.00 -0.47 0.00 0.00 55.73 55.18 1hfn s ARG 18 Cb 0.00 0.15 -0.03 0.00 -0.57 0.00 0.00 34.95 34.50 1hfn s ARG 18 CO 0.00 -0.08 0.83 -1.25 -1.08 0.00 0.00 175.30 173.72 1hfn s PRO 19 N -0.62 4.44 0.27 3.89 0.04 -1.26 -5.07 135.00 136.70 1hfn s PRO 19 Ca 0.04 1.10 0.08 0.00 0.04 0.00 0.00 61.00 62.26 1hfn s PRO 19 Cb -0.02 -3.48 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1hfn s PRO 19 CO -0.06 -0.08 0.13 -0.51 0.04 0.00 0.00 177.00 176.52 1hfn s LEU 20 N 1.23 3.56 0.15 -3.56 1.43 -1.26 -5.11 118.68 115.12 1hfn s LEU 20 Ca 0.43 -0.43 -0.27 0.00 -1.03 0.00 0.00 54.13 52.83 1hfn s LEU 20 Cb -0.18 -2.09 -0.07 0.00 0.03 0.00 0.00 46.19 43.87 1hfn s LEU 20 CO 0.20 -0.06 0.84 -2.16 0.23 0.00 0.00 176.35 175.40 1hfn s PRO 21 N -3.80 4.64 0.00 1.29 0.04 -1.26 -4.94 135.00 130.98 1hfn s PRO 21 Ca 0.33 1.26 0.19 0.00 0.04 0.00 0.00 61.00 62.82 1hfn s PRO 21 Cb -0.07 -3.30 0.89 0.00 0.04 0.00 0.00 34.50 32.06 1hfn s PRO 21 CO 0.23 0.46 1.59 0.94 0.04 0.00 0.00 177.00 180.26 1hfn n GLN 22 N 1.95 0.15 -0.36 4.56 0.00 -1.26 -3.44 117.38 118.99 1hfn n GLN 22 Ca -0.03 0.14 0.06 0.00 -0.00 0.00 0.00 57.00 57.17 1hfn n GLN 22 Cb 0.49 -1.50 0.23 0.00 0.00 0.00 0.00 30.24 29.45 1hfn n GLN 22 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.06 176.82 1hfn h VAL 23 N 0.00 0.93 0.01 1.69 3.04 -2.03 -2.62 116.25 117.27 1hfn h VAL 23 Ca 0.00 -0.34 -0.34 0.00 -1.01 0.00 0.00 66.70 65.01 1hfn h VAL 23 Cb 0.24 -0.15 -0.06 0.00 -2.01 0.00 0.00 31.29 29.32 1hfn h VAL 23 CO 0.00 0.18 -2.07 0.00 -1.01 0.00 0.00 177.57 174.67 1hfn n LEU 24 N -4.62 0.75 -4.63 3.16 -0.00 -1.22 -4.97 117.00 105.47 1hfn n LEU 24 Ca 0.18 0.19 -0.38 0.00 -0.00 0.00 0.00 56.01 56.01 1hfn n LEU 24 Cb 0.34 0.16 0.06 0.00 -0.00 0.00 0.00 43.42 43.97 1hfn n LEU 24 CO 0.28 0.50 0.60 -0.11 -0.00 0.00 0.00 177.39 178.65 1hfn n LEU 25 N -2.96 4.08 0.01 1.47 7.94 -0.99 -0.74 117.00 125.80 1hfn n LEU 25 Ca -0.27 0.80 -0.01 0.00 -1.11 0.00 0.00 56.01 55.43 1hfn n LEU 25 Cb 1.09 -1.41 -0.00 0.00 0.53 0.00 0.00 43.42 43.63 1hfn n LEU 25 CO 0.43 -1.74 -0.06 -0.24 -1.11 0.00 0.00 177.39 174.67 1hfn n SER 26 N -0.97 0.46 -0.62 1.96 2.88 -1.09 -4.41 113.62 111.82 1hfn n SER 26 Ca 0.14 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 1hfn n SER 26 Cb 0.48 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.70 1hfn n SER 26 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1hfn n SER 27 N -2.93 0.00 -3.70 -3.46 3.41 -0.62 -4.75 113.62 101.57 1hfn n SER 27 Ca -0.01 -0.62 -0.13 0.00 -0.26 0.00 0.00 58.87 57.85 1hfn n SER 27 Cb 0.04 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.90 1hfn n SER 27 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 1hfn s TRP 28 N -3.54 -0.58 0.00 7.33 1.48 -1.26 -0.61 118.94 121.75 1hfn s TRP 28 Ca 0.00 1.38 0.06 0.00 -1.06 0.00 0.00 56.10 56.48 1hfn s TRP 28 Cb 0.00 0.21 -0.02 0.00 -1.16 0.00 0.00 33.47 32.51 1hfn s TRP 28 CO 0.00 -0.28 -0.19 1.52 -4.06 0.00 0.00 176.95 173.94 1hfn s TYR 29 N 0.41 1.67 0.33 1.66 1.13 0.61 -3.20 117.35 119.95 1hfn s TYR 29 Ca -0.01 -0.33 -0.23 0.00 -1.41 0.00 0.00 57.07 55.09 1hfn s TYR 29 Cb -0.04 -1.05 -0.10 0.00 -1.10 0.00 0.00 41.96 39.67 1hfn s TYR 29 CO -0.01 -0.00 0.89 -1.25 -2.51 0.00 0.00 175.55 172.67 1hfn s PRO 30 N -0.62 4.41 0.66 -3.49 0.04 -1.26 -0.46 135.00 134.28 1hfn s PRO 30 Ca 0.07 1.15 0.04 0.00 0.04 0.00 0.00 61.00 62.30 1hfn s PRO 30 Cb -0.07 -2.66 0.11 0.00 0.04 0.00 0.00 34.50 31.92 1hfn s PRO 30 CO -0.00 0.23 0.91 -0.08 0.04 0.00 0.00 177.00 178.10 1hfn s THR 31 N -1.74 2.10 0.46 1.26 -1.32 -1.14 -4.89 115.64 110.37 1hfn s THR 31 Ca 0.51 -0.78 -0.24 0.00 -1.21 0.00 0.00 61.69 59.97 1hfn s THR 31 Cb -0.16 -2.32 -0.08 0.00 -1.51 0.00 0.00 72.50 68.43 1hfn s THR 31 CO 0.21 0.00 1.35 -1.20 -2.21 0.00 0.00 174.62 172.76 1hfn n SER 32 N -2.59 2.85 0.04 8.08 7.64 -1.26 -4.75 113.62 123.63 1hfn n SER 32 Ca 0.16 1.08 -0.04 0.00 1.01 0.00 0.00 58.87 61.08 1hfn n SER 32 Cb 0.61 -1.56 -0.09 0.00 -1.01 0.00 0.00 64.21 62.16 1hfn n SER 32 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 1hfn h GLN 33 N 2.01 0.00 -0.27 1.43 4.15 -1.96 -3.32 115.11 117.14 1hfn h GLN 33 Ca -0.50 0.00 0.08 0.00 0.77 0.00 0.00 58.65 59.00 1hfn h GLN 33 Cb 1.29 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.97 1hfn h GLN 33 CO 0.60 0.54 0.30 -0.07 -1.93 0.00 0.00 178.83 178.27 1hfn h LEU 34 N 0.00 0.00 -9.99 -2.39 4.07 -2.02 -3.43 115.31 101.54 1hfn h LEU 34 Ca -0.15 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 57.26 1hfn h LEU 34 Cb 1.74 0.00 0.14 0.00 1.08 0.00 0.00 40.66 43.61 1hfn h LEU 34 CO 0.08 0.00 0.59 0.00 -1.08 0.00 0.00 178.44 178.02 1hfn h SER 36 N 1.62 1.00 -2.65 0.00 0.87 -1.93 -3.29 113.55 109.17 1hfn h SER 36 Ca -0.50 -0.05 -0.61 0.00 -1.23 0.00 0.00 61.79 59.40 1hfn h SER 36 Cb 1.30 -0.25 -0.41 0.00 -0.44 0.00 0.00 62.40 62.59 1hfn h SER 36 CO 0.58 0.76 -0.67 1.17 -0.53 0.00 0.00 176.83 178.14 1hfn n LYS 37 N -4.37 1.76 -2.06 2.24 3.00 -1.26 -5.08 118.16 112.39 1hfn n LYS 37 Ca 0.09 -4.30 -0.28 0.00 -0.00 0.00 0.00 58.31 53.83 1hfn n LYS 37 Cb 0.06 -2.13 0.13 0.00 0.00 0.00 0.00 35.03 33.09 1hfn n LYS 37 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1hfn s PRO 38 N -1.57 1.37 0.00 1.64 0.04 -1.24 -2.63 135.00 132.60 1hfn s PRO 38 Ca 0.31 -0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.00 1hfn s PRO 38 Cb 0.04 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1hfn s PRO 38 CO -0.12 -1.89 0.00 0.41 0.04 0.00 0.00 177.00 175.44 1hfn n GLY 39 N -3.39 -0.54 3.30 0.56 0.00 -1.26 -4.86 105.19 98.99 1hfn n GLY 39 Ca 0.12 0.24 -0.13 0.00 0.00 0.00 0.00 46.02 46.25 1hfn n GLY 39 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfn s VAL 40 N 0.00 -0.00 -0.13 1.61 1.01 -0.90 -2.89 120.40 119.10 1hfn s VAL 40 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 1hfn s VAL 40 Cb 0.00 -0.57 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 1hfn s VAL 40 CO 0.00 0.00 0.19 -0.63 0.00 0.00 0.00 175.10 174.66 1hfn s ILE 41 N 0.23 5.40 -0.27 2.22 1.09 0.39 -0.02 121.20 130.24 1hfn s ILE 41 Ca -0.00 0.33 -0.13 0.00 -1.10 0.00 0.00 60.65 59.75 1hfn s ILE 41 Cb -0.03 -3.49 -0.04 0.00 -1.06 0.00 0.00 42.46 37.84 1hfn s ILE 41 CO 0.00 0.53 0.28 -0.36 -0.10 0.00 0.00 174.94 175.30 1hfn s PHE 42 N -0.45 3.24 -0.56 3.97 0.40 0.11 -0.29 117.98 124.39 1hfn s PHE 42 Ca 0.14 0.27 -0.18 0.00 -0.60 0.00 0.00 56.93 56.57 1hfn s PHE 42 Cb -0.12 -2.47 0.10 0.00 0.51 0.00 0.00 43.02 41.04 1hfn s PHE 42 CO 0.04 -0.19 0.62 -0.51 0.70 0.00 0.00 175.22 175.88 1hfn s LEU 43 N 1.89 5.57 1.00 -0.37 1.43 0.22 -1.74 118.68 126.68 1hfn s LEU 43 Ca 0.11 -1.47 -0.12 0.00 -1.03 0.00 0.00 54.13 51.63 1hfn s LEU 43 Cb -0.16 -2.29 0.19 0.00 0.03 0.00 0.00 46.19 43.97 1hfn s LEU 43 CO 0.10 -1.00 1.08 0.42 0.23 0.00 0.00 176.35 177.19 1hfn s THR 44 N 2.33 2.28 0.08 5.49 -4.23 -1.05 -1.58 115.64 118.95 1hfn s THR 44 Ca 0.09 0.09 -0.33 0.00 -1.18 0.00 0.00 61.69 60.36 1hfn s THR 44 Cb -0.25 -2.33 -0.17 0.00 1.34 0.00 0.00 72.50 71.08 1hfn s THR 44 CO 0.06 -0.12 1.61 0.11 -0.54 0.00 0.00 174.62 175.75 1hfn h LYS 45 N -2.02 -0.86 0.00 3.99 1.57 -1.14 -3.38 116.57 114.73 1hfn h LYS 45 Ca -0.53 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1hfn h LYS 45 Cb 1.30 0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.81 1hfn h LYS 45 CO 0.51 -0.57 0.00 -2.13 -0.57 0.00 0.00 179.45 176.68 1hfn n ARG 46 N -5.50 -0.22 0.00 3.15 0.63 -1.26 -4.99 116.66 108.47 1hfn n ARG 46 Ca -0.12 -0.36 0.00 0.00 -0.92 0.00 0.00 57.85 56.45 1hfn n ARG 46 Cb 0.39 -0.75 0.00 0.00 0.45 0.00 0.00 32.46 32.54 1hfn n ARG 46 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1hfn n GLY 47 N -0.03 1.64 1.15 5.14 0.00 -1.26 -5.12 105.19 106.71 1hfn n GLY 47 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1hfn n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hfn n ARG 48 N 0.00 0.28 -3.05 1.61 1.74 -1.26 -4.92 116.66 111.06 1hfn n ARG 48 Ca 0.00 -0.85 -0.31 0.00 -0.77 0.00 0.00 57.85 55.92 1hfn n ARG 48 Cb 0.00 0.90 -0.04 0.00 -1.02 0.00 0.00 32.46 32.30 1hfn n ARG 48 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1hfn s GLN 49 N -2.18 3.81 -0.13 5.56 -0.21 -1.26 -2.53 119.66 122.72 1hfn s GLN 49 Ca 0.08 0.42 -0.05 0.00 0.02 0.00 0.00 55.36 55.83 1hfn s GLN 49 Cb -0.01 -2.46 0.06 0.00 1.00 0.00 0.00 33.01 31.60 1hfn s GLN 49 CO 0.06 0.08 0.26 0.08 -2.12 0.00 0.00 175.29 173.65 1hfn s VAL 50 N -2.19 -0.40 0.04 1.09 1.01 -0.71 -4.88 120.40 114.36 1hfn s VAL 50 Ca 0.50 0.28 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 1hfn s VAL 50 Cb -0.10 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.78 1hfn s VAL 50 CO 0.27 0.12 1.22 0.00 0.00 0.00 0.00 175.10 176.71 1hfn s ALA 52 N 1.32 -1.53 1.09 0.00 0.00 0.97 0.10 121.76 123.71 1hfn s ALA 52 Ca 0.59 2.02 -0.10 0.00 0.00 0.00 0.00 51.96 54.46 1hfn s ALA 52 Cb -0.29 -1.20 0.15 0.00 0.00 0.00 0.00 23.12 21.78 1hfn s ALA 52 CO 0.28 -0.33 0.61 -0.25 0.00 0.00 0.00 175.76 176.07 1hfn n ASP 53 N 4.11 -1.09 -0.03 0.00 8.00 -1.26 -2.11 116.55 124.17 1hfn n ASP 53 Ca -0.20 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.33 1hfn n ASP 53 Cb 0.57 -0.53 -0.10 0.00 -0.02 0.00 0.00 41.12 41.05 1hfn n ASP 53 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1hfn n LYS 54 N -3.02 1.25 0.16 -1.24 4.01 -1.26 -4.47 118.16 113.60 1hfn n LYS 54 Ca 0.08 -0.06 0.19 0.00 -0.51 0.00 0.00 58.31 58.01 1hfn n LYS 54 Cb 0.31 -1.30 0.79 0.00 -0.51 0.00 0.00 35.03 34.32 1hfn n LYS 54 CO 0.00 0.00 0.00 0.77 -1.11 0.00 0.00 177.40 177.06 1hfn h SER 55 N 0.00 0.00 -1.60 4.39 0.02 -1.99 -3.39 113.55 110.98 1hfn h SER 55 Ca -0.16 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.67 1hfn h SER 55 Cb 1.16 0.00 0.07 0.00 0.14 0.00 0.00 62.40 63.77 1hfn h SER 55 CO 0.01 0.00 -0.06 0.29 -1.14 0.00 0.00 176.83 175.93 1hfn n LYS 56 N -3.63 -2.83 -0.07 3.45 5.02 -1.26 -5.00 118.16 113.84 1hfn n LYS 56 Ca 0.04 -0.47 -0.14 0.00 -2.02 0.00 0.00 58.31 55.71 1hfn n LYS 56 Cb 0.48 -0.63 -0.05 0.00 -0.02 0.00 0.00 35.03 34.82 1hfn n LYS 56 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1hfn n ASP 57 N -3.80 1.14 0.20 4.39 2.03 -1.26 -4.24 116.55 115.01 1hfn n ASP 57 Ca 0.04 0.15 0.06 0.00 0.52 0.00 0.00 54.79 55.56 1hfn n ASP 57 Cb 0.19 -0.39 0.44 0.00 -0.72 0.00 0.00 41.12 40.65 1hfn n ASP 57 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 1hfn h TRP 58 N -0.45 0.00 -0.02 -0.67 5.08 -1.95 -2.53 115.95 115.41 1hfn h TRP 58 Ca -0.34 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.43 1hfn h TRP 58 Cb 1.32 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.47 1hfn h TRP 58 CO -0.04 0.31 -0.82 0.28 -1.28 0.00 0.00 178.44 176.89 1hfn h VAL 59 N 0.00 1.45 -0.50 0.12 2.07 -1.87 -2.90 116.25 114.62 1hfn h VAL 59 Ca -0.00 -2.42 -0.04 0.00 0.82 0.00 0.00 66.70 65.06 1hfn h VAL 59 Cb 0.64 2.33 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 1hfn h VAL 59 CO 0.04 0.71 0.16 0.50 0.02 0.00 0.00 177.57 179.01 1hfn h LYS 60 N 0.16 0.77 -0.58 1.57 3.64 -1.64 -1.04 116.57 119.45 1hfn h LYS 60 Ca -0.04 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.16 1hfn h LYS 60 Cb 1.42 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 33.10 1hfn h LYS 60 CO 0.13 0.72 0.29 -0.22 -2.27 0.00 0.00 179.45 178.10 1hfn h LYS 61 N 0.67 0.84 -0.60 1.90 3.64 -1.50 -2.58 116.57 118.94 1hfn h LYS 61 Ca 0.16 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1hfn h LYS 61 Cb 0.26 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1hfn h LYS 61 CO -0.01 0.67 0.35 -0.07 -2.27 0.00 0.00 179.45 178.12 1hfn h LEU 62 N 0.79 0.74 -1.26 5.20 3.38 -1.29 0.34 115.31 123.21 1hfn h LEU 62 Ca 0.20 -0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.26 1hfn h LEU 62 Cb 0.10 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.59 1hfn h LEU 62 CO -0.03 0.60 0.59 0.24 0.09 0.00 0.00 178.44 179.93 1hfn h MET 63 N 0.82 0.65 0.04 1.13 2.86 -0.82 0.91 114.93 120.52 1hfn h MET 63 Ca 0.21 -0.04 -0.27 0.00 -2.06 0.00 0.00 59.70 57.54 1hfn h MET 63 Cb 0.01 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.49 1hfn h MET 63 CO -0.04 0.43 -1.42 0.37 1.06 0.00 0.00 176.91 177.31 1hfn h GLN 64 N 0.67 0.08 -0.32 1.72 4.15 -1.05 -3.34 115.11 117.03 1hfn h GLN 64 Ca 0.48 -0.14 -0.17 0.00 0.77 0.00 0.00 58.65 59.58 1hfn h GLN 64 Cb 0.82 0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.56 1hfn h GLN 64 CO -0.23 0.87 -0.49 1.96 -1.93 0.00 0.00 178.83 179.01 1hfn h GLN 65 N 0.02 0.87 -5.98 1.69 1.08 0.13 -3.44 115.11 109.49 1hfn h GLN 65 Ca -0.18 -0.52 -0.60 0.00 -1.45 0.00 0.00 58.65 55.90 1hfn h GLN 65 Cb 1.93 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 29.37 1hfn h GLN 65 CO 0.12 1.16 -0.50 -0.51 -0.95 0.00 0.00 178.83 178.15 1hfn s LEU 66 N -8.73 4.29 0.00 1.46 1.43 0.30 -5.06 118.68 112.37 1hfn s LEU 66 Ca -0.10 0.21 0.00 0.00 -1.03 0.00 0.00 54.13 53.20 1hfn s LEU 66 Cb 0.11 -2.89 0.00 0.00 0.03 0.00 0.00 46.19 43.44 1hfn s LEU 66 CO 0.88 0.14 0.04 -0.81 0.23 0.00 0.00 176.35 176.83 1hfn n PRO 67 N 0.07 0.00 0.00 1.29 -0.04 -1.26 -4.70 135.00 130.36 1hfn n PRO 67 Ca -0.06 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1hfn n PRO 67 Cb 0.52 -0.60 0.00 0.00 -0.04 0.00 0.00 33.50 33.38 1hfn n PRO 67 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1hfn n VAL 68 N -0.68 0.00 -1.73 0.52 0.31 -1.26 -4.90 118.33 110.59 1hfn n VAL 68 Ca 0.00 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 1hfn n VAL 68 Cb 0.00 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.00 1hfn n VAL 68 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1hfn s THR 69 N -2.00 2.25 0.31 2.52 -4.23 -1.19 -4.81 115.64 108.48 1hfn s THR 69 Ca 0.00 0.15 -0.05 0.00 -1.18 0.00 0.00 61.69 60.60 1hfn s THR 69 Cb 0.00 -2.97 0.08 0.00 1.34 0.00 0.00 72.50 70.95 1hfn s THR 69 CO 0.00 -0.04 0.31 0.00 -0.54 0.00 0.00 174.62 174.35 1hfn n ALA 70 N -2.03 -0.79 0.34 3.99 0.00 -1.26 -5.08 120.51 115.68 1hfn n ALA 70 Ca 0.15 -0.44 0.04 0.00 0.00 0.00 0.00 53.44 53.19 1hfn n ALA 70 Cb 0.49 -0.03 0.03 0.00 0.00 0.00 0.00 19.45 19.95 1hfn n ALA 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04