#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfn n GLY 2 N 0.00 0.84 2.93 -0.72 0.00 -1.26 -5.08 105.19 101.91 1hfn n GLY 2 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1hfn n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfn s ALA 3 N -3.90 -1.23 -0.28 4.61 0.00 -1.26 -5.13 121.76 114.58 1hfn s ALA 3 Ca 0.00 0.83 -0.23 0.00 0.00 0.00 0.00 51.96 52.55 1hfn s ALA 3 Cb 0.00 -1.82 -0.00 0.00 0.00 0.00 0.00 23.12 21.30 1hfn s ALA 3 CO 0.00 -1.39 0.79 -1.12 0.00 0.00 0.00 175.76 174.04 1hfn s SER 4 N 2.57 6.71 -0.08 0.00 0.01 -1.26 -4.87 113.70 116.78 1hfn s SER 4 Ca 0.13 0.79 0.22 0.00 1.31 0.00 0.00 55.95 58.40 1hfn s SER 4 Cb -0.15 -2.41 0.41 0.00 0.21 0.00 0.00 66.02 64.08 1hfn s SER 4 CO -0.20 -0.56 1.15 1.87 0.41 0.00 0.00 173.24 175.92 1hfn n TRP 5 N 6.09 0.24 0.00 2.43 -0.00 -1.26 -4.82 117.44 120.12 1hfn n TRP 5 Ca 0.04 -0.96 0.00 0.00 -0.00 0.00 0.00 57.50 56.58 1hfn n TRP 5 Cb 0.48 -0.04 0.00 0.00 -0.00 0.00 0.00 31.31 31.75 1hfn n TRP 5 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 177.69 178.41 1hfn n HIS 6 N 0.09 0.00 -0.02 5.87 8.25 -1.26 -4.84 115.22 123.31 1hfn n HIS 6 Ca 0.02 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.37 1hfn n HIS 6 Cb 1.01 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 32.02 1hfn n HIS 6 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1hfn h ARG 7 N 0.00 -0.06 -6.23 -0.41 2.43 -2.02 -3.42 114.38 104.67 1hfn h ARG 7 Ca 0.00 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.62 1hfn h ARG 7 Cb 0.00 0.01 -0.09 0.00 -0.42 0.00 0.00 29.97 29.47 1hfn h ARG 7 CO 0.00 0.58 0.98 -1.25 -1.51 0.00 0.00 179.97 178.77 1hfn s PRO 8 N -2.81 3.19 -0.08 0.20 0.04 -1.26 -4.76 135.00 129.51 1hfn s PRO 8 Ca -0.14 -0.31 0.25 0.00 0.04 0.00 0.00 61.00 60.84 1hfn s PRO 8 Cb -0.01 -4.18 0.46 0.00 0.04 0.00 0.00 34.50 30.81 1hfn s PRO 8 CO 0.55 -2.08 1.15 -0.40 0.04 0.00 0.00 177.00 176.26 1hfn n ASP 9 N 9.09 1.20 -3.56 6.66 5.68 -1.26 -4.59 116.55 129.77 1hfn n ASP 9 Ca 0.02 -2.03 -0.29 0.00 -0.50 0.00 0.00 54.79 51.99 1hfn n ASP 9 Cb 0.48 -0.36 -0.15 0.00 -1.14 0.00 0.00 41.12 39.95 1hfn n ASP 9 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1hfn s LYS 10 N -1.24 0.24 0.23 0.11 -2.85 -1.26 -5.12 119.74 109.84 1hfn s LYS 10 Ca 0.32 -0.56 -0.03 0.00 -1.00 0.00 0.00 55.97 54.70 1hfn s LYS 10 Cb 0.37 -1.28 0.05 0.00 -2.06 0.00 0.00 37.83 34.91 1hfn s LYS 10 CO -0.13 -1.00 0.31 0.00 0.10 0.00 0.00 175.35 174.64 1hfn h LEU 13 N 6.33 0.38 0.00 0.00 3.38 -1.95 -3.42 115.31 120.04 1hfn h LEU 13 Ca -0.33 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 56.92 1hfn h LEU 13 Cb 1.17 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1hfn h LEU 13 CO 0.48 1.63 0.00 0.61 0.09 0.00 0.00 178.44 181.25 1hfn n GLY 14 N 1.84 3.78 3.63 0.83 0.00 -1.26 -4.99 105.19 109.02 1hfn n GLY 14 Ca -0.25 -2.10 -0.11 0.00 0.00 0.00 0.00 46.02 43.55 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 0.84 0.56 0.18 1.61 2.02 -1.26 -4.82 117.35 116.48 1hfn s TYR 15 Ca 0.00 -0.98 -0.13 0.00 -0.37 0.00 0.00 57.07 55.59 1hfn s TYR 15 Cb 0.00 0.32 0.12 0.00 -0.40 0.00 0.00 41.96 42.00 1hfn s TYR 15 CO 0.00 -1.27 1.79 0.37 -1.57 0.00 0.00 175.55 174.87 1hfn h GLN 16 N 2.09 0.52 -1.15 -0.62 5.75 0.33 -3.46 115.11 118.56 1hfn h GLN 16 Ca -0.29 -0.03 -0.42 0.00 -0.15 0.00 0.00 58.65 57.76 1hfn h GLN 16 Cb 1.25 -0.12 -0.16 0.00 1.07 0.00 0.00 27.48 29.52 1hfn h GLN 16 CO 0.38 0.34 -0.39 1.17 -2.65 0.00 0.00 178.83 177.68 1hfn n LYS 17 N -4.86 -1.47 -3.59 1.69 4.81 -1.26 -4.93 118.16 108.55 1hfn n LYS 17 Ca 0.04 1.20 -0.15 0.00 -0.87 0.00 0.00 58.31 58.53 1hfn n LYS 17 Cb 0.12 -5.60 -0.07 0.00 0.02 0.00 0.00 35.03 29.50 1hfn n LYS 17 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1hfn s ARG 18 N -3.82 0.91 -0.11 1.64 0.52 -1.26 -5.15 118.95 111.67 1hfn s ARG 18 Ca 0.00 0.75 -0.26 0.00 -0.52 0.00 0.00 55.73 55.70 1hfn s ARG 18 Cb 0.00 0.44 -0.02 0.00 0.52 0.00 0.00 34.95 35.89 1hfn s ARG 18 CO 0.00 -0.18 0.84 -1.25 0.02 0.00 0.00 175.30 174.74 1hfn s PRO 19 N -0.14 4.39 0.25 3.54 0.04 -1.26 -5.04 135.00 136.77 1hfn s PRO 19 Ca -0.04 1.08 0.09 0.00 0.04 0.00 0.00 61.00 62.18 1hfn s PRO 19 Cb -0.03 -3.52 -0.04 0.00 0.04 0.00 0.00 34.50 30.94 1hfn s PRO 19 CO 0.04 -0.19 0.01 -0.51 0.04 0.00 0.00 177.00 176.39 1hfn s LEU 20 N 1.63 3.24 0.14 -3.56 1.43 -1.26 -5.12 118.68 115.19 1hfn s LEU 20 Ca 0.41 -0.58 -0.27 0.00 -1.03 0.00 0.00 54.13 52.66 1hfn s LEU 20 Cb -0.18 -1.79 -0.07 0.00 0.03 0.00 0.00 46.19 44.18 1hfn s LEU 20 CO 0.17 0.02 0.84 -2.16 0.23 0.00 0.00 176.35 175.45 1hfn s PRO 21 N -3.55 4.64 0.00 1.29 0.04 -1.26 -4.94 135.00 131.22 1hfn s PRO 21 Ca 0.31 1.26 0.17 0.00 0.04 0.00 0.00 61.00 62.78 1hfn s PRO 21 Cb -0.07 -3.31 0.77 0.00 0.04 0.00 0.00 34.50 31.93 1hfn s PRO 21 CO 0.20 0.43 1.52 0.94 0.04 0.00 0.00 177.00 180.13 1hfn n GLN 22 N 2.06 0.10 -0.27 4.56 0.00 -1.26 -3.44 117.38 119.13 1hfn n GLN 22 Ca -0.03 0.18 0.04 0.00 -0.00 0.00 0.00 57.00 57.19 1hfn n GLN 22 Cb 0.49 -1.50 0.18 0.00 0.00 0.00 0.00 30.24 29.40 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 0.79 0.01 1.69 3.04 -2.03 -2.50 116.25 117.26 1hfn h VAL 23 Ca 0.00 -0.21 -0.31 0.00 -1.01 0.00 0.00 66.70 65.17 1hfn h VAL 23 Cb 0.24 0.13 -0.05 0.00 -2.01 0.00 0.00 31.29 29.60 1hfn h VAL 23 CO 0.00 0.11 -1.84 0.00 -1.01 0.00 0.00 177.57 174.83 1hfn n LEU 24 N -4.88 1.01 -4.69 3.16 -0.00 -1.22 -4.94 117.00 105.44 1hfn n LEU 24 Ca 0.14 0.33 -0.38 0.00 -0.00 0.00 0.00 56.01 56.10 1hfn n LEU 24 Cb 0.35 0.04 0.05 0.00 -0.00 0.00 0.00 43.42 43.85 1hfn n LEU 24 CO 0.23 0.47 0.80 -0.11 -0.00 0.00 0.00 177.39 178.77 1hfn n LEU 25 N -3.06 4.79 -0.01 1.47 7.94 -0.94 -0.75 117.00 126.44 1hfn n LEU 25 Ca -0.21 0.90 -0.01 0.00 -1.11 0.00 0.00 56.01 55.58 1hfn n LEU 25 Cb 1.06 -1.49 -0.00 0.00 0.53 0.00 0.00 43.42 43.51 1hfn n LEU 25 CO 0.44 -1.13 -0.10 -0.24 -1.11 0.00 0.00 177.39 175.24 1hfn n SER 26 N -0.95 0.46 -0.50 1.96 2.88 -1.12 -4.49 113.62 111.86 1hfn n SER 26 Ca 0.12 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1hfn n SER 26 Cb 0.46 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 1hfn n SER 26 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1hfn n SER 27 N -2.94 0.00 -3.74 -3.46 7.64 -0.93 -4.80 113.62 105.38 1hfn n SER 27 Ca -0.02 -0.50 -0.13 0.00 1.01 0.00 0.00 58.87 59.23 1hfn n SER 27 Cb 0.08 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.17 1hfn n SER 27 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1hfn s TRP 28 N -3.87 -0.43 -0.05 1.43 1.48 -1.26 -0.90 118.94 115.34 1hfn s TRP 28 Ca 0.00 1.04 0.06 0.00 -1.06 0.00 0.00 56.10 56.14 1hfn s TRP 28 Cb 0.00 0.15 -0.02 0.00 -1.16 0.00 0.00 33.47 32.44 1hfn s TRP 28 CO 0.00 -0.21 -0.22 1.52 -4.06 0.00 0.00 176.95 173.98 1hfn s TYR 29 N 0.30 2.49 0.41 1.66 1.13 -0.11 -3.59 117.35 119.64 1hfn s TYR 29 Ca -0.01 -0.51 -0.18 0.00 -1.41 0.00 0.00 57.07 54.96 1hfn s TYR 29 Cb -0.03 -1.59 -0.10 0.00 -1.10 0.00 0.00 41.96 39.14 1hfn s TYR 29 CO -0.01 -0.08 0.89 -1.25 -2.51 0.00 0.00 175.55 172.59 1hfn s PRO 30 N -0.38 4.09 0.39 -3.49 0.04 -1.26 -2.06 135.00 132.33 1hfn s PRO 30 Ca 0.03 0.93 0.03 0.00 0.04 0.00 0.00 61.00 62.03 1hfn s PRO 30 Cb -0.12 -2.25 0.03 0.00 0.04 0.00 0.00 34.50 32.20 1hfn s PRO 30 CO 0.02 -0.02 0.29 -2.37 0.04 0.00 0.00 177.00 174.96 1hfn n THR 31 N -0.75 0.00 -1.75 1.26 5.66 -1.17 -4.95 114.28 112.58 1hfn n THR 31 Ca 0.06 -1.54 -0.39 0.00 -3.05 0.00 0.00 64.05 59.13 1hfn n THR 31 Cb 0.54 -0.16 0.03 0.00 -1.55 0.00 0.00 70.33 69.19 1hfn n THR 31 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1hfn n SER 32 N -1.88 2.98 -2.33 1.09 7.64 -1.26 -4.85 113.62 115.01 1hfn n SER 32 Ca -0.02 1.04 -0.34 0.00 1.01 0.00 0.00 58.87 60.56 1hfn n SER 32 Cb 0.44 -1.59 0.07 0.00 -1.01 0.00 0.00 64.21 62.12 1hfn n SER 32 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1hfn n GLN 33 N -0.69 2.83 -2.73 1.43 -0.06 -1.26 -4.37 117.38 112.54 1hfn n GLN 33 Ca 0.08 -3.44 -0.02 0.00 -2.00 0.00 0.00 57.00 51.62 1hfn n GLN 33 Cb 0.43 -2.29 0.10 0.00 -4.06 0.00 0.00 30.24 24.42 1hfn n GLN 33 CO 0.00 0.00 0.00 1.47 -0.20 0.00 0.00 177.06 178.33 1hfn n LEU 34 N -0.86 -0.35 -1.49 1.69 -0.00 -1.26 -4.93 117.00 109.80 1hfn n LEU 34 Ca 0.59 -3.19 -0.13 0.00 -0.00 0.00 0.00 56.01 53.28 1hfn n LEU 34 Cb 0.67 0.23 0.11 0.00 -0.00 0.00 0.00 43.42 44.44 1hfn n LEU 34 CO 0.72 1.49 0.45 0.00 -0.00 0.00 0.00 177.39 180.05 1hfn n SER 36 N -0.93 0.00 -3.36 0.00 2.88 -1.26 -4.23 113.62 106.72 1hfn n SER 36 Ca 0.37 0.00 -0.26 0.00 -1.33 0.00 0.00 58.87 57.65 1hfn n SER 36 Cb 0.89 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 64.27 1hfn n SER 36 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1hfn n LYS 37 N 0.00 1.62 -2.09 -1.46 2.85 -1.26 -5.11 118.16 112.70 1hfn n LYS 37 Ca 0.00 -3.99 -0.28 0.00 -1.05 0.00 0.00 58.31 52.99 1hfn n LYS 37 Cb 0.00 -1.81 0.14 0.00 -0.65 0.00 0.00 35.03 32.72 1hfn n LYS 37 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1hfn s PRO 38 N -1.74 1.21 0.00 -1.58 0.04 -1.26 -4.65 135.00 127.02 1hfn s PRO 38 Ca 0.37 -0.46 0.00 0.00 0.04 0.00 0.00 61.00 60.94 1hfn s PRO 38 Cb 0.14 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.68 1hfn s PRO 38 CO -0.07 -1.97 0.00 0.41 0.04 0.00 0.00 177.00 175.41 1hfn n GLY 39 N -3.42 1.47 2.88 0.56 0.00 -1.26 -4.91 105.19 100.52 1hfn n GLY 39 Ca 0.13 0.02 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 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 0.68 0.13 -0.01 1.61 1.01 -1.02 -3.03 120.40 119.77 1hfn s VAL 40 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 61.98 61.87 1hfn s VAL 40 Cb 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 36.38 36.19 1hfn s VAL 40 CO 0.00 0.06 0.26 -0.63 0.00 0.00 0.00 175.10 174.79 1hfn s ILE 41 N 0.16 5.31 -0.23 2.22 1.09 -0.88 0.81 121.20 129.68 1hfn s ILE 41 Ca -0.01 0.23 -0.07 0.00 -1.10 0.00 0.00 60.65 59.70 1hfn s ILE 41 Cb -0.03 -3.55 -0.03 0.00 -1.06 0.00 0.00 42.46 37.78 1hfn s ILE 41 CO -0.00 0.42 0.06 -0.36 -0.10 0.00 0.00 174.94 174.96 1hfn s PHE 42 N -1.24 3.10 -0.55 3.97 0.40 0.28 -0.94 117.98 123.00 1hfn s PHE 42 Ca 0.25 -0.35 -0.18 0.00 -0.60 0.00 0.00 56.93 56.05 1hfn s PHE 42 Cb -0.13 -2.20 0.10 0.00 0.51 0.00 0.00 43.02 41.30 1hfn s PHE 42 CO 0.14 -0.27 0.63 -0.51 0.70 0.00 0.00 175.22 175.91 1hfn s LEU 43 N 1.36 5.45 1.09 -0.37 1.02 -0.08 -0.73 118.68 126.42 1hfn s LEU 43 Ca 0.05 -1.37 -0.12 0.00 0.02 0.00 0.00 54.13 52.71 1hfn s LEU 43 Cb -0.15 -2.31 0.24 0.00 0.02 0.00 0.00 46.19 44.00 1hfn s LEU 43 CO 0.03 -0.99 1.06 0.42 0.02 0.00 0.00 176.35 176.89 1hfn s THR 44 N 2.41 2.09 0.07 5.49 -4.23 -1.00 -2.19 115.64 118.28 1hfn s THR 44 Ca 0.10 0.03 -0.33 0.00 -1.18 0.00 0.00 61.69 60.32 1hfn s THR 44 Cb -0.24 -2.19 -0.18 0.00 1.34 0.00 0.00 72.50 71.23 1hfn s THR 44 CO 0.07 -0.04 1.63 0.11 -0.54 0.00 0.00 174.62 175.85 1hfn h LYS 45 N -2.34 -0.84 0.00 3.99 1.57 -1.17 -3.39 116.57 114.40 1hfn h LYS 45 Ca -0.57 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1hfn h LYS 45 Cb 1.32 0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.82 1hfn h LYS 45 CO 0.51 -0.56 0.00 -2.13 -0.57 0.00 0.00 179.45 176.70 1hfn n ARG 46 N -5.47 -0.30 0.00 3.15 0.63 -1.26 -5.00 116.66 108.41 1hfn n ARG 46 Ca -0.13 -0.33 0.00 0.00 -0.92 0.00 0.00 57.85 56.47 1hfn n ARG 46 Cb 0.36 -0.75 0.00 0.00 0.45 0.00 0.00 32.46 32.52 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 1.80 1.07 5.14 0.00 -1.26 -5.12 105.19 106.79 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 0.26 -2.37 1.61 5.12 -1.26 -4.91 116.66 115.10 1hfn n ARG 48 Ca 0.00 -0.80 -0.32 0.00 -1.93 0.00 0.00 57.85 54.80 1hfn n ARG 48 Cb 0.00 0.83 -0.03 0.00 -1.16 0.00 0.00 32.46 32.10 1hfn n ARG 48 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1hfn s GLN 49 N -2.17 3.91 -0.19 5.56 -0.21 -1.26 -2.38 119.66 122.92 1hfn s GLN 49 Ca 0.08 0.91 -0.04 0.00 0.02 0.00 0.00 55.36 56.32 1hfn s GLN 49 Cb -0.01 -2.14 0.09 0.00 1.00 0.00 0.00 33.01 31.95 1hfn s GLN 49 CO 0.05 -0.29 0.26 0.08 -2.12 0.00 0.00 175.29 173.28 1hfn s VAL 50 N -2.66 -0.39 0.00 1.09 1.01 0.09 -4.86 120.40 114.67 1hfn s VAL 50 Ca 0.58 0.00 -0.30 0.00 0.00 0.00 0.00 61.98 62.26 1hfn s VAL 50 Cb -0.10 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 1hfn s VAL 50 CO 0.33 -0.10 1.37 0.00 0.00 0.00 0.00 175.10 176.71 1hfn s ALA 52 N 2.29 -0.80 -0.10 0.00 0.00 0.24 0.10 121.76 123.49 1hfn s ALA 52 Ca 0.63 1.19 -0.30 0.00 0.00 0.00 0.00 51.96 53.49 1hfn s ALA 52 Cb -0.31 -1.03 -0.02 0.00 0.00 0.00 0.00 23.12 21.77 1hfn s ALA 52 CO 0.26 -0.54 1.11 -0.51 0.00 0.00 0.00 175.76 176.08 1hfn s ASP 53 N 2.13 7.13 0.62 0.00 1.01 -1.26 -2.43 116.67 123.86 1hfn s ASP 53 Ca -0.03 1.65 0.31 0.00 0.71 0.00 0.00 52.55 55.19 1hfn s ASP 53 Cb -0.11 -2.55 1.73 0.00 1.01 0.00 0.00 42.92 42.99 1hfn s ASP 53 CO -0.10 -0.55 2.06 0.07 0.21 0.00 0.00 175.17 176.86 1hfn h LYS 54 N 7.37 0.00 -0.16 8.23 2.10 -1.91 0.12 116.57 132.32 1hfn h LYS 54 Ca -0.31 0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.39 1hfn h LYS 54 Cb 1.14 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.46 1hfn h LYS 54 CO 0.89 0.00 0.15 0.66 -2.00 0.00 0.00 179.45 179.14 1hfn h SER 55 N 0.00 0.00 -1.67 7.07 4.64 -1.95 -3.32 113.55 118.31 1hfn h SER 55 Ca 0.07 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.27 1hfn h SER 55 Cb 0.57 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.74 1hfn h SER 55 CO -0.00 0.00 -0.06 0.29 -0.87 0.00 0.00 176.83 176.19 1hfn n LYS 56 N -4.06 -2.99 -0.07 4.77 5.02 0.03 -4.93 118.16 115.93 1hfn n LYS 56 Ca 0.01 -0.50 -0.07 0.00 -2.02 0.00 0.00 58.31 55.73 1hfn n LYS 56 Cb 0.27 -0.65 -0.02 0.00 -0.02 0.00 0.00 35.03 34.60 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 -3.98 1.54 0.25 4.39 2.03 -1.26 -3.79 116.55 115.72 1hfn n ASP 57 Ca 0.05 0.29 0.08 0.00 0.52 0.00 0.00 54.79 55.73 1hfn n ASP 57 Cb 0.21 -0.70 0.61 0.00 -0.72 0.00 0.00 41.12 40.52 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 -0.80 0.00 -0.05 -0.67 5.08 -1.95 -1.22 115.95 116.35 1hfn h TRP 58 Ca 0.00 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.80 1hfn h TRP 58 Cb 0.76 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.91 1hfn h TRP 58 CO -0.33 0.09 -0.73 0.28 -1.28 0.00 0.00 178.44 176.48 1hfn h VAL 59 N 0.00 1.42 -0.16 0.12 2.07 -1.86 -2.65 116.25 115.19 1hfn h VAL 59 Ca -0.00 -2.24 -0.01 0.00 0.82 0.00 0.00 66.70 65.28 1hfn h VAL 59 Cb 0.17 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 1hfn h VAL 59 CO 0.01 0.66 0.07 0.50 0.02 0.00 0.00 177.57 178.83 1hfn h LYS 60 N 0.17 0.23 -0.13 1.57 3.64 -1.33 -0.62 116.57 120.10 1hfn h LYS 60 Ca -0.02 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.28 1hfn h LYS 60 Cb 1.29 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 1hfn h LYS 60 CO 0.11 0.29 -0.09 1.57 -2.27 0.00 0.00 179.45 179.07 1hfn h LYS 61 N 0.12 0.20 0.36 1.90 2.10 -1.48 -2.39 116.57 117.38 1hfn h LYS 61 Ca 0.05 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.65 1hfn h LYS 61 Cb 0.14 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 1hfn h LYS 61 CO -0.01 0.31 -0.17 -0.07 -2.00 0.00 0.00 179.45 177.51 1hfn h LEU 62 N 0.20 -0.41 -0.82 7.07 3.38 -1.05 0.61 115.31 124.29 1hfn h LEU 62 Ca 0.04 -0.10 0.17 0.00 0.09 0.00 0.00 57.88 58.08 1hfn h LEU 62 Cb 0.29 0.11 -0.11 0.00 0.09 0.00 0.00 40.66 41.04 1hfn h LEU 62 CO 0.02 -0.13 0.35 0.24 0.09 0.00 0.00 178.44 179.01 1hfn h MET 63 N -0.70 0.44 -0.00 1.13 2.86 -0.84 1.00 114.93 118.82 1hfn h MET 63 Ca -0.05 -0.03 -0.18 0.00 -2.06 0.00 0.00 59.70 57.39 1hfn h MET 63 Cb 0.49 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.03 1hfn h MET 63 CO 0.08 0.29 -0.81 0.37 1.06 0.00 0.00 176.91 177.90 1hfn h GLN 64 N 0.46 0.11 -0.12 1.72 4.15 -1.31 -3.27 115.11 116.84 1hfn h GLN 64 Ca 0.47 -0.11 -0.06 0.00 0.77 0.00 0.00 58.65 59.72 1hfn h GLN 64 Cb 0.77 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.49 1hfn h GLN 64 CO -0.44 0.86 -0.15 1.96 -1.93 0.00 0.00 178.83 179.12 1hfn h GLN 65 N 0.06 0.32 -6.24 1.69 1.08 0.34 -3.44 115.11 108.92 1hfn h GLN 65 Ca -0.02 -0.18 -0.57 0.00 -1.45 0.00 0.00 58.65 56.43 1hfn h GLN 65 Cb 1.42 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.83 1hfn h GLN 65 CO 0.12 0.74 -0.25 -0.51 -0.95 0.00 0.00 178.83 177.97 1hfn s LEU 66 N -9.05 4.24 0.00 1.46 1.43 0.31 -5.06 118.68 112.02 1hfn s LEU 66 Ca -0.14 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 53.65 1hfn s LEU 66 Cb 0.05 -3.39 0.00 0.00 0.03 0.00 0.00 46.19 42.87 1hfn s LEU 66 CO 0.75 0.02 0.02 -0.81 0.23 0.00 0.00 176.35 176.56 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 -0.02 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1hfn n PRO 67 Cb 0.52 -0.58 0.00 0.00 -0.04 0.00 0.00 33.50 33.40 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 -0.69 0.00 -2.72 0.52 0.31 -1.26 -4.87 118.33 109.62 1hfn n VAL 68 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.07 1hfn n VAL 68 Cb 0.00 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.94 1hfn n VAL 68 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1hfn s THR 69 N -1.44 4.34 -0.13 2.52 -1.32 -1.24 -4.90 115.64 113.47 1hfn s THR 69 Ca 0.00 -0.09 -0.29 0.00 -1.21 0.00 0.00 61.69 60.09 1hfn s THR 69 Cb 0.00 -3.65 -0.02 0.00 -1.51 0.00 0.00 72.50 67.32 1hfn s THR 69 CO 0.00 -0.59 1.20 0.00 -2.21 0.00 0.00 174.62 173.02 1hfn s ALA 70 N -2.73 3.59 -2.00 11.08 0.00 -1.26 -4.94 121.76 125.50 1hfn s ALA 70 Ca 0.49 0.47 0.21 0.00 0.00 0.00 0.00 51.96 53.13 1hfn s ALA 70 Cb -0.10 -3.56 1.27 0.00 0.00 0.00 0.00 23.12 20.72 1hfn s ALA 70 CO 0.42 -0.98 1.65 2.89 0.00 0.00 0.00 175.76 179.74