#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 0.53 3.22 -3.96 0.00 -1.26 -5.08 105.19 98.64 1hfn n GLY 2 Ca 0.00 -0.37 0.04 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.53 -3.26 -0.08 4.61 0.00 -1.26 -5.05 121.76 114.19 1hfn s ALA 3 Ca 0.00 1.66 0.03 0.00 0.00 0.00 0.00 51.96 53.65 1hfn s ALA 3 Cb 0.00 -2.35 0.10 0.00 0.00 0.00 0.00 23.12 20.87 1hfn s ALA 3 CO 0.00 -1.22 1.00 0.45 0.00 0.00 0.00 175.76 176.00 1hfn n SER 4 N 5.13 -0.96 -3.71 0.00 2.88 -1.26 -5.11 113.62 110.59 1hfn n SER 4 Ca -0.08 -1.79 -0.14 0.00 -1.33 0.00 0.00 58.87 55.54 1hfn n SER 4 Cb 0.54 0.35 -0.14 0.00 -0.75 0.00 0.00 64.21 64.21 1hfn n SER 4 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1hfn s TRP 5 N 0.03 -0.29 -0.14 0.66 -0.00 -1.26 -5.09 118.94 112.85 1hfn s TRP 5 Ca 0.02 0.73 -0.05 0.00 -0.00 0.00 0.00 56.10 56.80 1hfn s TRP 5 Cb 0.11 -0.06 -0.04 0.00 -0.00 0.00 0.00 33.47 33.49 1hfn s TRP 5 CO -0.03 -0.26 0.04 -1.58 -0.00 0.00 0.00 176.95 175.13 1hfn s HIS 6 N 1.71 3.25 -0.03 5.86 2.46 -1.26 -5.03 115.29 122.25 1hfn s HIS 6 Ca -0.05 0.13 -0.24 0.00 0.47 0.00 0.00 55.06 55.37 1hfn s HIS 6 Cb -0.11 -1.96 -0.18 0.00 -0.13 0.00 0.00 32.58 30.20 1hfn s HIS 6 CO -0.07 0.30 1.11 0.00 -2.47 0.00 0.00 174.74 173.60 1hfn h ARG 7 N 6.03 -0.19 -6.03 2.88 3.08 -2.06 -3.38 114.38 114.70 1hfn h ARG 7 Ca -0.43 0.01 -0.62 0.00 0.07 0.00 0.00 59.98 59.02 1hfn h ARG 7 Cb 1.18 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 31.18 1hfn h ARG 7 CO 0.63 0.23 1.58 -1.25 -1.07 0.00 0.00 179.97 180.10 1hfn s PRO 8 N -4.04 3.65 -0.25 0.04 0.04 -1.26 -4.97 135.00 128.22 1hfn s PRO 8 Ca -0.14 -1.28 -0.29 0.00 0.04 0.00 0.00 61.00 59.33 1hfn s PRO 8 Cb 0.01 -5.37 0.01 0.00 0.04 0.00 0.00 34.50 29.19 1hfn s PRO 8 CO 0.56 -2.20 1.06 -0.51 0.04 0.00 0.00 177.00 175.95 1hfn s ASP 9 N 4.82 7.06 -0.08 6.66 1.01 -1.26 -4.78 116.67 130.09 1hfn s ASP 9 Ca 0.47 1.32 0.03 0.00 0.71 0.00 0.00 52.55 55.08 1hfn s ASP 9 Cb 0.00 -2.54 0.10 0.00 1.01 0.00 0.00 42.92 41.49 1hfn s ASP 9 CO -0.07 -0.72 0.83 1.17 0.21 0.00 0.00 175.17 176.59 1hfn n LYS 10 N 6.45 0.34 -0.13 8.23 4.81 -1.26 -5.15 118.16 131.44 1hfn n LYS 10 Ca 0.12 -0.68 -0.09 0.00 -0.87 0.00 0.00 58.31 56.79 1hfn n LYS 10 Cb 0.46 0.41 0.08 0.00 0.02 0.00 0.00 35.03 36.01 1hfn n LYS 10 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1hfn n LEU 13 N -0.28 2.14 0.00 0.00 4.77 -1.26 -4.58 117.00 117.78 1hfn n LEU 13 Ca -0.08 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.75 1hfn n LEU 13 Cb 0.59 -0.09 0.04 0.00 -2.33 0.00 0.00 43.42 41.63 1hfn n LEU 13 CO 0.35 0.39 0.21 0.61 -1.33 0.00 0.00 177.39 177.62 1hfn n GLY 14 N 3.21 2.16 3.34 -0.72 0.00 -1.26 -5.03 105.19 106.89 1hfn n GLY 14 Ca -0.05 -2.21 -0.18 0.00 0.00 0.00 0.00 46.02 43.58 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 -1.68 1.55 0.23 1.61 1.51 -1.26 -4.72 117.35 114.60 1hfn s TYR 15 Ca 0.39 -1.56 -0.07 0.00 -1.01 0.00 0.00 57.07 54.82 1hfn s TYR 15 Cb -0.03 -0.53 0.27 0.00 -0.11 0.00 0.00 41.96 41.56 1hfn s TYR 15 CO 0.25 -0.95 1.87 0.37 -1.11 0.00 0.00 175.55 175.98 1hfn h GLN 16 N 2.13 1.01 -0.99 -0.62 5.75 -0.32 -3.46 115.11 118.61 1hfn h GLN 16 Ca -0.26 -0.06 -0.34 0.00 -0.15 0.00 0.00 58.65 57.84 1hfn h GLN 16 Cb 1.23 -0.23 -0.12 0.00 1.07 0.00 0.00 27.48 29.44 1hfn h GLN 16 CO 0.37 0.67 -0.32 1.63 -2.65 0.00 0.00 178.83 178.53 1hfn n LYS 17 N -4.57 -1.18 -3.62 1.69 4.76 -1.26 -4.94 118.16 109.05 1hfn n LYS 17 Ca 0.11 1.05 -0.06 0.00 -2.87 0.00 0.00 58.31 56.54 1hfn n LYS 17 Cb 0.10 -5.29 -0.05 0.00 -1.84 0.00 0.00 35.03 27.96 1hfn n LYS 17 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1hfn s ARG 18 N -3.59 0.33 0.02 1.97 1.70 -1.26 -5.16 118.95 112.96 1hfn s ARG 18 Ca 0.00 0.14 -0.27 0.00 -0.47 0.00 0.00 55.73 55.13 1hfn s ARG 18 Cb 0.00 0.16 -0.04 0.00 -0.57 0.00 0.00 34.95 34.49 1hfn s ARG 18 CO 0.00 -0.09 0.84 -1.25 -1.08 0.00 0.00 175.30 173.72 1hfn s PRO 19 N -0.80 4.53 0.26 3.89 0.04 -1.26 -5.06 135.00 136.60 1hfn s PRO 19 Ca 0.04 1.19 0.09 0.00 0.04 0.00 0.00 61.00 62.35 1hfn s PRO 19 Cb -0.02 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.07 1hfn s PRO 19 CO -0.05 0.12 0.05 -0.51 0.04 0.00 0.00 177.00 176.66 1hfn s LEU 20 N 0.47 3.37 0.04 -3.56 1.43 -1.26 -5.11 118.68 114.07 1hfn s LEU 20 Ca 0.44 -0.53 -0.26 0.00 -1.03 0.00 0.00 54.13 52.75 1hfn s LEU 20 Cb -0.20 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 1hfn s LEU 20 CO 0.24 -0.01 0.79 -2.16 0.23 0.00 0.00 176.35 175.45 1hfn s PRO 21 N -3.70 4.52 0.00 1.29 0.04 -1.26 -4.94 135.00 130.95 1hfn s PRO 21 Ca 0.32 1.11 0.21 0.00 0.04 0.00 0.00 61.00 62.68 1hfn s PRO 21 Cb -0.07 -3.37 0.98 0.00 0.04 0.00 0.00 34.50 32.08 1hfn s PRO 21 CO 0.21 0.25 1.66 0.94 0.04 0.00 0.00 177.00 180.10 1hfn n GLN 22 N 2.90 0.19 0.22 4.56 7.27 -1.26 -3.44 117.38 127.82 1hfn n GLN 22 Ca -0.01 0.11 0.18 0.00 0.07 0.00 0.00 57.00 57.35 1hfn n GLN 22 Cb 0.50 -1.50 0.79 0.00 2.41 0.00 0.00 30.24 32.44 1hfn n GLN 22 CO 0.00 0.00 0.00 -0.24 0.07 0.00 0.00 177.06 176.89 1hfn h VAL 23 N 0.00 0.20 0.00 1.69 3.04 -2.05 -1.89 116.25 117.24 1hfn h VAL 23 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1hfn h VAL 23 Cb 0.25 0.68 0.00 0.00 -2.01 0.00 0.00 31.29 30.21 1hfn h VAL 23 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.56 1hfn n LEU 24 N -3.33 0.71 -4.83 3.16 -0.00 -1.22 -5.07 117.00 106.42 1hfn n LEU 24 Ca 0.02 -0.71 -0.29 0.00 -0.00 0.00 0.00 56.01 55.03 1hfn n LEU 24 Cb 0.48 0.00 0.15 0.00 -0.00 0.00 0.00 43.42 44.05 1hfn n LEU 24 CO 0.21 0.18 0.77 -0.22 -0.00 0.00 0.00 177.39 178.32 1hfn s LEU 25 N -0.02 2.15 0.05 1.47 2.96 -0.71 -1.16 118.68 123.42 1hfn s LEU 25 Ca 0.00 0.68 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1hfn s LEU 25 Cb 0.00 -2.89 0.00 0.00 0.50 0.00 0.00 46.19 43.80 1hfn s LEU 25 CO 0.00 -2.66 0.00 -0.24 -1.32 0.00 0.00 176.35 172.13 1hfn n SER 26 N -3.79 0.13 -0.52 3.68 2.88 -1.09 -4.40 113.62 110.51 1hfn n SER 26 Ca 0.10 0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 1hfn n SER 26 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 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 -2.76 0.00 -3.76 -3.46 7.64 -1.18 -4.80 113.62 105.31 1hfn n SER 27 Ca 0.00 -0.52 -0.13 0.00 1.01 0.00 0.00 58.87 59.23 1hfn n SER 27 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 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 -5.04 -0.36 -0.07 1.43 1.48 -1.26 -1.30 118.94 113.81 1hfn s TRP 28 Ca 0.00 0.87 0.03 0.00 -1.06 0.00 0.00 56.10 55.94 1hfn s TRP 28 Cb 0.00 0.12 -0.02 0.00 -1.16 0.00 0.00 33.47 32.41 1hfn s TRP 28 CO 0.00 -0.18 -0.15 1.52 -4.06 0.00 0.00 176.95 174.08 1hfn s TYR 29 N 0.29 2.70 0.57 1.66 1.13 -0.48 -2.75 117.35 120.47 1hfn s TYR 29 Ca -0.01 -0.37 -0.10 0.00 -1.41 0.00 0.00 57.07 55.18 1hfn s TYR 29 Cb -0.03 -1.69 -0.04 0.00 -1.10 0.00 0.00 41.96 39.10 1hfn s TYR 29 CO -0.01 0.02 0.95 -1.25 -2.51 0.00 0.00 175.55 172.76 1hfn s PRO 30 N -0.34 3.62 0.28 -3.49 0.04 -1.26 -2.39 135.00 131.47 1hfn s PRO 30 Ca 0.03 0.62 0.00 0.00 0.04 0.00 0.00 61.00 61.69 1hfn s PRO 30 Cb -0.13 -2.17 -0.00 0.00 0.04 0.00 0.00 34.50 32.24 1hfn s PRO 30 CO 0.02 -0.43 0.01 -2.37 0.04 0.00 0.00 177.00 174.27 1hfn n THR 31 N -2.46 0.00 -1.82 1.26 5.66 -1.26 -4.94 114.28 110.72 1hfn n THR 31 Ca 0.05 -1.35 -0.41 0.00 -3.05 0.00 0.00 64.05 59.28 1hfn n THR 31 Cb 0.54 0.28 -0.01 0.00 -1.55 0.00 0.00 70.33 69.59 1hfn n THR 31 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1hfn s SER 32 N -2.56 6.41 -0.68 1.09 0.01 -1.26 -4.90 113.70 111.80 1hfn s SER 32 Ca 0.01 2.94 -0.02 0.00 1.31 0.00 0.00 55.95 60.19 1hfn s SER 32 Cb 0.00 -2.64 0.41 0.00 0.21 0.00 0.00 66.02 64.00 1hfn s SER 32 CO 0.01 -0.86 2.05 0.00 0.41 0.00 0.00 173.24 174.84 1hfn n GLN 33 N 1.63 2.64 -2.69 12.44 10.64 -1.26 -4.37 117.38 136.42 1hfn n GLN 33 Ca 0.06 -3.21 -0.07 0.00 -1.83 0.00 0.00 57.00 51.95 1hfn n GLN 33 Cb 0.38 -2.24 0.09 0.00 -0.86 0.00 0.00 30.24 27.61 1hfn n GLN 33 CO 0.00 0.00 0.00 1.47 -1.83 0.00 0.00 177.06 176.70 1hfn n LEU 34 N -0.75 -0.46 -1.04 2.61 -0.00 -1.26 -4.92 117.00 111.18 1hfn n LEU 34 Ca 0.59 -3.48 0.02 0.00 -0.00 0.00 0.00 56.01 53.14 1hfn n LEU 34 Cb 0.57 0.20 0.14 0.00 -0.00 0.00 0.00 43.42 44.34 1hfn n LEU 34 CO 0.71 1.70 0.26 0.00 -0.00 0.00 0.00 177.39 180.06 1hfn n SER 36 N -0.69 0.00 -3.93 0.00 7.64 -1.26 -4.39 113.62 110.99 1hfn n SER 36 Ca 0.18 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.77 1hfn n SER 36 Cb 0.83 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.92 1hfn n SER 36 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1hfn n LYS 37 N 0.00 1.96 -2.03 1.43 0.00 -1.26 -5.10 118.16 113.17 1hfn n LYS 37 Ca 0.00 -4.50 -0.30 0.00 -0.00 0.00 0.00 58.31 53.52 1hfn n LYS 37 Cb 0.00 -2.31 0.03 0.00 -0.00 0.00 0.00 35.03 32.75 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 -1.48 3.18 -0.16 -1.58 0.04 -1.26 -4.48 135.00 129.26 1hfn s PRO 38 Ca 0.25 0.46 -0.31 0.00 0.04 0.00 0.00 61.00 61.45 1hfn s PRO 38 Cb -0.04 -2.11 0.13 0.00 0.04 0.00 0.00 34.50 32.52 1hfn s PRO 38 CO -0.16 -0.75 1.07 0.20 0.04 0.00 0.00 177.00 177.40 1hfn s GLY 39 N -4.27 -0.25 0.05 0.56 0.00 -1.26 -4.89 107.32 97.25 1hfn s GLY 39 Ca 0.55 1.88 -0.19 0.00 0.00 0.00 0.00 44.72 46.96 1hfn s GLY 39 CO 0.51 0.81 0.55 0.14 0.00 0.00 0.00 173.10 175.11 1hfn s VAL 40 N -1.73 4.80 -0.16 1.40 1.01 -0.94 -4.28 120.40 120.50 1hfn s VAL 40 Ca 0.03 1.16 -0.08 0.00 0.00 0.00 0.00 61.98 63.09 1hfn s VAL 40 Cb -0.01 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 1hfn s VAL 40 CO -0.03 0.54 0.12 -0.63 0.00 0.00 0.00 175.10 175.10 1hfn s ILE 41 N -1.00 5.32 0.46 2.22 1.09 -1.00 0.13 121.20 128.41 1hfn s ILE 41 Ca 0.28 0.15 -0.03 0.00 -1.10 0.00 0.00 60.65 59.95 1hfn s ILE 41 Cb -0.19 -3.37 -0.02 0.00 -1.06 0.00 0.00 42.46 37.81 1hfn s ILE 41 CO 0.18 0.52 0.72 -0.36 -0.10 0.00 0.00 174.94 175.90 1hfn s PHE 42 N -0.21 3.46 -0.32 3.97 0.08 0.12 -1.38 117.98 123.71 1hfn s PHE 42 Ca 0.10 0.59 -0.01 0.00 0.12 0.00 0.00 56.93 57.72 1hfn s PHE 42 Cb -0.12 -2.25 0.10 0.00 -0.57 0.00 0.00 43.02 40.19 1hfn s PHE 42 CO 0.01 -0.25 0.12 -0.51 -0.10 0.00 0.00 175.22 174.48 1hfn s LEU 43 N -4.64 1.82 1.08 -0.37 2.01 -0.42 -2.46 118.68 115.71 1hfn s LEU 43 Ca 0.46 -1.67 -0.12 0.00 0.01 0.00 0.00 54.13 52.81 1hfn s LEU 43 Cb -0.10 -0.74 0.24 0.00 0.01 0.00 0.00 46.19 45.60 1hfn s LEU 43 CO 0.42 -0.40 1.06 0.42 1.01 0.00 0.00 176.35 178.85 1hfn s THR 44 N 1.60 2.10 0.06 5.49 -4.23 -1.13 -2.67 115.64 116.86 1hfn s THR 44 Ca 0.11 0.03 -0.32 0.00 -1.18 0.00 0.00 61.69 60.33 1hfn s THR 44 Cb -0.18 -2.22 -0.18 0.00 1.34 0.00 0.00 72.50 71.26 1hfn s THR 44 CO -0.25 -0.04 1.57 0.11 -0.54 0.00 0.00 174.62 175.47 1hfn h LYS 45 N -2.31 -0.82 0.00 3.99 1.57 -1.34 -3.39 116.57 114.27 1hfn h LYS 45 Ca -0.57 0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 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 -0.53 0.00 -2.13 -0.57 0.00 0.00 179.45 176.73 1hfn n ARG 46 N -5.44 -0.49 0.00 3.15 0.63 -1.26 -5.01 116.66 108.23 1hfn n ARG 46 Ca -0.13 -0.28 0.00 0.00 -0.92 0.00 0.00 57.85 56.52 1hfn n ARG 46 Cb 0.35 -0.76 0.00 0.00 0.45 0.00 0.00 32.46 32.50 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 -0.00 0.51 0.63 5.14 0.00 -1.26 -5.11 105.19 105.09 1hfn n GLY 47 Ca 0.00 -0.02 -0.02 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 0.16 -3.08 1.61 1.74 -1.26 -4.93 116.66 110.89 1hfn n ARG 48 Ca 0.00 -0.46 -0.29 0.00 -0.77 0.00 0.00 57.85 56.32 1hfn n ARG 48 Cb 0.00 0.49 -0.03 0.00 -1.02 0.00 0.00 32.46 31.90 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 -2.09 3.69 -0.18 5.56 -0.21 -1.26 -2.83 119.66 122.34 1hfn s GLN 49 Ca 0.04 0.22 -0.08 0.00 0.02 0.00 0.00 55.36 55.56 1hfn s GLN 49 Cb -0.00 -2.52 0.07 0.00 1.00 0.00 0.00 33.01 31.56 1hfn s GLN 49 CO 0.03 0.08 0.41 0.08 -2.12 0.00 0.00 175.29 173.77 1hfn s VAL 50 N -2.25 -0.21 0.16 1.09 1.01 -1.03 -4.92 120.40 114.25 1hfn s VAL 50 Ca 0.47 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.27 1hfn s VAL 50 Cb -0.10 -0.62 -0.07 0.00 0.00 0.00 0.00 36.38 35.58 1hfn s VAL 50 CO 0.31 0.05 1.10 0.00 0.00 0.00 0.00 175.10 176.56 1hfn s ALA 52 N -0.09 -0.89 -0.16 0.00 0.00 0.12 0.48 121.76 121.22 1hfn s ALA 52 Ca 0.50 1.32 -0.29 0.00 0.00 0.00 0.00 51.96 53.49 1hfn s ALA 52 Cb -0.29 -0.94 -0.00 0.00 0.00 0.00 0.00 23.12 21.88 1hfn s ALA 52 CO 0.34 -0.39 1.06 -0.51 0.00 0.00 0.00 175.76 176.26 1hfn s ASP 53 N 1.72 7.14 0.58 0.00 1.01 -1.26 -2.22 116.67 123.65 1hfn s ASP 53 Ca -0.07 1.51 0.28 0.00 0.71 0.00 0.00 52.55 54.98 1hfn s ASP 53 Cb -0.10 -2.55 1.64 0.00 1.01 0.00 0.00 42.92 42.93 1hfn s ASP 53 CO -0.11 -0.58 2.11 0.07 0.21 0.00 0.00 175.17 176.86 1hfn h LYS 54 N 7.38 0.00 -0.12 8.23 -0.00 -1.93 0.11 116.57 130.25 1hfn h LYS 54 Ca -0.26 0.00 0.03 0.00 -0.00 0.00 0.00 60.65 60.43 1hfn h LYS 54 Cb 1.11 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.33 1hfn h LYS 54 CO 0.92 0.00 0.13 0.66 -0.00 0.00 0.00 179.45 181.16 1hfn h SER 55 N 0.00 0.00 -1.69 7.07 4.64 -1.98 -3.35 113.55 118.25 1hfn h SER 55 Ca 0.09 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.27 1hfn h SER 55 Cb 0.47 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.64 1hfn h SER 55 CO -0.00 0.00 -0.07 0.29 -0.87 0.00 0.00 176.83 176.18 1hfn n LYS 56 N -3.85 -2.89 -0.08 4.77 4.76 0.03 -4.94 118.16 115.95 1hfn n LYS 56 Ca 0.00 -0.55 -0.15 0.00 -2.87 0.00 0.00 58.31 54.75 1hfn n LYS 56 Cb 0.24 -0.73 -0.05 0.00 -1.84 0.00 0.00 35.03 32.65 1hfn n LYS 56 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1hfn n ASP 57 N -3.85 1.61 0.22 4.39 8.00 -1.26 -3.90 116.55 121.76 1hfn n ASP 57 Ca 0.05 0.27 0.06 0.00 0.71 0.00 0.00 54.79 55.88 1hfn n ASP 57 Cb 0.23 -0.63 0.52 0.00 -0.02 0.00 0.00 41.12 41.21 1hfn n ASP 57 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 1hfn h TRP 58 N -0.75 0.00 -0.12 1.24 5.08 -1.95 -2.39 115.95 117.06 1hfn h TRP 58 Ca -0.27 0.00 -0.15 0.00 1.08 0.00 0.00 58.89 59.55 1hfn h TRP 58 Cb 1.12 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 27.28 1hfn h TRP 58 CO -0.19 0.21 -0.51 0.28 -1.28 0.00 0.00 178.44 176.95 1hfn h VAL 59 N 0.00 1.36 -0.68 0.12 2.07 -1.86 -2.79 116.25 114.46 1hfn h VAL 59 Ca -0.00 -1.81 0.11 0.00 0.82 0.00 0.00 66.70 65.82 1hfn h VAL 59 Cb 0.39 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.26 1hfn h VAL 59 CO 0.03 0.55 0.45 0.50 0.02 0.00 0.00 177.57 179.12 1hfn h LYS 60 N 0.17 0.47 -0.26 1.57 3.64 -1.56 0.28 116.57 120.89 1hfn h LYS 60 Ca -0.03 -0.03 -0.19 0.00 -1.27 0.00 0.00 60.65 59.14 1hfn h LYS 60 Cb 1.14 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1hfn h LYS 60 CO 0.11 0.31 -0.56 0.87 -2.27 0.00 0.00 179.45 177.90 1hfn h LYS 61 N 0.49 0.83 -0.35 1.90 1.57 -1.40 -2.15 116.57 117.45 1hfn h LYS 61 Ca 0.32 -0.55 -0.07 0.00 -1.87 0.00 0.00 60.65 58.48 1hfn h LYS 61 Cb 0.59 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 1hfn h LYS 61 CO -0.10 1.18 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.85 1hfn h LEU 62 N 0.60 0.65 -0.81 2.94 3.38 -0.85 0.84 115.31 122.06 1hfn h LEU 62 Ca 0.00 -0.34 0.04 0.00 0.09 0.00 0.00 57.88 57.68 1hfn h LEU 62 Cb 1.18 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.70 1hfn h LEU 62 CO 0.12 0.84 0.51 0.24 0.09 0.00 0.00 178.44 180.24 1hfn h MET 63 N 0.45 0.94 0.05 1.13 2.86 -0.51 0.85 114.93 120.70 1hfn h MET 63 Ca 0.09 -0.06 -0.23 0.00 -2.06 0.00 0.00 59.70 57.45 1hfn h MET 63 Cb 0.53 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1hfn h MET 63 CO 0.03 0.62 -1.07 1.96 1.06 0.00 0.00 176.91 179.52 1hfn h GLN 64 N 0.97 0.16 -0.28 1.72 1.08 -1.21 -3.28 115.11 114.27 1hfn h GLN 64 Ca 0.33 -0.24 -0.17 0.00 -1.45 0.00 0.00 58.65 57.12 1hfn h GLN 64 Cb 0.07 0.08 -0.00 0.00 -0.05 0.00 0.00 27.48 27.58 1hfn h GLN 64 CO -0.13 1.08 -0.51 1.96 -0.95 0.00 0.00 178.83 180.27 1hfn h GLN 65 N 0.06 0.79 -5.96 1.46 4.20 0.14 -3.44 115.11 112.37 1hfn h GLN 65 Ca -0.07 -0.48 -0.63 0.00 0.06 0.00 0.00 58.65 57.53 1hfn h GLN 65 Cb 1.78 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 29.56 1hfn h GLN 65 CO 0.16 1.11 -0.52 -0.51 -0.67 0.00 0.00 178.83 178.40 1hfn s LEU 66 N -8.63 4.23 0.00 1.46 1.43 0.29 -5.05 118.68 112.42 1hfn s LEU 66 Ca -0.10 0.22 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 1hfn s LEU 66 Cb 0.11 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.53 1hfn s LEU 66 CO 0.87 0.18 0.04 -0.81 0.23 0.00 0.00 176.35 176.87 1hfn n PRO 67 N 0.43 0.00 0.00 1.29 -0.04 -1.26 -4.68 135.00 130.74 1hfn n PRO 67 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 1hfn n PRO 67 Cb 0.51 -0.33 0.00 0.00 -0.04 0.00 0.00 33.50 33.65 1hfn n PRO 67 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1hfn n VAL 68 N -0.24 0.00 -3.74 0.52 3.14 -1.26 -4.80 118.33 111.94 1hfn n VAL 68 Ca 0.00 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 61.07 1hfn n VAL 68 Cb 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 32.73 1hfn n VAL 68 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1hfn s THR 69 N -0.91 5.23 0.32 1.55 -1.32 -1.11 -4.87 115.64 114.52 1hfn s THR 69 Ca 0.00 -0.07 -0.05 0.00 -1.21 0.00 0.00 61.69 60.35 1hfn s THR 69 Cb 0.00 -3.62 0.08 0.00 -1.51 0.00 0.00 72.50 67.45 1hfn s THR 69 CO 0.00 0.08 0.28 0.00 -2.21 0.00 0.00 174.62 172.77 1hfn n ALA 70 N 0.17 -0.90 0.77 11.08 0.00 -1.26 -4.64 120.51 125.73 1hfn n ALA 70 Ca -0.03 -0.42 0.09 0.00 0.00 0.00 0.00 53.44 53.08 1hfn n ALA 70 Cb 0.52 -0.03 0.08 0.00 0.00 0.00 0.00 19.45 20.01 1hfn n ALA 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04