#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 2.28 3.60 -0.72 0.00 -1.26 -5.15 105.19 103.94 1hfn n GLY 2 Ca 0.00 -2.17 0.01 0.00 0.00 0.00 0.00 46.02 43.87 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 -2.15 -2.28 -0.15 4.61 0.00 -1.26 -5.09 121.76 115.44 1hfn s ALA 3 Ca 0.11 0.93 -0.15 0.00 0.00 0.00 0.00 51.96 52.84 1hfn s ALA 3 Cb -0.01 0.23 -0.05 0.00 0.00 0.00 0.00 23.12 23.29 1hfn s ALA 3 CO 0.07 -0.97 -0.29 0.43 0.00 0.00 0.00 175.76 174.99 1hfn n SER 4 N -0.42 1.65 -1.45 0.00 7.64 -1.26 -5.12 113.62 114.66 1hfn n SER 4 Ca -0.07 0.29 0.13 0.00 1.01 0.00 0.00 58.87 60.23 1hfn n SER 4 Cb 0.62 -0.71 -0.07 0.00 -1.01 0.00 0.00 64.21 63.04 1hfn n SER 4 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 1hfn n TRP 5 N -4.17 -3.93 -3.92 1.43 -0.00 -1.26 -4.86 117.44 100.73 1hfn n TRP 5 Ca -0.12 2.16 -0.35 0.00 -0.00 0.00 0.00 57.50 59.20 1hfn n TRP 5 Cb 0.43 -3.51 -0.14 0.00 -0.00 0.00 0.00 31.31 28.10 1hfn n TRP 5 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 177.69 174.31 1hfn s HIS 6 N -4.57 2.95 0.64 5.87 -3.43 -1.26 -5.11 115.29 110.38 1hfn s HIS 6 Ca 0.00 -1.00 -0.08 0.00 -0.80 0.00 0.00 55.06 53.19 1hfn s HIS 6 Cb 0.00 -2.09 0.02 0.00 -1.43 0.00 0.00 32.58 29.07 1hfn s HIS 6 CO 0.00 -0.57 0.97 1.03 -2.00 0.00 0.00 174.74 174.17 1hfn s ARG 7 N 1.46 2.82 0.00 -0.38 3.00 -1.26 -5.10 118.95 119.50 1hfn s ARG 7 Ca 0.06 0.11 0.00 0.00 0.00 0.00 0.00 55.73 55.90 1hfn s ARG 7 Cb -0.14 -2.18 0.00 0.00 0.00 0.00 0.00 34.95 32.63 1hfn s ARG 7 CO -0.04 -0.86 0.00 -0.35 0.00 0.00 0.00 175.30 174.05 1hfn n PRO 8 N -2.75 0.52 0.28 3.54 -0.04 -1.26 -5.00 135.00 130.30 1hfn n PRO 8 Ca 0.06 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.35 1hfn n PRO 8 Cb 0.58 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.95 1hfn n PRO 8 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1hfn h ASP 9 N 0.00 -0.59 0.00 3.54 5.19 -2.08 -3.45 116.42 119.03 1hfn h ASP 9 Ca 0.00 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1hfn h ASP 9 Cb 0.00 0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.66 1hfn h ASP 9 CO 0.00 -0.36 0.00 0.29 -3.12 0.00 0.00 179.24 176.05 1hfn n LYS 10 N -5.36 0.00 -0.10 3.56 4.76 -1.26 -4.79 118.16 114.97 1hfn n LYS 10 Ca -0.12 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.22 1hfn n LYS 10 Cb 0.30 0.00 0.09 0.00 -1.84 0.00 0.00 35.03 33.59 1hfn n LYS 10 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hfn n LEU 13 N 0.30 1.92 -4.90 0.00 -0.00 -1.26 -4.19 117.00 108.87 1hfn n LEU 13 Ca 0.01 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.73 1hfn n LEU 13 Cb 0.58 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.96 1hfn n LEU 13 CO 0.08 0.30 0.18 -0.83 -0.00 0.00 0.00 177.39 177.12 1hfn s GLY 14 N -4.16 1.93 0.26 1.47 0.00 -1.26 -5.08 107.32 100.49 1hfn s GLY 14 Ca 0.00 -0.55 0.01 0.00 0.00 0.00 0.00 44.72 44.19 1hfn s GLY 14 CO 0.00 -0.44 0.09 -0.19 0.00 0.00 0.00 173.10 172.56 1hfn s TYR 15 N -2.00 1.57 -0.31 1.90 1.51 -1.26 -4.59 117.35 114.18 1hfn s TYR 15 Ca 0.44 -1.16 -0.29 0.00 -1.01 0.00 0.00 57.07 55.05 1hfn s TYR 15 Cb -0.11 -0.93 -0.02 0.00 -0.11 0.00 0.00 41.96 40.79 1hfn s TYR 15 CO 0.28 -0.31 1.69 -1.14 -1.11 0.00 0.00 175.55 174.96 1hfn s GLN 16 N -4.02 3.50 0.00 -0.62 2.00 -0.41 -4.84 119.66 115.26 1hfn s GLN 16 Ca 0.38 1.42 0.25 0.00 -2.00 0.00 0.00 55.36 55.40 1hfn s GLN 16 Cb 0.08 -4.13 1.07 0.00 0.80 0.00 0.00 33.01 30.83 1hfn s GLN 16 CO 0.14 -1.66 1.80 0.36 -0.50 0.00 0.00 175.29 175.43 1hfn n LYS 17 N 8.17 0.02 -4.43 1.67 2.85 -1.26 -4.77 118.16 120.41 1hfn n LYS 17 Ca 0.21 0.07 -0.29 0.00 -1.05 0.00 0.00 58.31 57.25 1hfn n LYS 17 Cb 0.46 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 33.21 1hfn n LYS 17 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 177.40 176.37 1hfn s ARG 18 N -2.97 1.43 0.05 -1.58 1.70 -1.26 -5.12 118.95 111.19 1hfn s ARG 18 Ca 0.13 -1.32 -0.27 0.00 -0.47 0.00 0.00 55.73 53.80 1hfn s ARG 18 Cb 0.16 -1.89 -0.05 0.00 -0.57 0.00 0.00 34.95 32.60 1hfn s ARG 18 CO 0.45 0.45 0.84 -1.25 -1.08 0.00 0.00 175.30 174.71 1hfn s PRO 19 N -1.98 4.56 0.08 3.89 0.04 -1.26 -5.07 135.00 135.26 1hfn s PRO 19 Ca 0.14 1.20 0.04 0.00 0.04 0.00 0.00 61.00 62.41 1hfn s PRO 19 Cb -0.10 -3.39 -0.04 0.00 0.04 0.00 0.00 34.50 31.01 1hfn s PRO 19 CO 0.06 0.20 0.04 -0.51 0.04 0.00 0.00 177.00 176.83 1hfn s LEU 20 N 0.17 3.64 0.28 -3.56 1.43 -1.26 -5.11 118.68 114.26 1hfn s LEU 20 Ca 0.42 -0.09 -0.23 0.00 -1.03 0.00 0.00 54.13 53.21 1hfn s LEU 20 Cb -0.21 -2.35 -0.09 0.00 0.03 0.00 0.00 46.19 43.57 1hfn s LEU 20 CO 0.25 0.17 0.83 -2.16 0.23 0.00 0.00 176.35 175.68 1hfn s PRO 21 N -2.36 4.41 0.00 1.29 0.04 -1.26 -4.95 135.00 132.17 1hfn s PRO 21 Ca 0.28 1.09 0.18 0.00 0.04 0.00 0.00 61.00 62.59 1hfn s PRO 21 Cb -0.12 -2.82 0.82 0.00 0.04 0.00 0.00 34.50 32.42 1hfn s PRO 21 CO 0.20 0.33 1.56 0.94 0.04 0.00 0.00 177.00 180.07 1hfn n GLN 22 N 0.60 0.11 -0.25 4.56 0.00 -1.26 -3.28 117.38 117.86 1hfn n GLN 22 Ca -0.00 0.16 0.00 0.00 -0.00 0.00 0.00 57.00 57.17 1hfn n GLN 22 Cb 0.51 -1.50 0.13 0.00 0.00 0.00 0.00 30.24 29.37 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 0.91 0.01 1.69 3.04 -2.03 -2.81 116.25 117.06 1hfn h VAL 23 Ca 0.00 -0.23 -0.32 0.00 -1.01 0.00 0.00 66.70 65.14 1hfn h VAL 23 Cb 0.25 0.18 -0.05 0.00 -2.01 0.00 0.00 31.29 29.65 1hfn h VAL 23 CO 0.00 0.12 -1.95 0.00 -1.01 0.00 0.00 177.57 174.73 1hfn n LEU 24 N -4.81 0.85 -4.71 3.16 -0.00 -1.22 -4.95 117.00 105.32 1hfn n LEU 24 Ca 0.10 0.26 -0.38 0.00 -0.00 0.00 0.00 56.01 55.99 1hfn n LEU 24 Cb 0.23 0.12 0.05 0.00 -0.00 0.00 0.00 43.42 43.82 1hfn n LEU 24 CO 0.27 0.48 0.88 -0.11 -0.00 0.00 0.00 177.39 178.90 1hfn n LEU 25 N -3.01 5.11 -0.01 1.47 7.94 -1.06 -0.68 117.00 126.76 1hfn n LEU 25 Ca -0.24 0.94 -0.01 0.00 -1.11 0.00 0.00 56.01 55.59 1hfn n LEU 25 Cb 1.08 -1.53 -0.00 0.00 0.53 0.00 0.00 43.42 43.50 1hfn n LEU 25 CO 0.44 -0.90 -0.09 -0.24 -1.11 0.00 0.00 177.39 175.49 1hfn n SER 26 N -0.97 0.39 -0.48 1.96 2.88 -1.04 -4.53 113.62 111.82 1hfn n SER 26 Ca 0.12 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 1hfn n SER 26 Cb 0.45 -0.33 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 -2.88 0.00 -3.64 -3.46 7.64 -0.80 -4.79 113.62 105.69 1hfn n SER 27 Ca -0.02 -0.48 -0.15 0.00 1.01 0.00 0.00 58.87 59.23 1hfn n SER 27 Cb 0.07 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.19 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 -3.89 -0.64 0.04 1.43 1.48 -1.26 -0.26 118.94 115.84 1hfn s TRP 28 Ca 0.00 1.45 0.09 0.00 -1.06 0.00 0.00 56.10 56.58 1hfn s TRP 28 Cb 0.00 0.26 -0.03 0.00 -1.16 0.00 0.00 33.47 32.54 1hfn s TRP 28 CO 0.00 -0.38 -0.26 1.52 -4.06 0.00 0.00 176.95 173.77 1hfn s TYR 29 N -0.08 2.28 0.61 1.66 -0.85 -0.96 -1.09 117.35 118.93 1hfn s TYR 29 Ca -0.03 -0.41 -0.11 0.00 -0.52 0.00 0.00 57.07 56.00 1hfn s TYR 29 Cb -0.04 -1.38 -0.04 0.00 0.38 0.00 0.00 41.96 40.89 1hfn s TYR 29 CO 0.03 0.11 1.02 -1.25 -1.52 0.00 0.00 175.55 173.94 1hfn s PRO 30 N -1.19 3.62 0.62 -3.49 0.04 -1.26 -2.41 135.00 130.92 1hfn s PRO 30 Ca 0.11 0.75 0.02 0.00 0.04 0.00 0.00 61.00 61.92 1hfn s PRO 30 Cb -0.10 -2.09 0.12 0.00 0.04 0.00 0.00 34.50 32.47 1hfn s PRO 30 CO 0.02 -0.55 0.85 0.25 0.04 0.00 0.00 177.00 177.61 1hfn n THR 31 N -2.68 0.00 -0.69 1.26 -2.24 -1.13 -4.90 114.28 103.90 1hfn n THR 31 Ca 0.06 -1.48 0.00 0.00 -2.27 0.00 0.00 64.05 60.36 1hfn n THR 31 Cb 0.54 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 1hfn n THR 31 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1hfn n SER 32 N -2.79 0.00 -0.06 3.42 2.88 -1.26 -4.98 113.62 110.83 1hfn n SER 32 Ca 0.15 -0.44 -0.06 0.00 -1.33 0.00 0.00 58.87 57.18 1hfn n SER 32 Cb 0.53 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.90 1hfn n SER 32 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1hfn n GLN 33 N -0.44 1.97 -1.68 -1.46 -0.06 -1.26 -4.67 117.38 109.78 1hfn n GLN 33 Ca 0.00 0.01 -0.39 0.00 -2.00 0.00 0.00 57.00 54.62 1hfn n GLN 33 Cb 0.00 -1.28 -0.02 0.00 -4.06 0.00 0.00 30.24 24.88 1hfn n GLN 33 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1hfn n LEU 34 N -2.47 8.28 0.00 1.69 4.32 -1.26 -4.05 117.00 123.51 1hfn n LEU 34 Ca -0.19 -4.63 0.00 0.00 -0.02 0.00 0.00 56.01 51.17 1hfn n LEU 34 Cb 0.85 -1.44 0.00 0.00 -1.62 0.00 0.00 43.42 41.21 1hfn n LEU 34 CO 0.22 2.06 0.15 0.00 -1.22 0.00 0.00 177.39 178.60 1hfn n SER 36 N -0.05 0.00 -3.14 0.00 3.41 -1.26 -4.05 113.62 108.53 1hfn n SER 36 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1hfn n SER 36 Cb 0.08 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1hfn n SER 36 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1hfn n LYS 37 N 0.00 1.67 -0.05 4.33 4.81 -1.26 -5.11 118.16 122.55 1hfn n LYS 37 Ca 0.00 -3.86 0.00 0.00 -0.87 0.00 0.00 58.31 53.58 1hfn n LYS 37 Cb 0.00 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.23 1hfn n LYS 37 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1hfn n PRO 38 N 0.38 0.34 0.00 1.64 -0.04 -1.26 -4.35 135.00 131.70 1hfn n PRO 38 Ca 0.26 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.72 1hfn n PRO 38 Cb 0.54 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 1hfn n PRO 38 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1hfn n GLY 39 N 5.00 -0.15 3.38 0.55 0.00 -1.26 -4.97 105.19 107.74 1hfn n GLY 39 Ca 0.00 0.57 -0.12 0.00 0.00 0.00 0.00 46.02 46.48 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 2.71 -0.01 -0.32 1.61 1.01 -0.89 -2.82 120.40 121.68 1hfn s VAL 40 Ca 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 61.98 61.88 1hfn s VAL 40 Cb 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 1hfn s VAL 40 CO 0.00 0.01 0.29 -0.63 0.00 0.00 0.00 175.10 174.78 1hfn s ILE 41 N 0.82 5.23 0.05 2.22 -1.09 -1.01 0.35 121.20 127.77 1hfn s ILE 41 Ca -0.05 0.05 -0.29 0.00 -2.23 0.00 0.00 60.65 58.13 1hfn s ILE 41 Cb -0.05 -3.72 -0.05 0.00 -1.58 0.00 0.00 42.46 37.06 1hfn s ILE 41 CO -0.06 0.03 0.94 -0.36 -1.23 0.00 0.00 174.94 174.25 1hfn s PHE 42 N 1.89 3.73 -0.54 3.97 0.40 -0.28 -2.26 117.98 124.89 1hfn s PHE 42 Ca 0.10 1.71 -0.12 0.00 -0.60 0.00 0.00 56.93 58.01 1hfn s PHE 42 Cb -0.17 -3.05 0.13 0.00 0.51 0.00 0.00 43.02 40.44 1hfn s PHE 42 CO 0.11 0.12 0.45 -0.51 0.70 0.00 0.00 175.22 176.09 1hfn s LEU 43 N 0.45 5.98 1.04 -0.37 1.43 0.64 -1.91 118.68 125.94 1hfn s LEU 43 Ca 0.48 -1.97 -0.12 0.00 -1.03 0.00 0.00 54.13 51.50 1hfn s LEU 43 Cb -0.22 -2.10 0.21 0.00 0.03 0.00 0.00 46.19 44.11 1hfn s LEU 43 CO 0.28 -0.74 1.07 0.42 0.23 0.00 0.00 176.35 177.61 1hfn s THR 44 N 1.30 2.18 0.08 5.49 -4.23 -1.15 -1.90 115.64 117.41 1hfn s THR 44 Ca 0.06 0.06 -0.30 0.00 -1.18 0.00 0.00 61.69 60.33 1hfn s THR 44 Cb -0.26 -2.26 -0.17 0.00 1.34 0.00 0.00 72.50 71.15 1hfn s THR 44 CO -0.00 -0.08 1.66 0.11 -0.54 0.00 0.00 174.62 175.77 1hfn h LYS 45 N -2.16 -0.59 0.00 3.99 1.57 -1.14 -3.38 116.57 114.86 1hfn h LYS 45 Ca -0.55 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1hfn h LYS 45 Cb 1.31 0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.75 1hfn h LYS 45 CO 0.51 -0.39 0.00 -2.13 -0.57 0.00 0.00 179.45 176.86 1hfn n ARG 46 N -5.36 -0.19 0.00 3.15 0.63 -1.26 -5.00 116.66 108.64 1hfn n ARG 46 Ca -0.11 -0.32 0.00 0.00 -0.92 0.00 0.00 57.85 56.50 1hfn n ARG 46 Cb 0.26 -0.72 0.00 0.00 0.45 0.00 0.00 32.46 32.45 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 1.07 0.01 5.14 0.00 -1.26 -5.12 105.19 105.00 1hfn n GLY 47 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 -2.63 1.61 1.74 -1.26 -4.92 116.66 111.21 1hfn n ARG 48 Ca 0.00 -0.01 -0.32 0.00 -0.77 0.00 0.00 57.85 56.75 1hfn n ARG 48 Cb 0.00 0.01 -0.05 0.00 -1.02 0.00 0.00 32.46 31.40 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 -2.00 4.03 -0.09 5.56 1.11 -1.26 -2.95 119.66 124.06 1hfn s GLN 49 Ca 0.00 0.94 -0.03 0.00 0.01 0.00 0.00 55.36 56.28 1hfn s GLN 49 Cb -0.00 -2.19 0.05 0.00 -1.01 0.00 0.00 33.01 29.85 1hfn s GLN 49 CO 0.00 -0.14 0.13 0.08 0.01 0.00 0.00 175.29 175.37 1hfn s VAL 50 N -2.42 -0.21 -0.69 1.09 1.01 -0.80 -4.88 120.40 113.49 1hfn s VAL 50 Ca 0.59 0.30 -0.26 0.00 0.00 0.00 0.00 61.98 62.61 1hfn s VAL 50 Cb -0.10 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 35.94 1hfn s VAL 50 CO 0.25 0.10 1.90 0.00 0.00 0.00 0.00 175.10 177.34 1hfn s ALA 52 N 9.43 3.50 -0.21 0.00 0.00 0.15 -1.29 121.76 133.35 1hfn s ALA 52 Ca 0.68 -0.73 -0.08 0.00 0.00 0.00 0.00 51.96 51.84 1hfn s ALA 52 Cb -0.11 -1.84 -0.04 0.00 0.00 0.00 0.00 23.12 21.13 1hfn s ALA 52 CO 0.15 0.37 0.07 -0.51 0.00 0.00 0.00 175.76 175.84 1hfn s ASP 53 N -0.24 5.55 0.63 0.00 1.01 -1.26 -2.10 116.67 120.26 1hfn s ASP 53 Ca 0.08 0.01 0.34 0.00 0.71 0.00 0.00 52.55 53.69 1hfn s ASP 53 Cb -0.12 -1.97 1.91 0.00 1.01 0.00 0.00 42.92 43.75 1hfn s ASP 53 CO 0.01 0.11 2.16 0.50 0.21 0.00 0.00 175.17 178.16 1hfn h LYS 54 N 7.18 0.00 -0.33 8.23 1.63 -1.96 -0.76 116.57 130.56 1hfn h LYS 54 Ca -0.37 0.00 0.08 0.00 -0.85 0.00 0.00 60.65 59.52 1hfn h LYS 54 Cb 1.17 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.79 1hfn h LYS 54 CO 0.66 0.00 0.23 0.77 -3.45 0.00 0.00 179.45 177.66 1hfn h SER 55 N 0.00 0.05 -2.80 4.20 0.02 -2.00 -3.42 113.55 109.60 1hfn h SER 55 Ca 0.03 0.00 -0.31 0.00 -0.84 0.00 0.00 61.79 60.68 1hfn h SER 55 Cb 0.33 -0.01 0.17 0.00 0.14 0.00 0.00 62.40 63.03 1hfn h SER 55 CO -0.00 0.03 -0.02 0.29 -1.14 0.00 0.00 176.83 175.99 1hfn n LYS 56 N -4.45 -3.52 -0.06 3.45 4.01 -0.29 -5.01 118.16 112.28 1hfn n LYS 56 Ca 0.05 -1.31 -0.08 0.00 -0.51 0.00 0.00 58.31 56.46 1hfn n LYS 56 Cb 0.37 -1.43 -0.07 0.00 -0.51 0.00 0.00 35.03 33.39 1hfn n LYS 56 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1hfn n ASP 57 N -4.90 2.85 0.16 4.39 2.03 -1.26 -4.31 116.55 115.52 1hfn n ASP 57 Ca 0.12 -0.05 0.04 0.00 0.52 0.00 0.00 54.79 55.41 1hfn n ASP 57 Cb 0.48 0.08 0.22 0.00 -0.72 0.00 0.00 41.12 41.18 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 0.00 0.00 -0.11 -0.67 5.08 -1.95 -2.87 115.95 115.44 1hfn h TRP 58 Ca -0.28 0.00 -0.16 0.00 1.08 0.00 0.00 58.89 59.52 1hfn h TRP 58 Cb 1.50 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.65 1hfn h TRP 58 CO 0.01 0.47 -0.64 0.28 -1.28 0.00 0.00 178.44 177.28 1hfn h VAL 59 N 0.00 1.36 -0.52 0.12 2.07 -1.85 -2.64 116.25 114.80 1hfn h VAL 59 Ca -0.00 -1.99 -0.08 0.00 0.82 0.00 0.00 66.70 65.45 1hfn h VAL 59 Cb 1.09 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.82 1hfn h VAL 59 CO 0.06 0.60 0.01 0.50 0.02 0.00 0.00 177.57 178.76 1hfn h LYS 60 N 0.29 0.90 -0.57 1.57 3.64 -1.72 -1.75 116.57 118.93 1hfn h LYS 60 Ca -0.01 -0.28 -0.01 0.00 -1.27 0.00 0.00 60.65 59.08 1hfn h LYS 60 Cb 1.18 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.89 1hfn h LYS 60 CO 0.11 0.92 0.32 0.87 -2.27 0.00 0.00 179.45 179.40 1hfn h LYS 61 N 0.77 0.80 -0.45 1.90 1.57 -1.43 -2.55 116.57 117.18 1hfn h LYS 61 Ca 0.15 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1hfn h LYS 61 Cb 0.50 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1hfn h LYS 61 CO 0.02 0.61 0.28 -0.07 -0.57 0.00 0.00 179.45 179.72 1hfn h LEU 62 N 0.77 0.53 -1.27 2.94 3.38 -1.30 0.19 115.31 120.56 1hfn h LEU 62 Ca 0.20 -0.04 0.21 0.00 0.09 0.00 0.00 57.88 58.35 1hfn h LEU 62 Cb 0.04 -0.13 -0.09 0.00 0.09 0.00 0.00 40.66 40.56 1hfn h LEU 62 CO -0.03 0.41 0.62 0.24 0.09 0.00 0.00 178.44 179.77 1hfn h MET 63 N 0.60 0.53 0.03 1.13 2.86 -0.93 0.93 114.93 120.08 1hfn h MET 63 Ca 0.16 -0.03 -0.26 0.00 -2.06 0.00 0.00 59.70 57.51 1hfn h MET 63 Cb -0.03 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 1hfn h MET 63 CO -0.03 0.35 -1.33 0.37 1.06 0.00 0.00 176.91 177.33 1hfn h GLN 64 N 0.55 0.06 -0.17 1.72 4.15 -1.03 -3.32 115.11 117.07 1hfn h GLN 64 Ca 0.54 -0.10 -0.16 0.00 0.77 0.00 0.00 58.65 59.70 1hfn h GLN 64 Cb 1.14 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.86 1hfn h GLN 64 CO -0.29 0.87 -0.57 1.96 -1.93 0.00 0.00 178.83 178.87 1hfn h GLN 65 N 0.02 0.53 -6.51 1.69 4.20 0.22 -3.44 115.11 111.81 1hfn h GLN 65 Ca -0.15 -0.35 -0.65 0.00 0.06 0.00 0.00 58.65 57.57 1hfn h GLN 65 Cb 1.90 0.04 -0.15 0.00 0.30 0.00 0.00 27.48 29.58 1hfn h GLN 65 CO 0.12 0.96 -0.73 -0.51 -0.67 0.00 0.00 178.83 178.00 1hfn s LEU 66 N -8.29 3.01 0.00 1.46 1.43 0.29 -5.07 118.68 111.52 1hfn s LEU 66 Ca -0.07 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 1hfn s LEU 66 Cb 0.11 -1.75 0.00 0.00 0.03 0.00 0.00 46.19 44.58 1hfn s LEU 66 CO 0.84 0.14 0.05 -0.81 0.23 0.00 0.00 176.35 176.81 1hfn n PRO 67 N 0.39 0.00 0.00 1.29 -0.04 -1.26 -4.61 135.00 130.77 1hfn n PRO 67 Ca -0.12 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 1hfn n PRO 67 Cb 0.54 -0.43 0.00 0.00 -0.04 0.00 0.00 33.50 33.57 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 -0.35 0.00 -3.74 0.52 3.14 -1.26 -4.81 118.33 111.82 1hfn n VAL 68 Ca 0.00 0.00 -0.10 0.00 -2.96 0.00 0.00 64.34 61.28 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 -2.00 0.08 -0.08 1.55 -1.32 -0.25 -4.68 115.64 108.94 1hfn s THR 69 Ca 0.00 -0.86 0.03 0.00 -1.21 0.00 0.00 61.69 59.65 1hfn s THR 69 Cb 0.00 -1.35 0.09 0.00 -1.51 0.00 0.00 72.50 69.74 1hfn s THR 69 CO 0.00 -0.37 0.87 0.00 -2.21 0.00 0.00 174.62 172.91 1hfn n ALA 70 N -0.20 1.90 -0.93 11.08 0.00 -1.26 -4.06 120.51 127.04 1hfn n ALA 70 Ca -0.14 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1hfn n ALA 70 Cb 0.63 -0.44 0.00 0.00 0.00 0.00 0.00 19.45 19.64 1hfn n ALA 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04