#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 -2.01 1.83 -3.96 0.00 -1.26 -4.97 105.19 94.82 1hfn n GLY 2 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1hfn n GLY 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfn n ALA 3 N -0.37 1.72 -3.59 4.61 0.00 -1.26 -5.16 120.51 116.46 1hfn n ALA 3 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1hfn n ALA 3 Cb 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.46 1hfn n ALA 3 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1hfn s SER 4 N -3.63 -0.17 0.30 0.00 1.04 -1.26 -5.02 113.70 104.96 1hfn s SER 4 Ca 0.00 0.01 0.06 0.00 0.48 0.00 0.00 55.95 56.50 1hfn s SER 4 Cb 0.00 0.17 0.49 0.00 0.10 0.00 0.00 66.02 66.78 1hfn s SER 4 CO 0.00 -0.27 1.73 -0.25 0.98 0.00 0.00 173.24 175.43 1hfn h TRP 5 N 2.02 0.34 -3.39 5.02 7.01 -2.04 -3.43 115.95 121.48 1hfn h TRP 5 Ca -0.11 -0.08 -0.23 0.00 2.11 0.00 0.00 58.89 60.59 1hfn h TRP 5 Cb 1.17 -0.08 -0.29 0.00 -2.10 0.00 0.00 29.16 27.86 1hfn h TRP 5 CO 0.28 0.60 -0.61 -3.38 -2.79 0.00 0.00 178.44 172.54 1hfn s HIS 6 N -4.31 -0.12 -0.51 2.65 -3.43 -1.26 -5.11 115.29 103.20 1hfn s HIS 6 Ca -0.05 0.35 0.03 0.00 -0.80 0.00 0.00 55.06 54.59 1hfn s HIS 6 Cb 0.14 -0.03 0.14 0.00 -1.43 0.00 0.00 32.58 31.40 1hfn s HIS 6 CO 0.77 -0.10 0.31 1.03 -2.00 0.00 0.00 174.74 174.74 1hfn s ARG 7 N 0.57 1.64 -1.38 -0.38 0.52 -1.26 -5.03 118.95 113.63 1hfn s ARG 7 Ca -0.04 -2.43 -0.14 0.00 -0.52 0.00 0.00 55.73 52.60 1hfn s ARG 7 Cb -0.06 -2.68 0.08 0.00 0.52 0.00 0.00 34.95 32.81 1hfn s ARG 7 CO -0.02 -1.20 2.00 -0.35 0.02 0.00 0.00 175.30 175.74 1hfn n PRO 8 N 3.05 3.09 -2.73 3.54 -0.04 -1.26 -4.59 135.00 136.06 1hfn n PRO 8 Ca 0.12 -3.00 -0.03 0.00 -0.04 0.00 0.00 63.50 60.55 1hfn n PRO 8 Cb 0.35 -3.27 0.00 0.00 -0.04 0.00 0.00 33.50 30.55 1hfn n PRO 8 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1hfn n ASP 9 N 6.31 -7.83 -0.08 3.54 9.92 -1.26 -4.98 116.55 122.18 1hfn n ASP 9 Ca 0.48 1.02 -0.13 0.00 -0.53 0.00 0.00 54.79 55.63 1hfn n ASP 9 Cb 0.41 -5.24 -0.15 0.00 -0.64 0.00 0.00 41.12 35.50 1hfn n ASP 9 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1hfn n LYS 10 N 0.25 0.68 -0.18 -1.24 5.02 -1.26 -4.29 118.16 117.14 1hfn n LYS 10 Ca 0.05 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1hfn n LYS 10 Cb 0.19 -1.59 0.25 0.00 -0.02 0.00 0.00 35.03 33.87 1hfn n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hfn h LEU 13 N 4.10 0.16-10.55 0.00 -0.00 -1.94 -3.42 115.31 103.66 1hfn h LEU 13 Ca 0.00 -0.26 -0.45 0.00 -0.00 0.00 0.00 57.88 57.17 1hfn h LEU 13 Cb 0.00 -0.05 0.05 0.00 -0.00 0.00 0.00 40.66 40.65 1hfn h LEU 13 CO 0.00 1.22 -0.06 -0.83 -0.00 0.00 0.00 178.44 178.77 1hfn s GLY 14 N -5.02 1.82 0.34 0.83 0.00 -1.26 -4.96 107.32 99.07 1hfn s GLY 14 Ca -0.07 -1.62 0.01 0.00 0.00 0.00 0.00 44.72 43.05 1hfn s GLY 14 CO 0.83 -1.27 0.42 -1.72 0.00 0.00 0.00 173.10 171.36 1hfn n TYR 15 N -2.32 -1.24 0.21 1.90 4.02 -1.26 -4.78 117.16 113.69 1hfn n TYR 15 Ca 0.11 -2.43 -0.15 0.00 -0.01 0.00 0.00 57.90 55.42 1hfn n TYR 15 Cb 0.60 0.47 -0.08 0.00 -0.02 0.00 0.00 39.34 40.31 1hfn n TYR 15 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1hfn h GLN 16 N 0.00 -0.46 0.00 -0.72 5.75 -0.65 -3.47 115.11 115.56 1hfn h GLN 16 Ca -0.25 0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.28 1hfn h GLN 16 Cb 1.16 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.82 1hfn h GLN 16 CO 0.35 -0.30 0.00 1.17 -2.65 0.00 0.00 178.83 177.41 1hfn n LYS 17 N -5.29 0.00 -4.08 1.69 4.81 -1.26 -4.96 118.16 109.06 1hfn n LYS 17 Ca -0.10 0.00 -0.27 0.00 -0.87 0.00 0.00 58.31 57.07 1hfn n LYS 17 Cb 0.21 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.20 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 0.00 2.87 0.14 1.64 0.52 -1.26 -5.10 118.95 117.75 1hfn s ARG 18 Ca 0.00 -0.86 -0.27 0.00 -0.52 0.00 0.00 55.73 54.08 1hfn s ARG 18 Cb 0.00 -2.64 -0.07 0.00 0.52 0.00 0.00 34.95 32.76 1hfn s ARG 18 CO 0.00 0.49 0.84 -1.25 0.02 0.00 0.00 175.30 175.40 1hfn s PRO 19 N -2.98 4.63 0.17 3.54 0.04 -1.26 -5.08 135.00 134.06 1hfn s PRO 19 Ca 0.30 1.25 0.07 0.00 0.04 0.00 0.00 61.00 62.67 1hfn s PRO 19 Cb -0.10 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.09 1hfn s PRO 19 CO 0.23 0.43 -0.03 -0.51 0.04 0.00 0.00 177.00 177.16 1hfn s LEU 20 N -0.70 3.23 0.15 -3.56 1.43 -1.26 -5.12 118.68 112.86 1hfn s LEU 20 Ca 0.39 -0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 52.82 1hfn s LEU 20 Cb -0.23 -1.90 -0.08 0.00 0.03 0.00 0.00 46.19 44.01 1hfn s LEU 20 CO 0.27 0.10 0.78 -2.16 0.23 0.00 0.00 176.35 175.57 1hfn s PRO 21 N -2.84 4.56 0.00 1.29 0.04 -1.26 -4.95 135.00 131.84 1hfn s PRO 21 Ca 0.26 1.15 0.20 0.00 0.04 0.00 0.00 61.00 62.65 1hfn s PRO 21 Cb -0.09 -3.28 0.92 0.00 0.04 0.00 0.00 34.50 32.09 1hfn s PRO 21 CO 0.18 0.53 1.62 0.94 0.04 0.00 0.00 177.00 180.31 1hfn n GLN 22 N 1.77 0.14 0.21 4.56 0.00 -1.26 -3.42 117.38 119.38 1hfn n GLN 22 Ca -0.05 0.13 0.18 0.00 -0.00 0.00 0.00 57.00 57.26 1hfn n GLN 22 Cb 0.49 -1.50 0.78 0.00 0.00 0.00 0.00 30.24 30.00 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 0.21 0.00 1.69 3.04 -2.05 -1.86 116.25 117.28 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 0.26 0.66 0.00 0.00 -2.01 0.00 0.00 31.29 30.20 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 -3.34 0.67 -4.91 3.16 -0.00 -1.22 -5.07 117.00 106.29 1hfn n LEU 24 Ca 0.03 -0.68 -0.29 0.00 -0.00 0.00 0.00 56.01 55.07 1hfn n LEU 24 Cb 0.51 0.00 0.11 0.00 -0.00 0.00 0.00 43.42 44.04 1hfn n LEU 24 CO 0.21 0.17 0.78 -0.22 -0.00 0.00 0.00 177.39 178.33 1hfn s LEU 25 N -0.04 2.60 0.05 1.47 2.96 -0.70 -1.83 118.68 123.20 1hfn s LEU 25 Ca 0.00 0.59 0.00 0.00 -0.22 0.00 0.00 54.13 54.50 1hfn s LEU 25 Cb 0.00 -2.99 0.00 0.00 0.50 0.00 0.00 46.19 43.70 1hfn s LEU 25 CO 0.00 -2.06 0.00 -0.24 -1.32 0.00 0.00 176.35 172.73 1hfn n SER 26 N -3.36 0.10 -0.49 3.68 2.88 -1.19 -4.38 113.62 110.85 1hfn n SER 26 Ca 0.10 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1hfn n SER 26 Cb 0.61 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 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 -1.17 -4.73 113.62 105.38 1hfn n SER 27 Ca 0.00 -0.49 -0.13 0.00 1.01 0.00 0.00 58.87 59.26 1hfn n SER 27 Cb 0.00 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.10 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 -3.40 -0.29 -0.09 1.43 1.48 -1.26 -1.78 118.94 115.03 1hfn s TRP 28 Ca 0.00 0.63 0.02 0.00 -1.06 0.00 0.00 56.10 55.70 1hfn s TRP 28 Cb 0.00 0.11 -0.02 0.00 -1.16 0.00 0.00 33.47 32.40 1hfn s TRP 28 CO 0.00 -0.25 -0.16 1.52 -4.06 0.00 0.00 176.95 174.00 1hfn s TYR 29 N -0.40 2.70 0.43 1.66 -0.85 -0.45 0.26 117.35 120.70 1hfn s TYR 29 Ca -0.05 -0.50 -0.14 0.00 -0.52 0.00 0.00 57.07 55.86 1hfn s TYR 29 Cb -0.03 -1.72 -0.08 0.00 0.38 0.00 0.00 41.96 40.51 1hfn s TYR 29 CO 0.02 -0.08 0.84 -1.25 -1.52 0.00 0.00 175.55 173.56 1hfn s PRO 30 N -0.11 3.90 0.55 -3.49 0.04 -1.26 -2.16 135.00 132.46 1hfn s PRO 30 Ca -0.02 0.70 0.03 0.00 0.04 0.00 0.00 61.00 61.75 1hfn s PRO 30 Cb -0.14 -2.30 0.03 0.00 0.04 0.00 0.00 34.50 32.13 1hfn s PRO 30 CO 0.04 -0.07 0.27 -0.08 0.04 0.00 0.00 177.00 177.19 1hfn s THR 31 N -2.37 1.37 0.30 1.26 -1.32 -1.21 -4.95 115.64 108.72 1hfn s THR 31 Ca 0.55 -1.68 -0.30 0.00 -1.21 0.00 0.00 61.69 59.06 1hfn s THR 31 Cb -0.10 -2.05 -0.11 0.00 -1.51 0.00 0.00 72.50 68.73 1hfn s THR 31 CO 0.28 0.00 1.52 -0.44 -2.21 0.00 0.00 174.62 173.77 1hfn s SER 32 N -4.16 6.46 -0.27 8.08 0.01 -1.26 -4.87 113.70 117.68 1hfn s SER 32 Ca 0.21 2.88 0.08 0.00 1.31 0.00 0.00 55.95 60.44 1hfn s SER 32 Cb -0.01 -2.64 0.63 0.00 0.21 0.00 0.00 66.02 64.21 1hfn s SER 32 CO 0.13 -0.84 1.64 0.00 0.41 0.00 0.00 173.24 174.59 1hfn n GLN 33 N 1.87 3.30 -1.10 12.44 0.00 -1.26 -4.19 117.38 128.44 1hfn n GLN 33 Ca 0.06 -2.57 -0.05 0.00 0.00 0.00 0.00 57.00 54.44 1hfn n GLN 33 Cb 0.39 -2.07 0.14 0.00 0.00 0.00 0.00 30.24 28.70 1hfn n GLN 33 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.06 178.53 1hfn n LEU 34 N -0.08 3.58 -4.87 2.61 -0.00 -1.26 -5.01 117.00 111.97 1hfn n LEU 34 Ca 0.35 -4.20 -0.28 0.00 -0.00 0.00 0.00 56.01 51.88 1hfn n LEU 34 Cb 1.23 -0.47 -0.02 0.00 -0.00 0.00 0.00 43.42 44.15 1hfn n LEU 34 CO 0.37 1.64 -0.03 0.00 -0.00 0.00 0.00 177.39 179.38 1hfn h SER 36 N 0.91 0.44 -2.40 0.00 0.87 -1.95 -3.39 113.55 108.02 1hfn h SER 36 Ca -0.39 -0.38 -0.59 0.00 -1.23 0.00 0.00 61.79 59.20 1hfn h SER 36 Cb 1.30 -0.14 -0.38 0.00 -0.44 0.00 0.00 62.40 62.74 1hfn h SER 36 CO 0.62 1.21 -0.95 0.29 -0.53 0.00 0.00 176.83 177.47 1hfn n LYS 37 N -3.68 0.40 -2.06 2.24 5.02 -1.26 -5.13 118.16 113.69 1hfn n LYS 37 Ca -0.06 -3.31 -0.29 0.00 -2.02 0.00 0.00 58.31 52.62 1hfn n LYS 37 Cb 0.87 -1.70 0.04 0.00 -0.02 0.00 0.00 35.03 34.22 1hfn n LYS 37 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1hfn s PRO 38 N -0.19 2.83 0.00 1.97 0.04 -1.26 -4.41 135.00 133.98 1hfn s PRO 38 Ca 0.32 0.29 0.00 0.00 0.04 0.00 0.00 61.00 61.65 1hfn s PRO 38 Cb 0.04 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1hfn s PRO 38 CO -0.19 -0.95 0.00 0.41 0.04 0.00 0.00 177.00 176.31 1hfn n GLY 39 N -2.88 1.31 3.28 0.56 0.00 -1.26 -4.87 105.19 101.33 1hfn n GLY 39 Ca 0.06 0.02 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 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 0.67 -0.01 -0.19 1.61 1.01 -0.03 -3.29 120.40 120.18 1hfn s VAL 40 Ca 0.00 0.03 -0.12 0.00 0.00 0.00 0.00 61.98 61.89 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 0.01 0.20 -0.63 0.00 0.00 0.00 175.10 174.68 1hfn s ILE 41 N 0.57 5.36 -0.02 2.22 1.09 -0.92 0.93 121.20 130.44 1hfn s ILE 41 Ca -0.03 0.32 -0.19 0.00 -1.10 0.00 0.00 60.65 59.65 1hfn s ILE 41 Cb -0.05 -3.54 -0.05 0.00 -1.06 0.00 0.00 42.46 37.77 1hfn s ILE 41 CO -0.03 0.41 0.55 -0.36 -0.10 0.00 0.00 174.94 175.41 1hfn s PHE 42 N 0.51 3.67 -0.43 3.97 0.40 0.38 -1.34 117.98 125.13 1hfn s PHE 42 Ca 0.11 1.13 -0.07 0.00 -0.60 0.00 0.00 56.93 57.50 1hfn s PHE 42 Cb -0.12 -2.56 0.10 0.00 0.51 0.00 0.00 43.02 40.95 1hfn s PHE 42 CO 0.01 0.37 0.26 -0.51 0.70 0.00 0.00 175.22 176.05 1hfn s LEU 43 N -0.20 5.33 1.10 -0.37 2.01 -0.74 -1.89 118.68 123.92 1hfn s LEU 43 Ca 0.29 -1.82 -0.12 0.00 0.01 0.00 0.00 54.13 52.49 1hfn s LEU 43 Cb -0.18 -1.93 0.24 0.00 0.01 0.00 0.00 46.19 44.34 1hfn s LEU 43 CO 0.16 -0.59 1.05 0.42 1.01 0.00 0.00 176.35 178.41 1hfn s THR 44 N 1.30 2.07 0.07 5.49 -4.23 -1.12 -3.01 115.64 116.21 1hfn s THR 44 Ca 0.05 0.02 -0.31 0.00 -1.18 0.00 0.00 61.69 60.27 1hfn s THR 44 Cb -0.24 -2.21 -0.18 0.00 1.34 0.00 0.00 72.50 71.21 1hfn s THR 44 CO -0.01 -0.03 1.61 0.11 -0.54 0.00 0.00 174.62 175.76 1hfn h LYS 45 N -2.35 -0.75 0.00 3.99 1.57 -1.56 -3.39 116.57 114.08 1hfn h LYS 45 Ca -0.58 0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1hfn h LYS 45 Cb 1.33 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.81 1hfn h LYS 45 CO 0.52 -0.49 0.00 -2.13 -0.57 0.00 0.00 179.45 176.78 1hfn n ARG 46 N -5.42 0.04 0.00 3.15 0.63 -1.26 -5.02 116.66 108.78 1hfn n ARG 46 Ca -0.13 -0.39 0.00 0.00 -0.92 0.00 0.00 57.85 56.41 1hfn n ARG 46 Cb 0.32 -0.70 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 -0.05 1.34 0.95 5.14 0.00 -1.26 -5.12 105.19 106.19 1hfn n GLY 47 Ca 0.00 -0.00 -0.03 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 0.23 -2.95 1.61 1.74 -1.26 -4.93 116.66 111.09 1hfn n ARG 48 Ca 0.00 -0.70 -0.28 0.00 -0.77 0.00 0.00 57.85 56.10 1hfn n ARG 48 Cb 0.00 0.74 -0.02 0.00 -1.02 0.00 0.00 32.46 32.16 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 -2.15 3.64 -0.22 5.56 1.11 -1.26 -2.81 119.66 123.53 1hfn s GLN 49 Ca 0.07 0.19 -0.06 0.00 0.01 0.00 0.00 55.36 55.57 1hfn s GLN 49 Cb -0.01 -2.47 0.11 0.00 -1.01 0.00 0.00 33.01 29.63 1hfn s GLN 49 CO 0.05 -0.01 0.45 0.08 0.01 0.00 0.00 175.29 175.86 1hfn s VAL 50 N -2.41 -0.70 -0.03 1.09 1.01 -0.79 -4.92 120.40 113.65 1hfn s VAL 50 Ca 0.47 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 62.25 1hfn s VAL 50 Cb -0.10 -0.75 -0.05 0.00 0.00 0.00 0.00 36.38 35.47 1hfn s VAL 50 CO 0.36 0.02 1.48 0.00 0.00 0.00 0.00 175.10 176.96 1hfn s ALA 52 N 2.99 0.00 0.04 0.00 0.00 0.26 0.14 121.76 125.19 1hfn s ALA 52 Ca 0.66 0.36 -0.24 0.00 0.00 0.00 0.00 51.96 52.75 1hfn s ALA 52 Cb -0.32 -0.27 -0.06 0.00 0.00 0.00 0.00 23.12 22.47 1hfn s ALA 52 CO 0.26 -0.11 0.72 -0.51 0.00 0.00 0.00 175.76 176.12 1hfn s ASP 53 N 1.01 7.16 0.60 0.00 1.01 -1.26 -0.85 116.67 124.34 1hfn s ASP 53 Ca -0.08 1.38 0.31 0.00 0.71 0.00 0.00 52.55 54.88 1hfn s ASP 53 Cb -0.12 -2.44 1.89 0.00 1.01 0.00 0.00 42.92 43.26 1hfn s ASP 53 CO -0.03 0.06 2.26 0.07 0.21 0.00 0.00 175.17 177.73 1hfn h LYS 54 N 5.54 0.00 -0.32 8.23 2.10 -1.92 -1.53 116.57 128.66 1hfn h LYS 54 Ca -0.45 0.00 0.09 0.00 -2.00 0.00 0.00 60.65 58.30 1hfn h LYS 54 Cb 1.20 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.52 1hfn h LYS 54 CO 0.70 0.00 0.26 0.77 -2.00 0.00 0.00 179.45 179.18 1hfn h SER 55 N 0.00 0.00 -3.09 7.07 0.02 -1.98 -3.38 113.55 112.19 1hfn h SER 55 Ca 0.01 0.00 -0.41 0.00 -0.84 0.00 0.00 61.79 60.55 1hfn h SER 55 Cb 0.04 0.00 0.22 0.00 0.14 0.00 0.00 62.40 62.80 1hfn h SER 55 CO -0.00 0.00 -0.07 -0.54 -1.14 0.00 0.00 176.83 175.08 1hfn s LYS 56 N -4.90 -2.01 -0.24 3.45 1.02 -0.58 -4.97 119.74 111.52 1hfn s LYS 56 Ca -0.05 0.53 -0.07 0.00 0.02 0.00 0.00 55.97 56.40 1hfn s LYS 56 Cb 0.18 -1.45 -0.17 0.00 -0.52 0.00 0.00 37.83 35.86 1hfn s LYS 56 CO 0.66 -4.36 -0.12 -0.40 -0.92 0.00 0.00 175.35 170.21 1hfn n ASP 57 N -5.33 1.99 0.17 2.83 5.75 -1.26 -3.68 116.55 117.01 1hfn n ASP 57 Ca 0.07 0.12 0.03 0.00 -0.01 0.00 0.00 54.79 54.99 1hfn n ASP 57 Cb 0.57 -0.67 0.28 0.00 -1.03 0.00 0.00 41.12 40.27 1hfn n ASP 57 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 1hfn h TRP 58 N -0.38 0.00 -0.09 2.11 5.08 -1.94 -2.88 115.95 117.84 1hfn h TRP 58 Ca -0.57 0.00 -0.19 0.00 1.08 0.00 0.00 58.89 59.22 1hfn h TRP 58 Cb 1.78 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.93 1hfn h TRP 58 CO 0.01 0.47 -0.73 0.28 -1.28 0.00 0.00 178.44 177.19 1hfn h VAL 59 N 0.00 1.37 -0.51 0.12 2.07 -1.85 -2.89 116.25 114.56 1hfn h VAL 59 Ca -0.00 -2.12 -0.03 0.00 0.82 0.00 0.00 66.70 65.37 1hfn h VAL 59 Cb 0.93 2.09 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 1hfn h VAL 59 CO 0.06 0.64 0.21 0.50 0.02 0.00 0.00 177.57 179.00 1hfn h LYS 60 N 0.30 0.77 -0.67 1.57 3.64 -1.59 -1.53 116.57 119.05 1hfn h LYS 60 Ca -0.03 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 1hfn h LYS 60 Cb 1.31 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.97 1hfn h LYS 60 CO 0.13 0.68 0.37 0.87 -2.27 0.00 0.00 179.45 179.22 1hfn h LYS 61 N 0.69 0.93 -0.61 1.90 1.57 -1.50 -2.51 116.57 117.03 1hfn h LYS 61 Ca 0.17 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1hfn h LYS 61 Cb 0.19 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 1hfn h LYS 61 CO -0.01 0.70 0.36 -0.07 -0.57 0.00 0.00 179.45 179.86 1hfn h LEU 62 N 0.92 0.74 -1.09 2.94 3.38 -1.28 0.41 115.31 121.33 1hfn h LEU 62 Ca 0.24 -0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.30 1hfn h LEU 62 Cb 0.04 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 40.51 1hfn h LEU 62 CO -0.04 0.59 0.61 0.24 0.09 0.00 0.00 178.44 179.94 1hfn h MET 63 N 0.83 0.79 0.01 1.13 2.86 -0.86 0.56 114.93 120.25 1hfn h MET 63 Ca 0.22 -0.05 -0.25 0.00 -2.06 0.00 0.00 59.70 57.56 1hfn h MET 63 Cb -0.01 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.43 1hfn h MET 63 CO -0.04 0.52 -1.36 1.96 1.06 0.00 0.00 176.91 179.05 1hfn h GLN 64 N 0.81 0.02 -0.01 1.72 1.08 -1.10 -3.31 115.11 114.32 1hfn h GLN 64 Ca 0.52 -0.04 -0.12 0.00 -1.45 0.00 0.00 58.65 57.57 1hfn h GLN 64 Cb 0.74 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.17 1hfn h GLN 64 CO -0.29 0.78 -0.56 1.96 -0.95 0.00 0.00 178.83 179.77 1hfn h GLN 65 N 0.01 0.03 -6.37 1.46 1.08 0.14 -3.44 115.11 108.02 1hfn h GLN 65 Ca -0.15 -0.02 -0.61 0.00 -1.45 0.00 0.00 58.65 56.41 1hfn h GLN 65 Cb 1.90 0.00 -0.14 0.00 -0.05 0.00 0.00 27.48 29.19 1hfn h GLN 65 CO 0.11 0.58 -0.74 -0.51 -0.95 0.00 0.00 178.83 177.32 1hfn s LEU 66 N -7.78 2.77 0.00 1.46 1.43 0.18 -5.05 118.68 111.68 1hfn s LEU 66 Ca -0.02 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.28 1hfn s LEU 66 Cb 0.13 -1.38 0.00 0.00 0.03 0.00 0.00 46.19 44.97 1hfn s LEU 66 CO 0.76 0.07 0.01 -0.81 0.23 0.00 0.00 176.35 176.61 1hfn n PRO 67 N -0.29 0.00 -3.59 1.29 -0.04 -1.26 -4.68 135.00 126.43 1hfn n PRO 67 Ca -0.09 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.41 1hfn n PRO 67 Cb 0.58 -0.19 -0.00 0.00 -0.04 0.00 0.00 33.50 33.85 1hfn n PRO 67 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1hfn s VAL 68 N -0.02 0.00 0.19 0.52 0.11 -1.26 -4.82 120.40 115.12 1hfn s VAL 68 Ca 0.00 -0.04 -0.12 0.00 -2.93 0.00 0.00 61.98 58.89 1hfn s VAL 68 Cb 0.00 -2.05 0.11 0.00 -1.53 0.00 0.00 36.38 32.91 1hfn s VAL 68 CO 0.00 0.00 1.85 0.00 -3.33 0.00 0.00 175.10 173.62 1hfn h THR 69 N 2.00 1.14 -3.53 5.04 1.03 -0.57 -3.43 112.91 114.60 1hfn h THR 69 Ca -0.33 -0.29 0.32 0.00 -0.01 0.00 0.00 66.41 66.11 1hfn h THR 69 Cb 1.19 0.23 -0.18 0.00 -1.07 0.00 0.00 68.15 68.32 1hfn h THR 69 CO 0.30 0.15 -1.26 0.00 -0.01 0.00 0.00 175.52 174.70 1hfn n ALA 70 N -2.28 -3.65 0.63 0.00 0.00 -1.26 -5.06 120.51 108.89 1hfn n ALA 70 Ca 0.05 0.91 0.08 0.00 0.00 0.00 0.00 53.44 54.48 1hfn n ALA 70 Cb 0.03 -1.58 0.06 0.00 0.00 0.00 0.00 19.45 17.97 1hfn n ALA 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04