#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfh n LYS 2 N 0.00 0.00 -3.13 3.49 5.02 -1.26 -4.88 118.16 117.39 1hfh n LYS 2 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.90 1hfh n LYS 2 Cb 0.00 -0.09 -0.06 0.00 -0.02 0.00 0.00 35.03 34.86 1hfh n LYS 2 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1hfh s ILE 3 N -0.05 4.56 0.91 -0.18 1.09 -1.26 -4.88 121.20 121.39 1hfh s ILE 3 Ca 0.05 1.45 -0.11 0.00 -1.10 0.00 0.00 60.65 60.94 1hfh s ILE 3 Cb -0.08 -4.02 0.14 0.00 -1.06 0.00 0.00 42.46 37.45 1hfh s ILE 3 CO 0.04 0.54 1.09 -2.16 -0.10 0.00 0.00 174.94 174.35 1hfh s PRO 4 N -1.12 1.13 0.53 2.79 0.04 -1.26 0.22 135.00 137.33 1hfh s PRO 4 Ca 0.32 0.98 0.09 0.00 0.04 0.00 0.00 61.00 62.43 1hfh s PRO 4 Cb -0.21 -1.78 0.06 0.00 0.04 0.00 0.00 34.50 32.60 1hfh s PRO 4 CO 0.22 -2.37 0.68 0.00 0.04 0.00 0.00 177.00 175.57 1hfh n SER 6 N -2.06 1.92 -3.02 0.00 3.41 -1.26 -1.33 113.62 111.29 1hfh n SER 6 Ca 0.11 -0.95 -0.43 0.00 -0.26 0.00 0.00 58.87 57.35 1hfh n SER 6 Cb 0.61 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.48 1hfh n SER 6 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hfh n GLN 7 N -0.04 0.00 -0.87 4.33 1.13 -0.53 -4.64 117.38 116.76 1hfh n GLN 7 Ca 0.00 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 54.71 1hfh n GLN 7 Cb 0.00 -1.04 0.09 0.00 0.11 0.00 0.00 30.24 29.40 1hfh n GLN 7 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1hfh n PRO 8 N 4.83 -0.39 -0.43 -1.09 -0.04 -1.26 -4.94 135.00 131.66 1hfh n PRO 8 Ca 0.36 -0.10 -0.09 0.00 -0.04 0.00 0.00 63.50 63.63 1hfh n PRO 8 Cb -0.03 -1.43 0.07 0.00 -0.04 0.00 0.00 33.50 32.07 1hfh n PRO 8 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1hfh n PRO 9 N 0.16 -1.19 -4.24 0.54 -0.04 -1.26 -4.91 135.00 124.06 1hfh n PRO 9 Ca 0.02 -0.59 -0.21 0.00 -0.04 0.00 0.00 63.50 62.68 1hfh n PRO 9 Cb 0.59 -0.48 -0.12 0.00 -0.04 0.00 0.00 33.50 33.45 1hfh n PRO 9 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1hfh s GLN 10 N -3.83 1.01 0.26 0.54 1.11 -1.26 -4.52 119.66 112.96 1hfh s GLN 10 Ca 0.23 -1.10 -0.07 0.00 0.01 0.00 0.00 55.36 54.43 1hfh s GLN 10 Cb -0.02 -1.13 -0.06 0.00 -1.01 0.00 0.00 33.01 30.79 1hfh s GLN 10 CO 0.17 0.26 0.55 0.42 0.01 0.00 0.00 175.29 176.70 1hfh s ILE 11 N -1.32 4.98 0.05 1.08 1.01 -1.14 -4.86 121.20 121.00 1hfh s ILE 11 Ca 0.04 0.26 0.00 0.00 0.00 0.00 0.00 60.65 60.95 1hfh s ILE 11 Cb -0.09 -3.68 0.06 0.00 0.01 0.00 0.00 42.46 38.76 1hfh s ILE 11 CO 0.03 -0.20 0.23 -1.84 0.00 0.00 0.00 174.94 173.16 1hfh n GLU 12 N -0.55 -0.01 -2.79 2.79 0.00 -1.26 -0.57 120.64 118.24 1hfh n GLU 12 Ca -0.01 0.22 -0.02 0.00 0.00 0.00 0.00 57.16 57.35 1hfh n GLU 12 Cb 0.53 -0.35 0.05 0.00 0.00 0.00 0.00 31.44 31.67 1hfh n GLU 12 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 1hfh n HIS 13 N -3.90 0.92 -4.24 -1.84 1.44 -1.26 -5.12 115.22 101.22 1hfh n HIS 13 Ca 0.04 -2.23 -0.17 0.00 -2.01 0.00 0.00 57.72 53.34 1hfh n HIS 13 Cb 0.12 -0.09 -0.08 0.00 0.12 0.00 0.00 29.99 30.06 1hfh n HIS 13 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1hfh s GLY 14 N -3.43 2.06 0.23 -1.39 0.00 0.26 -2.56 107.32 102.49 1hfh s GLY 14 Ca 0.26 -1.93 -0.05 0.00 0.00 0.00 0.00 44.72 43.00 1hfh s GLY 14 CO -0.03 -1.38 0.28 -1.59 0.00 0.00 0.00 173.10 170.37 1hfh s THR 15 N -3.50 0.00 0.38 0.90 2.01 -0.18 -2.90 115.64 112.35 1hfh s THR 15 Ca 0.39 -1.77 -0.24 0.00 0.31 0.00 0.00 61.69 60.38 1hfh s THR 15 Cb 0.03 -2.40 -0.10 0.00 0.01 0.00 0.00 72.50 70.03 1hfh s THR 15 CO 0.24 0.00 0.99 -0.51 -0.69 0.00 0.00 174.62 174.65 1hfh s ILE 16 N -4.02 4.04 -0.59 1.82 1.10 -1.26 -2.18 121.20 120.11 1hfh s ILE 16 Ca 0.33 1.54 0.05 0.00 -0.51 0.00 0.00 60.65 62.06 1hfh s ILE 16 Cb 0.04 -3.78 0.32 0.00 0.15 0.00 0.00 42.46 39.19 1hfh s ILE 16 CO 0.12 -0.02 0.90 -3.20 -2.11 0.00 0.00 174.94 170.64 1hfh n ASN 17 N 0.02 4.25 -3.94 4.50 2.85 -1.06 -4.78 115.26 117.10 1hfh n ASN 17 Ca 0.04 -3.62 -0.30 0.00 -0.11 0.00 0.00 54.58 50.59 1hfh n ASN 17 Cb 0.51 -0.59 -0.14 0.00 1.24 0.00 0.00 39.78 40.80 1hfh n ASN 17 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1hfh s SER 18 N -3.23 4.44 -0.77 1.20 0.15 -1.26 -4.50 113.70 109.73 1hfh s SER 18 Ca 0.47 -2.47 -0.10 0.00 0.70 0.00 0.00 55.95 54.54 1hfh s SER 18 Cb 0.25 -1.51 0.01 0.00 -1.71 0.00 0.00 66.02 63.06 1hfh s SER 18 CO -0.11 -0.32 0.50 -1.54 1.20 0.00 0.00 173.24 172.97 1hfh n SER 19 N 3.82 -3.58 0.00 5.45 3.41 -1.26 -4.59 113.62 116.87 1hfh n SER 19 Ca 0.04 -0.87 0.00 0.00 -0.26 0.00 0.00 58.87 57.78 1hfh n SER 19 Cb 0.38 -1.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 1hfh n SER 19 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1hfh n ARG 20 N -2.93 0.00 -3.87 4.33 5.12 -1.26 -2.48 116.66 115.57 1hfh n ARG 20 Ca -0.20 0.00 -0.30 0.00 -1.93 0.00 0.00 57.85 55.42 1hfh n ARG 20 Cb 0.51 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.67 1hfh n ARG 20 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1hfh s SER 21 N -0.28 4.23 0.04 0.55 0.15 -1.26 -4.85 113.70 112.27 1hfh s SER 21 Ca 0.00 -2.43 0.00 0.00 0.70 0.00 0.00 55.95 54.22 1hfh s SER 21 Cb 0.00 -1.35 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 1hfh s SER 21 CO 0.00 -0.31 0.00 -1.54 1.20 0.00 0.00 173.24 172.59 1hfh n SER 22 N 3.85 0.40 -4.64 5.45 3.41 -1.04 -5.09 113.62 115.96 1hfh n SER 22 Ca 0.04 0.06 -0.25 0.00 -0.26 0.00 0.00 58.87 58.46 1hfh n SER 22 Cb 0.37 -0.11 -0.09 0.00 -0.26 0.00 0.00 64.21 64.12 1hfh n SER 22 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1hfh s GLN 23 N -2.00 2.07 -0.06 4.33 -0.21 -1.26 -5.05 119.66 117.48 1hfh s GLN 23 Ca 0.00 -1.84 -0.00 0.00 0.02 0.00 0.00 55.36 53.54 1hfh s GLN 23 Cb 0.00 -1.88 -0.04 0.00 1.00 0.00 0.00 33.01 32.10 1hfh s GLN 23 CO 0.00 0.06 -0.06 0.39 -2.12 0.00 0.00 175.29 173.56 1hfh n GLU 24 N -1.00 0.14 -4.22 2.91 -0.58 -1.26 -4.99 120.64 111.64 1hfh n GLU 24 Ca -0.04 0.04 -0.26 0.00 -0.42 0.00 0.00 57.16 56.49 1hfh n GLU 24 Cb 0.64 -1.02 -0.08 0.00 -0.57 0.00 0.00 31.44 30.41 1hfh n GLU 24 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1hfh s SER 25 N -4.82 4.74 0.32 1.62 1.04 -1.26 -1.46 113.70 113.88 1hfh s SER 25 Ca -0.08 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 55.96 1hfh s SER 25 Cb 0.02 -0.99 -0.06 0.00 0.10 0.00 0.00 66.02 65.09 1hfh s SER 25 CO 0.13 0.07 0.01 -0.31 0.98 0.00 0.00 173.24 174.12 1hfh s TYR 26 N -1.85 2.01 0.63 5.02 1.51 -0.44 -4.95 117.35 119.27 1hfh s TYR 26 Ca 0.28 -0.84 -0.02 0.00 -1.01 0.00 0.00 57.07 55.48 1hfh s TYR 26 Cb -0.09 -1.27 0.13 0.00 -0.11 0.00 0.00 41.96 40.62 1hfh s TYR 26 CO 0.19 0.15 0.86 0.00 -1.11 0.00 0.00 175.55 175.63 1hfh n ALA 27 N -0.67 -0.03 -2.50 3.71 0.00 -1.26 -0.76 120.51 118.99 1hfh n ALA 27 Ca -0.04 -1.58 -0.38 0.00 0.00 0.00 0.00 53.44 51.43 1hfh n ALA 27 Cb 0.65 0.22 -0.06 0.00 0.00 0.00 0.00 19.45 20.27 1hfh n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1hfh s HIS 28 N -2.62 3.68 0.00 0.00 -3.43 -1.26 -3.51 115.29 108.15 1hfh s HIS 28 Ca 0.55 1.13 0.00 0.00 -0.80 0.00 0.00 55.06 55.94 1hfh s HIS 28 Cb -0.03 -2.54 0.00 0.00 -1.43 0.00 0.00 32.58 28.58 1hfh s HIS 28 CO 0.37 0.39 0.00 0.41 -2.00 0.00 0.00 174.74 173.91 1hfh n GLY 29 N 2.41 0.84 3.42 -1.38 0.00 -0.29 -5.03 105.19 105.16 1hfh n GLY 29 Ca -0.08 -0.62 -0.35 0.00 0.00 0.00 0.00 46.02 44.96 1hfh n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hfh s THR 30 N -2.39 3.91 -0.22 2.61 2.01 -1.23 -4.90 115.64 115.43 1hfh s THR 30 Ca 0.00 -0.32 0.02 0.00 0.31 0.00 0.00 61.69 61.70 1hfh s THR 30 Cb 0.00 -2.78 0.04 0.00 0.01 0.00 0.00 72.50 69.77 1hfh s THR 30 CO 0.00 0.41 -0.15 -1.59 -0.69 0.00 0.00 174.62 172.61 1hfh s LYS 31 N 1.17 2.54 0.35 4.92 -2.85 -1.26 -0.08 119.74 124.53 1hfh s LYS 31 Ca 0.03 -1.10 0.07 0.00 -1.00 0.00 0.00 55.97 53.98 1hfh s LYS 31 Cb -0.14 -2.72 -0.02 0.00 -2.06 0.00 0.00 37.83 32.88 1hfh s LYS 31 CO 0.01 -0.41 0.34 -0.51 0.10 0.00 0.00 175.35 174.88 1hfh s LEU 32 N 1.20 3.63 0.44 2.77 1.43 -0.84 -4.92 118.68 122.40 1hfh s LEU 32 Ca -0.03 -0.48 0.06 0.00 -1.03 0.00 0.00 54.13 52.65 1hfh s LEU 32 Cb -0.17 -2.29 0.01 0.00 0.03 0.00 0.00 46.19 43.77 1hfh s LEU 32 CO -0.09 -0.42 0.61 -0.44 0.23 0.00 0.00 176.35 176.24 1hfh s SER 33 N -4.05 5.63 0.26 2.29 0.01 -1.26 -1.38 113.70 115.19 1hfh s SER 33 Ca 0.43 -0.25 0.06 0.00 1.31 0.00 0.00 55.95 57.50 1hfh s SER 33 Cb -0.06 -0.85 -0.05 0.00 0.21 0.00 0.00 66.02 65.26 1hfh s SER 33 CO 0.28 -0.79 -0.05 -0.31 0.41 0.00 0.00 173.24 172.77 1hfh s TYR 34 N -2.43 1.81 -0.04 2.43 2.02 0.14 -2.57 117.35 118.71 1hfh s TYR 34 Ca 0.53 -0.75 -0.15 0.00 -0.37 0.00 0.00 57.07 56.34 1hfh s TYR 34 Cb -0.10 -1.02 0.03 0.00 -0.40 0.00 0.00 41.96 40.47 1hfh s TYR 34 CO 0.34 0.20 0.33 0.99 -1.57 0.00 0.00 175.55 175.84 1hfh s THR 35 N -3.12 0.04 0.32 -0.71 2.01 -0.93 -4.71 115.64 108.54 1hfh s THR 35 Ca 0.28 -0.37 0.06 0.00 0.31 0.00 0.00 61.69 61.97 1hfh s THR 35 Cb 0.04 -0.61 -0.06 0.00 0.01 0.00 0.00 72.50 71.87 1hfh s THR 35 CO 0.10 -0.20 -0.00 0.00 -0.69 0.00 0.00 174.62 173.83 1hfh n GLU 37 N -0.70 0.00 -1.67 0.00 0.28 -1.06 -4.75 120.64 112.74 1hfh n GLU 37 Ca -0.04 0.00 -0.44 0.00 -0.16 0.00 0.00 57.16 56.52 1hfh n GLU 37 Cb 0.65 -0.86 -0.04 0.00 1.43 0.00 0.00 31.44 32.63 1hfh n GLU 37 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1hfh n GLY 38 N 2.80 1.74 0.00 -1.84 0.00 -1.26 -2.84 105.19 103.79 1hfh n GLY 38 Ca 0.00 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.85 1hfh n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hfh n GLY 39 N 4.50 2.25 0.73 -0.02 0.00 -1.26 -5.09 105.19 106.30 1hfh n GLY 39 Ca 0.21 -0.78 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 1hfh n GLY 39 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hfh n PHE 40 N 0.00 -0.11 -4.59 1.61 3.01 -1.13 -4.95 117.46 111.30 1hfh n PHE 40 Ca 0.00 0.21 -0.34 0.00 1.01 0.00 0.00 57.45 58.33 1hfh n PHE 40 Cb 0.00 -0.42 -0.11 0.00 -0.01 0.00 0.00 39.48 38.94 1hfh n PHE 40 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1hfh s ARG 41 N -0.21 2.75 -0.16 -1.08 0.52 -0.87 -4.91 118.95 114.99 1hfh s ARG 41 Ca 0.14 -0.55 -0.03 0.00 -0.52 0.00 0.00 55.73 54.77 1hfh s ARG 41 Cb -0.20 -2.60 -0.02 0.00 0.52 0.00 0.00 34.95 32.65 1hfh s ARG 41 CO 0.12 0.66 -0.06 -1.50 0.02 0.00 0.00 175.30 174.54 1hfh s ILE 42 N -0.83 3.60 0.24 1.52 2.07 -1.26 -1.28 121.20 125.25 1hfh s ILE 42 Ca 0.13 -0.46 0.10 0.00 -1.41 0.00 0.00 60.65 59.01 1hfh s ILE 42 Cb -0.11 -2.57 -0.04 0.00 0.13 0.00 0.00 42.46 39.87 1hfh s ILE 42 CO 0.02 0.49 -0.10 -0.94 -1.91 0.00 0.00 174.94 172.50 1hfh s SER 43 N 0.50 4.12 -0.34 4.50 1.04 -0.55 -4.87 113.70 118.09 1hfh s SER 43 Ca -0.05 -0.76 -0.06 0.00 0.48 0.00 0.00 55.95 55.56 1hfh s SER 43 Cb -0.15 -0.61 0.01 0.00 0.10 0.00 0.00 66.02 65.37 1hfh s SER 43 CO 0.03 0.05 0.23 1.21 0.98 0.00 0.00 173.24 175.74 1hfh n GLU 44 N -0.50 -2.97 0.00 4.02 2.13 -1.26 -2.44 120.64 119.62 1hfh n GLU 44 Ca -0.08 2.47 0.00 0.00 0.66 0.00 0.00 57.16 60.22 1hfh n GLU 44 Cb 0.58 -5.37 0.00 0.00 0.27 0.00 0.00 31.44 26.92 1hfh n GLU 44 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1hfh n GLU 45 N 0.29 0.00 -1.48 5.31 2.13 -1.26 -4.40 120.64 121.22 1hfh n GLU 45 Ca 0.05 0.00 -0.36 0.00 0.66 0.00 0.00 57.16 57.51 1hfh n GLU 45 Cb 0.17 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.82 1hfh n GLU 45 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1hfh n ASN 46 N 0.93 2.52 -3.75 4.31 0.23 -1.26 -4.59 115.26 113.64 1hfh n ASN 46 Ca 0.00 -2.66 -0.14 0.00 -0.53 0.00 0.00 54.58 51.26 1hfh n ASN 46 Cb 0.00 -1.35 -0.09 0.00 -2.08 0.00 0.00 39.78 36.27 1hfh n ASN 46 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1hfh s GLU 47 N 6.02 0.68 0.18 -3.83 8.01 -1.26 -0.69 118.70 127.82 1hfh s GLU 47 Ca 0.65 -0.17 0.05 0.00 0.01 0.00 0.00 54.97 55.50 1hfh s GLU 47 Cb 0.07 0.30 -0.05 0.00 -4.31 0.00 0.00 34.13 30.15 1hfh s GLU 47 CO 0.15 -0.19 -0.08 -0.08 0.01 0.00 0.00 175.26 175.07 1hfh s THR 48 N -1.32 1.23 0.11 3.63 -1.32 -0.48 -4.03 115.64 113.46 1hfh s THR 48 Ca -0.13 -2.08 0.04 0.00 -1.21 0.00 0.00 61.69 58.31 1hfh s THR 48 Cb -0.05 -2.02 -0.04 0.00 -1.51 0.00 0.00 72.50 68.89 1hfh s THR 48 CO 0.04 -0.61 -0.10 -0.89 -2.21 0.00 0.00 174.62 170.85 1hfh s THR 49 N -3.29 1.01 -0.11 5.08 2.01 -1.26 -1.98 115.64 117.10 1hfh s THR 49 Ca 0.21 -1.74 0.02 0.00 0.31 0.00 0.00 61.69 60.48 1hfh s THR 49 Cb 0.03 -1.49 -0.01 0.00 0.01 0.00 0.00 72.50 71.04 1hfh s THR 49 CO 0.04 -0.60 -0.17 0.00 -0.69 0.00 0.00 174.62 173.20 1hfh s TYR 51 N 0.24 0.82 -0.35 0.00 5.04 0.18 -1.14 117.35 122.14 1hfh s TYR 51 Ca -0.11 -0.21 -0.03 0.00 -2.44 0.00 0.00 57.07 54.27 1hfh s TYR 51 Cb -0.16 -0.62 0.03 0.00 0.35 0.00 0.00 41.96 41.56 1hfh s TYR 51 CO 0.06 -0.12 0.09 -1.33 -1.34 0.00 0.00 175.55 172.92 1hfh n MET 52 N 3.50 -2.66 -0.18 4.97 2.81 -1.26 -0.27 117.12 124.04 1hfh n MET 52 Ca -0.20 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 55.76 1hfh n MET 52 Cb 0.54 -4.59 0.00 0.00 -0.71 0.00 0.00 33.22 28.46 1hfh n MET 52 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hfh n GLY 53 N -0.61 1.37 3.80 3.03 0.00 0.13 -4.23 105.19 108.68 1hfh n GLY 53 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1hfh n GLY 53 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hfh s LYS 54 N -0.45 3.08 0.26 1.61 2.20 0.63 -4.33 119.74 122.75 1hfh s LYS 54 Ca 0.00 -0.51 0.06 0.00 -0.36 0.00 0.00 55.97 55.17 1hfh s LYS 54 Cb 0.00 -2.86 -0.03 0.00 -1.51 0.00 0.00 37.83 33.42 1hfh s LYS 54 CO 0.00 0.63 0.27 -1.58 -0.36 0.00 0.00 175.35 174.31 1hfh s TRP 55 N -1.26 3.20 0.47 4.03 0.52 -1.26 -0.65 118.94 124.00 1hfh s TRP 55 Ca 0.25 -0.10 0.02 0.00 0.02 0.00 0.00 56.10 56.28 1hfh s TRP 55 Cb -0.12 -1.51 0.01 0.00 -1.15 0.00 0.00 33.47 30.70 1hfh s TRP 55 CO 0.16 0.44 0.69 -1.12 0.02 0.00 0.00 176.95 177.14 1hfh s SER 56 N -3.91 5.64 0.21 2.95 0.01 -0.37 -4.92 113.70 113.30 1hfh s SER 56 Ca 0.34 0.11 -0.31 0.00 1.31 0.00 0.00 55.95 57.40 1hfh s SER 56 Cb -0.08 -1.23 -0.11 0.00 0.21 0.00 0.00 66.02 64.81 1hfh s SER 56 CO 0.27 -0.84 1.62 -0.55 0.41 0.00 0.00 173.24 174.15 1hfh s SER 57 N -4.29 6.48 1.17 2.44 0.15 -1.26 -4.68 113.70 113.70 1hfh s SER 57 Ca 0.52 2.77 -0.17 0.00 0.70 0.00 0.00 55.95 59.77 1hfh s SER 57 Cb -0.10 -2.61 0.26 0.00 -1.71 0.00 0.00 66.02 61.86 1hfh s SER 57 CO 0.37 -0.88 0.59 -0.81 1.20 0.00 0.00 173.24 173.70 1hfh n PRO 58 N 3.54 -2.71 -0.38 5.44 -0.04 -1.26 -4.87 135.00 134.72 1hfh n PRO 58 Ca 0.13 -0.99 -0.19 0.00 -0.04 0.00 0.00 63.50 62.42 1hfh n PRO 58 Cb 0.37 -1.60 0.18 0.00 -0.04 0.00 0.00 33.50 32.42 1hfh n PRO 58 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1hfh n PRO 59 N -3.03 -2.42 -3.83 0.54 -0.04 -1.26 -5.00 135.00 119.96 1hfh n PRO 59 Ca 0.09 -0.90 -0.35 0.00 -0.04 0.00 0.00 63.50 62.30 1hfh n PRO 59 Cb 0.41 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.25 1hfh n PRO 59 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1hfh s GLN 60 N -3.89 1.91 0.01 0.54 -0.21 -1.02 -4.97 119.66 112.04 1hfh s GLN 60 Ca 0.41 -1.81 -0.04 0.00 0.02 0.00 0.00 55.36 53.94 1hfh s GLN 60 Cb -0.07 -3.49 -0.04 0.00 1.00 0.00 0.00 33.01 30.40 1hfh s GLN 60 CO 0.35 -1.03 0.24 0.00 -2.12 0.00 0.00 175.29 172.73 1hfh n GLU 62 N 0.91 -0.33 0.00 0.00 0.28 -0.41 -4.89 120.64 116.21 1hfh n GLU 62 Ca -0.10 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.90 1hfh n GLU 62 Cb 0.53 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.40 1hfh n GLU 62 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1hfh n GLY 63 N 0.00 2.07 3.75 -1.84 0.00 -1.26 -2.05 105.19 105.86 1hfh n GLY 63 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1hfh n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hfh s LEU 64 N 0.00 4.58 0.17 0.99 2.01 -1.26 -4.91 118.68 120.26 1hfh s LEU 64 Ca 0.00 1.84 -0.33 0.00 0.01 0.00 0.00 54.13 55.64 1hfh s LEU 64 Cb 0.00 -3.55 -0.14 0.00 0.01 0.00 0.00 46.19 42.51 1hfh s LEU 64 CO 0.00 0.08 1.51 -0.81 1.01 0.00 0.00 176.35 178.15 1hfh n PRO 65 N 1.99 2.02 -3.01 1.29 -0.04 -1.26 -3.20 135.00 132.80 1hfh n PRO 65 Ca -0.01 0.73 -0.19 0.00 -0.04 0.00 0.00 63.50 63.98 1hfh n PRO 65 Cb 0.48 -2.46 0.06 0.00 -0.04 0.00 0.00 33.50 31.54 1hfh n PRO 65 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hfh n LYS 67 N -2.22 0.75 -1.66 0.00 5.02 -1.16 -4.53 118.16 114.36 1hfh n LYS 67 Ca 0.15 -1.05 -0.30 0.00 -2.02 0.00 0.00 58.31 55.09 1hfh n LYS 67 Cb 0.61 -0.12 0.21 0.00 -0.02 0.00 0.00 35.03 35.71 1hfh n LYS 67 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1hfh s SER 68 N -2.29 2.34 0.74 4.39 0.15 -1.26 -4.52 113.70 113.26 1hfh s SER 68 Ca 0.22 0.36 -0.14 0.00 0.70 0.00 0.00 55.95 57.09 1hfh s SER 68 Cb -0.02 -0.45 0.05 0.00 -1.71 0.00 0.00 66.02 63.89 1hfh s SER 68 CO 0.14 -3.22 1.17 -2.84 1.20 0.00 0.00 173.24 169.68 1hfh s PRO 69 N -5.75 2.14 0.99 5.44 0.02 -1.26 -4.95 135.00 131.63 1hfh s PRO 69 Ca 0.73 1.60 -0.14 0.00 0.02 0.00 0.00 61.00 63.21 1hfh s PRO 69 Cb -0.05 -1.85 0.18 0.00 0.02 0.00 0.00 34.50 32.80 1hfh s PRO 69 CO 0.54 -1.80 1.15 -1.25 -0.33 0.00 0.00 177.00 175.31 1hfh s PRO 70 N -4.14 0.52 0.29 5.54 0.04 -1.26 -5.07 135.00 130.92 1hfh s PRO 70 Ca 0.70 0.15 0.07 0.00 0.04 0.00 0.00 61.00 61.97 1hfh s PRO 70 Cb -0.25 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 1hfh s PRO 70 CO 0.47 -2.59 0.27 -2.00 0.04 0.00 0.00 177.00 173.19 1hfh s GLU 71 N -5.35 2.89 0.44 4.56 2.12 -1.26 -4.86 118.70 117.24 1hfh s GLU 71 Ca 0.67 -1.14 0.03 0.00 0.36 0.00 0.00 54.97 54.89 1hfh s GLU 71 Cb -0.13 -2.57 -0.03 0.00 0.26 0.00 0.00 34.13 31.66 1hfh s GLU 71 CO 0.54 0.24 0.06 0.96 -0.54 0.00 0.00 175.26 176.53 1hfh s ILE 72 N -2.20 1.00 -0.07 -3.70 -4.36 -1.26 -5.08 121.20 105.53 1hfh s ILE 72 Ca 0.37 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.78 1hfh s ILE 72 Cb -0.07 -2.38 -0.25 0.00 1.25 0.00 0.00 42.46 41.01 1hfh s ILE 72 CO 0.26 0.00 0.56 0.77 0.24 0.00 0.00 174.94 176.77 1hfh h SER 73 N 1.65 0.25 -0.00 4.36 4.64 -2.00 -3.42 113.55 119.03 1hfh h SER 73 Ca -0.40 -0.52 0.00 0.00 -0.47 0.00 0.00 61.79 60.40 1hfh h SER 73 Cb 1.28 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1hfh h SER 73 CO 0.67 1.46 -0.14 1.41 -0.87 0.00 0.00 176.83 179.36 1hfh n HIS 74 N -3.31 0.00 -2.90 4.77 8.25 -1.26 -5.08 115.22 115.69 1hfh n HIS 74 Ca -0.24 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 1hfh n HIS 74 Cb 1.05 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.16 1hfh n HIS 74 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hfh n GLY 75 N 0.96 6.30 3.65 -1.41 0.00 -1.26 -2.90 105.19 110.52 1hfh n GLY 75 Ca 0.01 -1.67 -0.02 0.00 0.00 0.00 0.00 46.02 44.34 1hfh n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hfh s VAL 76 N 0.06 0.00 -0.26 1.61 0.11 -0.99 -4.56 120.40 116.36 1hfh s VAL 76 Ca 0.00 0.00 -0.10 0.00 -2.93 0.00 0.00 61.98 58.95 1hfh s VAL 76 Cb 0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 1hfh s VAL 76 CO 0.00 0.00 0.17 0.54 -3.33 0.00 0.00 175.10 172.48 1hfh s VAL 77 N 0.93 5.22 -0.30 2.04 0.11 -1.26 -0.58 120.40 126.56 1hfh s VAL 77 Ca -0.05 0.13 0.16 0.00 -2.93 0.00 0.00 61.98 59.30 1hfh s VAL 77 Cb -0.03 -3.46 -0.22 0.00 -1.53 0.00 0.00 36.38 31.13 1hfh s VAL 77 CO -0.12 0.29 0.48 0.00 -3.33 0.00 0.00 175.10 172.42 1hfh n ALA 78 N 4.79 3.16 -2.88 1.54 0.00 -1.26 -4.53 120.51 121.33 1hfh n ALA 78 Ca -0.15 -0.41 -0.32 0.00 0.00 0.00 0.00 53.44 52.56 1hfh n ALA 78 Cb 0.52 -0.57 -0.02 0.00 0.00 0.00 0.00 19.45 19.38 1hfh n ALA 78 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1hfh n HIS 79 N -1.80 3.55 -4.28 0.00 8.25 -1.26 -4.99 115.22 114.69 1hfh n HIS 79 Ca -0.01 -3.50 -0.28 0.00 -0.26 0.00 0.00 57.72 53.67 1hfh n HIS 79 Cb 0.36 -0.75 -0.10 0.00 1.12 0.00 0.00 29.99 30.62 1hfh n HIS 79 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1hfh s MET 80 N -3.66 1.98 0.00 -0.41 0.00 -1.26 -4.43 119.30 111.52 1hfh s MET 80 Ca 0.44 -1.19 0.00 0.00 0.00 0.00 0.00 55.69 54.94 1hfh s MET 80 Cb 0.23 -2.17 0.00 0.00 0.00 0.00 0.00 34.83 32.89 1hfh s MET 80 CO -0.12 0.46 0.00 0.43 0.00 0.00 0.00 175.02 175.80 1hfh n SER 81 N 0.43 0.00 -0.06 -1.18 7.64 -1.26 -5.06 113.62 114.13 1hfh n SER 81 Ca -0.13 -1.00 -0.08 0.00 1.01 0.00 0.00 58.87 58.66 1hfh n SER 81 Cb 0.54 -0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.68 1hfh n SER 81 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1hfh n ASP 82 N -3.00 2.99 -4.02 6.43 -0.08 -1.26 -4.80 116.55 112.81 1hfh n ASP 82 Ca 0.00 -0.06 -0.36 0.00 -1.51 0.00 0.00 54.79 52.85 1hfh n ASP 82 Cb 0.00 -0.12 -0.05 0.00 2.34 0.00 0.00 41.12 43.29 1hfh n ASP 82 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1hfh n SER 83 N -2.83 4.56 -4.54 1.67 3.41 -1.26 -4.66 113.62 109.97 1hfh n SER 83 Ca -0.22 -3.21 -0.41 0.00 -0.26 0.00 0.00 58.87 54.78 1hfh n SER 83 Cb 0.74 -1.05 -0.09 0.00 -0.26 0.00 0.00 64.21 63.55 1hfh n SER 83 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1hfh s TYR 84 N -1.74 3.21 -0.20 7.33 2.02 -1.26 -5.04 117.35 121.68 1hfh s TYR 84 Ca 0.30 -0.03 -0.06 0.00 -0.37 0.00 0.00 57.07 56.91 1hfh s TYR 84 Cb -0.03 -2.64 -0.03 0.00 -0.40 0.00 0.00 41.96 38.87 1hfh s TYR 84 CO -0.08 -0.41 0.02 -0.65 -1.57 0.00 0.00 175.55 172.86 1hfh s GLN 85 N 1.98 3.70 0.00 -0.62 1.11 -1.26 -1.78 119.66 122.79 1hfh s GLN 85 Ca 0.11 -0.48 0.00 0.00 0.01 0.00 0.00 55.36 55.00 1hfh s GLN 85 Cb -0.17 -3.12 0.00 0.00 -1.01 0.00 0.00 33.01 28.71 1hfh s GLN 85 CO 0.11 0.06 0.00 2.48 0.01 0.00 0.00 175.29 177.95 1hfh n TYR 86 N 4.13 0.00 -2.82 0.91 4.11 -1.19 -4.14 117.16 118.16 1hfh n TYR 86 Ca -0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.60 1hfh n TYR 86 Cb 0.52 0.00 0.03 0.00 -0.00 0.00 0.00 39.34 39.89 1hfh n TYR 86 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1hfh n GLY 87 N 0.00 0.02 3.40 -7.48 0.00 -0.21 -4.83 105.19 96.08 1hfh n GLY 87 Ca 0.00 -0.22 -0.20 0.00 0.00 0.00 0.00 46.02 45.59 1hfh n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1hfh s GLU 88 N -5.36 1.46 0.16 1.61 2.02 -1.25 -4.93 118.70 112.41 1hfh s GLU 88 Ca 0.22 -1.69 0.07 0.00 0.02 0.00 0.00 54.97 53.59 1hfh s GLU 88 Cb -0.10 -1.22 -0.04 0.00 0.10 0.00 0.00 34.13 32.87 1hfh s GLU 88 CO 0.28 0.14 -0.16 -1.83 0.02 0.00 0.00 175.26 173.71 1hfh s GLU 89 N -3.66 1.21 0.14 1.61 4.04 -1.26 -1.32 118.70 119.46 1hfh s GLU 89 Ca 0.26 -1.41 0.03 0.00 0.04 0.00 0.00 54.97 53.89 1hfh s GLU 89 Cb 0.01 -1.13 -0.04 0.00 0.02 0.00 0.00 34.13 32.98 1hfh s GLU 89 CO 0.10 0.21 -0.06 0.14 -1.84 0.00 0.00 175.26 173.81 1hfh s VAL 90 N -2.36 0.90 -0.10 1.83 -7.23 -1.09 -5.02 120.40 107.33 1hfh s VAL 90 Ca 0.16 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.33 1hfh s VAL 90 Cb -0.04 -1.89 0.02 0.00 0.56 0.00 0.00 36.38 35.03 1hfh s VAL 90 CO 0.05 -0.69 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.14 1hfh s THR 91 N -3.50 1.24 0.55 5.32 2.01 -1.26 -2.73 115.64 117.26 1hfh s THR 91 Ca 0.18 -0.47 0.09 0.00 0.31 0.00 0.00 61.69 61.80 1hfh s THR 91 Cb 0.04 -1.17 0.09 0.00 0.01 0.00 0.00 72.50 71.47 1hfh s THR 91 CO 0.00 0.39 0.76 -1.22 -0.69 0.00 0.00 174.62 173.87 1hfh n TYR 92 N 4.44 -2.33 -4.52 4.92 4.02 0.11 -4.36 117.16 119.44 1hfh n TYR 92 Ca -0.17 -2.01 -0.30 0.00 -0.01 0.00 0.00 57.90 55.40 1hfh n TYR 92 Cb 0.51 -0.52 -0.07 0.00 -0.02 0.00 0.00 39.34 39.24 1hfh n TYR 92 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1hfh s LYS 93 N -4.50 2.18 0.49 -0.72 1.02 0.26 -4.86 119.74 113.60 1hfh s LYS 93 Ca 0.58 -2.24 0.08 0.00 0.02 0.00 0.00 55.97 54.41 1hfh s LYS 93 Cb -0.05 -1.70 0.03 0.00 -0.52 0.00 0.00 37.83 35.60 1hfh s LYS 93 CO 0.37 -0.34 0.55 0.00 -0.92 0.00 0.00 175.35 175.01 1hfh n PHE 95 N -1.87 -1.01 -4.00 0.00 3.72 -1.14 -4.85 117.46 108.30 1hfh n PHE 95 Ca 0.07 -0.18 -0.35 0.00 -0.05 0.00 0.00 57.45 56.94 1hfh n PHE 95 Cb 0.62 -0.03 -0.09 0.00 -0.94 0.00 0.00 39.48 39.03 1hfh n PHE 95 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1hfh s GLU 96 N -2.16 3.93 0.00 -1.08 -6.30 -1.26 -4.16 118.70 107.67 1hfh s GLU 96 Ca 0.02 -0.33 0.00 0.00 -2.50 0.00 0.00 54.97 52.16 1hfh s GLU 96 Cb -0.00 -3.21 0.00 0.00 0.00 0.00 0.00 34.13 30.92 1hfh s GLU 96 CO 0.01 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.01 1hfh n GLY 97 N 3.41 0.83 3.82 -1.50 0.00 -1.26 -5.08 105.19 105.41 1hfh n GLY 97 Ca -0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 1hfh n GLY 97 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hfh s PHE 98 N -2.05 2.84 0.48 1.61 0.40 -1.26 -5.10 117.98 114.91 1hfh s PHE 98 Ca 0.00 -0.33 0.05 0.00 -0.60 0.00 0.00 56.93 56.05 1hfh s PHE 98 Cb 0.00 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.75 1hfh s PHE 98 CO 0.00 0.22 0.14 0.20 0.70 0.00 0.00 175.22 176.48 1hfh s GLY 99 N -3.96 2.63 0.13 4.36 0.00 -1.26 -4.93 107.32 104.30 1hfh s GLY 99 Ca 0.40 -1.29 0.10 0.00 0.00 0.00 0.00 44.72 43.93 1hfh s GLY 99 CO 0.25 -2.05 -0.20 -0.42 0.00 0.00 0.00 173.10 170.68 1hfh s ILE 100 N -2.76 2.71 0.00 0.90 1.01 -1.26 -0.95 121.20 120.84 1hfh s ILE 100 Ca 0.25 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 59.30 1hfh s ILE 100 Cb 0.02 -2.25 0.00 0.00 0.01 0.00 0.00 42.46 40.25 1hfh s ILE 100 CO 0.14 0.07 0.00 -0.67 0.00 0.00 0.00 174.94 174.48 1hfh n ASP 101 N 0.73 0.00 0.00 3.58 2.03 -0.08 -4.91 116.55 117.90 1hfh n ASP 101 Ca -0.16 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.15 1hfh n ASP 101 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 1hfh n ASP 101 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1hfh n GLY 102 N 5.00 0.69 3.73 0.27 0.00 -1.26 -4.95 105.19 108.67 1hfh n GLY 102 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1hfh n GLY 102 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1hfh s PRO 103 N 0.10 4.45 -0.49 1.61 0.05 -1.26 -4.76 135.00 134.70 1hfh s PRO 103 Ca 0.00 0.96 0.00 0.00 0.05 0.00 0.00 61.00 62.01 1hfh s PRO 103 Cb 0.00 -3.41 0.46 0.00 0.05 0.00 0.00 34.50 31.60 1hfh s PRO 103 CO 0.00 0.17 1.92 0.00 0.05 0.00 0.00 177.00 179.14 1hfh n ALA 104 N 3.32 5.62 -2.72 8.56 0.00 -1.26 -0.81 120.51 133.21 1hfh n ALA 104 Ca -0.02 -2.73 -0.32 0.00 0.00 0.00 0.00 53.44 50.38 1hfh n ALA 104 Cb 0.51 -1.54 -0.08 0.00 0.00 0.00 0.00 19.45 18.34 1hfh n ALA 104 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1hfh s ILE 105 N -3.52 1.23 -0.01 0.00 -4.36 -1.26 -0.72 121.20 112.56 1hfh s ILE 105 Ca 0.52 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.91 1hfh s ILE 105 Cb 0.42 -2.29 0.01 0.00 1.25 0.00 0.00 42.46 41.85 1hfh s ILE 105 CO 0.03 0.00 -0.00 0.00 0.24 0.00 0.00 174.94 175.21 1hfh s ALA 106 N -2.88 0.18 -0.15 2.27 0.00 -1.11 -1.01 121.76 119.06 1hfh s ALA 106 Ca 0.11 0.06 0.02 0.00 0.00 0.00 0.00 51.96 52.15 1hfh s ALA 106 Cb 0.03 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.01 1hfh s ALA 106 CO 0.06 -0.02 -0.21 0.21 0.00 0.00 0.00 175.76 175.80 1hfh s LYS 107 N 0.44 3.04 0.37 0.00 2.20 -1.04 -2.68 119.74 122.07 1hfh s LYS 107 Ca -0.04 -0.84 -0.24 0.00 -0.36 0.00 0.00 55.97 54.49 1hfh s LYS 107 Cb -0.06 -2.47 -0.10 0.00 -1.51 0.00 0.00 37.83 33.69 1hfh s LYS 107 CO -0.01 -0.03 0.99 0.00 -0.36 0.00 0.00 175.35 175.93 1hfh n LEU 109 N 0.11 1.56 0.00 0.00 4.32 -0.55 -1.05 117.00 121.39 1hfh n LEU 109 Ca 0.04 -4.92 0.00 0.00 -0.02 0.00 0.00 56.01 51.11 1hfh n LEU 109 Cb 0.51 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.27 1hfh n LEU 109 CO 0.43 1.94 0.00 0.61 -1.22 0.00 0.00 177.39 179.15 1hfh n GLY 110 N 1.77 0.44 1.23 -0.72 0.00 -1.26 -4.27 105.19 102.38 1hfh n GLY 110 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1hfh n GLY 110 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1hfh n GLU 111 N 0.00 0.00 -0.39 1.61 2.13 -1.26 -3.75 120.64 118.98 1hfh n GLU 111 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1hfh n GLU 111 Cb 0.00 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 31.70 1hfh n GLU 111 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1hfh n LYS 112 N -2.52 2.64 -4.32 5.31 4.81 -1.26 -2.99 118.16 119.83 1hfh n LYS 112 Ca 0.00 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.15 1hfh n LYS 112 Cb 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 34.99 1hfh n LYS 112 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1hfh s TRP 113 N 1.35 2.01 0.48 5.64 0.52 -1.26 -1.48 118.94 126.20 1hfh s TRP 113 Ca 0.00 -0.81 0.01 0.00 0.02 0.00 0.00 56.10 55.32 1hfh s TRP 113 Cb 0.00 -1.80 0.01 0.00 -1.15 0.00 0.00 33.47 30.53 1hfh s TRP 113 CO 0.00 0.01 0.09 0.45 0.02 0.00 0.00 176.95 177.52 1hfh n SER 114 N -1.40 3.16 0.00 2.95 2.88 0.42 -4.84 113.62 116.78 1hfh n SER 114 Ca -0.08 -3.01 0.00 0.00 -1.33 0.00 0.00 58.87 54.45 1hfh n SER 114 Cb 0.66 0.24 0.00 0.00 -0.75 0.00 0.00 64.21 64.36 1hfh n SER 114 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1hfh n HIS 115 N -1.31 0.00 -1.04 0.66 8.25 -1.26 -2.49 115.22 118.03 1hfh n HIS 115 Ca -0.16 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.00 1hfh n HIS 115 Cb 0.60 0.00 0.13 0.00 1.12 0.00 0.00 29.99 31.84 1hfh n HIS 115 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1hfh s PRO 116 N 0.00 1.45 0.25 -0.41 0.04 -1.23 -3.88 135.00 131.22 1hfh s PRO 116 Ca 0.00 1.17 -0.05 0.00 0.04 0.00 0.00 61.00 62.16 1hfh s PRO 116 Cb 0.00 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.70 1hfh s PRO 116 CO 0.00 -2.21 -0.20 -2.30 0.04 0.00 0.00 177.00 172.34 1hfh n PRO 117 N -3.91 0.00 -2.87 0.56 -0.02 -0.18 -4.76 135.00 123.83 1hfh n PRO 117 Ca 0.09 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.23 1hfh n PRO 117 Cb 0.53 -0.27 -0.02 0.00 -0.02 0.00 0.00 33.50 33.73 1hfh n PRO 117 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1hfh n SER 118 N 0.91 5.69 -3.42 2.55 7.64 0.01 -4.85 113.62 122.16 1hfh n SER 118 Ca -0.00 -3.65 -0.26 0.00 1.01 0.00 0.00 58.87 55.96 1hfh n SER 118 Cb 0.15 -0.85 -0.09 0.00 -1.01 0.00 0.00 64.21 62.40 1hfh n SER 118 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03