#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfz s GLU 1 N 0.00 3.18 -0.08 3.17 2.02 -1.26 -4.99 118.70 120.74 1hfz s GLU 1 Ca 0.00 0.41 0.04 0.00 0.02 0.00 0.00 54.97 55.44 1hfz s GLU 1 Cb 0.00 -4.18 -0.01 0.00 0.10 0.00 0.00 34.13 30.04 1hfz s GLU 1 CO 0.00 -2.09 -0.21 -1.14 0.02 0.00 0.00 175.26 171.84 1hfz s GLN 2 N 5.79 2.81 0.00 1.61 0.74 -1.26 -0.25 119.66 129.10 1hfz s GLN 2 Ca 0.53 -0.83 0.00 0.00 0.05 0.00 0.00 55.36 55.11 1hfz s GLN 2 Cb -0.11 -2.31 0.00 0.00 1.10 0.00 0.00 33.01 31.69 1hfz s GLN 2 CO 0.23 0.34 0.00 1.28 -0.55 0.00 0.00 175.29 176.59 1hfz n LEU 3 N 3.09 0.00 -4.10 3.68 4.32 -1.16 -4.99 117.00 117.84 1hfz n LEU 3 Ca -0.18 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.73 1hfz n LEU 3 Cb 0.52 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 42.22 1hfz n LEU 3 CO 0.27 0.00 -0.37 0.42 -1.22 0.00 0.00 177.39 176.49 1hfz s THR 4 N 1.72 0.38 0.10 -5.08 -4.23 -1.26 -4.96 115.64 102.31 1hfz s THR 4 Ca 0.00 -1.73 -0.24 0.00 -1.18 0.00 0.00 61.69 58.55 1hfz s THR 4 Cb 0.00 -1.41 -0.07 0.00 1.34 0.00 0.00 72.50 72.36 1hfz s THR 4 CO 0.00 -0.88 1.40 0.50 -0.54 0.00 0.00 174.62 175.10 1hfz h LYS 5 N 3.30 -0.20 0.00 3.99 3.64 -1.99 -1.32 116.57 123.99 1hfz h LYS 5 Ca -0.34 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1hfz h LYS 5 Cb 1.16 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1hfz h LYS 5 CO 0.62 -0.13 0.00 0.00 -2.27 0.00 0.00 179.45 177.66 1hfz h GLU 7 N 0.00 0.12 0.00 0.00 5.08 -1.68 -3.20 114.58 114.90 1hfz h GLU 7 Ca 0.00 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1hfz h GLU 7 Cb 0.10 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 1hfz h GLU 7 CO 0.00 1.10 -0.09 0.28 -1.00 0.00 0.00 179.01 179.29 1hfz h VAL 8 N -0.56 0.78 -0.24 3.13 2.07 -0.85 0.14 116.25 120.71 1hfz h VAL 8 Ca -0.36 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 66.69 1hfz h VAL 8 Cb 1.59 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1hfz h VAL 8 CO -0.07 0.09 -0.26 0.15 0.02 0.00 0.00 177.57 177.50 1hfz h PHE 9 N 0.00 0.73 0.00 1.57 3.04 -1.51 -0.68 116.94 120.09 1hfz h PHE 9 Ca -0.00 -0.22 -0.11 0.00 3.98 0.00 0.00 57.97 61.61 1hfz h PHE 9 Cb 0.21 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.55 1hfz h PHE 9 CO 0.00 0.94 -0.53 -0.09 -2.02 0.00 0.00 178.31 176.60 1hfz h ARG 10 N 0.31 0.00 0.00 1.11 2.43 -1.29 -3.31 114.38 113.62 1hfz h ARG 10 Ca 0.04 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.05 1hfz h ARG 10 Cb 0.82 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1hfz h ARG 10 CO 0.06 0.53 -0.93 0.93 -1.51 0.00 0.00 179.97 179.06 1hfz h GLU 11 N 0.00 0.00 -0.58 0.20 4.39 -0.70 -3.32 114.58 114.57 1hfz h GLU 11 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 1hfz h GLU 11 Cb 1.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.87 1hfz h GLU 11 CO 0.07 0.55 0.00 1.28 -1.16 0.00 0.00 179.01 179.75 1hfz n LEU 12 N -3.15 3.28 -0.53 1.33 4.77 -0.27 -4.64 117.00 117.79 1hfz n LEU 12 Ca -0.03 -1.65 0.45 0.00 -0.03 0.00 0.00 56.01 54.75 1hfz n LEU 12 Cb 0.83 -0.43 0.78 0.00 -2.33 0.00 0.00 43.42 42.27 1hfz n LEU 12 CO 0.43 0.66 1.40 0.50 -1.33 0.00 0.00 177.39 179.06 1hfz h LYS 13 N 3.06 0.01 -0.37 3.23 3.64 -1.67 -0.17 116.57 124.30 1hfz h LYS 13 Ca 0.00 -0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 1hfz h LYS 13 Cb 0.95 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 1hfz h LYS 13 CO 0.10 0.01 -0.25 -0.44 -2.27 0.00 0.00 179.45 176.59 1hfz h ASP 14 N 0.01 0.78 0.11 4.20 3.32 -1.92 -2.91 116.42 120.03 1hfz h ASP 14 Ca 0.78 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 57.54 1hfz h ASP 14 Cb 3.06 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 42.40 1hfz h ASP 14 CO -0.04 1.00 0.00 0.18 -1.72 0.00 0.00 179.24 178.66 1hfz n LEU 15 N -4.10 0.00 -4.66 1.55 7.99 -0.08 -4.63 117.00 113.07 1hfz n LEU 15 Ca -0.00 0.14 -0.42 0.00 -0.01 0.00 0.00 56.01 55.72 1hfz n LEU 15 Cb 0.45 -0.14 -0.03 0.00 -0.11 0.00 0.00 43.42 43.59 1hfz n LEU 15 CO 0.45 -0.08 1.60 -0.75 -1.51 0.00 0.00 177.39 177.09 1hfz s LYS 16 N -2.28 4.10 0.00 3.23 2.20 -1.10 -3.11 119.74 122.78 1hfz s LYS 16 Ca 0.15 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.33 1hfz s LYS 16 Cb 0.09 -4.16 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 1hfz s LYS 16 CO 0.17 -1.00 0.00 0.41 -0.36 0.00 0.00 175.35 174.57 1hfz n GLY 17 N 4.58 1.58 3.59 5.54 0.00 -0.78 -4.93 105.19 114.77 1hfz n GLY 17 Ca 0.20 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.73 1hfz n GLY 17 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1hfz n TYR 18 N 0.00 2.02 -0.84 1.61 4.19 -1.18 0.80 117.16 123.76 1hfz n TYR 18 Ca 0.00 0.11 0.00 0.00 3.31 0.00 0.00 57.90 61.32 1hfz n TYR 18 Cb 0.00 -2.62 0.00 0.00 0.49 0.00 0.00 39.34 37.21 1hfz n TYR 18 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1hfz n GLY 19 N 5.31 0.58 2.50 2.98 0.00 -1.26 -3.57 105.19 111.73 1hfz n GLY 19 Ca 0.30 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1hfz n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hfz n GLY 20 N -2.84 2.03 3.68 -0.02 0.00 0.24 -4.95 105.19 103.32 1hfz n GLY 20 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1hfz n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfz s VAL 21 N -3.08 4.83 0.70 1.61 1.01 -1.23 -4.88 120.40 119.36 1hfz s VAL 21 Ca 0.00 1.80 -0.08 0.00 0.00 0.00 0.00 61.98 63.71 1hfz s VAL 21 Cb 0.00 -4.21 0.05 0.00 0.00 0.00 0.00 36.38 32.22 1hfz s VAL 21 CO 0.00 0.01 1.03 -0.94 0.00 0.00 0.00 175.10 175.20 1hfz s SER 22 N 1.13 4.95 0.17 3.32 1.04 -1.26 -1.87 113.70 121.18 1hfz s SER 22 Ca 0.42 0.61 -0.14 0.00 0.48 0.00 0.00 55.95 57.32 1hfz s SER 22 Cb -0.17 -1.30 0.06 0.00 0.10 0.00 0.00 66.02 64.71 1hfz s SER 22 CO 0.14 -1.54 1.80 -0.07 0.98 0.00 0.00 173.24 174.54 1hfz h LEU 23 N -0.61 0.64 -1.42 2.42 3.38 -1.96 -1.41 115.31 116.35 1hfz h LEU 23 Ca -0.45 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.43 1hfz h LEU 23 Cb 1.30 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1hfz h LEU 23 CO 0.62 0.52 0.08 -0.65 0.09 0.00 0.00 178.44 179.09 1hfz h PRO 24 N 0.71 0.46 0.00 1.13 0.11 -1.88 -1.71 132.00 130.81 1hfz h PRO 24 Ca 0.19 -0.07 -0.07 0.00 0.11 0.00 0.00 66.00 66.16 1hfz h PRO 24 Cb 0.01 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1hfz h PRO 24 CO -0.03 0.43 -0.33 0.93 -0.21 0.00 0.00 178.00 178.78 1hfz h GLU 25 N 0.45 0.00 0.12 1.05 5.08 -1.73 -2.45 114.58 117.10 1hfz h GLU 25 Ca 0.11 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.18 1hfz h GLU 25 Cb 0.18 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.46 1hfz h GLU 25 CO -0.00 0.33 -1.23 -1.49 -1.00 0.00 0.00 179.01 175.62 1hfz h TRP 26 N 0.00 0.92 -0.02 4.33 4.06 -0.57 -2.33 115.95 122.33 1hfz h TRP 26 Ca -0.00 -0.58 -0.11 0.00 2.06 0.00 0.00 58.89 60.25 1hfz h TRP 26 Cb 0.94 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 29.02 1hfz h TRP 26 CO 0.00 1.43 -0.51 0.28 -3.56 0.00 0.00 178.44 176.08 1hfz h VAL 27 N 0.24 1.37 0.04 1.49 2.07 -1.31 -2.12 116.25 118.03 1hfz h VAL 27 Ca -0.18 -1.76 -0.07 0.00 0.82 0.00 0.00 66.70 65.51 1hfz h VAL 27 Cb 1.91 1.92 0.01 0.00 -1.52 0.00 0.00 31.29 33.61 1hfz h VAL 27 CO 0.23 0.51 -0.30 0.00 0.02 0.00 0.00 177.57 178.03 1hfz h THR 29 N -0.70 0.32 0.00 0.00 2.02 -1.37 -1.97 112.91 111.22 1hfz h THR 29 Ca -0.05 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1hfz h THR 29 Cb 1.19 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1hfz h THR 29 CO 0.06 0.00 -0.01 0.71 0.37 0.00 0.00 175.52 176.65 1hfz h THR 30 N -0.47 1.00 -0.43 3.16 1.35 -1.51 -1.72 112.91 114.28 1hfz h THR 30 Ca 0.06 -0.04 -0.02 0.00 -0.55 0.00 0.00 66.41 65.85 1hfz h THR 30 Cb 0.55 1.02 -0.02 0.00 -1.73 0.00 0.00 68.15 67.97 1hfz h THR 30 CO -0.25 0.01 0.18 0.15 -0.25 0.00 0.00 175.52 175.36 1hfz h PHE 31 N 0.00 0.65 -0.00 4.73 3.57 -1.26 -1.05 116.94 123.58 1hfz h PHE 31 Ca -0.00 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.45 1hfz h PHE 31 Cb 0.02 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.56 1hfz h PHE 31 CO 0.00 0.56 -0.01 0.72 -2.23 0.00 0.00 178.31 177.36 1hfz n HIS 32 N -4.62 0.00 -0.10 0.41 8.25 -0.69 -1.08 115.22 117.39 1hfz n HIS 32 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.32 1hfz n HIS 32 Cb 0.14 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.19 1hfz n HIS 32 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1hfz n THR 33 N -0.68 1.49 0.01 1.59 -1.04 -0.85 -4.82 114.28 109.99 1hfz n THR 33 Ca 0.22 0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 1hfz n THR 33 Cb 0.19 -2.21 -0.00 0.00 -1.82 0.00 0.00 70.33 66.49 1hfz n THR 33 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1hfz n SER 34 N -4.44 0.78 -0.51 8.00 3.41 -0.45 -4.96 113.62 115.44 1hfz n SER 34 Ca -0.25 -0.43 -0.07 0.00 -0.26 0.00 0.00 58.87 57.87 1hfz n SER 34 Cb 0.58 1.00 -0.03 0.00 -0.26 0.00 0.00 64.21 65.50 1hfz n SER 34 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hfz n GLY 35 N 1.24 0.88 2.52 5.00 0.00 -0.24 -2.50 105.19 112.08 1hfz n GLY 35 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 1hfz n GLY 35 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1hfz n TYR 36 N -2.73 0.00 -2.39 1.61 4.01 -1.26 -4.79 117.16 111.62 1hfz n TYR 36 Ca -0.07 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.24 1hfz n TYR 36 Cb 0.26 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.27 1hfz n TYR 36 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1hfz s ASP 37 N -2.80 6.53 0.47 7.72 -1.08 -1.04 -3.01 116.67 123.45 1hfz s ASP 37 Ca 0.00 1.03 0.23 0.00 -0.52 0.00 0.00 52.55 53.29 1hfz s ASP 37 Cb 0.00 -2.54 1.15 0.00 -1.46 0.00 0.00 42.92 40.07 1hfz s ASP 37 CO 0.00 -1.23 1.96 0.71 0.52 0.00 0.00 175.17 177.12 1hfz h THR 38 N 6.18 0.73 -0.69 1.71 1.35 -0.97 -3.05 112.91 118.16 1hfz h THR 38 Ca -0.27 -0.85 -0.16 0.00 -0.55 0.00 0.00 66.41 64.59 1hfz h THR 38 Cb 1.10 1.53 -0.09 0.00 -1.73 0.00 0.00 68.15 68.95 1hfz h THR 38 CO 1.06 0.20 0.20 0.00 -0.25 0.00 0.00 175.52 176.73 1hfz n GLN 39 N -3.69 4.01 -2.68 4.72 6.02 -1.25 -4.02 117.38 120.49 1hfz n GLN 39 Ca -0.01 -3.03 -0.33 0.00 -0.01 0.00 0.00 57.00 53.61 1hfz n GLN 39 Cb 0.32 -2.22 -0.05 0.00 1.02 0.00 0.00 30.24 29.31 1hfz n GLN 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hfz s ALA 40 N -2.87 2.96 -0.15 -1.58 0.00 -1.15 -4.54 121.76 114.42 1hfz s ALA 40 Ca 0.54 0.49 -0.06 0.00 0.00 0.00 0.00 51.96 52.93 1hfz s ALA 40 Cb 0.43 -3.20 0.07 0.00 0.00 0.00 0.00 23.12 20.42 1hfz s ALA 40 CO 0.14 -0.09 0.32 0.42 0.00 0.00 0.00 175.76 176.55 1hfz s ILE 41 N -2.10 -0.47 -0.17 0.00 1.01 -1.26 -0.85 121.20 117.37 1hfz s ILE 41 Ca 0.64 0.23 0.01 0.00 0.00 0.00 0.00 60.65 61.53 1hfz s ILE 41 Cb -0.12 -0.52 0.02 0.00 0.01 0.00 0.00 42.46 41.84 1hfz s ILE 41 CO 0.17 0.10 -0.18 -0.69 0.00 0.00 0.00 174.94 174.33 1hfz s VAL 42 N 2.40 1.91 -0.51 2.92 1.01 -0.22 -4.96 120.40 122.97 1hfz s VAL 42 Ca -0.01 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 60.92 1hfz s VAL 42 Cb -0.12 -1.74 0.05 0.00 0.00 0.00 0.00 36.38 34.57 1hfz s VAL 42 CO -0.10 0.52 0.71 -1.10 0.00 0.00 0.00 175.10 175.13 1hfz s GLN 43 N 1.33 3.21 0.00 2.72 1.11 -1.26 -1.99 119.66 124.78 1hfz s GLN 43 Ca 0.04 -0.63 0.00 0.00 0.01 0.00 0.00 55.36 54.78 1hfz s GLN 43 Cb -0.13 -4.06 0.00 0.00 -1.01 0.00 0.00 33.01 27.81 1hfz s GLN 43 CO -0.12 -1.25 0.00 0.09 0.01 0.00 0.00 175.29 174.02 1hfz n ASN 44 N 6.53 0.00 -0.08 5.90 3.02 -0.11 -4.99 115.26 125.53 1hfz n ASN 44 Ca -0.03 -0.50 -0.00 0.00 -0.03 0.00 0.00 54.58 54.01 1hfz n ASN 44 Cb 0.46 0.00 0.27 0.00 -0.61 0.00 0.00 39.78 39.90 1hfz n ASN 44 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1hfz h ASN 45 N 0.00 0.65 0.00 6.41 4.21 -2.06 -3.38 115.58 121.41 1hfz h ASN 45 Ca 0.00 -0.09 0.00 0.00 1.21 0.00 0.00 56.30 57.42 1hfz h ASN 45 Cb 0.00 -0.17 0.00 0.00 -1.12 0.00 0.00 38.32 37.03 1hfz h ASN 45 CO 0.00 0.61 -0.99 -0.90 -1.29 0.00 0.00 177.43 174.86 1hfz n ASP 46 N -4.33 4.37 -4.56 5.81 5.68 -1.26 -5.11 116.55 117.15 1hfz n ASP 46 Ca 0.04 0.00 -0.26 0.00 -0.50 0.00 0.00 54.79 54.07 1hfz n ASP 46 Cb 0.17 0.21 -0.11 0.00 -1.14 0.00 0.00 41.12 40.25 1hfz n ASP 46 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1hfz s SER 47 N -3.56 3.34 -0.17 -1.12 1.04 -1.26 -4.99 113.70 106.98 1hfz s SER 47 Ca 0.00 -1.38 0.00 0.00 0.48 0.00 0.00 55.95 55.05 1hfz s SER 47 Cb 0.00 -0.26 0.04 0.00 0.10 0.00 0.00 66.02 65.90 1hfz s SER 47 CO 0.00 -0.52 -0.09 -0.89 0.98 0.00 0.00 173.24 172.72 1hfz s THR 48 N -2.92 1.38 0.00 2.02 2.01 -1.26 -0.93 115.64 115.94 1hfz s THR 48 Ca 0.35 -0.74 -0.14 0.00 0.31 0.00 0.00 61.69 61.47 1hfz s THR 48 Cb 0.09 -1.46 -0.06 0.00 0.01 0.00 0.00 72.50 71.09 1hfz s THR 48 CO 0.17 0.23 0.40 -1.61 -0.69 0.00 0.00 174.62 173.12 1hfz s GLU 49 N 1.53 3.89 0.22 4.92 2.02 -0.84 -2.79 118.70 127.65 1hfz s GLU 49 Ca 0.01 0.39 0.10 0.00 0.02 0.00 0.00 54.97 55.49 1hfz s GLU 49 Cb -0.15 -3.21 -0.04 0.00 0.10 0.00 0.00 34.13 30.83 1hfz s GLU 49 CO -0.08 0.69 -0.12 0.71 0.02 0.00 0.00 175.26 176.47 1hfz s TYR 50 N -1.10 2.53 0.18 1.61 1.51 0.57 -1.05 117.35 121.59 1hfz s TYR 50 Ca 0.24 -0.26 0.00 0.00 -1.01 0.00 0.00 57.07 56.04 1hfz s TYR 50 Cb -0.16 -1.19 0.00 0.00 -0.11 0.00 0.00 41.96 40.50 1hfz s TYR 50 CO 0.13 0.57 0.00 0.41 -1.11 0.00 0.00 175.55 175.55 1hfz n GLY 51 N -0.24 -1.53 0.33 0.71 0.00 -0.03 -2.09 105.19 102.34 1hfz n GLY 51 Ca -0.09 -1.11 0.12 0.00 0.00 0.00 0.00 46.02 44.93 1hfz n GLY 51 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1hfz h LEU 52 N 0.00 0.18 -0.70 0.99 5.85 -1.69 -1.68 115.31 118.25 1hfz h LEU 52 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1hfz h LEU 52 Cb 0.70 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.69 1hfz h LEU 52 CO 0.01 0.12 -0.24 0.49 -0.34 0.00 0.00 178.44 178.47 1hfz n PHE 53 N -4.47 0.00 -3.91 1.25 3.72 -1.26 -4.02 117.46 108.77 1hfz n PHE 53 Ca 0.05 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.05 1hfz n PHE 53 Cb 0.31 -0.08 0.03 0.00 -0.94 0.00 0.00 39.48 38.80 1hfz n PHE 53 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1hfz n GLN 54 N -0.34 -0.65 -2.71 -1.08 1.13 -0.63 -4.95 117.38 108.15 1hfz n GLN 54 Ca 0.13 0.24 -0.41 0.00 -1.94 0.00 0.00 57.00 55.03 1hfz n GLN 54 Cb 0.38 -3.15 -0.05 0.00 0.11 0.00 0.00 30.24 27.52 1hfz n GLN 54 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1hfz s ILE 55 N -3.49 4.21 0.07 5.09 1.01 -0.90 -4.60 121.20 122.60 1hfz s ILE 55 Ca 0.48 2.02 -0.11 0.00 0.00 0.00 0.00 60.65 63.04 1hfz s ILE 55 Cb -0.23 -4.29 -0.06 0.00 0.01 0.00 0.00 42.46 37.90 1hfz s ILE 55 CO 0.93 0.40 0.40 0.54 0.00 0.00 0.00 174.94 177.21 1hfz s ASN 56 N -0.58 6.67 -0.02 3.58 2.20 -1.26 -0.32 114.94 125.21 1hfz s ASN 56 Ca 0.44 0.82 0.02 0.00 -0.94 0.00 0.00 52.86 53.20 1hfz s ASN 56 Cb -0.25 -2.19 0.08 0.00 -2.00 0.00 0.00 41.25 36.89 1hfz s ASN 56 CO 0.32 0.20 0.74 -0.46 -2.94 0.00 0.00 177.10 174.96 1hfz n ASN 57 N 1.06 1.20 -0.09 3.54 0.23 -1.12 -1.89 115.26 118.18 1hfz n ASN 57 Ca -0.09 -2.07 -0.11 0.00 -0.53 0.00 0.00 54.58 51.79 1hfz n ASN 57 Cb 0.52 -0.39 -0.16 0.00 -2.08 0.00 0.00 39.78 37.67 1hfz n ASN 57 CO 0.00 0.00 0.00 1.17 -0.93 0.00 0.00 177.26 177.50 1hfz n LYS 58 N -0.03 0.68 0.00 -3.83 4.81 -1.26 -4.27 118.16 114.26 1hfz n LYS 58 Ca 0.03 0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 1hfz n LYS 58 Cb 0.27 -1.55 0.00 0.00 0.02 0.00 0.00 35.03 33.77 1hfz n LYS 58 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1hfz n ILE 59 N -2.82 0.00 -0.08 3.15 2.08 -1.23 -3.69 119.36 116.77 1hfz n ILE 59 Ca -0.32 0.00 -0.23 0.00 0.56 0.00 0.00 62.75 62.76 1hfz n ILE 59 Cb 1.14 -0.40 -0.12 0.00 -0.75 0.00 0.00 39.64 39.51 1hfz n ILE 59 CO 0.00 0.00 0.00 0.79 0.56 0.00 0.00 176.55 177.90 1hfz n TRP 60 N -1.75 0.89 -4.30 1.39 7.02 -0.79 -2.13 117.44 117.77 1hfz n TRP 60 Ca 0.00 0.31 -0.21 0.00 -1.02 0.00 0.00 57.50 56.59 1hfz n TRP 60 Cb 0.28 -1.10 -0.11 0.00 -2.42 0.00 0.00 31.31 27.96 1hfz n TRP 60 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1hfz s LYS 62 N -2.70 4.24 0.09 0.00 2.36 0.21 -4.34 119.74 119.59 1hfz s LYS 62 Ca 0.13 1.60 0.05 0.00 -2.55 0.00 0.00 55.97 55.20 1hfz s LYS 62 Cb -0.06 -3.74 -0.03 0.00 -1.05 0.00 0.00 37.83 32.95 1hfz s LYS 62 CO 0.05 -0.69 -0.14 0.34 1.55 0.00 0.00 175.35 176.46 1hfz s ASP 63 N 1.82 1.79 0.00 1.43 2.15 -1.20 -1.52 116.67 121.14 1hfz s ASP 63 Ca 0.53 -0.68 0.12 0.00 0.43 0.00 0.00 52.55 52.95 1hfz s ASP 63 Cb -0.20 -0.06 0.71 0.00 -0.30 0.00 0.00 42.92 43.07 1hfz s ASP 63 CO 0.13 -0.09 1.13 0.47 -0.17 0.00 0.00 175.17 176.64 1hfz n ASP 64 N 1.06 0.00 -0.10 -0.34 9.92 -1.26 -3.04 116.55 122.79 1hfz n ASP 64 Ca -0.20 -0.53 -0.13 0.00 -0.53 0.00 0.00 54.79 53.41 1hfz n ASP 64 Cb 0.55 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.99 1hfz n ASP 64 CO 0.00 0.00 0.00 1.67 0.13 0.00 0.00 177.20 179.00 1hfz n GLN 65 N -0.91 0.54 -3.75 -1.24 0.00 -1.26 -4.84 117.38 105.92 1hfz n GLN 65 Ca 0.09 0.22 -0.29 0.00 -0.00 0.00 0.00 57.00 57.02 1hfz n GLN 65 Cb 0.04 -1.44 -0.12 0.00 0.00 0.00 0.00 30.24 28.72 1hfz n GLN 65 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 1hfz s ASN 66 N -6.20 3.75 0.00 1.69 0.01 -1.25 -4.98 114.94 107.96 1hfz s ASN 66 Ca -0.31 -3.22 -0.05 0.00 -0.71 0.00 0.00 52.86 48.58 1hfz s ASN 66 Cb 0.06 -1.22 -0.20 0.00 0.41 0.00 0.00 41.25 40.29 1hfz s ASN 66 CO 0.44 -0.18 3.01 -2.65 -1.51 0.00 0.00 177.10 176.22 1hfz n PRO 67 N 2.77 1.62 -0.21 -0.60 -0.02 -1.17 -3.21 135.00 134.17 1hfz n PRO 67 Ca 0.16 -0.75 0.00 0.00 -2.02 0.00 0.00 63.50 60.89 1hfz n PRO 67 Cb 0.37 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1hfz n PRO 67 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1hfz n HIS 68 N 2.45 0.00 -2.28 6.00 8.25 -1.26 -5.01 115.22 123.36 1hfz n HIS 68 Ca 0.32 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.38 1hfz n HIS 68 Cb 0.75 0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.86 1hfz n HIS 68 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1hfz s SER 69 N -0.32 6.99 0.64 0.41 1.04 -1.25 -4.86 113.70 116.36 1hfz s SER 69 Ca 0.00 2.46 0.28 0.00 0.48 0.00 0.00 55.95 59.17 1hfz s SER 69 Cb 0.00 -2.63 1.52 0.00 0.10 0.00 0.00 66.02 65.01 1hfz s SER 69 CO 0.00 -0.38 1.88 0.77 0.98 0.00 0.00 173.24 176.49 1hfz h SER 70 N 4.01 0.00 -6.17 7.02 4.64 -1.68 -3.45 113.55 117.92 1hfz h SER 70 Ca -0.47 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.46 1hfz h SER 70 Cb 1.22 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 63.38 1hfz h SER 70 CO 0.69 0.00 -0.86 -3.20 -0.87 0.00 0.00 176.83 172.59 1hfz n ASN 71 N -3.12 -5.59 -0.20 4.97 5.15 -0.91 -4.90 115.26 110.66 1hfz n ASN 71 Ca 0.01 -0.91 -0.09 0.00 -0.60 0.00 0.00 54.58 52.99 1hfz n ASN 71 Cb 0.49 -3.46 0.02 0.00 -0.53 0.00 0.00 39.78 36.30 1hfz n ASN 71 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 1hfz h ILE 72 N -1.48 1.27 0.00 -1.44 2.04 -1.47 -1.81 117.51 114.62 1hfz h ILE 72 Ca -0.60 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.09 1hfz h ILE 72 Cb 1.33 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 1hfz h ILE 72 CO 0.45 0.42 0.00 0.00 0.00 0.00 0.00 178.15 179.02 1hfz n ASN 74 N -2.88 -7.67 -3.54 0.00 4.05 -0.68 -5.01 115.26 99.52 1hfz n ASN 74 Ca 0.03 0.18 -0.11 0.00 0.45 0.00 0.00 54.58 55.13 1hfz n ASN 74 Cb 0.43 -5.06 -0.04 0.00 1.23 0.00 0.00 39.78 36.33 1hfz n ASN 74 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 1hfz s ILE 75 N -2.75 0.00 0.09 -1.44 2.07 -1.26 -5.03 121.20 112.87 1hfz s ILE 75 Ca 0.13 0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.07 1hfz s ILE 75 Cb -0.03 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.50 1hfz s ILE 75 CO 0.77 0.00 0.98 -0.94 -1.91 0.00 0.00 174.94 173.84 1hfz s SER 76 N -1.59 7.45 0.00 4.50 1.04 -1.26 0.66 113.70 124.49 1hfz s SER 76 Ca -0.01 1.78 0.00 0.00 0.48 0.00 0.00 55.95 58.21 1hfz s SER 76 Cb -0.01 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.53 1hfz s SER 76 CO -0.01 -0.13 0.86 0.00 0.98 0.00 0.00 173.24 174.94 1hfz h ASP 78 N 0.00 0.00 0.35 0.00 5.19 -1.91 -2.71 116.42 117.33 1hfz h ASP 78 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1hfz h ASP 78 Cb 0.21 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.72 1hfz h ASP 78 CO 0.00 0.34 0.00 0.29 -3.12 0.00 0.00 179.24 176.75 1hfz n LYS 79 N -3.31 0.50 -0.40 3.56 5.02 -0.55 -1.41 118.16 121.56 1hfz n LYS 79 Ca 0.01 0.03 0.11 0.00 -2.02 0.00 0.00 58.31 56.45 1hfz n LYS 79 Cb 0.57 -1.50 0.32 0.00 -0.02 0.00 0.00 35.03 34.40 1hfz n LYS 79 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1hfz n PHE 80 N -1.21 1.03 0.41 2.13 3.72 -1.02 -4.11 117.46 118.42 1hfz n PHE 80 Ca 0.14 -0.52 0.04 0.00 -0.05 0.00 0.00 57.45 57.07 1hfz n PHE 80 Cb 0.17 -0.04 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 1hfz n PHE 80 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1hfz n LEU 81 N 1.52 0.83 -4.88 4.37 4.77 -0.50 -3.37 117.00 119.74 1hfz n LEU 81 Ca 0.24 -0.65 -0.35 0.00 -0.03 0.00 0.00 56.01 55.22 1hfz n LEU 81 Cb 0.65 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.69 1hfz n LEU 81 CO 0.17 0.18 -0.08 1.51 -1.33 0.00 0.00 177.39 177.84 1hfz s ASP 82 N -1.52 6.49 0.53 -1.43 -4.77 -1.25 -4.45 116.67 110.27 1hfz s ASP 82 Ca 0.06 0.56 0.44 0.00 -3.30 0.00 0.00 52.55 50.31 1hfz s ASP 82 Cb 0.07 -2.09 1.65 0.00 -1.09 0.00 0.00 42.92 41.46 1hfz s ASP 82 CO 0.29 0.29 1.62 0.44 0.70 0.00 0.00 175.17 178.51 1hfz h ASP 83 N 4.25 0.05 -2.34 2.11 3.32 -1.94 -3.36 116.42 118.51 1hfz h ASP 83 Ca -0.51 0.03 -0.53 0.00 0.02 0.00 0.00 57.03 56.04 1hfz h ASP 83 Cb 1.21 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.73 1hfz h ASP 83 CO 0.64 -0.04 1.23 -0.62 -1.72 0.00 0.00 179.24 178.73 1hfz s ASP 84 N -4.20 5.71 0.00 6.45 2.15 -1.26 -4.82 116.67 120.70 1hfz s ASP 84 Ca -0.06 0.29 0.20 0.00 0.43 0.00 0.00 52.55 53.41 1hfz s ASP 84 Cb 0.27 -2.54 1.16 0.00 -0.30 0.00 0.00 42.92 41.51 1hfz s ASP 84 CO 0.87 -2.04 1.61 0.18 -0.17 0.00 0.00 175.17 175.61 1hfz n LEU 85 N 11.10 0.00 -0.30 -1.34 4.77 -1.26 -4.24 117.00 125.73 1hfz n LEU 85 Ca 0.16 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.02 1hfz n LEU 85 Cb 0.50 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.51 1hfz n LEU 85 CO 0.71 0.00 0.50 0.74 -1.33 0.00 0.00 177.39 178.01 1hfz h THR 86 N 0.00 0.01 -0.47 -5.08 2.02 -1.91 -1.83 112.91 105.65 1hfz h THR 86 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 1hfz h THR 86 Cb 0.00 0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.40 1hfz h THR 86 CO 0.00 0.00 0.01 -2.24 0.37 0.00 0.00 175.52 173.66 1hfz h ASP 87 N -0.16 0.73 0.21 4.18 3.04 -1.89 -3.20 116.42 119.34 1hfz h ASP 87 Ca 0.14 -0.17 0.00 0.00 -3.24 0.00 0.00 57.03 53.77 1hfz h ASP 87 Cb 0.50 -0.19 -0.01 0.00 -1.04 0.00 0.00 39.33 38.58 1hfz h ASP 87 CO -0.80 0.79 -0.19 0.44 -2.04 0.00 0.00 179.24 177.44 1hfz h ASP 88 N 0.71 -0.51 0.07 4.15 5.19 -1.62 -2.83 116.42 121.59 1hfz h ASP 88 Ca 0.14 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.62 1hfz h ASP 88 Cb 0.43 0.17 -0.04 0.00 0.18 0.00 0.00 39.33 40.07 1hfz h ASP 88 CO 0.02 -0.29 -0.32 0.40 -3.12 0.00 0.00 179.24 175.92 1hfz h ILE 89 N -0.43 0.30 -0.74 0.35 1.08 -1.40 0.13 117.51 116.80 1hfz h ILE 89 Ca -0.00 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.61 1hfz h ILE 89 Cb 0.40 0.30 -0.10 0.00 -3.07 0.00 0.00 36.82 34.35 1hfz h ILE 89 CO -0.03 0.00 0.26 0.58 -0.69 0.00 0.00 178.15 178.26 1hfz h VAL 90 N -0.52 0.62 0.00 1.67 2.07 -1.55 0.31 116.25 118.84 1hfz h VAL 90 Ca 0.04 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.33 1hfz h VAL 90 Cb 0.57 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1hfz h VAL 90 CO -0.22 0.07 -0.50 0.00 0.02 0.00 0.00 177.57 176.94 1hfz h VAL 92 N 0.00 0.73 0.14 0.00 2.07 0.23 -2.68 116.25 116.73 1hfz h VAL 92 Ca -0.00 -1.63 -0.30 0.00 0.82 0.00 0.00 66.70 65.58 1hfz h VAL 92 Cb 1.02 2.07 0.03 0.00 -1.52 0.00 0.00 31.29 32.89 1hfz h VAL 92 CO 0.06 0.35 -1.27 0.11 0.02 0.00 0.00 177.57 176.85 1hfz h LYS 93 N 0.00 0.58 0.00 1.57 1.57 -0.31 -2.49 116.57 117.48 1hfz h LYS 93 Ca -0.00 -0.80 -0.05 0.00 -1.87 0.00 0.00 60.65 57.92 1hfz h LYS 93 Cb 1.04 0.27 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 1hfz h LYS 93 CO 0.05 1.37 -0.25 0.87 -0.57 0.00 0.00 179.45 180.91 1hfz h LYS 94 N 0.24 0.00 -0.24 3.15 1.57 -1.39 -0.82 116.57 119.08 1hfz h LYS 94 Ca -0.19 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.42 1hfz h LYS 94 Cb 1.94 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.26 1hfz h LYS 94 CO 0.24 0.25 -0.53 0.82 -0.57 0.00 0.00 179.45 179.66 1hfz h ILE 95 N 0.00 1.29 -0.66 1.86 2.04 -1.48 0.17 117.51 120.73 1hfz h ILE 95 Ca -0.00 -1.73 0.09 0.00 1.00 0.00 0.00 64.86 64.22 1hfz h ILE 95 Cb 0.45 1.76 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 1hfz h ILE 95 CO 0.03 0.55 0.44 -0.07 0.00 0.00 0.00 178.15 179.10 1hfz h LEU 96 N 0.53 0.48 0.04 1.44 3.38 -0.71 0.39 115.31 120.87 1hfz h LEU 96 Ca 0.00 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1hfz h LEU 96 Cb 1.14 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1hfz h LEU 96 CO 0.12 0.30 -0.02 0.44 0.09 0.00 0.00 178.44 179.36 1hfz h ASP 97 N 0.54 -0.04 0.79 -0.43 3.32 -1.08 -3.26 116.42 116.26 1hfz h ASP 97 Ca 0.30 -0.42 -0.04 0.00 0.02 0.00 0.00 57.03 56.89 1hfz h ASP 97 Cb 0.46 0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.03 1hfz h ASP 97 CO -0.09 0.65 -0.38 0.11 -1.72 0.00 0.00 179.24 177.81 1hfz h LYS 98 N -0.98 -1.02 0.00 3.56 1.79 -0.43 -3.42 116.57 116.07 1hfz h LYS 98 Ca -0.01 0.07 -0.42 0.00 -2.18 0.00 0.00 60.65 58.11 1hfz h LYS 98 Cb 0.46 0.23 -0.06 0.00 -1.58 0.00 0.00 32.23 31.28 1hfz h LYS 98 CO 0.01 -0.68 -2.35 0.28 -1.08 0.00 0.00 179.45 175.63 1hfz n VAL 99 N -5.07 1.53 0.00 0.50 0.31 0.13 -5.06 118.33 110.66 1hfz n VAL 99 Ca -0.13 -0.33 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 1hfz n VAL 99 Cb 0.42 -1.92 0.00 0.00 -0.91 0.00 0.00 33.84 31.43 1hfz n VAL 99 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1hfz n GLY 100 N 1.28 3.18 0.32 2.92 0.00 -0.66 -4.75 105.19 107.48 1hfz n GLY 100 Ca -0.51 -1.99 0.15 0.00 0.00 0.00 0.00 46.02 43.68 1hfz n GLY 100 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1hfz h ILE 101 N 0.00 0.00 0.00 -0.61 6.09 -1.88 0.46 117.51 121.57 1hfz h ILE 101 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1hfz h ILE 101 Cb 0.00 0.65 0.00 0.00 0.47 0.00 0.00 36.82 37.94 1hfz h ILE 101 CO 0.00 0.00 0.00 -0.46 -3.07 0.00 0.00 178.15 174.62 1hfz n ASN 102 N -2.81 0.00 0.22 2.19 6.94 -1.26 -0.99 115.26 119.55 1hfz n ASN 102 Ca -0.02 -0.63 0.14 0.00 -0.02 0.00 0.00 54.58 54.05 1hfz n ASN 102 Cb 0.35 0.00 0.46 0.00 -2.36 0.00 0.00 39.78 38.23 1hfz n ASN 102 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 1hfz h TYR 103 N 0.00 0.00 -3.51 -2.53 3.20 -1.22 -3.35 116.97 109.55 1hfz h TYR 103 Ca 0.00 0.00 -0.68 0.00 3.14 0.00 0.00 58.73 61.19 1hfz h TYR 103 Cb 0.00 0.00 -0.37 0.00 1.54 0.00 0.00 36.73 37.90 1hfz h TYR 103 CO 0.00 0.00 -0.53 -1.58 -1.64 0.00 0.00 178.16 174.41 1hfz s TRP 104 N -3.40 3.46 0.66 -3.82 0.51 -0.16 -4.98 118.94 111.21 1hfz s TRP 104 Ca 0.05 -2.80 0.42 0.00 -2.12 0.00 0.00 56.10 51.65 1hfz s TRP 104 Cb 0.08 -3.07 2.31 0.00 -0.81 0.00 0.00 33.47 31.98 1hfz s TRP 104 CO 0.56 -0.87 2.32 -0.07 -0.51 0.00 0.00 176.95 178.39 1hfz h LEU 105 N 7.26 0.00 -0.92 2.99 4.07 -1.81 -2.42 115.31 124.49 1hfz h LEU 105 Ca -0.06 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.80 1hfz h LEU 105 Cb 0.97 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.70 1hfz h LEU 105 CO 0.67 0.00 -0.20 0.00 -1.08 0.00 0.00 178.44 177.83 1hfz h ALA 106 N 1.93 1.09 -0.03 1.53 0.00 -1.92 -3.14 119.26 118.72 1hfz h ALA 106 Ca 0.00 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.60 1hfz h ALA 106 Cb 0.07 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1hfz h ALA 106 CO -0.00 0.56 -0.30 1.25 0.00 0.00 0.00 179.25 180.76 1hfz h HIS 107 N 0.50 -0.90 -0.21 0.00 6.17 -1.77 0.51 115.15 119.45 1hfz h HIS 107 Ca 0.08 0.03 -0.15 0.00 0.71 0.00 0.00 60.37 61.04 1hfz h HIS 107 Cb 0.63 0.40 -0.01 0.00 2.52 0.00 0.00 27.41 30.95 1hfz h HIS 107 CO 0.02 -0.32 -0.49 -0.22 0.71 0.00 0.00 177.93 177.64 1hfz h LYS 108 N -0.36 0.57 -0.13 5.26 3.64 -1.77 -1.19 116.57 122.59 1hfz h LYS 108 Ca 0.01 -0.33 -0.04 0.00 -1.27 0.00 0.00 60.65 59.02 1hfz h LYS 108 Cb 0.40 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1hfz h LYS 108 CO -0.22 0.93 -0.06 0.00 -2.27 0.00 0.00 179.45 177.83 1hfz h ALA 109 N 1.01 0.19 -0.00 5.00 0.00 -1.44 -3.37 119.26 120.64 1hfz h ALA 109 Ca 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1hfz h ALA 109 Cb 1.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1hfz h ALA 109 CO 0.09 -0.03 -0.08 1.28 0.00 0.00 0.00 179.25 180.52 1hfz n LEU 110 N -4.68 0.32 -1.32 0.00 4.77 0.17 -4.76 117.00 111.51 1hfz n LEU 110 Ca -0.06 -0.60 -0.09 0.00 -0.03 0.00 0.00 56.01 55.23 1hfz n LEU 110 Cb 0.29 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.52 1hfz n LEU 110 CO 0.37 0.07 0.47 0.00 -1.33 0.00 0.00 177.39 176.98 1hfz n SER 112 N -0.98 1.16 -4.36 0.00 7.64 -1.22 -4.82 113.62 111.04 1hfz n SER 112 Ca 0.34 -1.08 -0.19 0.00 1.01 0.00 0.00 58.87 58.95 1hfz n SER 112 Cb 0.88 0.78 -0.10 0.00 -1.01 0.00 0.00 64.21 64.76 1hfz n SER 112 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1hfz s GLU 113 N -2.33 1.37 -1.52 1.43 -1.05 -1.26 -4.84 118.70 110.50 1hfz s GLU 113 Ca 0.10 -1.64 -0.07 0.00 -0.15 0.00 0.00 54.97 53.21 1hfz s GLU 113 Cb 0.13 -1.01 0.06 0.00 -0.44 0.00 0.00 34.13 32.87 1hfz s GLU 113 CO 0.58 0.09 0.55 1.63 0.95 0.00 0.00 175.26 179.06 1hfz n LYS 114 N -0.42 -3.27 0.08 -4.83 5.02 -1.26 -4.86 118.16 108.61 1hfz n LYS 114 Ca -0.07 0.39 -0.05 0.00 -2.02 0.00 0.00 58.31 56.56 1hfz n LYS 114 Cb 0.62 -4.72 0.13 0.00 -0.02 0.00 0.00 35.03 31.03 1hfz n LYS 114 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1hfz h LEU 115 N -1.74 0.31 0.00 -0.35 3.38 -1.91 -2.99 115.31 112.01 1hfz h LEU 115 Ca -0.62 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.19 1hfz h LEU 115 Cb 1.38 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1hfz h LEU 115 CO 0.68 0.80 0.00 -0.90 0.09 0.00 0.00 178.44 179.12 1hfz n ASP 116 N -3.91 0.00 -0.47 -0.43 5.75 -1.26 -2.19 116.55 114.05 1hfz n ASP 116 Ca -0.02 -0.07 0.13 0.00 -0.01 0.00 0.00 54.79 54.82 1hfz n ASP 116 Cb 0.59 -0.23 0.50 0.00 -1.03 0.00 0.00 41.12 40.95 1hfz n ASP 116 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1hfz n GLN 117 N -1.23 1.63 -0.39 0.11 10.64 -1.13 -3.45 117.38 123.57 1hfz n GLN 117 Ca 0.09 -0.93 0.08 0.00 -1.83 0.00 0.00 57.00 54.41 1hfz n GLN 117 Cb 0.12 -1.45 0.25 0.00 -0.86 0.00 0.00 30.24 28.30 1hfz n GLN 117 CO 0.00 0.00 0.00 0.91 -1.83 0.00 0.00 177.06 176.14 1hfz n TRP 118 N 0.13 0.91 -1.75 2.61 7.02 -0.93 -4.97 117.44 120.46 1hfz n TRP 118 Ca 0.18 -0.64 -0.30 0.00 -1.02 0.00 0.00 57.50 55.73 1hfz n TRP 118 Cb 0.33 -0.17 0.08 0.00 -2.42 0.00 0.00 31.31 29.12 1hfz n TRP 118 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1hfz s LEU 119 N -1.75 2.66 0.00 -0.99 1.43 -1.22 -4.60 118.68 114.20 1hfz s LEU 119 Ca 0.38 1.11 0.00 0.00 -1.03 0.00 0.00 54.13 54.59 1hfz s LEU 119 Cb 0.25 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.71 1hfz s LEU 119 CO 0.17 -1.74 0.00 0.00 0.23 0.00 0.00 176.35 175.01 1hfz n GLU 121 N -2.41 0.00 0.00 0.00 -0.58 -1.26 -4.64 120.64 111.75 1hfz n GLU 121 Ca 0.00 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 1hfz n GLU 121 Cb 0.00 -0.09 0.00 0.00 -0.57 0.00 0.00 31.44 30.78 1hfz n GLU 121 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1hfz n LYS 122 N -0.23 -2.65 0.00 3.49 4.81 -1.26 -5.30 118.16 117.01 1hfz n LYS 122 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1hfz n LYS 122 Cb 0.03 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.08 1hfz n LYS 122 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46