#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 0.46 0.31 2.12 2.56 -1.26 -4.98 118.70 117.91 1hfz s GLU 1 Ca 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 54.97 54.80 1hfz s GLU 1 Cb 0.00 0.06 -0.04 0.00 2.00 0.00 0.00 34.13 36.14 1hfz s GLU 1 CO 0.00 -0.67 0.55 -0.65 -0.56 0.00 0.00 175.26 173.93 1hfz s GLN 2 N 1.92 3.56 0.39 4.30 -0.21 -1.26 -1.42 119.66 126.93 1hfz s GLN 2 Ca 0.15 -0.14 0.08 0.00 0.02 0.00 0.00 55.36 55.47 1hfz s GLN 2 Cb -0.00 -2.66 -0.04 0.00 1.00 0.00 0.00 33.01 31.31 1hfz s GLN 2 CO -0.11 0.18 0.22 -0.51 -2.12 0.00 0.00 175.29 172.95 1hfz s LEU 3 N -3.88 3.25 0.29 2.90 1.43 -0.92 -4.97 118.68 116.79 1hfz s LEU 3 Ca 0.42 -0.87 0.06 0.00 -1.03 0.00 0.00 54.13 52.71 1hfz s LEU 3 Cb -0.10 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 1hfz s LEU 3 CO 0.33 -0.48 0.42 0.42 0.23 0.00 0.00 176.35 177.27 1hfz s THR 4 N -2.50 4.69 0.24 5.49 -4.23 -1.26 -4.84 115.64 113.23 1hfz s THR 4 Ca 0.42 -0.98 -0.10 0.00 -1.18 0.00 0.00 61.69 59.85 1hfz s THR 4 Cb -0.00 -3.64 0.31 0.00 1.34 0.00 0.00 72.50 70.50 1hfz s THR 4 CO 0.24 -0.25 1.61 0.50 -0.54 0.00 0.00 174.62 176.18 1hfz h LYS 5 N 1.02 0.02 -0.17 3.99 3.64 -1.99 0.11 116.57 123.19 1hfz h LYS 5 Ca -0.49 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.81 1hfz h LYS 5 Cb 1.24 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 1hfz h LYS 5 CO 0.57 0.02 -0.25 0.00 -2.27 0.00 0.00 179.45 177.52 1hfz h GLU 7 N 0.28 0.69 -0.65 0.00 5.08 -1.43 -2.42 114.58 116.14 1hfz h GLU 7 Ca 0.05 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 1hfz h GLU 7 Cb 0.59 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1hfz h GLU 7 CO 0.04 0.95 0.33 0.28 -1.00 0.00 0.00 179.01 179.61 1hfz h VAL 8 N 0.43 1.21 -0.09 3.13 2.07 -0.85 0.28 116.25 122.44 1hfz h VAL 8 Ca 0.05 -0.56 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 1hfz h VAL 8 Cb 0.79 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1hfz h VAL 8 CO 0.06 0.24 -0.14 0.15 0.02 0.00 0.00 177.57 177.90 1hfz h PHE 9 N 0.91 0.14 0.12 1.57 3.04 -1.14 -1.00 116.94 120.58 1hfz h PHE 9 Ca 0.23 -0.01 -0.19 0.00 3.98 0.00 0.00 57.97 61.97 1hfz h PHE 9 Cb 0.07 -0.04 0.01 0.00 2.56 0.00 0.00 35.95 38.55 1hfz h PHE 9 CO 0.01 0.28 -0.90 -0.09 -2.02 0.00 0.00 178.31 175.58 1hfz h ARG 10 N 0.13 0.26 0.00 1.11 1.12 -0.58 -3.36 114.38 113.06 1hfz h ARG 10 Ca 0.03 -0.44 0.00 0.00 -1.11 0.00 0.00 59.98 58.45 1hfz h ARG 10 Cb 0.33 0.16 0.00 0.00 -0.01 0.00 0.00 29.97 30.46 1hfz h ARG 10 CO 0.02 1.21 0.00 0.39 -3.11 0.00 0.00 179.97 178.48 1hfz n GLU 11 N -4.12 0.08 -0.72 0.20 1.02 0.83 -3.51 120.64 114.42 1hfz n GLU 11 Ca -0.16 0.09 0.08 0.00 -0.02 0.00 0.00 57.16 57.14 1hfz n GLU 11 Cb 0.81 -1.60 0.36 0.00 -0.02 0.00 0.00 31.44 30.99 1hfz n GLU 11 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1hfz n LEU 12 N -1.74 5.05 0.06 -4.62 4.77 -0.39 -4.69 117.00 115.45 1hfz n LEU 12 Ca 0.06 -2.86 0.21 0.00 -0.03 0.00 0.00 56.01 53.39 1hfz n LEU 12 Cb 0.35 -0.62 0.74 0.00 -2.33 0.00 0.00 43.42 41.56 1hfz n LEU 12 CO 0.27 0.67 1.19 0.50 -1.33 0.00 0.00 177.39 178.69 1hfz h LYS 13 N 3.40 0.00 -0.01 3.23 3.64 -1.71 -1.73 116.57 123.40 1hfz h LYS 13 Ca 0.00 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.24 1hfz h LYS 13 Cb 1.73 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.53 1hfz h LYS 13 CO 0.37 0.00 -0.65 -0.44 -2.27 0.00 0.00 179.45 176.46 1hfz h ASP 14 N 0.00 0.04 0.68 4.20 3.32 -1.90 -3.14 116.42 119.62 1hfz h ASP 14 Ca 0.21 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1hfz h ASP 14 Cb 1.08 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1hfz h ASP 14 CO -0.00 0.68 0.00 0.18 -1.72 0.00 0.00 179.24 178.37 1hfz n LEU 15 N -3.78 0.00 -4.58 1.55 4.77 -0.65 -4.67 117.00 109.64 1hfz n LEU 15 Ca -0.01 0.41 -0.44 0.00 -0.03 0.00 0.00 56.01 55.94 1hfz n LEU 15 Cb 0.64 -0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1hfz n LEU 15 CO 0.43 -0.07 1.85 1.17 -1.33 0.00 0.00 177.39 179.44 1hfz n LYS 16 N -1.41 1.87 0.00 3.23 3.00 -1.19 -1.90 118.16 121.75 1hfz n LYS 16 Ca 0.08 0.51 0.00 0.00 -0.00 0.00 0.00 58.31 58.90 1hfz n LYS 16 Cb 0.25 -3.15 0.00 0.00 0.00 0.00 0.00 35.03 32.13 1hfz n LYS 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1hfz n GLY 17 N 5.85 2.85 3.64 3.14 0.00 -0.37 -5.00 105.19 115.31 1hfz n GLY 17 Ca 0.31 -0.03 -0.46 0.00 0.00 0.00 0.00 46.02 45.85 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 2.28 -1.00 1.61 4.19 -0.80 -0.26 117.16 123.17 1hfz n TYR 18 Ca 0.00 -0.13 -0.00 0.00 3.31 0.00 0.00 57.90 61.08 1hfz n TYR 18 Cb 0.00 -2.71 -0.00 0.00 0.49 0.00 0.00 39.34 37.12 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 4.85 0.47 2.25 2.98 0.00 -1.26 -3.59 105.19 110.89 1hfz n GLY 19 Ca 0.24 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.91 2.04 3.67 -0.02 0.00 0.64 -4.99 105.19 103.61 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 0.54 0.00 0.00 0.00 173.32 173.86 1hfz s VAL 21 N -2.86 4.78 0.97 1.61 0.11 -1.24 -4.85 120.40 118.91 1hfz s VAL 21 Ca 0.00 1.89 -0.13 0.00 -2.93 0.00 0.00 61.98 60.82 1hfz s VAL 21 Cb 0.00 -4.25 0.17 0.00 -1.53 0.00 0.00 36.38 30.77 1hfz s VAL 21 CO 0.00 -0.06 1.12 -0.94 -3.33 0.00 0.00 175.10 171.89 1hfz s SER 22 N 1.17 2.97 0.18 3.54 1.04 -1.26 -1.23 113.70 120.12 1hfz s SER 22 Ca 0.43 1.03 -0.03 0.00 0.48 0.00 0.00 55.95 57.86 1hfz s SER 22 Cb -0.16 -1.62 0.09 0.00 0.10 0.00 0.00 66.02 64.42 1hfz s SER 22 CO 0.12 -2.89 1.48 -0.07 0.98 0.00 0.00 173.24 172.85 1hfz h LEU 23 N -1.73 0.58 -1.63 2.42 3.38 -1.94 -2.89 115.31 113.49 1hfz h LEU 23 Ca -0.52 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.09 1hfz h LEU 23 Cb 1.33 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1hfz h LEU 23 CO 0.59 1.05 -0.13 -0.65 0.09 0.00 0.00 178.44 179.39 1hfz h PRO 24 N 0.38 0.00 -0.08 1.13 0.11 -1.92 -0.80 132.00 130.82 1hfz h PRO 24 Ca -0.01 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.98 1hfz h PRO 24 Cb 1.17 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.29 1hfz h PRO 24 CO 0.11 0.13 -0.43 0.93 -0.21 0.00 0.00 178.00 178.53 1hfz h GLU 25 N 0.00 0.43 -0.37 1.05 5.08 -1.81 -1.68 114.58 117.28 1hfz h GLU 25 Ca -0.00 -0.36 -0.06 0.00 -1.00 0.00 0.00 59.36 57.94 1hfz h GLU 25 Cb 0.49 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1hfz h GLU 25 CO 0.02 0.99 -0.04 -1.49 -1.00 0.00 0.00 179.01 177.49 1hfz h TRP 26 N -0.03 0.63 -0.18 4.33 -0.00 -1.36 0.32 115.95 119.67 1hfz h TRP 26 Ca -0.03 -0.08 -0.19 0.00 -0.00 0.00 0.00 58.89 58.59 1hfz h TRP 26 Cb 1.08 -0.18 0.00 0.00 -0.00 0.00 0.00 29.16 30.07 1hfz h TRP 26 CO 0.12 0.63 -0.65 0.28 -0.00 0.00 0.00 178.44 178.83 1hfz h VAL 27 N 0.56 1.31 -0.06 1.49 2.07 -1.15 -1.52 116.25 118.95 1hfz h VAL 27 Ca 0.11 -1.89 -0.02 0.00 0.82 0.00 0.00 66.70 65.72 1hfz h VAL 27 Cb 0.42 1.86 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1hfz h VAL 27 CO 0.02 0.60 -0.04 0.00 0.02 0.00 0.00 177.57 178.17 1hfz h THR 29 N -0.26 0.74 0.00 0.00 2.02 -0.36 -2.56 112.91 112.49 1hfz h THR 29 Ca 0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.16 1hfz h THR 29 Cb 0.49 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1hfz h THR 29 CO 0.01 0.00 -0.14 0.71 0.37 0.00 0.00 175.52 176.47 1hfz h THR 30 N -0.17 0.68 -0.13 3.16 1.35 -1.35 0.26 112.91 116.71 1hfz h THR 30 Ca 0.04 -0.59 -0.03 0.00 -0.55 0.00 0.00 66.41 65.28 1hfz h THR 30 Cb 0.22 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 68.00 1hfz h THR 30 CO -0.10 0.14 -0.04 0.15 -0.25 0.00 0.00 175.52 175.41 1hfz h PHE 31 N 0.00 0.29 0.00 4.73 3.57 -1.30 -0.76 116.94 123.46 1hfz h PHE 31 Ca -0.00 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1hfz h PHE 31 Cb 0.35 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1hfz h PHE 31 CO 0.00 0.56 0.00 0.72 -2.23 0.00 0.00 178.31 177.36 1hfz n HIS 32 N -4.71 0.75 -0.08 0.41 8.25 -0.90 -0.21 115.22 118.73 1hfz n HIS 32 Ca -0.06 0.27 -0.14 0.00 -0.26 0.00 0.00 57.72 57.53 1hfz n HIS 32 Cb 0.26 -0.93 -0.08 0.00 1.12 0.00 0.00 29.99 30.37 1hfz n HIS 32 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1hfz h THR 33 N 0.00 0.65 0.00 1.59 2.02 -0.72 -3.45 112.91 113.00 1hfz h THR 33 Ca 0.00 -1.72 0.00 0.00 0.77 0.00 0.00 66.41 65.46 1hfz h THR 33 Cb 0.47 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.34 1hfz h THR 33 CO 0.00 0.22 0.00 -1.54 0.37 0.00 0.00 175.52 174.57 1hfz n SER 34 N -4.54 0.82 -0.61 4.18 3.41 -0.31 -4.96 113.62 111.60 1hfz n SER 34 Ca -0.19 -1.25 -0.08 0.00 -0.26 0.00 0.00 58.87 57.10 1hfz n SER 34 Cb 0.47 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 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 -0.12 0.93 2.54 5.00 0.00 0.71 -2.57 105.19 111.68 1hfz n GLY 35 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.54 0.00 -2.66 1.61 4.01 -1.23 -4.76 117.16 111.58 1hfz n TYR 36 Ca -0.08 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.23 1hfz n TYR 36 Cb 0.38 -0.80 -0.03 0.00 -0.31 0.00 0.00 39.34 38.58 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 -2.08 6.62 0.28 7.72 2.15 -1.06 -2.16 116.67 128.15 1hfz s ASP 37 Ca 0.00 0.43 0.21 0.00 0.43 0.00 0.00 52.55 53.62 1hfz s ASP 37 Cb 0.00 -2.52 1.04 0.00 -0.30 0.00 0.00 42.92 41.14 1hfz s ASP 37 CO 0.00 -1.16 1.64 0.35 -0.17 0.00 0.00 175.17 175.83 1hfz n THR 38 N 6.64 1.01 -1.53 1.71 -2.24 -0.51 -1.95 114.28 117.40 1hfz n THR 38 Ca 0.10 0.53 0.02 0.00 -2.27 0.00 0.00 64.05 62.44 1hfz n THR 38 Cb 0.49 -1.50 0.20 0.00 -2.10 0.00 0.00 70.33 67.42 1hfz n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hfz n GLN 39 N -2.20 1.68 -1.96 -0.78 6.02 -1.26 -3.96 117.38 114.92 1hfz n GLN 39 Ca -0.00 -3.25 -0.42 0.00 -0.01 0.00 0.00 57.00 53.32 1hfz n GLN 39 Cb 0.11 -1.69 -0.03 0.00 1.02 0.00 0.00 30.24 29.65 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 -3.23 3.75 -0.09 -1.58 0.00 -0.82 -4.77 121.76 115.01 1hfz s ALA 40 Ca 0.40 1.33 -0.00 0.00 0.00 0.00 0.00 51.96 53.69 1hfz s ALA 40 Cb 0.38 -3.62 0.02 0.00 0.00 0.00 0.00 23.12 19.90 1hfz s ALA 40 CO -0.04 -0.80 -0.05 0.42 0.00 0.00 0.00 175.76 175.28 1hfz s ILE 41 N 1.32 0.78 -0.09 0.00 1.01 -1.26 -0.50 121.20 122.47 1hfz s ILE 41 Ca 0.70 -0.17 0.00 0.00 0.00 0.00 0.00 60.65 61.19 1hfz s ILE 41 Cb -0.43 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.24 1hfz s ILE 41 CO 0.31 0.32 -0.07 -0.69 0.00 0.00 0.00 174.94 174.80 1hfz s VAL 42 N 1.57 0.93 -0.09 2.92 1.01 -0.36 -4.94 120.40 121.44 1hfz s VAL 42 Ca 0.01 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 61.72 1hfz s VAL 42 Cb -0.13 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 1hfz s VAL 42 CO -0.05 0.34 -0.06 -1.58 0.00 0.00 0.00 175.10 173.75 1hfz s GLN 43 N 1.46 3.01 0.08 2.72 2.00 -1.26 0.33 119.66 128.00 1hfz s GLN 43 Ca -0.00 -0.54 0.00 0.00 -2.00 0.00 0.00 55.36 52.82 1hfz s GLN 43 Cb -0.13 -2.68 0.00 0.00 0.80 0.00 0.00 33.01 31.00 1hfz s GLN 43 CO -0.05 0.55 0.00 0.27 -0.50 0.00 0.00 175.29 175.56 1hfz n ASN 44 N 2.58 0.58 0.00 6.67 2.04 -1.10 -5.02 115.26 121.01 1hfz n ASN 44 Ca -0.18 0.12 0.00 0.00 -0.44 0.00 0.00 54.58 54.08 1hfz n ASN 44 Cb 0.53 -0.14 0.00 0.00 -2.53 0.00 0.00 39.78 37.64 1hfz n ASN 44 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1hfz n ASN 45 N -3.28 0.00 -0.46 0.53 2.85 -1.26 -4.98 115.26 108.66 1hfz n ASN 45 Ca 0.00 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.59 1hfz n ASN 45 Cb 0.16 0.00 0.24 0.00 1.24 0.00 0.00 39.78 41.42 1hfz n ASN 45 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1hfz n ASP 46 N -0.38 1.70 -3.94 1.20 8.00 -1.26 -4.97 116.55 116.89 1hfz n ASP 46 Ca 0.00 -1.34 -0.09 0.00 0.71 0.00 0.00 54.79 54.06 1hfz n ASP 46 Cb 0.00 0.20 -0.10 0.00 -0.02 0.00 0.00 41.12 41.21 1hfz n ASP 46 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1hfz s SER 47 N -2.34 0.20 -0.03 -2.24 1.04 -1.26 -4.90 113.70 104.16 1hfz s SER 47 Ca 0.25 -0.54 0.01 0.00 0.48 0.00 0.00 55.95 56.15 1hfz s SER 47 Cb 0.19 0.21 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 1hfz s SER 47 CO 0.48 -0.49 -0.03 -0.89 0.98 0.00 0.00 173.24 173.29 1hfz s THR 48 N -2.51 3.95 -0.11 2.02 2.01 -1.26 -2.69 115.64 117.04 1hfz s THR 48 Ca -0.06 -0.54 0.02 0.00 0.31 0.00 0.00 61.69 61.42 1hfz s THR 48 Cb -0.02 -2.70 0.01 0.00 0.01 0.00 0.00 72.50 69.81 1hfz s THR 48 CO -0.04 0.48 -0.18 -1.61 -0.69 0.00 0.00 174.62 172.58 1hfz s GLU 49 N -1.21 2.53 -0.04 4.92 2.02 0.15 -1.26 118.70 125.82 1hfz s GLU 49 Ca 0.16 -0.68 -0.00 0.00 0.02 0.00 0.00 54.97 54.46 1hfz s GLU 49 Cb -0.11 -2.07 -0.04 0.00 0.10 0.00 0.00 34.13 32.01 1hfz s GLU 49 CO 0.06 -0.01 0.02 0.71 0.02 0.00 0.00 175.26 176.06 1hfz s TYR 50 N 0.83 3.16 0.00 1.61 1.51 0.04 -1.23 117.35 123.27 1hfz s TYR 50 Ca -0.09 0.16 0.00 0.00 -1.01 0.00 0.00 57.07 56.13 1hfz s TYR 50 Cb -0.16 -1.74 0.00 0.00 -0.11 0.00 0.00 41.96 39.96 1hfz s TYR 50 CO 0.00 0.49 0.00 0.41 -1.11 0.00 0.00 175.55 175.34 1hfz n GLY 51 N 1.67 -1.08 0.26 0.71 0.00 0.35 -1.98 105.19 105.12 1hfz n GLY 51 Ca -0.16 -1.17 0.05 0.00 0.00 0.00 0.00 46.02 44.74 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 0.17 -0.91 0.99 6.46 -1.69 -2.92 115.31 117.41 1hfz h LEU 52 Ca 0.00 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1hfz h LEU 52 Cb 0.00 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 39.89 1hfz h LEU 52 CO 0.00 0.21 -0.44 0.49 -0.62 0.00 0.00 178.44 178.08 1hfz n PHE 53 N -4.41 0.00 -3.37 1.25 3.72 -1.26 -4.17 117.46 109.21 1hfz n PHE 53 Ca -0.01 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.26 1hfz n PHE 53 Cb 0.16 -0.02 0.01 0.00 -0.94 0.00 0.00 39.48 38.69 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 -0.13 -1.42 -3.35 -1.08 1.13 -0.98 -4.96 117.38 106.59 1hfz n GLN 54 Ca 0.10 1.10 -0.39 0.00 -1.94 0.00 0.00 57.00 55.87 1hfz n GLN 54 Cb 0.45 -4.52 -0.08 0.00 0.11 0.00 0.00 30.24 26.20 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 -3.09 5.16 0.41 5.09 1.01 -0.84 -4.58 121.20 124.37 1hfz s ILE 55 Ca 0.10 0.71 -0.23 0.00 0.00 0.00 0.00 60.65 61.23 1hfz s ILE 55 Cb -0.03 -3.74 -0.10 0.00 0.01 0.00 0.00 42.46 38.60 1hfz s ILE 55 CO 0.81 0.19 1.00 0.54 0.00 0.00 0.00 174.94 177.47 1hfz s ASN 56 N 1.32 6.86 -0.00 3.58 2.20 -1.26 -0.78 114.94 126.86 1hfz s ASN 56 Ca 0.18 1.88 0.04 0.00 -0.94 0.00 0.00 52.86 54.02 1hfz s ASN 56 Cb -0.15 -2.57 0.12 0.00 -2.00 0.00 0.00 41.25 36.66 1hfz s ASN 56 CO 0.09 -0.41 1.06 -0.46 -2.94 0.00 0.00 177.10 174.44 1hfz n ASN 57 N -0.24 0.86 -0.08 3.54 6.94 -0.39 -2.83 115.26 123.06 1hfz n ASN 57 Ca 0.06 -2.02 -0.20 0.00 -0.02 0.00 0.00 54.58 52.40 1hfz n ASN 57 Cb 0.51 -0.14 -0.12 0.00 -2.36 0.00 0.00 39.78 37.67 1hfz n ASN 57 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 1hfz h LYS 58 N 0.80 0.04 0.00 -3.83 3.64 -1.82 -3.40 116.57 112.00 1hfz h LYS 58 Ca 0.00 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.24 1hfz h LYS 58 Cb 0.25 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1hfz h LYS 58 CO 0.01 1.04 -1.23 -0.89 -2.27 0.00 0.00 179.45 176.11 1hfz n ILE 59 N -4.37 0.23 -0.04 2.00 2.08 -1.25 -2.71 119.36 115.31 1hfz n ILE 59 Ca -0.26 -0.11 -0.14 0.00 0.56 0.00 0.00 62.75 62.80 1hfz n ILE 59 Cb 0.68 -0.74 -0.14 0.00 -0.75 0.00 0.00 39.64 38.69 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 -2.44 0.83 -4.15 1.39 7.02 -1.13 -1.21 117.44 117.76 1hfz n TRP 60 Ca -0.07 0.24 -0.10 0.00 -1.02 0.00 0.00 57.50 56.56 1hfz n TRP 60 Cb 0.59 -1.13 -0.10 0.00 -2.42 0.00 0.00 31.31 28.25 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 -3.96 4.59 -0.05 0.00 2.47 0.27 -4.53 119.74 118.54 1hfz s LYS 62 Ca 0.17 1.33 0.04 0.00 -1.56 0.00 0.00 55.97 55.95 1hfz s LYS 62 Cb 0.07 -3.41 -0.00 0.00 -1.46 0.00 0.00 37.83 33.03 1hfz s LYS 62 CO -0.03 0.12 -0.18 0.34 0.16 0.00 0.00 175.35 175.77 1hfz s ASP 63 N 0.40 2.27 0.00 1.43 2.15 -1.26 -1.24 116.67 120.42 1hfz s ASP 63 Ca 0.46 -0.38 0.02 0.00 0.43 0.00 0.00 52.55 53.09 1hfz s ASP 63 Cb -0.22 -0.72 0.11 0.00 -0.30 0.00 0.00 42.92 41.79 1hfz s ASP 63 CO 0.27 0.15 0.92 0.47 -0.17 0.00 0.00 175.17 176.80 1hfz n ASP 64 N 3.25 0.00 -0.84 -0.34 8.00 -1.26 -3.01 116.55 122.35 1hfz n ASP 64 Ca -0.19 0.30 0.05 0.00 0.71 0.00 0.00 54.79 55.67 1hfz n ASP 64 Cb 0.53 -0.33 0.10 0.00 -0.02 0.00 0.00 41.12 41.40 1hfz n ASP 64 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hfz n GLN 65 N -1.33 0.74 -3.14 -1.24 -0.00 -1.26 -4.93 117.38 106.23 1hfz n GLN 65 Ca 0.01 -2.40 -0.01 0.00 -0.00 0.00 0.00 57.00 54.60 1hfz n GLN 65 Cb 0.02 -0.85 -0.01 0.00 -0.00 0.00 0.00 30.24 29.40 1hfz n GLN 65 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.06 178.27 1hfz s ASN 66 N -2.42 -1.43 0.05 2.61 2.47 -1.17 -5.01 114.94 110.05 1hfz s ASN 66 Ca 0.30 -0.98 0.25 0.00 0.42 0.00 0.00 52.86 52.86 1hfz s ASN 66 Cb 0.31 1.90 1.03 0.00 -1.45 0.00 0.00 41.25 43.05 1hfz s ASN 66 CO -0.08 -0.15 1.80 -0.81 -3.72 0.00 0.00 177.10 174.14 1hfz n PRO 67 N 4.15 0.06 0.00 0.43 -0.04 -1.26 -2.93 135.00 135.41 1hfz n PRO 67 Ca 0.12 0.11 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 1hfz n PRO 67 Cb 0.56 -1.58 0.72 0.00 -0.04 0.00 0.00 33.50 33.16 1hfz n PRO 67 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1hfz n HIS 68 N -1.69 0.00 -1.65 0.54 8.25 -1.26 -4.89 115.22 114.52 1hfz n HIS 68 Ca 0.06 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.14 1hfz n HIS 68 Cb 0.32 -0.15 0.06 0.00 1.12 0.00 0.00 29.99 31.33 1hfz n HIS 68 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1hfz n SER 69 N -1.15 1.21 0.11 0.41 2.88 -1.15 -4.91 113.62 111.01 1hfz n SER 69 Ca 0.16 0.81 0.08 0.00 -1.33 0.00 0.00 58.87 58.59 1hfz n SER 69 Cb 0.15 -1.45 0.01 0.00 -0.75 0.00 0.00 64.21 62.18 1hfz n SER 69 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1hfz h SER 70 N 0.50 0.00 -6.69 -3.46 0.02 -1.64 -3.49 113.55 98.80 1hfz h SER 70 Ca -0.49 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 59.92 1hfz h SER 70 Cb 1.36 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.79 1hfz h SER 70 CO 0.52 0.21 -0.91 -3.20 -1.14 0.00 0.00 176.83 172.31 1hfz n ASN 71 N -2.87 -0.09 0.10 3.07 5.15 -0.71 -4.84 115.26 115.07 1hfz n ASN 71 Ca -0.02 -1.09 0.08 0.00 -0.60 0.00 0.00 54.58 52.96 1hfz n ASN 71 Cb 0.64 -2.60 0.55 0.00 -0.53 0.00 0.00 39.78 37.84 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 -1.80 1.00 0.00 -1.44 2.04 -1.12 0.13 117.51 116.33 1hfz h ILE 72 Ca -0.64 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.14 1hfz h ILE 72 Cb 1.38 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1hfz h ILE 72 CO 0.66 0.05 0.00 0.00 0.00 0.00 0.00 178.15 178.86 1hfz n ASN 74 N -1.37 -5.18 -4.19 0.00 3.02 0.45 -4.96 115.26 103.02 1hfz n ASN 74 Ca 0.11 -0.29 -0.12 0.00 -0.03 0.00 0.00 54.58 54.25 1hfz n ASN 74 Cb 0.27 -4.22 -0.10 0.00 -0.61 0.00 0.00 39.78 35.11 1hfz n ASN 74 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1hfz s ILE 75 N -3.06 0.37 0.07 2.41 2.07 -1.26 -5.02 121.20 116.78 1hfz s ILE 75 Ca 0.32 -1.94 -0.22 0.00 -1.41 0.00 0.00 60.65 57.39 1hfz s ILE 75 Cb -0.15 -2.09 -0.06 0.00 0.13 0.00 0.00 42.46 40.29 1hfz s ILE 75 CO 0.39 -0.46 0.67 -0.55 -1.91 0.00 0.00 174.94 173.07 1hfz s SER 76 N -3.11 7.15 0.56 4.50 0.15 -1.26 -0.56 113.70 121.12 1hfz s SER 76 Ca 0.24 1.37 0.24 0.00 0.70 0.00 0.00 55.95 58.50 1hfz s SER 76 Cb 0.07 -2.42 1.55 0.00 -1.71 0.00 0.00 66.02 63.51 1hfz s SER 76 CO 0.03 0.16 2.16 0.00 1.20 0.00 0.00 173.24 176.78 1hfz h ASP 78 N 0.00 0.00 0.27 0.00 3.04 -1.93 -2.09 116.42 115.71 1hfz h ASP 78 Ca 0.05 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.84 1hfz h ASP 78 Cb 0.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.52 1hfz h ASP 78 CO -0.00 0.10 0.00 0.29 -2.04 0.00 0.00 179.24 177.59 1hfz n LYS 79 N -3.37 0.21 0.00 4.15 5.02 -0.87 -0.33 118.16 122.97 1hfz n LYS 79 Ca -0.01 0.15 0.12 0.00 -2.02 0.00 0.00 58.31 56.55 1hfz n LYS 79 Cb 0.29 -1.50 0.15 0.00 -0.02 0.00 0.00 35.03 33.94 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 -1.28 0.00 0.92 2.13 3.72 -0.78 -4.18 117.46 117.98 1hfz n PHE 80 Ca 0.07 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.58 1hfz n PHE 80 Cb 0.12 -0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.70 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 0.96 2.42 0.00 4.37 4.77 0.55 -3.81 117.00 126.25 1hfz n LEU 81 Ca 0.14 -0.89 -0.10 0.00 -0.03 0.00 0.00 56.01 55.13 1hfz n LEU 81 Cb 0.54 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.70 1hfz n LEU 81 CO 0.17 0.42 0.28 -0.90 -1.33 0.00 0.00 177.39 176.04 1hfz n ASP 82 N 0.65 0.36 0.09 -1.43 5.68 -1.25 -4.40 116.55 116.25 1hfz n ASP 82 Ca 0.11 -1.36 0.13 0.00 -0.50 0.00 0.00 54.79 53.16 1hfz n ASP 82 Cb 0.50 -0.32 0.29 0.00 -1.14 0.00 0.00 41.12 40.45 1hfz n ASP 82 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1hfz h ASP 83 N -0.42 0.00 -3.60 -1.12 2.03 -1.92 -3.45 116.42 107.94 1hfz h ASP 83 Ca -0.15 -0.09 -0.63 0.00 -0.73 0.00 0.00 57.03 55.43 1hfz h ASP 83 Cb 0.49 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 38.86 1hfz h ASP 83 CO 0.14 0.05 -0.02 -0.62 -1.03 0.00 0.00 179.24 177.75 1hfz s ASP 84 N -4.46 6.39 -0.01 4.15 2.15 -1.26 -4.94 116.67 118.69 1hfz s ASP 84 Ca 0.08 0.35 0.17 0.00 0.43 0.00 0.00 52.55 53.58 1hfz s ASP 84 Cb 0.12 -2.28 0.49 0.00 -0.30 0.00 0.00 42.92 40.96 1hfz s ASP 84 CO 0.66 -0.35 1.41 0.18 -0.17 0.00 0.00 175.17 176.89 1hfz n LEU 85 N 5.62 3.02 0.05 -1.34 4.77 -1.26 -4.42 117.00 123.44 1hfz n LEU 85 Ca -0.04 -1.51 -0.12 0.00 -0.03 0.00 0.00 56.01 54.30 1hfz n LEU 85 Cb 0.49 -0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 41.13 1hfz n LEU 85 CO 0.42 0.73 0.86 0.74 -1.33 0.00 0.00 177.39 178.81 1hfz h THR 86 N 3.23 0.99 0.00 -5.08 2.02 -1.93 -0.69 112.91 111.45 1hfz h THR 86 Ca 0.00 -0.02 -0.13 0.00 0.77 0.00 0.00 66.41 67.03 1hfz h THR 86 Cb 0.77 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 1hfz h THR 86 CO 0.01 0.01 -0.60 -2.24 0.37 0.00 0.00 175.52 173.07 1hfz h ASP 87 N -0.03 0.00 -0.30 4.18 3.04 -1.92 -2.61 116.42 118.78 1hfz h ASP 87 Ca -0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1hfz h ASP 87 Cb 0.02 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.30 1hfz h ASP 87 CO 0.00 0.60 0.19 0.44 -2.04 0.00 0.00 179.24 178.44 1hfz h ASP 88 N 0.00 0.35 -0.68 4.15 5.19 -1.74 0.08 116.42 123.77 1hfz h ASP 88 Ca -0.01 -0.02 0.05 0.00 -0.62 0.00 0.00 57.03 56.44 1hfz h ASP 88 Cb 1.27 -0.09 -0.04 0.00 0.18 0.00 0.00 39.33 40.65 1hfz h ASP 88 CO 0.08 0.26 0.45 0.40 -3.12 0.00 0.00 179.24 177.31 1hfz h ILE 89 N 0.40 1.04 -0.36 0.35 5.03 -1.04 0.58 117.51 123.51 1hfz h ILE 89 Ca 0.11 -0.25 -0.09 0.00 -0.12 0.00 0.00 64.86 64.51 1hfz h ILE 89 Cb -0.03 0.25 -0.01 0.00 -3.03 0.00 0.00 36.82 33.99 1hfz h ILE 89 CO -0.02 0.13 -0.15 1.62 -0.68 0.00 0.00 178.15 179.05 1hfz h VAL 90 N 0.73 1.28 -0.27 1.67 3.04 -0.65 -2.39 116.25 119.66 1hfz h VAL 90 Ca 0.29 -1.25 -0.01 0.00 -1.01 0.00 0.00 66.70 64.71 1hfz h VAL 90 Cb 0.21 1.34 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 1hfz h VAL 90 CO -0.09 0.41 0.13 0.00 -1.01 0.00 0.00 177.57 177.02 1hfz h VAL 92 N 0.31 0.42 0.00 0.00 2.07 -0.80 0.16 116.25 118.41 1hfz h VAL 92 Ca 0.09 0.00 -0.19 0.00 0.82 0.00 0.00 66.70 67.43 1hfz h VAL 92 Cb 0.11 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 1hfz h VAL 92 CO -0.01 0.00 -0.95 0.11 0.02 0.00 0.00 177.57 176.74 1hfz h LYS 93 N 0.00 0.00 -0.06 1.57 1.57 -0.88 -2.65 116.57 116.12 1hfz h LYS 93 Ca 0.04 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.57 1hfz h LYS 93 Cb 0.28 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.60 1hfz h LYS 93 CO -0.00 0.77 -0.94 0.87 -0.57 0.00 0.00 179.45 179.58 1hfz h LYS 94 N 0.00 0.73 -0.56 3.15 1.57 -0.48 -2.20 116.57 118.78 1hfz h LYS 94 Ca -0.04 -0.71 -0.03 0.00 -1.87 0.00 0.00 60.65 58.00 1hfz h LYS 94 Cb 1.67 0.18 -0.02 0.00 0.08 0.00 0.00 32.23 34.14 1hfz h LYS 94 CO 0.10 1.29 0.21 0.82 -0.57 0.00 0.00 179.45 181.31 1hfz h ILE 95 N 0.45 1.22 0.00 1.86 2.04 -1.31 -1.29 117.51 120.48 1hfz h ILE 95 Ca -0.10 -0.71 -0.07 0.00 1.00 0.00 0.00 64.86 64.98 1hfz h ILE 95 Cb 1.58 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1hfz h ILE 95 CO 0.19 0.27 -0.31 -0.07 0.00 0.00 0.00 178.15 178.23 1hfz h LEU 96 N 0.77 0.00 -0.20 1.44 3.38 -1.48 0.54 115.31 119.75 1hfz h LEU 96 Ca 0.18 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.08 1hfz h LEU 96 Cb 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1hfz h LEU 96 CO -0.01 0.31 -0.15 0.44 0.09 0.00 0.00 178.44 179.12 1hfz h ASP 97 N 0.00 0.48 0.11 -0.43 3.32 -0.73 -3.16 116.42 116.01 1hfz h ASP 97 Ca -0.00 -0.45 -0.31 0.00 0.02 0.00 0.00 57.03 56.29 1hfz h ASP 97 Cb 0.57 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1hfz h ASP 97 CO 0.04 0.83 -1.65 0.11 -1.72 0.00 0.00 179.24 176.85 1hfz h LYS 98 N 0.14 0.23 0.00 3.56 1.57 -1.07 -3.44 116.57 117.57 1hfz h LYS 98 Ca 0.04 -0.40 -0.34 0.00 -1.87 0.00 0.00 60.65 58.08 1hfz h LYS 98 Cb 0.67 0.15 -0.05 0.00 0.08 0.00 0.00 32.23 33.08 1hfz h LYS 98 CO 0.04 1.19 -2.13 0.28 -0.57 0.00 0.00 179.45 178.26 1hfz n VAL 99 N -3.79 1.11 0.00 0.50 0.31 0.18 -5.09 118.33 111.54 1hfz n VAL 99 Ca -0.29 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 63.74 1hfz n VAL 99 Cb 0.94 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 32.17 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 1.83 1.79 0.10 2.92 0.00 -0.52 -4.70 105.19 106.60 1hfz n GLY 100 Ca -0.39 -2.12 0.08 0.00 0.00 0.00 0.00 46.02 43.59 1hfz n GLY 100 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1hfz n ILE 101 N 0.11 1.21 1.75 -0.61 0.13 -1.26 -2.52 119.36 118.16 1hfz n ILE 101 Ca 0.00 0.50 0.06 0.00 -1.10 0.00 0.00 62.75 62.21 1hfz n ILE 101 Cb 0.00 -1.45 0.37 0.00 -0.84 0.00 0.00 39.64 37.72 1hfz n ILE 101 CO 0.00 0.00 0.00 0.59 2.80 0.00 0.00 176.55 179.94 1hfz n ASN 102 N -1.98 0.00 0.11 9.51 3.02 -1.26 -2.11 115.26 122.55 1hfz n ASN 102 Ca 0.00 -1.37 0.00 0.00 -0.03 0.00 0.00 54.58 53.19 1hfz n ASN 102 Cb 0.09 0.00 0.31 0.00 -0.61 0.00 0.00 39.78 39.57 1hfz n ASN 102 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1hfz h TYR 103 N 0.00 0.24 -3.38 3.10 5.03 -1.82 -3.38 116.97 116.76 1hfz h TYR 103 Ca 0.00 -0.05 -0.71 0.00 2.58 0.00 0.00 58.73 60.56 1hfz h TYR 103 Cb 0.00 -0.06 -0.20 0.00 1.55 0.00 0.00 36.73 38.02 1hfz h TYR 103 CO 0.00 0.49 -0.18 -1.58 -1.32 0.00 0.00 178.16 175.57 1hfz s TRP 104 N -4.39 3.16 0.33 -3.82 0.51 -0.90 -4.97 118.94 108.87 1hfz s TRP 104 Ca -0.05 -0.61 0.16 0.00 -2.12 0.00 0.00 56.10 53.48 1hfz s TRP 104 Cb 0.14 -3.15 0.79 0.00 -0.81 0.00 0.00 33.47 30.44 1hfz s TRP 104 CO 0.75 -0.82 1.83 -0.07 -0.51 0.00 0.00 176.95 178.13 1hfz h LEU 105 N 9.13 0.00 -1.98 2.99 3.38 -1.84 -2.80 115.31 124.19 1hfz h LEU 105 Ca -0.27 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1hfz h LEU 105 Cb 1.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1hfz h LEU 105 CO 0.87 0.35 -0.10 0.00 0.09 0.00 0.00 178.44 179.65 1hfz h ALA 106 N 1.65 1.30 0.55 1.53 0.00 -1.92 -2.86 119.26 119.51 1hfz h ALA 106 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1hfz h ALA 106 Cb 0.69 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1hfz h ALA 106 CO 0.05 0.13 -0.37 1.25 0.00 0.00 0.00 179.25 180.30 1hfz h HIS 107 N 0.00 -1.00 -0.70 0.00 -0.00 -1.82 0.61 115.15 112.24 1hfz h HIS 107 Ca -0.00 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.33 1hfz h HIS 107 Cb 0.30 0.36 -0.03 0.00 -0.00 0.00 0.00 27.41 28.04 1hfz h HIS 107 CO 0.00 -0.54 0.30 -0.22 -0.00 0.00 0.00 177.93 177.47 1hfz h LYS 108 N -0.87 1.03 -0.16 5.26 3.64 -1.72 -0.86 116.57 122.89 1hfz h LYS 108 Ca -0.07 -0.18 -0.10 0.00 -1.27 0.00 0.00 60.65 59.03 1hfz h LYS 108 Cb 0.71 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1hfz h LYS 108 CO 0.05 0.84 -0.28 0.00 -2.27 0.00 0.00 179.45 177.79 1hfz h ALA 109 N 1.14 0.26 0.00 5.00 0.00 -1.51 -3.42 119.26 120.73 1hfz h ALA 109 Ca 0.23 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1hfz h ALA 109 Cb 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1hfz h ALA 109 CO -0.02 0.26 -0.12 1.28 0.00 0.00 0.00 179.25 180.65 1hfz n LEU 110 N -4.40 0.00 -0.27 0.00 4.77 0.14 -4.90 117.00 112.35 1hfz n LEU 110 Ca -0.06 -0.33 0.08 0.00 -0.03 0.00 0.00 56.01 55.67 1hfz n LEU 110 Cb 0.46 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.68 1hfz n LEU 110 CO 0.42 0.00 0.47 0.00 -1.33 0.00 0.00 177.39 176.96 1hfz n SER 112 N -1.14 1.16 -4.12 0.00 7.64 -1.07 -4.76 113.62 111.33 1hfz n SER 112 Ca 0.14 -1.08 -0.17 0.00 1.01 0.00 0.00 58.87 58.78 1hfz n SER 112 Cb 0.67 0.92 -0.12 0.00 -1.01 0.00 0.00 64.21 64.67 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 -2.90 0.72 -1.06 1.43 1.03 -1.26 -4.88 118.70 111.78 1hfz s GLU 113 Ca 0.10 -0.81 -0.13 0.00 0.03 0.00 0.00 54.97 54.16 1hfz s GLU 113 Cb 0.16 -0.65 -0.03 0.00 -0.80 0.00 0.00 34.13 32.81 1hfz s GLU 113 CO 0.82 0.15 0.84 1.63 -1.33 0.00 0.00 175.26 177.36 1hfz n LYS 114 N 1.55 -1.66 -0.05 -4.83 5.02 -1.26 -4.90 118.16 112.02 1hfz n LYS 114 Ca -0.21 0.71 0.10 0.00 -2.02 0.00 0.00 58.31 56.89 1hfz n LYS 114 Cb 0.55 -4.91 0.45 0.00 -0.02 0.00 0.00 35.03 31.10 1hfz n LYS 114 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1hfz n LEU 115 N -3.58 0.98 0.21 -0.35 4.77 -1.26 -4.29 117.00 113.48 1hfz n LEU 115 Ca -0.08 -0.40 0.06 0.00 -0.03 0.00 0.00 56.01 55.56 1hfz n LEU 115 Cb 0.60 -0.06 0.47 0.00 -2.33 0.00 0.00 43.42 42.10 1hfz n LEU 115 CO 0.63 0.20 0.80 0.44 -1.33 0.00 0.00 177.39 178.13 1hfz h ASP 116 N 1.31 0.00 0.76 -1.43 3.32 -1.97 -2.44 116.42 115.97 1hfz h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1hfz h ASP 116 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1hfz h ASP 116 CO 0.00 0.28 0.00 0.00 -1.72 0.00 0.00 179.24 177.80 1hfz n GLN 117 N -3.84 0.05 -0.67 3.56 10.64 -1.26 -3.04 117.38 122.82 1hfz n GLN 117 Ca -0.01 0.09 0.06 0.00 -1.83 0.00 0.00 57.00 55.31 1hfz n GLN 117 Cb 0.37 -1.50 0.32 0.00 -0.86 0.00 0.00 30.24 28.57 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 -1.47 1.57 -3.43 2.61 7.02 -0.92 -4.96 117.44 117.87 1hfz n TRP 118 Ca 0.06 -0.56 -0.32 0.00 -1.02 0.00 0.00 57.50 55.66 1hfz n TRP 118 Cb 0.26 -0.37 -0.05 0.00 -2.42 0.00 0.00 31.31 28.73 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 -2.06 4.17 -0.21 -0.99 1.43 -1.17 -4.77 118.68 115.08 1hfz s LEU 119 Ca 0.44 0.90 -0.04 0.00 -1.03 0.00 0.00 54.13 54.40 1hfz s LEU 119 Cb 0.32 -3.66 0.08 0.00 0.03 0.00 0.00 46.19 42.96 1hfz s LEU 119 CO 0.15 -0.07 0.15 0.00 0.23 0.00 0.00 176.35 176.81 1hfz n GLU 121 N 5.29 4.12 0.00 0.00 2.13 -1.26 -5.08 120.64 125.83 1hfz n GLU 121 Ca -0.06 -4.78 0.00 0.00 0.66 0.00 0.00 57.16 52.98 1hfz n GLU 121 Cb 0.48 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.86 1hfz n GLU 121 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35