#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hf2 s VAL 2 N 0.00 -0.12 -0.09 1.12 1.01 -1.26 0.46 120.40 121.53 1hf2 s VAL 2 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 1hf2 s VAL 2 Cb 0.00 -0.36 0.07 0.00 0.00 0.00 0.00 36.38 36.09 1hf2 s VAL 2 CO 0.00 0.08 0.67 -0.62 0.00 0.00 0.00 175.10 175.23 1hf2 s ASP 3 N 1.52 -0.65 0.19 3.32 2.15 -0.86 -4.94 116.67 117.40 1hf2 s ASP 3 Ca -0.07 0.81 -0.08 0.00 0.43 0.00 0.00 52.55 53.64 1hf2 s ASP 3 Cb -0.11 0.68 -0.07 0.00 -0.30 0.00 0.00 42.92 43.13 1hf2 s ASP 3 CO -0.08 -0.54 0.49 -0.36 -0.17 0.00 0.00 175.17 174.51 1hf2 s PHE 4 N -0.93 3.45 -0.13 -5.34 0.40 -1.26 -0.96 117.98 113.21 1hf2 s PHE 4 Ca -0.09 0.78 -0.10 0.00 -0.60 0.00 0.00 56.93 56.92 1hf2 s PHE 4 Cb -0.01 -2.18 0.04 0.00 0.51 0.00 0.00 43.02 41.38 1hf2 s PHE 4 CO 0.08 0.33 0.34 0.15 0.70 0.00 0.00 175.22 176.83 1hf2 s LYS 5 N -2.70 0.37 -0.16 0.44 1.02 -0.37 -4.95 119.74 113.38 1hf2 s LYS 5 Ca 0.45 0.55 -0.24 0.00 0.02 0.00 0.00 55.97 56.74 1hf2 s LYS 5 Cb -0.12 0.11 -0.02 0.00 -0.52 0.00 0.00 37.83 37.28 1hf2 s LYS 5 CO 0.22 -0.09 0.76 1.41 -0.92 0.00 0.00 175.35 176.73 1hf2 s MET 6 N 0.58 4.29 0.32 1.68 -2.45 -1.26 -1.30 119.30 121.15 1hf2 s MET 6 Ca -0.03 0.88 0.04 0.00 -1.25 0.00 0.00 55.69 55.33 1hf2 s MET 6 Cb -0.05 -3.56 -0.02 0.00 1.25 0.00 0.00 34.83 32.46 1hf2 s MET 6 CO -0.03 -0.25 0.15 0.25 1.05 0.00 0.00 175.02 176.18 1hf2 n THR 7 N 4.60 0.00 0.40 10.11 -2.24 -0.90 -4.98 114.28 121.27 1hf2 n THR 7 Ca 0.02 -1.98 0.11 0.00 -2.27 0.00 0.00 64.05 59.92 1hf2 n THR 7 Cb 0.49 0.79 0.45 0.00 -2.10 0.00 0.00 70.33 69.96 1hf2 n THR 7 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hf2 n LYS 8 N -0.70 0.15 0.00 -0.78 5.02 -1.26 -0.57 118.16 120.02 1hf2 n LYS 8 Ca -0.02 0.40 0.13 0.00 -2.02 0.00 0.00 58.31 56.80 1hf2 n LYS 8 Cb 0.50 -1.79 0.41 0.00 -0.02 0.00 0.00 35.03 34.13 1hf2 n LYS 8 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1hf2 n GLU 9 N -2.07 0.62 0.00 1.97 -0.58 -1.26 -5.05 120.64 114.27 1hf2 n GLU 9 Ca 0.02 -0.33 0.00 0.00 -0.42 0.00 0.00 57.16 56.43 1hf2 n GLU 9 Cb 0.20 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 1hf2 n GLU 9 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1hf2 n GLY 10 N 1.36 -1.78 3.74 0.62 0.00 0.26 -4.89 105.19 104.50 1hf2 n GLY 10 Ca 0.11 -2.00 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 1hf2 n GLY 10 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hf2 s LEU 11 N 0.00 4.36 -0.05 0.99 1.43 -1.26 -2.13 118.68 122.03 1hf2 s LEU 11 Ca 0.00 2.80 0.02 0.00 -1.03 0.00 0.00 54.13 55.92 1hf2 s LEU 11 Cb 0.00 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.62 1hf2 s LEU 11 CO 0.00 -0.85 -0.07 -0.69 0.23 0.00 0.00 176.35 174.97 1hf2 s VAL 12 N 0.37 0.73 -0.32 -1.59 1.01 -0.42 -1.22 120.40 118.96 1hf2 s VAL 12 Ca 0.65 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 62.21 1hf2 s VAL 12 Cb -0.46 -0.70 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1hf2 s VAL 12 CO 0.41 0.26 0.45 -0.22 0.00 0.00 0.00 175.10 176.00 1hf2 s LEU 13 N 0.70 4.25 -0.22 3.92 2.96 0.26 -1.23 118.68 129.31 1hf2 s LEU 13 Ca -0.11 0.08 -0.14 0.00 -0.22 0.00 0.00 54.13 53.75 1hf2 s LEU 13 Cb -0.14 -2.50 -0.04 0.00 0.50 0.00 0.00 46.19 44.01 1hf2 s LEU 13 CO 0.01 -0.35 0.30 -0.22 -1.32 0.00 0.00 176.35 174.77 1hf2 s LEU 14 N 2.22 4.13 -0.39 -0.68 0.20 -0.13 -1.61 118.68 122.42 1hf2 s LEU 14 Ca 0.17 0.34 -0.03 0.00 0.69 0.00 0.00 54.13 55.29 1hf2 s LEU 14 Cb -0.16 -2.34 0.09 0.00 -0.43 0.00 0.00 46.19 43.35 1hf2 s LEU 14 CO 0.12 -0.02 0.17 -0.63 -0.29 0.00 0.00 176.35 175.69 1hf2 s ILE 15 N 1.24 3.32 0.37 6.68 1.01 0.71 -2.03 121.20 132.51 1hf2 s ILE 15 Ca 0.14 -1.85 -0.25 0.00 0.00 0.00 0.00 60.65 58.69 1hf2 s ILE 15 Cb -0.14 -3.18 -0.09 0.00 0.01 0.00 0.00 42.46 39.06 1hf2 s ILE 15 CO 0.07 -0.55 1.08 -0.54 0.00 0.00 0.00 174.94 175.00 1hf2 s LYS 16 N 1.19 4.25 0.18 2.79 1.02 0.17 -0.67 119.74 128.68 1hf2 s LYS 16 Ca 0.05 1.64 -0.12 0.00 0.02 0.00 0.00 55.97 57.57 1hf2 s LYS 16 Cb -0.22 -2.72 -0.08 0.00 -0.52 0.00 0.00 37.83 34.29 1hf2 s LYS 16 CO -0.03 -0.10 0.10 -3.47 -0.92 0.00 0.00 175.35 170.94 1hf2 n ASP 17 N 0.25 -1.24 -3.72 2.83 2.03 -1.26 -4.81 116.55 110.62 1hf2 n ASP 17 Ca 0.03 0.45 -0.11 0.00 0.52 0.00 0.00 54.79 55.69 1hf2 n ASP 17 Cb 0.48 -0.46 -0.06 0.00 -0.72 0.00 0.00 41.12 40.36 1hf2 n ASP 17 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1hf2 s TYR 18 N -0.76 -0.13 -0.38 -0.67 -0.85 -1.26 -4.97 117.35 108.33 1hf2 s TYR 18 Ca 0.31 -0.08 0.14 0.00 -0.52 0.00 0.00 57.07 56.92 1hf2 s TYR 18 Cb -0.36 0.14 -0.18 0.00 0.38 0.00 0.00 41.96 41.94 1hf2 s TYR 18 CO 0.31 -0.57 0.46 1.04 -1.52 0.00 0.00 175.55 175.27 1hf2 n GLN 19 N 0.27 1.67 -3.70 -3.49 1.13 -1.26 -4.92 117.38 107.08 1hf2 n GLN 19 Ca -0.17 -0.05 -0.24 0.00 -1.94 0.00 0.00 57.00 54.59 1hf2 n GLN 19 Cb 0.61 -1.22 -0.17 0.00 0.11 0.00 0.00 30.24 29.57 1hf2 n GLN 19 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1hf2 s ASN 20 N -2.82 1.99 0.13 1.08 3.04 -1.26 -5.04 114.94 112.06 1hf2 s ASN 20 Ca 0.01 -0.35 -0.18 0.00 0.04 0.00 0.00 52.86 52.37 1hf2 s ASN 20 Cb 0.10 -0.36 -0.02 0.00 -1.54 0.00 0.00 41.25 39.43 1hf2 s ASN 20 CO 0.57 -0.27 1.77 0.25 -3.04 0.00 0.00 177.10 176.37 1hf2 h LEU 21 N 8.36 0.19 -1.51 3.21 6.46 -2.00 -1.90 115.31 128.12 1hf2 h LEU 21 Ca -0.16 0.01 0.23 0.00 -0.12 0.00 0.00 57.88 57.84 1hf2 h LEU 21 Cb 1.13 -0.02 -0.07 0.00 -0.73 0.00 0.00 40.66 40.96 1hf2 h LEU 21 CO 0.26 0.15 0.63 -0.33 -0.62 0.00 0.00 178.44 178.53 1hf2 h GLU 22 N 0.27 0.36 -0.26 1.25 4.39 -1.99 0.52 114.58 119.12 1hf2 h GLU 22 Ca 0.11 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.74 1hf2 h GLU 22 Cb 0.03 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 1hf2 h GLU 22 CO -0.07 0.24 -0.04 0.93 -1.16 0.00 0.00 179.01 178.91 1hf2 h GLU 23 N 0.37 0.48 0.37 2.33 4.39 -1.79 -1.98 114.58 118.76 1hf2 h GLU 23 Ca 0.51 -0.17 -0.02 0.00 0.34 0.00 0.00 59.36 60.02 1hf2 h GLU 23 Cb 1.33 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1hf2 h GLU 23 CO -0.20 0.68 -0.20 0.28 -1.16 0.00 0.00 179.01 178.41 1hf2 h VAL 24 N 0.24 0.58 -0.98 3.13 2.07 0.32 0.12 116.25 121.73 1hf2 h VAL 24 Ca 0.07 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.69 1hf2 h VAL 24 Cb 0.48 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 30.75 1hf2 h VAL 24 CO 0.02 0.00 0.61 -0.07 0.02 0.00 0.00 177.57 178.15 1hf2 h LEU 25 N -0.54 0.93 -1.01 2.57 3.38 -0.93 0.45 115.31 120.16 1hf2 h LEU 25 Ca -0.05 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1hf2 h LEU 25 Cb 0.43 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1hf2 h LEU 25 CO 0.06 0.53 0.18 0.78 0.09 0.00 0.00 178.44 180.08 1hf2 h ASN 26 N 1.02 0.83 -0.37 -0.43 -0.26 -0.88 -1.41 115.58 114.09 1hf2 h ASN 26 Ca 0.46 -0.14 -0.14 0.00 -0.56 0.00 0.00 56.30 55.93 1hf2 h ASN 26 Cb 0.38 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 1hf2 h ASN 26 CO -0.24 0.78 -0.32 0.00 -1.06 0.00 0.00 177.43 176.60 1hf2 h ALA 27 N 1.33 0.53 -0.89 -0.83 0.00 0.21 -1.94 119.26 117.67 1hf2 h ALA 27 Ca 0.20 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1hf2 h ALA 27 Cb 0.26 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1hf2 h ALA 27 CO -0.01 0.59 0.51 0.82 0.00 0.00 0.00 179.25 181.16 1hf2 h ILE 28 N 0.66 1.25 -0.44 0.00 2.04 0.10 0.28 117.51 121.41 1hf2 h ILE 28 Ca 0.06 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 1hf2 h ILE 28 Cb 0.90 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1hf2 h ILE 28 CO 0.08 0.27 0.20 0.28 0.00 0.00 0.00 178.15 178.99 1hf2 h SER 29 N 1.23 0.58 -0.42 1.72 0.02 -1.14 0.12 113.55 115.67 1hf2 h SER 29 Ca 0.32 -0.14 -0.09 0.00 -0.84 0.00 0.00 61.79 61.04 1hf2 h SER 29 Cb -0.01 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1hf2 h SER 29 CO -0.05 0.55 -0.09 0.00 -1.14 0.00 0.00 176.83 176.10 1hf2 h ALA 30 N 1.05 0.58 -0.17 3.77 0.00 -0.94 -2.40 119.26 121.14 1hf2 h ALA 30 Ca 0.15 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1hf2 h ALA 30 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1hf2 h ALA 30 CO -0.02 0.45 0.09 -0.09 0.00 0.00 0.00 179.25 179.68 1hf2 h ARG 31 N 0.63 0.24 -0.76 0.00 9.65 -0.23 -1.59 114.38 122.32 1hf2 h ARG 31 Ca 0.11 -0.03 0.16 0.00 -1.10 0.00 0.00 59.98 59.12 1hf2 h ARG 31 Cb 0.61 -0.05 -0.11 0.00 -1.39 0.00 0.00 29.97 29.04 1hf2 h ARG 31 CO 0.04 0.26 0.25 0.82 2.80 0.00 0.00 179.97 184.14 1hf2 h ILE 32 N 0.16 0.56 -0.80 1.20 1.08 -0.67 -0.01 117.51 119.03 1hf2 h ILE 32 Ca 0.06 -0.12 -0.01 0.00 -0.39 0.00 0.00 64.86 64.40 1hf2 h ILE 32 Cb 0.09 0.18 -0.04 0.00 -3.07 0.00 0.00 36.82 33.99 1hf2 h ILE 32 CO -0.01 0.06 0.45 0.74 -0.69 0.00 0.00 178.15 178.71 1hf2 h THR 33 N 0.35 1.23 -0.77 -0.27 2.02 -0.88 -2.99 112.91 111.59 1hf2 h THR 33 Ca 0.43 -0.56 -0.04 0.00 0.77 0.00 0.00 66.41 67.01 1hf2 h THR 33 Cb 0.72 0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.25 1hf2 h THR 33 CO -0.47 0.25 0.31 1.56 0.37 0.00 0.00 175.52 177.54 1hf2 h GLN 34 N 1.10 1.15 0.00 6.66 4.20 -0.07 -2.64 115.11 125.51 1hf2 h GLN 34 Ca 0.28 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1hf2 h GLN 34 Cb 0.01 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.60 1hf2 h GLN 34 CO -0.05 0.93 0.00 -1.33 -0.67 0.00 0.00 178.83 177.72 1hf2 n MET 35 N -4.31 0.00 0.00 1.46 2.81 -0.77 -4.93 117.12 111.38 1hf2 n MET 35 Ca 0.07 0.26 0.00 0.00 -1.81 0.00 0.00 57.70 56.22 1hf2 n MET 35 Cb 0.18 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 1hf2 n MET 35 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hf2 n GLY 36 N -1.26 0.98 0.81 3.03 0.00 -1.00 -2.14 105.19 105.62 1hf2 n GLY 36 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1hf2 n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hf2 n GLY 37 N 0.00 1.69 0.36 -0.02 0.00 -1.26 -4.11 105.19 101.86 1hf2 n GLY 37 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1hf2 n GLY 37 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1hf2 h PHE 38 N 0.11 1.04 -3.06 1.61 3.57 -1.81 -3.42 116.94 114.97 1hf2 h PHE 38 Ca 0.00 0.03 -0.60 0.00 3.53 0.00 0.00 57.97 60.93 1hf2 h PHE 38 Cb 0.76 -0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 1hf2 h PHE 38 CO 0.00 0.62 -0.25 -0.06 -2.23 0.00 0.00 178.31 176.39 1hf2 s PHE 39 N -5.92 3.61 0.17 0.41 0.08 -1.26 -5.10 117.98 109.97 1hf2 s PHE 39 Ca -0.12 0.81 0.06 0.00 0.12 0.00 0.00 56.93 57.80 1hf2 s PHE 39 Cb 0.18 -2.17 -0.04 0.00 -0.57 0.00 0.00 43.02 40.43 1hf2 s PHE 39 CO 0.80 0.55 0.05 0.00 -0.10 0.00 0.00 175.22 176.52 1hf2 s ALA 40 N -1.32 3.35 0.39 5.36 0.00 -1.26 -5.02 121.76 123.26 1hf2 s ALA 40 Ca 0.30 -1.30 0.16 0.00 0.00 0.00 0.00 51.96 51.13 1hf2 s ALA 40 Cb -0.14 -1.15 1.04 0.00 0.00 0.00 0.00 23.12 22.87 1hf2 s ALA 40 CO 0.17 0.50 1.81 -0.22 0.00 0.00 0.00 175.76 178.01 1hf2 h LYS 41 N 2.60 0.44 0.02 0.00 3.64 -1.94 -1.72 116.57 119.61 1hf2 h LYS 41 Ca -0.47 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 58.68 1hf2 h LYS 41 Cb 1.20 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.91 1hf2 h LYS 41 CO 0.60 0.29 -0.92 0.78 -2.27 0.00 0.00 179.45 177.93 1hf2 h GLY 42 N 0.45 0.13 -1.52 5.01 0.00 -1.96 -3.39 103.07 101.80 1hf2 h GLY 42 Ca 0.54 -0.27 -0.20 0.00 0.00 0.00 0.00 47.33 47.41 1hf2 h GLY 42 CO -0.26 0.23 0.05 1.22 0.00 0.00 0.00 176.54 177.79 1hf2 n ASP 43 N -3.57 0.06 -4.66 0.19 9.92 -0.65 -4.46 116.55 113.39 1hf2 n ASP 43 Ca -0.03 0.28 -0.35 0.00 -0.53 0.00 0.00 54.79 54.17 1hf2 n ASP 43 Cb 0.85 -0.22 -0.10 0.00 -0.64 0.00 0.00 41.12 41.01 1hf2 n ASP 43 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1hf2 s ARG 44 N 0.16 2.92 0.08 -1.24 0.52 -1.26 -1.44 118.95 118.69 1hf2 s ARG 44 Ca 0.23 -0.45 0.01 0.00 -0.52 0.00 0.00 55.73 54.99 1hf2 s ARG 44 Cb -0.32 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.37 1hf2 s ARG 44 CO 0.15 0.69 -0.05 0.96 0.02 0.00 0.00 175.30 177.07 1hf2 s ILE 45 N -0.89 0.50 0.19 1.52 -4.36 0.63 -4.77 121.20 114.02 1hf2 s ILE 45 Ca 0.14 -1.88 -0.03 0.00 -0.26 0.00 0.00 60.65 58.61 1hf2 s ILE 45 Cb -0.11 -1.61 -0.05 0.00 1.25 0.00 0.00 42.46 41.93 1hf2 s ILE 45 CO 0.03 -0.92 0.41 -0.44 0.24 0.00 0.00 174.94 174.25 1hf2 s SER 46 N -2.99 6.45 -0.03 4.36 0.01 -0.36 -1.20 113.70 119.94 1hf2 s SER 46 Ca 0.10 0.55 0.07 0.00 1.31 0.00 0.00 55.95 57.98 1hf2 s SER 46 Cb 0.06 -2.07 -0.02 0.00 0.21 0.00 0.00 66.02 64.20 1hf2 s SER 46 CO -0.07 -0.02 -0.25 -0.22 0.41 0.00 0.00 173.24 173.09 1hf2 s LEU 47 N -3.03 2.07 -0.07 2.44 2.96 -0.00 -0.57 118.68 122.48 1hf2 s LEU 47 Ca 0.41 -0.48 -0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1hf2 s LEU 47 Cb -0.11 -1.36 0.04 0.00 0.50 0.00 0.00 46.19 45.26 1hf2 s LEU 47 CO 0.27 0.29 0.12 -0.32 -1.32 0.00 0.00 176.35 175.39 1hf2 s MET 48 N -0.45 -0.01 -0.16 1.98 -2.45 -0.64 0.82 119.30 118.39 1hf2 s MET 48 Ca 0.05 0.49 -0.02 0.00 -1.25 0.00 0.00 55.69 54.96 1hf2 s MET 48 Cb -0.11 -0.36 -0.02 0.00 1.25 0.00 0.00 34.83 35.59 1hf2 s MET 48 CO 0.01 -0.31 -0.08 0.42 1.05 0.00 0.00 175.02 176.10 1hf2 s ILE 49 N 2.22 3.35 0.00 10.11 1.01 -1.26 -0.21 121.20 136.42 1hf2 s ILE 49 Ca 0.04 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.15 1hf2 s ILE 49 Cb -0.12 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 39.89 1hf2 s ILE 49 CO -0.05 0.49 0.00 -0.62 0.00 0.00 0.00 174.94 174.76 1hf2 n GLU 50 N 3.91 0.00 -0.61 2.79 1.02 0.16 -3.00 120.64 124.91 1hf2 n GLU 50 Ca -0.18 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.67 1hf2 n GLU 50 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.89 1hf2 n GLU 50 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1hf2 n ASN 51 N 0.00 1.96 -0.34 1.62 4.05 -1.26 -4.67 115.26 116.62 1hf2 n ASN 51 Ca 0.00 -2.40 0.11 0.00 0.45 0.00 0.00 54.58 52.74 1hf2 n ASN 51 Cb 0.00 -0.79 0.29 0.00 1.23 0.00 0.00 39.78 40.51 1hf2 n ASN 51 CO 0.00 0.00 0.00 1.12 -3.05 0.00 0.00 177.26 175.33 1hf2 h HIS 52 N 8.22 0.97 -0.00 1.20 2.07 -1.94 -1.34 115.15 124.33 1hf2 h HIS 52 Ca 0.29 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.85 1hf2 h HIS 52 Cb 0.42 -0.29 -0.00 0.00 2.57 0.00 0.00 27.41 30.11 1hf2 h HIS 52 CO 1.50 0.22 0.03 -0.91 -3.07 0.00 0.00 177.93 175.70 1hf2 h ASN 53 N 0.72 0.00 0.66 3.10 2.35 -1.90 -1.17 115.58 119.34 1hf2 h ASN 53 Ca 0.54 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.29 1hf2 h ASN 53 Cb 0.81 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.18 1hf2 h ASN 53 CO -0.38 0.00 -0.90 1.17 -1.65 0.00 0.00 177.43 175.67 1hf2 n LYS 54 N -3.17 0.34 -0.05 0.81 4.81 -0.51 -4.18 118.16 116.21 1hf2 n LYS 54 Ca -0.03 0.04 0.03 0.00 -0.87 0.00 0.00 58.31 57.48 1hf2 n LYS 54 Cb 0.10 -1.66 0.05 0.00 0.02 0.00 0.00 35.03 33.55 1hf2 n LYS 54 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1hf2 n HIS 55 N -2.12 0.09 -0.23 5.64 8.25 -0.52 -4.81 115.22 121.51 1hf2 n HIS 55 Ca 0.02 -0.61 0.02 0.00 -0.26 0.00 0.00 57.72 56.89 1hf2 n HIS 55 Cb 0.46 -0.08 0.12 0.00 1.12 0.00 0.00 29.99 31.61 1hf2 n HIS 55 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1hf2 h SER 56 N 0.29 -0.37 0.03 0.41 0.87 -1.50 -0.58 113.55 112.71 1hf2 h SER 56 Ca 0.00 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1hf2 h SER 56 Cb 0.65 0.32 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1hf2 h SER 56 CO 0.01 -0.16 0.00 0.00 -0.53 0.00 0.00 176.83 176.15 1hf2 n GLN 57 N -5.34 0.66 0.00 2.24 10.64 -1.26 -2.78 117.38 121.55 1hf2 n GLN 57 Ca 0.11 0.01 0.11 0.00 -1.83 0.00 0.00 57.00 55.39 1hf2 n GLN 57 Cb 0.40 -1.50 0.04 0.00 -0.86 0.00 0.00 30.24 28.32 1hf2 n GLN 57 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1hf2 n ASP 58 N -1.02 0.99 -0.18 2.61 8.00 -0.22 -4.53 116.55 122.19 1hf2 n ASP 58 Ca 0.16 -0.84 -0.01 0.00 0.71 0.00 0.00 54.79 54.81 1hf2 n ASP 58 Cb 0.08 0.65 0.08 0.00 -0.02 0.00 0.00 41.12 41.92 1hf2 n ASP 58 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1hf2 h ILE 59 N 0.40 0.73 -0.26 0.53 2.04 -1.58 -1.78 117.51 117.58 1hf2 h ILE 59 Ca 0.00 -0.10 0.06 0.00 1.00 0.00 0.00 64.86 65.82 1hf2 h ILE 59 Cb 0.53 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 36.97 1hf2 h ILE 59 CO 0.00 0.05 -0.11 -0.65 0.00 0.00 0.00 178.15 177.44 1hf2 h PRO 60 N 0.29 -0.07 -0.19 2.37 0.11 -1.84 0.30 132.00 132.96 1hf2 h PRO 60 Ca 0.27 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.31 1hf2 h PRO 60 Cb 0.36 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 1hf2 h PRO 60 CO -0.33 -0.05 -0.23 0.00 -0.21 0.00 0.00 178.00 177.18 1hf2 h ARG 61 N -0.08 0.34 -0.07 1.05 3.08 -1.80 0.21 114.38 117.12 1hf2 h ARG 61 Ca 0.13 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.99 1hf2 h ARG 61 Cb 0.28 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1hf2 h ARG 61 CO -0.31 0.56 -0.27 0.82 -1.07 0.00 0.00 179.97 179.70 1hf2 h ILE 62 N 0.31 1.43 -0.65 2.04 2.04 -0.89 0.78 117.51 122.57 1hf2 h ILE 62 Ca 0.05 -1.67 -0.02 0.00 1.00 0.00 0.00 64.86 64.22 1hf2 h ILE 62 Cb 0.58 2.31 -0.03 0.00 -0.74 0.00 0.00 36.82 38.94 1hf2 h ILE 62 CO 0.04 0.48 0.31 0.58 0.00 0.00 0.00 178.15 179.56 1hf2 h VAL 63 N -0.19 1.21 -0.28 1.67 2.07 -0.26 -0.64 116.25 119.82 1hf2 h VAL 63 Ca -0.01 -0.59 -0.15 0.00 0.82 0.00 0.00 66.70 66.77 1hf2 h VAL 63 Cb 0.91 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 1hf2 h VAL 63 CO 0.06 0.25 -0.39 -1.28 0.02 0.00 0.00 177.57 176.22 1hf2 h SER 64 N 0.91 0.84 -0.67 0.57 0.87 -0.52 -0.91 113.55 114.64 1hf2 h SER 64 Ca 0.22 -0.50 -0.06 0.00 -1.23 0.00 0.00 61.79 60.22 1hf2 h SER 64 Cb 0.09 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 1hf2 h SER 64 CO -0.03 1.18 0.20 -0.74 -0.53 0.00 0.00 176.83 176.91 1hf2 h HIS 65 N 0.52 1.10 -0.42 2.24 6.17 -0.45 -0.06 115.15 124.24 1hf2 h HIS 65 Ca 0.03 -0.11 -0.12 0.00 0.71 0.00 0.00 60.37 60.88 1hf2 h HIS 65 Cb 0.99 -0.32 -0.01 0.00 2.52 0.00 0.00 27.41 30.59 1hf2 h HIS 65 CO 0.08 0.88 -0.20 -0.07 0.71 0.00 0.00 177.93 179.33 1hf2 h LEU 66 N 1.02 0.91 -0.55 0.26 -0.00 -1.04 -2.67 115.31 113.23 1hf2 h LEU 66 Ca 0.22 -0.40 -0.04 0.00 -0.00 0.00 0.00 57.88 57.66 1hf2 h LEU 66 Cb 0.31 -0.25 -0.02 0.00 -0.00 0.00 0.00 40.66 40.69 1hf2 h LEU 66 CO -0.01 1.11 0.19 -0.09 -0.00 0.00 0.00 178.44 179.64 1hf2 h ARG 67 N 0.71 0.85 0.00 1.13 2.43 -0.76 0.14 114.38 118.87 1hf2 h ARG 67 Ca 0.10 -0.17 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1hf2 h ARG 67 Cb 0.76 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.19 1hf2 h ARG 67 CO 0.06 0.76 0.00 0.09 -1.51 0.00 0.00 179.97 179.37 1hf2 n ASN 68 N -4.47 0.59 -0.96 -3.80 5.03 -0.07 -1.32 115.26 110.26 1hf2 n ASN 68 Ca 0.02 0.66 0.12 0.00 0.87 0.00 0.00 54.58 56.25 1hf2 n ASN 68 Cb 0.19 -0.78 0.19 0.00 -1.02 0.00 0.00 39.78 38.36 1hf2 n ASN 68 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1hf2 n LEU 69 N -2.16 2.95 0.00 3.41 4.77 -0.65 -4.95 117.00 120.37 1hf2 n LEU 69 Ca 0.02 -1.09 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 1hf2 n LEU 69 Cb 0.21 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1hf2 n LEU 69 CO 0.18 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 1hf2 n GLY 70 N 1.37 0.51 3.56 -0.72 0.00 -0.44 -4.98 105.19 104.50 1hf2 n GLY 70 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1hf2 n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hf2 s LEU 71 N 0.00 3.58 -0.25 0.99 1.02 0.41 -4.11 118.68 120.32 1hf2 s LEU 71 Ca 0.00 -0.04 -0.10 0.00 0.02 0.00 0.00 54.13 54.01 1hf2 s LEU 71 Cb 0.00 -1.91 -0.05 0.00 0.02 0.00 0.00 46.19 44.25 1hf2 s LEU 71 CO 0.00 0.13 0.16 -0.70 0.02 0.00 0.00 176.35 175.95 1hf2 s GLU 72 N 0.65 4.00 -0.30 1.70 2.56 -0.52 -2.34 118.70 124.45 1hf2 s GLU 72 Ca 0.02 -0.30 -0.27 0.00 0.00 0.00 0.00 54.97 54.41 1hf2 s GLU 72 Cb -0.13 -3.55 0.01 0.00 2.00 0.00 0.00 34.13 32.46 1hf2 s GLU 72 CO 0.02 -0.02 0.99 0.08 -0.56 0.00 0.00 175.26 175.77 1hf2 s VAL 73 N 1.27 4.62 -0.13 3.70 1.01 -1.26 -0.27 120.40 129.35 1hf2 s VAL 73 Ca 0.07 1.65 0.18 0.00 0.00 0.00 0.00 61.98 63.88 1hf2 s VAL 73 Cb -0.14 -4.32 -0.19 0.00 0.00 0.00 0.00 36.38 31.73 1hf2 s VAL 73 CO 0.06 -0.35 0.63 -1.54 0.00 0.00 0.00 175.10 173.90 1hf2 n SER 74 N 6.57 0.57 -3.52 3.32 3.41 -0.34 -4.70 113.62 118.93 1hf2 n SER 74 Ca 0.10 0.25 -0.16 0.00 -0.26 0.00 0.00 58.87 58.80 1hf2 n SER 74 Cb 0.47 0.60 -0.05 0.00 -0.26 0.00 0.00 64.21 64.97 1hf2 n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1hf2 s GLN 75 N -2.94 1.01 -0.21 4.33 -2.07 -1.26 -0.60 119.66 117.92 1hf2 s GLN 75 Ca -0.05 0.13 -0.05 0.00 -1.82 0.00 0.00 55.36 53.57 1hf2 s GLN 75 Cb 0.09 0.47 -0.02 0.00 -1.09 0.00 0.00 33.01 32.47 1hf2 s GLN 75 CO 0.83 -0.34 -0.02 0.42 -1.32 0.00 0.00 175.29 174.86 1hf2 s ILE 76 N -1.58 3.71 -0.08 3.63 1.01 -0.56 -0.82 121.20 126.50 1hf2 s ILE 76 Ca -0.07 -0.39 -0.10 0.00 0.00 0.00 0.00 60.65 60.09 1hf2 s ILE 76 Cb -0.00 -2.68 -0.05 0.00 0.01 0.00 0.00 42.46 39.74 1hf2 s ILE 76 CO 0.05 0.42 0.23 -0.76 0.00 0.00 0.00 174.94 174.88 1hf2 s LEU 77 N 1.25 4.42 -0.17 2.97 1.43 0.24 -2.41 118.68 126.41 1hf2 s LEU 77 Ca 0.03 0.64 -0.06 0.00 -1.03 0.00 0.00 54.13 53.71 1hf2 s LEU 77 Cb -0.15 -2.25 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 1hf2 s LEU 77 CO 0.00 0.38 0.03 -0.69 0.23 0.00 0.00 176.35 176.30 1hf2 s VAL 78 N -1.02 4.52 0.00 -1.59 1.01 0.74 -4.22 120.40 119.84 1hf2 s VAL 78 Ca 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1hf2 s VAL 78 Cb -0.14 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1hf2 s VAL 78 CO 0.07 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1hf2 n GLY 79 N 3.45 0.50 0.43 4.51 0.00 -1.26 0.36 105.19 113.18 1hf2 n GLY 79 Ca -0.17 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.12 1hf2 n GLY 79 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1hf2 h LYS 90 N 0.00 -0.65 -4.64 1.61 -0.00 -2.07 -3.45 116.57 107.37 1hf2 h LYS 90 Ca 0.00 0.04 -0.65 0.00 -0.00 0.00 0.00 60.65 60.04 1hf2 h LYS 90 Cb 0.00 0.15 -0.38 0.00 -0.00 0.00 0.00 32.23 32.00 1hf2 h LYS 90 CO 0.00 -0.43 -0.77 0.08 -0.00 0.00 0.00 179.45 178.32 1hf2 s VAL 91 N -5.87 1.99 0.00 0.07 1.01 -1.26 -5.01 120.40 111.32 1hf2 s VAL 91 Ca -0.16 -1.73 0.00 0.00 0.00 0.00 0.00 61.98 60.09 1hf2 s VAL 91 Cb 0.07 -2.25 0.00 0.00 0.00 0.00 0.00 36.38 34.20 1hf2 s VAL 91 CO 0.63 -0.24 0.40 1.67 0.00 0.00 0.00 175.10 177.56 1hf2 n GLN 92 N 4.46 0.00 -4.65 2.72 7.27 0.16 -4.98 117.38 122.35 1hf2 n GLN 92 Ca -0.08 0.47 -0.29 0.00 0.07 0.00 0.00 57.00 57.17 1hf2 n GLN 92 Cb 0.42 -1.18 -0.09 0.00 2.41 0.00 0.00 30.24 31.81 1hf2 n GLN 92 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1hf2 s SER 93 N -2.52 3.62 0.02 1.69 0.01 -1.19 -4.97 113.70 110.36 1hf2 s SER 93 Ca 0.00 -1.58 -0.28 0.00 1.31 0.00 0.00 55.95 55.40 1hf2 s SER 93 Cb 0.00 0.29 0.10 0.00 0.21 0.00 0.00 66.02 66.62 1hf2 s SER 93 CO 0.00 -0.77 0.96 0.00 0.41 0.00 0.00 173.24 173.84 1hf2 s ARG 94 N -3.81 0.86 -0.12 12.44 1.70 -1.26 -0.19 118.95 128.57 1hf2 s ARG 94 Ca 0.18 -0.38 -0.20 0.00 -0.47 0.00 0.00 55.73 54.86 1hf2 s ARG 94 Cb 0.04 0.35 0.05 0.00 -0.57 0.00 0.00 34.95 34.82 1hf2 s ARG 94 CO 0.10 -0.38 0.49 0.95 -1.08 0.00 0.00 175.30 175.37 1hf2 s THR 95 N -3.07 0.01 -0.21 4.99 -4.23 -1.01 -4.92 115.64 107.20 1hf2 s THR 95 Ca 0.08 -0.12 -0.25 0.00 -1.18 0.00 0.00 61.69 60.22 1hf2 s THR 95 Cb -0.01 -0.74 -0.01 0.00 1.34 0.00 0.00 72.50 73.08 1hf2 s THR 95 CO -0.05 -0.07 0.85 -0.89 -0.54 0.00 0.00 174.62 173.92 1hf2 s THR 96 N -0.42 4.84 -0.30 3.99 2.01 0.55 -1.50 115.64 124.81 1hf2 s THR 96 Ca -0.06 1.63 -0.29 0.00 0.31 0.00 0.00 61.69 63.28 1hf2 s THR 96 Cb -0.03 -4.14 0.00 0.00 0.01 0.00 0.00 72.50 68.34 1hf2 s THR 96 CO 0.03 -0.04 1.30 -0.69 -0.69 0.00 0.00 174.62 174.53 1hf2 s VAL 97 N 2.59 4.15 -1.17 3.82 1.01 0.23 -0.47 120.40 130.55 1hf2 s VAL 97 Ca 0.37 1.29 -0.21 0.00 0.00 0.00 0.00 61.98 63.43 1hf2 s VAL 97 Cb -0.16 -4.17 -0.05 0.00 0.00 0.00 0.00 36.38 32.00 1hf2 s VAL 97 CO 0.09 -0.49 1.90 -0.62 0.00 0.00 0.00 175.10 175.98 1hf2 n GLU 98 N 7.32 2.11 -1.51 2.72 -0.58 0.22 -4.77 120.64 126.16 1hf2 n GLU 98 Ca 0.15 -2.60 -0.45 0.00 -0.42 0.00 0.00 57.16 53.83 1hf2 n GLU 98 Cb 0.47 -3.51 -0.06 0.00 -0.57 0.00 0.00 31.44 27.77 1hf2 n GLU 98 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1hf2 n SER 99 N 11.08 2.33 0.00 1.62 7.64 -1.26 -4.67 113.62 130.36 1hf2 n SER 99 Ca 0.47 0.14 0.00 0.00 1.01 0.00 0.00 58.87 60.49 1hf2 n SER 99 Cb 0.45 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1hf2 n SER 99 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1hf2 n THR 100 N 7.55 0.00 -4.73 0.44 -2.24 -1.26 -5.16 114.28 108.87 1hf2 n THR 100 Ca 0.39 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.85 1hf2 n THR 100 Cb 0.34 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.49 1hf2 n THR 100 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1hf2 s GLY 101 N 0.00 2.92 0.35 3.38 0.00 -1.26 -5.02 107.32 107.69 1hf2 s GLY 101 Ca 0.00 -0.77 0.12 0.00 0.00 0.00 0.00 44.72 44.07 1hf2 s GLY 101 CO 0.00 -2.17 1.78 0.50 0.00 0.00 0.00 173.10 173.21 1hf2 h LYS 102 N 1.44 0.55 -4.82 2.90 6.56 -1.94 -3.37 116.57 117.89 1hf2 h LYS 102 Ca -0.44 -0.03 -0.67 0.00 -1.06 0.00 0.00 60.65 58.45 1hf2 h LYS 102 Cb 1.30 -0.12 -0.23 0.00 -0.57 0.00 0.00 32.23 32.61 1hf2 h LYS 102 CO 0.75 0.36 -0.58 0.08 -2.06 0.00 0.00 179.45 178.00 1hf2 s VAL 103 N -5.66 4.46 -0.23 0.50 1.01 -1.26 -1.40 120.40 117.82 1hf2 s VAL 103 Ca -0.10 -0.40 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 1hf2 s VAL 103 Cb 0.25 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 1hf2 s VAL 103 CO 0.80 0.13 0.11 -0.63 0.00 0.00 0.00 175.10 175.50 1hf2 s ILE 104 N 1.60 4.90 -0.73 2.22 -1.09 0.51 -5.00 121.20 123.61 1hf2 s ILE 104 Ca 0.05 0.02 0.03 0.00 -2.23 0.00 0.00 60.65 58.51 1hf2 s ILE 104 Cb -0.17 -3.27 0.34 0.00 -1.58 0.00 0.00 42.46 37.79 1hf2 s ILE 104 CO 0.05 0.37 1.30 0.29 -1.23 0.00 0.00 174.94 175.72 1hf2 n LYS 105 N 4.31 3.95 -3.72 2.79 5.02 -1.26 -0.25 118.16 129.01 1hf2 n LYS 105 Ca -0.16 -4.71 0.00 0.00 -2.02 0.00 0.00 58.31 51.43 1hf2 n LYS 105 Cb 0.52 -2.32 -0.00 0.00 -0.02 0.00 0.00 35.03 33.21 1hf2 n LYS 105 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1hf2 s ARG 106 N -3.79 0.62 0.34 1.97 1.70 -1.22 -4.97 118.95 113.59 1hf2 s ARG 106 Ca 0.46 -0.36 -0.24 0.00 -0.47 0.00 0.00 55.73 55.12 1hf2 s ARG 106 Cb 0.27 0.20 -0.10 0.00 -0.57 0.00 0.00 34.95 34.75 1hf2 s ARG 106 CO -0.16 -0.29 0.93 -0.80 -1.08 0.00 0.00 175.30 173.91 1hf2 s ASN 107 N -3.13 7.23 -0.52 -2.89 0.01 -1.26 -4.34 114.94 110.04 1hf2 s ASN 107 Ca 0.17 1.77 -0.21 0.00 -0.71 0.00 0.00 52.86 53.88 1hf2 s ASN 107 Cb 0.02 -2.56 0.05 0.00 0.41 0.00 0.00 41.25 39.18 1hf2 s ASN 107 CO -0.02 -0.12 0.75 -0.63 -1.51 0.00 0.00 177.10 175.57 1hf2 s ILE 108 N -1.74 4.68 0.73 0.60 -1.09 0.22 -4.92 121.20 119.69 1hf2 s ILE 108 Ca 0.52 -0.16 -0.11 0.00 -2.23 0.00 0.00 60.65 58.67 1hf2 s ILE 108 Cb -0.16 -4.39 0.03 0.00 -1.58 0.00 0.00 42.46 36.36 1hf2 s ILE 108 CO 0.21 -0.92 1.08 -0.13 -1.23 0.00 0.00 174.94 173.95 1hf2 s ARG 109 N 3.15 2.63 0.29 2.79 0.52 -1.26 -1.13 118.95 125.94 1hf2 s ARG 109 Ca 0.21 0.79 -0.30 0.00 -0.52 0.00 0.00 55.73 55.92 1hf2 s ARG 109 Cb -0.16 -1.97 -0.12 0.00 0.52 0.00 0.00 34.95 33.22 1hf2 s ARG 109 CO 0.15 -1.28 1.58 0.45 0.02 0.00 0.00 175.30 176.22 1hf2 n SER 110 N -3.23 3.76 0.00 0.23 2.88 -1.26 -1.32 113.62 114.68 1hf2 n SER 110 Ca 0.07 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 1hf2 n SER 110 Cb 0.55 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.43 1hf2 n SER 110 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1hf2 n GLY 111 N 2.18 1.29 3.83 0.46 0.00 -0.72 -4.86 105.19 107.38 1hf2 n GLY 111 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1hf2 n GLY 111 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hf2 s GLN 112 N -0.30 3.26 -0.08 1.61 -0.21 -0.43 -0.33 119.66 123.18 1hf2 s GLN 112 Ca 0.00 -0.34 -0.00 0.00 0.02 0.00 0.00 55.36 55.04 1hf2 s GLN 112 Cb 0.00 -3.01 0.02 0.00 1.00 0.00 0.00 33.01 31.03 1hf2 s GLN 112 CO 0.00 0.69 -0.05 0.99 -2.12 0.00 0.00 175.29 174.80 1hf2 s THR 113 N -1.17 0.74 -0.08 -0.19 2.01 0.38 -1.97 115.64 115.36 1hf2 s THR 113 Ca 0.22 -0.15 -0.18 0.00 0.31 0.00 0.00 61.69 61.89 1hf2 s THR 113 Cb -0.12 -0.79 -0.05 0.00 0.01 0.00 0.00 72.50 71.55 1hf2 s THR 113 CO 0.12 0.31 0.49 -0.69 -0.69 0.00 0.00 174.62 174.16 1hf2 s VAL 114 N 1.52 5.12 -0.13 3.82 1.01 -0.25 -0.61 120.40 130.88 1hf2 s VAL 114 Ca -0.00 0.99 -0.01 0.00 0.00 0.00 0.00 61.98 62.96 1hf2 s VAL 114 Cb -0.13 -3.83 0.03 0.00 0.00 0.00 0.00 36.38 32.46 1hf2 s VAL 114 CO -0.04 0.37 -0.06 -0.69 0.00 0.00 0.00 175.10 174.68 1hf2 s VAL 115 N 0.28 0.98 0.02 2.92 1.01 -1.26 -0.07 120.40 124.29 1hf2 s VAL 115 Ca 0.27 -0.39 -0.00 0.00 0.00 0.00 0.00 61.98 61.85 1hf2 s VAL 115 Cb -0.16 -1.09 -0.02 0.00 0.00 0.00 0.00 36.38 35.11 1hf2 s VAL 115 CO 0.12 0.25 -0.03 -1.00 0.00 0.00 0.00 175.10 174.43 1hf2 s HIS 116 N 1.71 0.29 -0.34 5.22 3.76 -0.41 -4.91 115.29 120.61 1hf2 s HIS 116 Ca 0.03 -0.59 0.21 0.00 -0.15 0.00 0.00 55.06 54.56 1hf2 s HIS 116 Cb -0.14 -0.21 0.23 0.00 1.11 0.00 0.00 32.58 33.57 1hf2 s HIS 116 CO -0.08 -0.21 1.50 0.77 -0.85 0.00 0.00 174.74 175.87 1hf2 h SER 117 N 4.48 0.00 0.00 1.40 0.02 -1.87 -0.19 113.55 117.39 1hf2 h SER 117 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1hf2 h SER 117 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1hf2 h SER 117 CO 0.44 0.15 0.00 0.61 -1.14 0.00 0.00 176.83 176.89 1hf2 n GLY 118 N 1.15 5.19 3.79 -3.77 0.00 -1.26 -3.61 105.19 106.67 1hf2 n GLY 118 Ca 0.03 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 44.08 1hf2 n GLY 118 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hf2 s ASP 119 N 1.00 6.17 -0.07 1.61 1.01 -1.26 -1.81 116.67 123.32 1hf2 s ASP 119 Ca 0.00 1.97 0.03 0.00 0.71 0.00 0.00 52.55 55.26 1hf2 s ASP 119 Cb 0.00 -2.56 0.01 0.00 1.01 0.00 0.00 42.92 41.37 1hf2 s ASP 119 CO 0.00 -0.90 -0.17 -0.69 0.21 0.00 0.00 175.17 173.62 1hf2 s VAL 120 N -1.97 1.47 -0.14 -1.27 1.01 0.10 -4.78 120.40 114.81 1hf2 s VAL 120 Ca 0.68 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1hf2 s VAL 120 Cb -0.18 -1.30 0.02 0.00 0.00 0.00 0.00 36.38 34.92 1hf2 s VAL 120 CO 0.23 0.43 -0.16 -0.63 0.00 0.00 0.00 175.10 174.97 1hf2 s ILE 121 N 0.50 1.64 -0.25 2.22 1.01 -0.49 -0.64 121.20 125.18 1hf2 s ILE 121 Ca -0.15 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 1hf2 s ILE 121 Cb -0.16 -1.51 0.02 0.00 0.01 0.00 0.00 42.46 40.82 1hf2 s ILE 121 CO 0.05 0.47 -0.05 -0.69 0.00 0.00 0.00 174.94 174.72 1hf2 s VAL 122 N 1.30 2.93 -1.16 2.92 1.01 0.42 -0.36 120.40 127.46 1hf2 s VAL 122 Ca 0.01 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 60.89 1hf2 s VAL 122 Cb -0.14 -2.49 0.23 0.00 0.00 0.00 0.00 36.38 33.99 1hf2 s VAL 122 CO -0.08 0.20 1.32 0.49 0.00 0.00 0.00 175.10 177.02 1hf2 n PHE 123 N 4.68 4.79 -0.52 5.22 3.72 0.66 0.53 117.46 136.54 1hf2 n PHE 123 Ca -0.16 -3.53 0.00 0.00 -0.05 0.00 0.00 57.45 53.71 1hf2 n PHE 123 Cb 0.47 -1.88 0.00 0.00 -0.94 0.00 0.00 39.48 37.14 1hf2 n PHE 123 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hf2 n GLY 124 N 3.12 -0.67 3.39 1.37 0.00 -1.19 -3.44 105.19 107.76 1hf2 n GLY 124 Ca 0.30 -0.50 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 1hf2 n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hf2 s ASN 125 N -4.00 2.98 -0.47 1.61 0.01 -1.26 -3.09 114.94 110.72 1hf2 s ASN 125 Ca 0.00 -0.97 -0.03 0.00 -0.71 0.00 0.00 52.86 51.15 1hf2 s ASN 125 Cb 0.00 -0.20 0.12 0.00 0.41 0.00 0.00 41.25 41.58 1hf2 s ASN 125 CO 0.00 -0.04 0.27 -0.69 -1.51 0.00 0.00 177.10 175.13 1hf2 s VAL 126 N -2.47 3.45 0.99 1.60 1.01 -0.24 0.69 120.40 125.44 1hf2 s VAL 126 Ca 0.23 -2.28 -0.11 0.00 0.00 0.00 0.00 61.98 59.82 1hf2 s VAL 126 Cb -0.04 -3.33 0.17 0.00 0.00 0.00 0.00 36.38 33.18 1hf2 s VAL 126 CO 0.09 -0.75 0.98 0.59 0.00 0.00 0.00 175.10 176.02 1hf2 n ASN 127 N 4.32 -0.55 -0.28 3.32 3.02 -0.28 0.25 115.26 125.06 1hf2 n ASN 127 Ca 0.00 0.25 0.08 0.00 -0.03 0.00 0.00 54.58 54.89 1hf2 n ASN 127 Cb 0.40 -1.37 0.21 0.00 -0.61 0.00 0.00 39.78 38.41 1hf2 n ASN 127 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1hf2 h LYS 128 N -2.06 0.11 -0.40 3.52 1.57 -1.88 -0.30 116.57 117.12 1hf2 h LYS 128 Ca -0.48 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1hf2 h LYS 128 Cb 1.29 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1hf2 h LYS 128 CO 0.42 0.07 0.00 0.41 -0.57 0.00 0.00 179.45 179.78 1hf2 n GLY 129 N -1.43 0.85 3.91 3.86 0.00 -1.26 -4.03 105.19 107.10 1hf2 n GLY 129 Ca 0.17 -0.43 -0.27 0.00 0.00 0.00 0.00 46.02 45.49 1hf2 n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hf2 s ALA 130 N -1.48 3.46 -0.01 4.61 0.00 -0.18 -1.76 121.76 126.40 1hf2 s ALA 130 Ca 0.26 -0.55 -0.07 0.00 0.00 0.00 0.00 51.96 51.60 1hf2 s ALA 130 Cb 0.14 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.76 1hf2 s ALA 130 CO 0.18 -0.23 0.15 -2.00 0.00 0.00 0.00 175.76 173.86 1hf2 s GLU 131 N -4.51 0.46 -0.10 0.00 2.12 -0.83 -1.12 118.70 114.71 1hf2 s GLU 131 Ca 0.46 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.48 1hf2 s GLU 131 Cb -0.10 0.19 0.02 0.00 0.26 0.00 0.00 34.13 34.50 1hf2 s GLU 131 CO 0.41 -0.11 -0.08 0.42 -0.54 0.00 0.00 175.26 175.37 1hf2 s ILE 132 N -1.20 0.99 -0.33 -3.70 1.01 -0.38 -1.09 121.20 116.49 1hf2 s ILE 132 Ca -0.13 -0.30 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 1hf2 s ILE 132 Cb -0.07 -0.99 0.05 0.00 0.01 0.00 0.00 42.46 41.46 1hf2 s ILE 132 CO 0.02 0.35 0.07 -0.76 0.00 0.00 0.00 174.94 174.62 1hf2 s LEU 133 N 1.45 4.24 -0.08 2.97 1.43 0.90 -0.79 118.68 128.79 1hf2 s LEU 133 Ca -0.00 -1.26 0.05 0.00 -1.03 0.00 0.00 54.13 51.89 1hf2 s LEU 133 Cb -0.13 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 1hf2 s LEU 133 CO -0.05 -0.32 -0.24 0.00 0.23 0.00 0.00 176.35 175.97 1hf2 s ALA 134 N 1.33 2.21 0.04 4.21 0.00 0.91 -1.28 121.76 129.18 1hf2 s ALA 134 Ca -0.02 -1.00 0.32 0.00 0.00 0.00 0.00 51.96 51.25 1hf2 s ALA 134 Cb -0.20 -0.77 1.21 0.00 0.00 0.00 0.00 23.12 23.36 1hf2 s ALA 134 CO 0.01 0.35 1.93 0.78 0.00 0.00 0.00 175.76 178.83 1hf2 h GLY 135 N 6.37 0.00 0.00 0.00 0.00 -1.05 -2.10 103.07 106.29 1hf2 h GLY 135 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1hf2 h GLY 135 CO 0.48 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.63 1hf2 n GLY 136 N 0.17 5.07 3.91 4.60 0.00 -0.75 -1.10 105.19 117.09 1hf2 n GLY 136 Ca 0.01 -1.44 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 1hf2 n GLY 136 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hf2 s SER 137 N 1.00 5.41 -0.05 1.61 0.01 -1.26 -0.53 113.70 119.89 1hf2 s SER 137 Ca 0.00 0.76 0.01 0.00 1.31 0.00 0.00 55.95 58.03 1hf2 s SER 137 Cb 0.00 -1.64 0.02 0.00 0.21 0.00 0.00 66.02 64.61 1hf2 s SER 137 CO 0.00 -1.23 -0.06 -0.69 0.41 0.00 0.00 173.24 171.67 1hf2 s VAL 138 N -3.12 0.66 -0.13 3.43 1.01 0.02 -0.73 120.40 121.54 1hf2 s VAL 138 Ca 0.56 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.36 1hf2 s VAL 138 Cb -0.11 -0.66 0.02 0.00 0.00 0.00 0.00 36.38 35.63 1hf2 s VAL 138 CO 0.46 0.25 -0.13 -0.69 0.00 0.00 0.00 175.10 175.00 1hf2 s VAL 139 N 0.91 1.40 -0.34 2.92 1.01 0.19 -0.43 120.40 126.05 1hf2 s VAL 139 Ca -0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.29 1hf2 s VAL 139 Cb -0.15 -1.32 0.06 0.00 0.00 0.00 0.00 36.38 34.97 1hf2 s VAL 139 CO 0.01 0.43 0.10 -0.69 0.00 0.00 0.00 175.10 174.94 1hf2 s VAL 140 N 1.41 3.40 -1.39 2.92 1.01 0.11 -0.43 120.40 127.43 1hf2 s VAL 140 Ca 0.02 -1.44 -0.12 0.00 0.00 0.00 0.00 61.98 60.43 1hf2 s VAL 140 Cb -0.13 -3.03 0.09 0.00 0.00 0.00 0.00 36.38 33.30 1hf2 s VAL 140 CO -0.08 -0.28 2.08 0.33 0.00 0.00 0.00 175.10 177.15 1hf2 n PHE 141 N 4.70 3.37 -1.67 5.22 7.35 0.19 -2.33 117.46 134.27 1hf2 n PHE 141 Ca -0.10 -2.91 0.00 0.00 -0.76 0.00 0.00 57.45 53.67 1hf2 n PHE 141 Cb 0.43 -2.33 0.00 0.00 0.35 0.00 0.00 39.48 37.93 1hf2 n PHE 141 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1hf2 n GLY 142 N 3.66 -0.58 3.69 7.13 0.00 -1.18 -3.17 105.19 114.74 1hf2 n GLY 142 Ca 0.47 -0.72 -0.39 0.00 0.00 0.00 0.00 46.02 45.38 1hf2 n GLY 142 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hf2 s LYS 143 N -1.16 4.29 -0.30 1.61 2.20 -1.26 -2.18 119.74 122.94 1hf2 s LYS 143 Ca 0.00 0.61 -0.07 0.00 -0.36 0.00 0.00 55.97 56.15 1hf2 s LYS 143 Cb 0.00 -3.51 0.01 0.00 -1.51 0.00 0.00 37.83 32.81 1hf2 s LYS 143 CO 0.00 -0.07 0.09 0.00 -0.36 0.00 0.00 175.35 175.01 1hf2 s ALA 144 N 1.33 3.09 -0.02 3.13 0.00 0.41 -1.08 121.76 128.62 1hf2 s ALA 144 Ca 0.29 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 50.80 1hf2 s ALA 144 Cb -0.16 -2.18 -0.01 0.00 0.00 0.00 0.00 23.12 20.77 1hf2 s ALA 144 CO 0.12 -0.93 -0.01 1.04 0.00 0.00 0.00 175.76 175.97 1hf2 n GLN 145 N 4.88 0.67 0.00 0.00 6.02 0.14 -0.77 117.38 128.32 1hf2 n GLN 145 Ca -0.14 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 56.86 1hf2 n GLN 145 Cb 0.48 -1.04 0.00 0.00 1.02 0.00 0.00 30.24 30.70 1hf2 n GLN 145 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1hf2 n GLY 146 N 3.32 -3.15 3.46 1.08 0.00 -0.86 -0.79 105.19 108.24 1hf2 n GLY 146 Ca -0.03 -0.89 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 1hf2 n GLY 146 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hf2 s ASN 147 N -2.05 4.79 -0.23 1.61 0.01 -0.28 -1.77 114.94 117.04 1hf2 s ASN 147 Ca 0.00 -0.19 -0.02 0.00 -0.71 0.00 0.00 52.86 51.94 1hf2 s ASN 147 Cb 0.00 -1.81 0.01 0.00 0.41 0.00 0.00 41.25 39.87 1hf2 s ASN 147 CO 0.00 0.10 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.98 1hf2 s ILE 148 N 0.81 2.90 -0.28 0.60 1.01 -0.46 -1.25 121.20 124.52 1hf2 s ILE 148 Ca -0.00 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 59.83 1hf2 s ILE 148 Cb -0.14 -2.37 0.05 0.00 0.01 0.00 0.00 42.46 40.00 1hf2 s ILE 148 CO 0.02 0.34 -0.06 -0.13 0.00 0.00 0.00 174.94 175.11 1hf2 s ARG 149 N 1.37 2.39 0.42 2.79 0.52 0.03 -0.73 118.95 125.75 1hf2 s ARG 149 Ca 0.03 -1.27 0.07 0.00 -0.52 0.00 0.00 55.73 54.04 1hf2 s ARG 149 Cb -0.15 -3.03 -0.06 0.00 0.52 0.00 0.00 34.95 32.23 1hf2 s ARG 149 CO -0.06 -0.57 0.12 0.00 0.02 0.00 0.00 175.30 174.81 1hf2 s ALA 150 N 1.19 3.52 0.00 2.13 0.00 0.22 -0.06 121.76 128.76 1hf2 s ALA 150 Ca -0.06 -2.03 0.00 0.00 0.00 0.00 0.00 51.96 49.87 1hf2 s ALA 150 Cb -0.20 -0.19 0.00 0.00 0.00 0.00 0.00 23.12 22.74 1hf2 s ALA 150 CO -0.03 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 175.98 1hf2 n GLY 151 N -1.17 0.18 0.35 0.00 0.00 0.31 -1.12 105.19 103.74 1hf2 n GLY 151 Ca -0.04 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.13 1hf2 n GLY 151 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1hf2 h LEU 152 N 0.00 0.00 0.00 0.99 3.38 -1.40 0.74 115.31 119.02 1hf2 h LEU 152 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1hf2 h LEU 152 Cb 0.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1hf2 h LEU 152 CO 0.00 0.00 -1.19 0.59 0.09 0.00 0.00 178.44 177.93 1hf2 n ASN 153 N -3.00 1.22 0.07 -0.43 3.02 -0.66 -4.82 115.26 110.66 1hf2 n ASN 153 Ca 0.00 0.03 -0.06 0.00 -0.03 0.00 0.00 54.58 54.52 1hf2 n ASN 153 Cb 0.51 -0.09 -0.09 0.00 -0.61 0.00 0.00 39.78 39.50 1hf2 n ASN 153 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 1hf2 h GLU 154 N -0.09 0.00 0.00 3.52 4.11 -1.02 -3.50 114.58 117.60 1hf2 h GLU 154 Ca -0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.34 1hf2 h GLU 154 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1hf2 h GLU 154 CO -0.04 0.95 0.00 0.41 0.07 0.00 0.00 179.01 180.40 1hf2 n GLY 155 N 1.26 -0.43 0.32 1.06 0.00 0.24 -4.72 105.19 102.92 1hf2 n GLY 155 Ca -0.00 -2.14 0.21 0.00 0.00 0.00 0.00 46.02 44.09 1hf2 n GLY 155 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1hf2 h GLY 156 N 0.00 0.00 1.80 -0.02 0.00 -1.87 -2.50 103.07 100.48 1hf2 h GLY 156 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1hf2 h GLY 156 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.48 1hf2 n GLN 157 N -3.08 0.18 -1.23 4.80 6.02 -1.26 -4.22 117.38 118.59 1hf2 n GLN 157 Ca -0.02 0.04 -0.32 0.00 -0.01 0.00 0.00 57.00 56.69 1hf2 n GLN 157 Cb 0.15 -1.50 0.11 0.00 1.02 0.00 0.00 30.24 30.02 1hf2 n GLN 157 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1hf2 s ALA 158 N -2.80 2.04 0.07 -1.58 0.00 -0.94 -4.96 121.76 113.58 1hf2 s ALA 158 Ca 0.19 0.56 0.01 0.00 0.00 0.00 0.00 51.96 52.71 1hf2 s ALA 158 Cb 0.18 -3.38 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 1hf2 s ALA 158 CO 0.45 -1.99 -0.05 0.08 0.00 0.00 0.00 175.76 174.25 1hf2 s VAL 159 N -2.50 0.45 -0.10 0.00 1.01 -1.26 -4.52 120.40 113.47 1hf2 s VAL 159 Ca 0.67 -1.72 0.00 0.00 0.00 0.00 0.00 61.98 60.94 1hf2 s VAL 159 Cb -0.22 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1hf2 s VAL 159 CO 0.51 -0.84 -0.09 -0.69 0.00 0.00 0.00 175.10 173.99 1hf2 s VAL 160 N -3.33 1.07 0.04 2.92 1.01 -0.59 -0.80 120.40 120.72 1hf2 s VAL 160 Ca 0.05 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.72 1hf2 s VAL 160 Cb 0.03 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 1hf2 s VAL 160 CO -0.06 0.37 -0.09 0.00 0.00 0.00 0.00 175.10 175.32 1hf2 s ALA 161 N 1.48 0.69 0.10 5.51 0.00 0.43 0.21 121.76 130.19 1hf2 s ALA 161 Ca 0.01 -0.76 -0.16 0.00 0.00 0.00 0.00 51.96 51.05 1hf2 s ALA 161 Cb -0.13 -0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.02 1hf2 s ALA 161 CO -0.06 0.04 0.39 0.00 0.00 0.00 0.00 175.76 176.13 1hf2 s ALA 162 N -1.22 -0.92 0.29 0.00 0.00 -1.05 0.05 121.76 118.92 1hf2 s ALA 162 Ca -0.07 0.02 0.12 0.00 0.00 0.00 0.00 51.96 52.03 1hf2 s ALA 162 Cb -0.09 0.60 0.48 0.00 0.00 0.00 0.00 23.12 24.10 1hf2 s ALA 162 CO 0.01 -0.59 1.68 -0.07 0.00 0.00 0.00 175.76 176.78 1hf2 h LEU 163 N 2.55 0.00 -6.51 0.00 3.38 -1.03 -2.11 115.31 111.58 1hf2 h LEU 163 Ca -0.33 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.18 1hf2 h LEU 163 Cb 1.24 0.00 -0.35 0.00 0.09 0.00 0.00 40.66 41.64 1hf2 h LEU 163 CO 0.46 0.53 -0.75 -0.62 0.09 0.00 0.00 178.44 178.16 1hf2 s ASP 164 N -6.82 2.18 -1.37 -0.43 -1.08 -0.94 -2.65 116.67 105.56 1hf2 s ASP 164 Ca -0.02 -1.63 -0.14 0.00 -0.52 0.00 0.00 52.55 50.25 1hf2 s ASP 164 Cb 0.13 0.10 0.09 0.00 -1.46 0.00 0.00 42.92 41.77 1hf2 s ASP 164 CO 0.75 -0.32 2.00 -0.11 0.52 0.00 0.00 175.17 178.01 1hf2 n LEU 165 N 4.46 6.35 -3.26 -1.34 7.94 -1.26 -0.44 117.00 129.44 1hf2 n LEU 165 Ca 0.07 -4.24 -0.36 0.00 -1.11 0.00 0.00 56.01 50.37 1hf2 n LEU 165 Cb 0.42 -1.63 0.00 0.00 0.53 0.00 0.00 43.42 42.74 1hf2 n LEU 165 CO 0.09 0.97 0.99 0.00 -1.11 0.00 0.00 177.39 178.33 1hf2 n GLN 166 N 5.96 4.33 -3.14 1.96 1.13 0.05 -0.98 117.38 126.68 1hf2 n GLN 166 Ca 0.47 -4.57 -0.35 0.00 -1.94 0.00 0.00 57.00 50.62 1hf2 n GLN 166 Cb 0.40 -2.36 -0.06 0.00 0.11 0.00 0.00 30.24 28.33 1hf2 n GLN 166 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1hf2 s THR 167 N -4.56 4.64 0.22 5.09 -4.23 -0.87 -3.91 115.64 112.02 1hf2 s THR 167 Ca 0.44 1.11 -0.01 0.00 -1.18 0.00 0.00 61.69 62.05 1hf2 s THR 167 Cb 0.26 -3.76 -0.01 0.00 1.34 0.00 0.00 72.50 70.33 1hf2 s THR 167 CO -0.17 0.07 1.58 0.28 -0.54 0.00 0.00 174.62 175.83 1hf2 h SER 168 N 3.02 0.58 -4.74 3.99 0.02 -0.13 -3.44 113.55 112.85 1hf2 h SER 168 Ca -0.48 -0.27 -0.10 0.00 -0.84 0.00 0.00 61.79 60.10 1hf2 h SER 168 Cb 1.19 -0.16 -0.21 0.00 0.14 0.00 0.00 62.40 63.36 1hf2 h SER 168 CO 0.65 0.94 -0.13 -0.22 -1.14 0.00 0.00 176.83 176.94 1hf2 s LEU 169 N -8.47 0.31 -0.04 5.07 0.20 -1.24 -4.71 118.68 109.81 1hf2 s LEU 169 Ca -0.07 0.45 -0.01 0.00 0.69 0.00 0.00 54.13 55.18 1hf2 s LEU 169 Cb 0.12 1.67 0.03 0.00 -0.43 0.00 0.00 46.19 47.59 1hf2 s LEU 169 CO 0.82 -0.42 0.05 -0.63 -0.29 0.00 0.00 176.35 175.88 1hf2 s ILE 170 N -0.93 -0.07 0.08 6.68 1.01 -0.76 -1.36 121.20 125.85 1hf2 s ILE 170 Ca -0.10 0.36 0.10 0.00 0.00 0.00 0.00 60.65 61.01 1hf2 s ILE 170 Cb -0.03 -0.15 -0.03 0.00 0.01 0.00 0.00 42.46 42.25 1hf2 s ILE 170 CO 0.05 0.16 -0.26 -1.58 0.00 0.00 0.00 174.94 173.31 1hf2 s GLN 171 N 1.89 1.65 -0.23 2.79 0.74 0.09 -1.49 119.66 125.10 1hf2 s GLN 171 Ca 0.01 -1.20 -0.03 0.00 0.05 0.00 0.00 55.36 54.19 1hf2 s GLN 171 Cb -0.12 -1.95 0.10 0.00 1.10 0.00 0.00 33.01 32.13 1hf2 s GLN 171 CO -0.03 0.49 0.21 0.42 -0.55 0.00 0.00 175.29 175.83 1hf2 s ILE 172 N -0.91 -0.28 0.00 -2.34 1.01 -0.32 -0.61 121.20 117.76 1hf2 s ILE 172 Ca 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.51 1hf2 s ILE 172 Cb -0.10 -0.76 0.00 0.00 0.01 0.00 0.00 42.46 41.61 1hf2 s ILE 172 CO 0.04 -0.33 0.00 0.00 0.00 0.00 0.00 174.94 174.65 1hf2 n ALA 173 N 5.30 0.00 0.91 9.38 0.00 -0.28 -1.34 120.51 134.48 1hf2 n ALA 173 Ca -0.05 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.53 1hf2 n ALA 173 Cb 0.48 0.00 0.56 0.00 0.00 0.00 0.00 19.45 20.48 1hf2 n ALA 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hf2 n GLY 174 N 0.00 -1.55 3.89 0.00 0.00 -1.26 -4.88 105.19 101.40 1hf2 n GLY 174 Ca 0.00 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 1hf2 n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hf2 s PHE 175 N -3.03 3.52 0.16 1.61 0.40 -0.45 -5.10 117.98 115.09 1hf2 s PHE 175 Ca 0.13 0.89 -0.07 0.00 -0.60 0.00 0.00 56.93 57.28 1hf2 s PHE 175 Cb 0.17 -2.34 -0.02 0.00 0.51 0.00 0.00 43.02 41.35 1hf2 s PHE 175 CO 0.55 -0.18 0.22 0.42 0.70 0.00 0.00 175.22 176.93 1hf2 s ILE 176 N -2.56 0.07 -0.14 0.64 1.01 -1.26 -1.17 121.20 117.80 1hf2 s ILE 176 Ca 0.49 -1.53 -0.31 0.00 0.00 0.00 0.00 60.65 59.30 1hf2 s ILE 176 Cb -0.10 -1.91 0.13 0.00 0.01 0.00 0.00 42.46 40.59 1hf2 s ILE 176 CO 0.39 -0.33 1.04 0.28 0.00 0.00 0.00 174.94 176.32 1hf2 s THR 177 N -3.99 0.00 -0.26 2.92 -1.32 -0.56 -4.65 115.64 107.78 1hf2 s THR 177 Ca 0.19 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.70 1hf2 s THR 177 Cb 0.04 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.04 1hf2 s THR 177 CO 0.01 0.00 0.44 1.41 -2.21 0.00 0.00 174.62 174.26 1hf2 n HIS 178 N 0.32 0.00 -2.19 9.09 8.25 -1.26 -1.83 115.22 127.60 1hf2 n HIS 178 Ca -0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.03 1hf2 n HIS 178 Cb 0.59 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.71 1hf2 n HIS 178 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1hf2 s SER 179 N -0.51 5.63 0.45 0.41 1.04 -1.26 -4.82 113.70 114.64 1hf2 s SER 179 Ca 0.02 2.26 0.05 0.00 0.48 0.00 0.00 55.95 58.76 1hf2 s SER 179 Cb 0.02 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.50 1hf2 s SER 179 CO 0.05 -1.28 0.02 -0.54 0.98 0.00 0.00 173.24 172.47 1hf2 s LYS 180 N -3.22 2.06 0.39 4.02 1.02 -1.26 -4.88 119.74 117.88 1hf2 s LYS 180 Ca 0.73 -2.20 0.00 0.00 0.02 0.00 0.00 55.97 54.52 1hf2 s LYS 180 Cb -0.26 -1.62 -0.02 0.00 -0.52 0.00 0.00 37.83 35.41 1hf2 s LYS 180 CO 0.30 -0.17 0.61 0.20 -0.92 0.00 0.00 175.35 175.36 1hf2 s GLY 181 N -3.78 1.44 0.48 -3.33 0.00 -0.15 -5.02 107.32 96.95 1hf2 s GLY 181 Ca 0.25 -0.96 -0.23 0.00 0.00 0.00 0.00 44.72 43.78 1hf2 s GLY 181 CO 0.13 -0.85 1.22 1.18 0.00 0.00 0.00 173.10 174.78 1hf2 n GLU 182 N -1.92 1.67 -1.62 2.90 1.02 -1.26 -4.73 120.64 116.70 1hf2 n GLU 182 Ca -0.02 0.60 -0.48 0.00 -0.02 0.00 0.00 57.16 57.25 1hf2 n GLU 182 Cb 0.57 -2.36 -0.04 0.00 -0.02 0.00 0.00 31.44 29.59 1hf2 n GLU 182 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1hf2 n GLU 183 N -0.33 1.60 -3.84 3.49 2.13 -1.26 -2.32 120.64 120.11 1hf2 n GLU 183 Ca 0.09 0.57 -0.30 0.00 0.66 0.00 0.00 57.16 58.18 1hf2 n GLU 183 Cb 0.42 -2.19 -0.03 0.00 0.27 0.00 0.00 31.44 29.91 1hf2 n GLU 183 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1hf2 n ASN 184 N 2.36 -2.75 -3.95 4.31 3.02 -1.26 -4.94 115.26 112.05 1hf2 n ASN 184 Ca 0.15 -0.70 -0.31 0.00 -0.03 0.00 0.00 54.58 53.69 1hf2 n ASN 184 Cb 0.27 -2.31 -0.15 0.00 -0.61 0.00 0.00 39.78 36.97 1hf2 n ASN 184 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1hf2 s VAL 185 N -3.00 1.64 -0.42 2.41 1.01 -0.98 -4.95 120.40 116.10 1hf2 s VAL 185 Ca 0.58 -1.43 -0.41 0.00 0.00 0.00 0.00 61.98 60.71 1hf2 s VAL 185 Cb -0.32 -1.96 -0.16 0.00 0.00 0.00 0.00 36.38 33.94 1hf2 s VAL 185 CO 0.71 -0.21 2.03 -2.65 0.00 0.00 0.00 175.10 174.97 1hf2 n PRO 186 N 4.60 0.51 -4.43 2.72 -0.02 -1.08 -4.65 135.00 132.65 1hf2 n PRO 186 Ca -0.09 0.15 -0.22 0.00 -2.02 0.00 0.00 63.50 61.32 1hf2 n PRO 186 Cb 0.43 -1.88 -0.10 0.00 -0.02 0.00 0.00 33.50 31.93 1hf2 n PRO 186 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1hf2 s SER 187 N 5.64 3.14 -0.09 2.55 0.01 -0.79 -0.11 113.70 124.05 1hf2 s SER 187 Ca 1.12 -1.07 -0.00 0.00 1.31 0.00 0.00 55.95 57.31 1hf2 s SER 187 Cb -1.24 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 64.78 1hf2 s SER 187 CO 0.63 -0.11 -0.07 -0.63 0.41 0.00 0.00 173.24 173.47 1hf2 s ILE 188 N -2.75 0.87 -0.25 1.44 1.01 -0.44 -2.51 121.20 118.57 1hf2 s ILE 188 Ca 0.28 -0.22 -0.11 0.00 0.00 0.00 0.00 60.65 60.59 1hf2 s ILE 188 Cb -0.01 -0.90 -0.05 0.00 0.01 0.00 0.00 42.46 41.51 1hf2 s ILE 188 CO 0.12 0.33 0.21 0.00 0.00 0.00 0.00 174.94 175.60 1hf2 s ALA 189 N 1.51 3.58 0.18 9.38 0.00 0.13 -2.42 121.76 134.13 1hf2 s ALA 189 Ca 0.00 -0.89 -0.06 0.00 0.00 0.00 0.00 51.96 51.00 1hf2 s ALA 189 Cb -0.13 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 1hf2 s ALA 189 CO -0.05 -0.32 0.24 -3.38 0.00 0.00 0.00 175.76 172.25 1hf2 s HIS 190 N 1.32 0.64 -0.41 0.00 -3.43 -0.13 -1.55 115.29 111.74 1hf2 s HIS 190 Ca 0.09 -0.97 -0.22 0.00 -0.80 0.00 0.00 55.06 53.16 1hf2 s HIS 190 Cb -0.14 -0.20 0.02 0.00 -1.43 0.00 0.00 32.58 30.83 1hf2 s HIS 190 CO 0.07 -0.72 0.73 0.08 -2.00 0.00 0.00 174.74 172.90 1hf2 s VAL 191 N -4.03 4.75 0.08 -5.38 1.01 -1.26 -0.07 120.40 115.50 1hf2 s VAL 191 Ca 0.24 0.51 0.06 0.00 0.00 0.00 0.00 61.98 62.79 1hf2 s VAL 191 Cb 0.04 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.17 1hf2 s VAL 191 CO 0.05 -0.54 -0.15 -0.75 0.00 0.00 0.00 175.10 173.70 1hf2 s LYS 192 N 3.03 0.88 1.15 2.72 2.20 -0.75 -4.91 119.74 124.06 1hf2 s LYS 192 Ca 0.28 -0.99 0.00 0.00 -0.36 0.00 0.00 55.97 54.89 1hf2 s LYS 192 Cb -0.13 -0.93 0.00 0.00 -1.51 0.00 0.00 37.83 35.26 1hf2 s LYS 192 CO 0.19 0.21 0.00 0.41 -0.36 0.00 0.00 175.35 175.80 1hf2 n GLY 193 N 1.24 0.99 0.30 5.54 0.00 -1.26 -1.72 105.19 110.28 1hf2 n GLY 193 Ca -0.21 0.48 -0.01 0.00 0.00 0.00 0.00 46.02 46.28 1hf2 n GLY 193 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1hf2 n ASN 194 N 3.38 -0.09 -3.59 1.61 5.15 -1.26 -5.14 115.26 115.32 1hf2 n ASN 194 Ca 0.00 -0.41 -0.17 0.00 -0.60 0.00 0.00 54.58 53.40 1hf2 n ASN 194 Cb 0.00 0.03 -0.08 0.00 -0.53 0.00 0.00 39.78 39.19 1hf2 n ASN 194 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1hf2 s ARG 195 N 0.00 1.61 -0.19 1.20 1.70 -0.70 -5.07 118.95 117.50 1hf2 s ARG 195 Ca 0.00 -1.88 -0.17 0.00 -0.47 0.00 0.00 55.73 53.21 1hf2 s ARG 195 Cb 0.00 0.32 -0.04 0.00 -0.57 0.00 0.00 34.95 34.66 1hf2 s ARG 195 CO 0.00 -0.59 0.44 0.42 -1.08 0.00 0.00 175.30 174.49 1hf2 s ILE 196 N -3.63 5.17 -0.01 4.99 1.01 -1.26 -1.81 121.20 125.66 1hf2 s ILE 196 Ca 0.39 0.80 0.01 0.00 0.00 0.00 0.00 60.65 61.86 1hf2 s ILE 196 Cb 0.03 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 1hf2 s ILE 196 CO 0.23 0.24 -0.01 -0.69 0.00 0.00 0.00 174.94 174.70 1hf2 s VAL 197 N 1.33 4.09 -0.21 2.92 1.01 0.90 -4.92 120.40 125.52 1hf2 s VAL 197 Ca 0.21 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.62 1hf2 s VAL 197 Cb -0.15 -2.80 0.05 0.00 0.00 0.00 0.00 36.38 33.48 1hf2 s VAL 197 CO 0.09 0.41 -0.09 -0.63 0.00 0.00 0.00 175.10 174.88 1hf2 s ILE 198 N -1.04 1.62 0.05 2.22 1.01 -1.26 -0.95 121.20 122.84 1hf2 s ILE 198 Ca 0.18 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 59.79 1hf2 s ILE 198 Cb -0.11 -1.75 -0.02 0.00 0.01 0.00 0.00 42.46 40.59 1hf2 s ILE 198 CO 0.09 0.09 -0.10 -1.83 0.00 0.00 0.00 174.94 173.20 1hf2 s GLU 199 N 1.39 0.61 0.88 2.79 -1.05 -1.01 -4.95 118.70 117.36 1hf2 s GLU 199 Ca -0.03 -0.77 -0.13 0.00 -0.15 0.00 0.00 54.97 53.90 1hf2 s GLU 199 Cb -0.17 -0.47 0.07 0.00 -0.44 0.00 0.00 34.13 33.12 1hf2 s GLU 199 CO -0.08 0.10 0.79 -0.35 0.95 0.00 0.00 175.26 176.68 1hf2 n PRO 200 N 1.55 -0.15 -0.32 -4.83 -0.04 -1.26 -1.33 135.00 128.61 1hf2 n PRO 200 Ca -0.21 0.02 0.01 0.00 -0.04 0.00 0.00 63.50 63.27 1hf2 n PRO 200 Cb 0.55 -2.12 0.14 0.00 -0.04 0.00 0.00 33.50 32.03 1hf2 n PRO 200 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1hf2 h PHE 201 N -1.35 1.02 0.00 0.54 -5.15 -0.84 -2.53 116.94 108.62 1hf2 h PHE 201 Ca -0.44 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.36 1hf2 h PHE 201 Cb 1.29 -0.33 0.00 0.00 0.22 0.00 0.00 35.95 37.13 1hf2 h PHE 201 CO 0.43 0.52 0.00 -0.40 -2.00 0.00 0.00 178.31 176.86 1hf2 n ASP 202 N -4.60 0.00 -1.08 -0.68 5.75 -1.26 -3.37 116.55 111.30 1hf2 n ASP 202 Ca 0.13 -0.95 0.01 0.00 -0.01 0.00 0.00 54.79 53.97 1hf2 n ASP 202 Cb 0.17 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1hf2 n ASP 202 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1hf2 n LYS 203 N -0.83 0.00 -2.44 0.11 5.02 -0.97 -5.10 118.16 113.96 1hf2 n LYS 203 Ca 0.11 -1.48 -0.40 0.00 -2.02 0.00 0.00 58.31 54.52 1hf2 n LYS 203 Cb 0.05 -0.10 -0.04 0.00 -0.02 0.00 0.00 35.03 34.92 1hf2 n LYS 203 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1hf2 s VAL 204 N 0.00 3.48 -0.29 -0.18 1.01 -1.14 -4.84 120.40 118.44 1hf2 s VAL 204 Ca 0.18 1.43 -0.03 0.00 0.00 0.00 0.00 61.98 63.56 1hf2 s VAL 204 Cb 0.21 -3.91 0.10 0.00 0.00 0.00 0.00 36.38 32.77 1hf2 s VAL 204 CO -0.09 0.32 0.12 -0.94 0.00 0.00 0.00 175.10 174.51 1hf2 s SER 205 N -0.64 3.63 0.00 3.32 1.04 -1.26 -5.12 113.70 114.66 1hf2 s SER 205 Ca 0.46 -1.35 0.26 0.00 0.48 0.00 0.00 55.95 55.80 1hf2 s SER 205 Cb -0.32 -0.47 1.58 0.00 0.10 0.00 0.00 66.02 66.91 1hf2 s SER 205 CO 0.41 -0.43 1.93 0.49 0.98 0.00 0.00 173.24 176.62