#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfj s LEU 4 N 0.00 4.09 0.63 3.14 1.02 -1.26 -5.02 118.68 121.28 1hfj s LEU 4 Ca 0.00 2.29 -0.12 0.00 0.02 0.00 0.00 54.13 56.32 1hfj s LEU 4 Cb 0.00 -4.16 -0.03 0.00 0.02 0.00 0.00 46.19 42.02 1hfj s LEU 4 CO 0.00 -0.78 1.04 -2.16 0.02 0.00 0.00 176.35 174.46 1hfj s PRO 5 N -2.53 3.42 -0.41 1.29 0.04 -1.26 -4.65 135.00 130.90 1hfj s PRO 5 Ca 0.61 0.86 -0.16 0.00 0.04 0.00 0.00 61.00 62.34 1hfj s PRO 5 Cb -0.29 -2.06 0.02 0.00 0.04 0.00 0.00 34.50 32.22 1hfj s PRO 5 CO 0.35 -0.71 0.40 -0.80 0.04 0.00 0.00 177.00 176.28 1hfj s ASN 6 N -3.86 6.17 -0.09 6.66 0.01 -1.26 -0.55 114.94 122.02 1hfj s ASN 6 Ca 0.57 -0.68 0.02 0.00 -0.71 0.00 0.00 52.86 52.06 1hfj s ASN 6 Cb -0.12 -2.21 -0.02 0.00 0.41 0.00 0.00 41.25 39.32 1hfj s ASN 6 CO 0.51 -0.52 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.79 1hfj s ILE 7 N 2.01 2.89 -0.15 0.60 -1.09 -0.28 -0.49 121.20 124.71 1hfj s ILE 7 Ca 0.10 -0.75 -0.06 0.00 -2.23 0.00 0.00 60.65 57.72 1hfj s ILE 7 Cb -0.17 -2.17 -0.04 0.00 -1.58 0.00 0.00 42.46 38.50 1hfj s ILE 7 CO 0.13 0.55 0.05 -0.69 -1.23 0.00 0.00 174.94 173.75 1hfj s VAL 8 N -0.09 4.72 -0.41 2.92 1.01 -1.01 -2.25 120.40 125.30 1hfj s VAL 8 Ca -0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 61.98 61.81 1hfj s VAL 8 Cb -0.14 -3.08 0.08 0.00 0.00 0.00 0.00 36.38 33.24 1hfj s VAL 8 CO 0.04 0.52 0.22 -0.63 0.00 0.00 0.00 175.10 175.25 1hfj s ILE 9 N -0.12 3.92 -0.31 2.22 1.01 0.75 -1.21 121.20 127.46 1hfj s ILE 9 Ca 0.07 -1.54 -0.22 0.00 0.00 0.00 0.00 60.65 58.96 1hfj s ILE 9 Cb -0.12 -3.44 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 1hfj s ILE 9 CO 0.01 -0.51 0.71 -0.76 0.00 0.00 0.00 174.94 174.39 1hfj s LEU 10 N 1.35 4.12 -0.12 2.97 1.43 -0.08 -0.96 118.68 127.39 1hfj s LEU 10 Ca 0.03 0.52 -0.09 0.00 -1.03 0.00 0.00 54.13 53.56 1hfj s LEU 10 Cb -0.23 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 1hfj s LEU 10 CO 0.00 -0.56 0.19 0.00 0.23 0.00 0.00 176.35 176.21 1hfj s ALA 11 N 2.80 3.79 0.00 4.21 0.00 -0.21 -1.15 121.76 131.20 1hfj s ALA 11 Ca 0.29 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.67 1hfj s ALA 11 Cb -0.14 -2.11 0.00 0.00 0.00 0.00 0.00 23.12 20.87 1hfj s ALA 11 CO 0.12 0.46 0.28 0.25 0.00 0.00 0.00 175.76 176.87 1hfj n THR 12 N 2.43 0.00 0.00 0.00 -2.24 -0.68 -0.92 114.28 112.86 1hfj n THR 12 Ca -0.18 -0.43 0.00 0.00 -2.27 0.00 0.00 64.05 61.17 1hfj n THR 12 Cb 0.54 1.08 0.00 0.00 -2.10 0.00 0.00 70.33 69.85 1hfj n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hfj n GLY 13 N 0.31 0.22 0.00 3.38 0.00 -1.22 -1.35 105.19 106.52 1hfj n GLY 13 Ca 0.00 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1hfj n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hfj n GLY 14 N 0.00 -0.73 0.23 -0.02 0.00 0.49 -4.22 105.19 100.93 1hfj n GLY 14 Ca 0.00 -1.70 0.07 0.00 0.00 0.00 0.00 46.02 44.39 1hfj n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hfj h THR 15 N 0.00 1.00 0.00 2.61 2.02 -1.82 -1.40 112.91 115.32 1hfj h THR 15 Ca 0.00 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.55 1hfj h THR 15 Cb 0.00 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 1hfj h THR 15 CO 0.00 0.17 0.00 0.00 0.37 0.00 0.00 175.52 176.06 1hfj n ILE 16 N -4.15 1.04 -1.25 3.11 3.06 -1.26 -0.29 119.36 119.63 1hfj n ILE 16 Ca -0.02 0.63 0.08 0.00 -2.50 0.00 0.00 62.75 60.94 1hfj n ILE 16 Cb 0.25 -1.61 0.13 0.00 0.54 0.00 0.00 39.64 38.94 1hfj n ILE 16 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1hfj n ALA 17 N -1.76 2.35 -2.00 1.51 0.00 -0.61 -4.56 120.51 115.43 1hfj n ALA 17 Ca -0.01 -2.48 -0.20 0.00 0.00 0.00 0.00 53.44 50.75 1hfj n ALA 17 Cb 0.07 -0.40 0.03 0.00 0.00 0.00 0.00 19.45 19.16 1hfj n ALA 17 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1hfj s GLY 18 N -2.67 1.83 0.03 0.00 0.00 0.60 -0.47 107.32 106.65 1hfj s GLY 18 Ca 0.29 -1.37 -0.21 0.00 0.00 0.00 0.00 44.72 43.42 1hfj s GLY 18 CO 0.02 -1.11 0.49 -1.35 0.00 0.00 0.00 173.10 171.14 1hfj s SER 19 N -4.40 -0.39 0.21 1.64 1.04 -0.87 -1.45 113.70 109.47 1hfj s SER 19 Ca 0.56 0.17 0.03 0.00 0.48 0.00 0.00 55.95 57.19 1hfj s SER 19 Cb -0.10 0.46 -0.05 0.00 0.10 0.00 0.00 66.02 66.43 1hfj s SER 19 CO 0.37 -0.67 0.01 0.00 0.98 0.00 0.00 173.24 173.93 1hfj s ALA 20 N -2.25 1.65 0.45 5.32 0.00 -1.26 -2.15 121.76 123.52 1hfj s ALA 20 Ca -0.06 -1.72 0.14 0.00 0.00 0.00 0.00 51.96 50.32 1hfj s ALA 20 Cb -0.01 0.58 0.99 0.00 0.00 0.00 0.00 23.12 24.68 1hfj s ALA 20 CO -0.00 -0.30 1.99 0.00 0.00 0.00 0.00 175.76 177.45 1hfj h ALA 21 N 2.54 1.69 -2.71 0.00 0.00 -1.97 -3.45 119.26 115.37 1hfj h ALA 21 Ca -0.38 -0.17 -0.39 0.00 0.00 0.00 0.00 54.91 53.97 1hfj h ALA 21 Cb 1.22 -0.03 -0.17 0.00 0.00 0.00 0.00 17.79 18.81 1hfj h ALA 21 CO 0.63 0.23 -0.75 0.95 0.00 0.00 0.00 179.25 180.32 1hfj s THR 22 N -4.65 1.30 -0.72 0.00 -4.23 -1.26 -5.03 115.64 101.05 1hfj s THR 22 Ca -0.04 -1.81 0.17 0.00 -1.18 0.00 0.00 61.69 58.83 1hfj s THR 22 Cb 0.16 -1.61 0.17 0.00 1.34 0.00 0.00 72.50 72.55 1hfj s THR 22 CO 0.70 -0.50 1.53 0.61 -0.54 0.00 0.00 174.62 176.42 1hfj n GLY 23 N 0.33 -1.04 1.05 3.99 0.00 -1.25 -2.14 105.19 106.13 1hfj n GLY 23 Ca -0.14 0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1hfj n GLY 23 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1hfj n THR 24 N -1.86 0.43 -3.24 2.61 -2.24 -1.26 -0.64 114.28 108.06 1hfj n THR 24 Ca 0.02 -0.71 -0.43 0.00 -2.27 0.00 0.00 64.05 60.66 1hfj n THR 24 Cb 0.16 1.05 -0.08 0.00 -2.10 0.00 0.00 70.33 69.37 1hfj n THR 24 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1hfj s GLN 25 N -1.48 3.13 0.00 -0.78 0.74 -0.91 -4.87 119.66 115.48 1hfj s GLN 25 Ca 0.34 -0.76 0.13 0.00 0.05 0.00 0.00 55.36 55.12 1hfj s GLN 25 Cb 0.21 -4.01 -0.05 0.00 1.10 0.00 0.00 33.01 30.26 1hfj s GLN 25 CO 0.29 -0.99 0.68 0.25 -0.55 0.00 0.00 175.29 174.97 1hfj n THR 26 N 5.54 0.00 -4.25 -0.34 -2.24 -1.26 -4.76 114.28 106.97 1hfj n THR 26 Ca -0.06 -0.31 -0.16 0.00 -2.27 0.00 0.00 64.05 61.25 1hfj n THR 26 Cb 0.47 1.10 -0.10 0.00 -2.10 0.00 0.00 70.33 69.70 1hfj n THR 26 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1hfj s THR 27 N -1.82 1.26 -0.63 4.28 -4.23 -1.26 -4.72 115.64 108.52 1hfj s THR 27 Ca 0.09 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 1hfj s THR 27 Cb 0.10 -1.76 0.00 0.00 1.34 0.00 0.00 72.50 72.18 1hfj s THR 27 CO 0.39 -0.64 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 1hfj n GLY 28 N 0.01 0.76 3.85 3.99 0.00 -1.26 -5.01 105.19 107.52 1hfj n GLY 28 Ca -0.12 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.38 1hfj n GLY 28 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1hfj n TYR 29 N -2.55 -3.92 -3.71 1.61 4.11 -1.26 -5.05 117.16 106.39 1hfj n TYR 29 Ca -0.06 -1.22 -0.38 0.00 -0.00 0.00 0.00 57.90 56.24 1hfj n TYR 29 Cb 0.34 -1.00 -0.12 0.00 -0.00 0.00 0.00 39.34 38.55 1hfj n TYR 29 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1hfj s LYS 30 N -5.84 2.85 0.55 -3.48 2.20 -0.91 -4.97 119.74 110.15 1hfj s LYS 30 Ca 0.74 -1.03 -0.15 0.00 -0.36 0.00 0.00 55.97 55.18 1hfj s LYS 30 Cb -0.02 -3.50 -0.07 0.00 -1.51 0.00 0.00 37.83 32.74 1hfj s LYS 30 CO 0.52 -0.59 1.00 0.00 -0.36 0.00 0.00 175.35 175.92 1hfj s ALA 31 N 1.48 3.07 -1.17 3.13 0.00 -1.26 -2.06 121.76 124.95 1hfj s ALA 31 Ca 0.01 0.10 -0.02 0.00 0.00 0.00 0.00 51.96 52.05 1hfj s ALA 31 Cb -0.19 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1hfj s ALA 31 CO 0.04 -0.39 0.99 0.41 0.00 0.00 0.00 175.76 176.81 1hfj n GLY 32 N -1.94 -0.35 0.04 0.00 0.00 -0.70 -4.52 105.19 97.71 1hfj n GLY 32 Ca 0.06 0.10 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 1hfj n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfj n ALA 33 N -4.17 2.02 -2.83 4.61 0.00 -0.01 -4.65 120.51 115.48 1hfj n ALA 33 Ca -0.21 -0.66 -0.27 0.00 0.00 0.00 0.00 53.44 52.30 1hfj n ALA 33 Cb 0.64 -0.21 -0.05 0.00 0.00 0.00 0.00 19.45 19.82 1hfj n ALA 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1hfj s LEU 34 N -4.57 3.93 0.47 0.00 1.43 0.38 -5.03 118.68 115.29 1hfj s LEU 34 Ca -0.06 -0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1hfj s LEU 34 Cb 0.06 -2.55 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 1hfj s LEU 34 CO 0.56 0.10 0.76 -0.83 0.23 0.00 0.00 176.35 177.17 1hfj s GLY 35 N -2.92 1.48 0.34 -3.19 0.00 -1.26 -4.90 107.32 96.87 1hfj s GLY 35 Ca 0.31 -0.57 0.07 0.00 0.00 0.00 0.00 44.72 44.53 1hfj s GLY 35 CO 0.24 -0.41 1.87 -0.24 0.00 0.00 0.00 173.10 174.57 1hfj h VAL 36 N 0.27 0.88 -0.13 1.40 3.04 -1.96 -1.71 116.25 118.05 1hfj h VAL 36 Ca -0.47 -0.27 -0.10 0.00 -1.01 0.00 0.00 66.70 64.85 1hfj h VAL 36 Cb 1.21 0.03 -0.01 0.00 -2.01 0.00 0.00 31.29 30.51 1hfj h VAL 36 CO 0.61 0.14 -0.35 0.44 -1.01 0.00 0.00 177.57 177.40 1hfj h ASP 37 N 0.78 0.27 -0.63 3.17 3.32 -1.94 0.54 116.42 121.93 1hfj h ASP 37 Ca 0.44 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.33 1hfj h ASP 37 Cb 0.60 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.05 1hfj h ASP 37 CO -0.20 0.61 0.15 0.74 -1.72 0.00 0.00 179.24 178.82 1hfj h THR 38 N 0.22 1.25 -0.45 0.35 2.02 -1.70 -0.75 112.91 113.86 1hfj h THR 38 Ca 0.03 -0.92 -0.03 0.00 0.77 0.00 0.00 66.41 66.25 1hfj h THR 38 Cb 0.74 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 1hfj h THR 38 CO 0.06 0.35 0.17 -0.07 0.37 0.00 0.00 175.52 176.39 1hfj h LEU 39 N 0.92 0.62 -0.59 2.58 3.38 -1.01 -1.97 115.31 119.24 1hfj h LEU 39 Ca 0.20 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1hfj h LEU 39 Cb 0.36 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1hfj h LEU 39 CO 0.00 0.63 0.23 0.40 0.09 0.00 0.00 178.44 179.80 1hfj h ILE 40 N 0.58 1.23 0.00 1.22 2.04 -0.60 -2.62 117.51 119.35 1hfj h ILE 40 Ca 0.15 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 1hfj h ILE 40 Cb 0.21 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.89 1hfj h ILE 40 CO -0.01 0.28 -0.07 0.78 0.00 0.00 0.00 178.15 179.13 1hfj h ASN 41 N 0.82 0.00 0.15 1.72 2.35 -1.00 -2.73 115.58 116.90 1hfj h ASN 41 Ca 0.20 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.85 1hfj h ASN 41 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1hfj h ASN 41 CO -0.01 0.07 -0.33 0.00 -1.65 0.00 0.00 177.43 175.50 1hfj h ALA 42 N 1.93 1.18 -2.35 -0.83 0.00 -0.96 -3.30 119.26 114.92 1hfj h ALA 42 Ca -0.00 -0.36 -0.60 0.00 0.00 0.00 0.00 54.91 53.95 1hfj h ALA 42 Cb 0.59 -0.09 -0.42 0.00 0.00 0.00 0.00 17.79 17.87 1hfj h ALA 42 CO 0.01 0.54 -0.62 1.33 0.00 0.00 0.00 179.25 180.51 1hfj n VAL 43 N -4.09 2.03 -0.10 0.00 0.24 -1.03 -4.93 118.33 110.46 1hfj n VAL 43 Ca -0.01 -5.08 0.21 0.00 -2.04 0.00 0.00 64.34 57.42 1hfj n VAL 43 Cb 0.43 -2.10 0.64 0.00 -1.47 0.00 0.00 33.84 31.33 1hfj n VAL 43 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1hfj h PRO 44 N 4.41 0.13 -0.82 7.34 0.11 -1.64 -1.06 132.00 140.47 1hfj h PRO 44 Ca 0.18 -0.01 0.23 0.00 0.11 0.00 0.00 66.00 66.52 1hfj h PRO 44 Cb 0.69 -0.03 -0.04 0.00 0.11 0.00 0.00 31.00 31.73 1hfj h PRO 44 CO 0.79 0.09 0.58 0.93 -0.21 0.00 0.00 178.00 180.18 1hfj h GLU 45 N 0.14 0.06 -0.94 1.05 3.07 -1.91 0.51 114.58 116.56 1hfj h GLU 45 Ca 0.34 -0.00 0.22 0.00 -0.50 0.00 0.00 59.36 59.42 1hfj h GLU 45 Cb 1.15 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 28.98 1hfj h GLU 45 CO -0.05 0.04 0.62 -0.24 -1.40 0.00 0.00 179.01 177.98 1hfj h VAL 46 N 0.06 0.64 0.00 3.13 3.04 -1.53 0.18 116.25 121.77 1hfj h VAL 46 Ca 0.40 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.95 1hfj h VAL 46 Cb 1.49 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.99 1hfj h VAL 46 CO -0.03 0.07 0.00 0.29 -1.01 0.00 0.00 177.57 176.89 1hfj n LYS 47 N -4.52 0.38 -0.00 4.17 5.02 0.17 -1.62 118.16 121.75 1hfj n LYS 47 Ca 0.21 0.05 0.09 0.00 -2.02 0.00 0.00 58.31 56.64 1hfj n LYS 47 Cb 0.75 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 34.14 1hfj n LYS 47 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1hfj n LYS 48 N -1.10 0.69 0.03 1.97 5.02 0.05 -4.22 118.16 120.60 1hfj n LYS 48 Ca 0.10 -0.03 0.05 0.00 -2.02 0.00 0.00 58.31 56.41 1hfj n LYS 48 Cb 0.07 -1.41 -0.09 0.00 -0.02 0.00 0.00 35.03 33.59 1hfj n LYS 48 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1hfj n LEU 49 N -1.59 0.54 -3.76 -0.35 4.77 -0.64 -5.03 117.00 110.94 1hfj n LEU 49 Ca 0.02 0.22 -0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1hfj n LEU 49 Cb 0.34 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1hfj n LEU 49 CO 0.39 0.04 0.93 0.00 -1.33 0.00 0.00 177.39 177.42 1hfj s ALA 50 N -3.18 -2.00 -0.47 -1.18 0.00 -1.16 -4.48 121.76 109.29 1hfj s ALA 50 Ca -0.04 0.25 -0.20 0.00 0.00 0.00 0.00 51.96 51.97 1hfj s ALA 50 Cb 0.10 0.59 0.04 0.00 0.00 0.00 0.00 23.12 23.85 1hfj s ALA 50 CO 0.83 -1.07 0.62 -0.80 0.00 0.00 0.00 175.76 175.35 1hfj s ASN 51 N -3.18 6.26 0.00 0.00 0.01 0.29 -4.45 114.94 113.86 1hfj s ASN 51 Ca 0.18 -0.64 0.00 0.00 -0.71 0.00 0.00 52.86 51.69 1hfj s ASN 51 Cb 0.01 -2.30 -0.04 0.00 0.41 0.00 0.00 41.25 39.33 1hfj s ASN 51 CO -0.00 -0.83 0.08 0.68 -1.51 0.00 0.00 177.10 175.52 1hfj s VAL 52 N 2.71 4.68 -0.06 1.60 -7.23 -1.26 -1.12 120.40 119.72 1hfj s VAL 52 Ca 0.18 -0.45 -0.00 0.00 -1.81 0.00 0.00 61.98 59.90 1hfj s VAL 52 Cb -0.17 -3.15 0.02 0.00 0.56 0.00 0.00 36.38 33.65 1hfj s VAL 52 CO 0.15 0.33 -0.02 -0.54 -0.31 0.00 0.00 175.10 174.71 1hfj s LYS 53 N -1.78 0.76 -0.02 4.82 1.02 -0.95 -5.00 119.74 118.58 1hfj s LYS 53 Ca 0.23 -0.01 -0.10 0.00 0.02 0.00 0.00 55.97 56.11 1hfj s LYS 53 Cb -0.12 -0.94 -0.05 0.00 -0.52 0.00 0.00 37.83 36.20 1hfj s LYS 53 CO 0.14 -0.19 0.30 0.20 -0.92 0.00 0.00 175.35 174.88 1hfj s GLY 54 N 1.44 2.32 -0.05 -3.33 0.00 -1.26 -0.18 107.32 106.26 1hfj s GLY 54 Ca -0.03 -0.44 0.01 0.00 0.00 0.00 0.00 44.72 44.26 1hfj s GLY 54 CO -0.03 -0.17 -0.06 1.85 0.00 0.00 0.00 173.10 174.69 1hfj s GLU 55 N -1.36 1.03 -0.67 2.90 2.12 -0.13 -4.91 118.70 117.68 1hfj s GLU 55 Ca 0.24 -0.17 -0.19 0.00 0.36 0.00 0.00 54.97 55.20 1hfj s GLU 55 Cb -0.14 -0.98 0.11 0.00 0.26 0.00 0.00 34.13 33.37 1hfj s GLU 55 CO 0.12 -0.07 0.82 -1.14 -0.54 0.00 0.00 175.26 174.46 1hfj s GLN 56 N 0.90 3.17 0.11 4.30 2.00 -1.26 -1.04 119.66 127.84 1hfj s GLN 56 Ca -0.11 -1.36 -0.09 0.00 -2.00 0.00 0.00 55.36 51.79 1hfj s GLN 56 Cb -0.15 -4.36 -0.12 0.00 0.80 0.00 0.00 33.01 29.18 1hfj s GLN 56 CO 0.01 -1.62 1.30 0.35 -0.50 0.00 0.00 175.29 174.83 1hfj h PHE 57 N 9.12 0.89 -2.08 1.67 3.57 -1.38 -3.48 116.94 125.25 1hfj h PHE 57 Ca -0.20 -0.43 0.12 0.00 3.53 0.00 0.00 57.97 60.98 1hfj h PHE 57 Cb 1.07 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 1hfj h PHE 57 CO 0.92 1.25 0.39 -1.13 -2.23 0.00 0.00 178.31 177.51 1hfj n SER 58 N -3.86 -0.97 -2.95 0.41 3.41 -0.77 -4.99 113.62 103.91 1hfj n SER 58 Ca -0.08 -1.47 -0.06 0.00 -0.26 0.00 0.00 58.87 57.01 1hfj n SER 58 Cb 0.79 1.57 -0.01 0.00 -0.26 0.00 0.00 64.21 66.30 1hfj n SER 58 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1hfj s ASN 59 N -2.49 -1.05 0.18 4.04 3.84 -1.14 -3.46 114.94 114.87 1hfj s ASN 59 Ca 0.14 -1.65 -0.01 0.00 0.21 0.00 0.00 52.86 51.55 1hfj s ASN 59 Cb -0.01 1.62 -0.04 0.00 -0.55 0.00 0.00 41.25 42.26 1hfj s ASN 59 CO 0.03 -0.10 0.11 0.00 -2.79 0.00 0.00 177.10 174.34 1hfj s MET 60 N 1.03 1.14 0.12 0.43 0.23 -0.46 -4.78 119.30 117.01 1hfj s MET 60 Ca 0.27 -1.59 -0.30 0.00 -1.03 0.00 0.00 55.69 53.04 1hfj s MET 60 Cb -0.01 0.23 -0.06 0.00 -1.53 0.00 0.00 34.83 33.46 1hfj s MET 60 CO -0.07 -0.35 1.00 0.00 -2.03 0.00 0.00 175.02 173.57 1hfj s ALA 61 N -4.11 3.27 -0.45 3.16 0.00 -1.26 -0.38 121.76 121.99 1hfj s ALA 61 Ca 0.35 0.63 0.16 0.00 0.00 0.00 0.00 51.96 53.10 1hfj s ALA 61 Cb 0.07 -3.30 0.85 0.00 0.00 0.00 0.00 23.12 20.75 1hfj s ALA 61 CO 0.09 -0.08 1.50 -1.13 0.00 0.00 0.00 175.76 176.15 1hfj n SER 62 N 2.76 0.42 0.11 0.00 3.41 -1.26 -1.43 113.62 117.64 1hfj n SER 62 Ca 0.03 0.68 0.12 0.00 -0.26 0.00 0.00 58.87 59.43 1hfj n SER 62 Cb 0.49 -0.74 0.47 0.00 -0.26 0.00 0.00 64.21 64.16 1hfj n SER 62 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1hfj n GLU 63 N -2.05 0.18 -0.20 4.33 0.00 -1.26 -2.28 120.64 119.36 1hfj n GLU 63 Ca -0.01 0.38 0.10 0.00 0.00 0.00 0.00 57.16 57.63 1hfj n GLU 63 Cb 0.05 -1.83 0.20 0.00 0.00 0.00 0.00 31.44 29.87 1hfj n GLU 63 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1hfj n ASN 64 N -2.17 3.28 -4.77 -1.84 3.02 -0.51 -4.96 115.26 107.33 1hfj n ASN 64 Ca 0.03 -1.94 -0.40 0.00 -0.03 0.00 0.00 54.58 52.24 1hfj n ASN 64 Cb 0.25 -0.26 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 1hfj n ASN 64 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1hfj s MET 65 N -1.24 4.35 0.25 3.52 1.75 -0.97 -5.03 119.30 121.94 1hfj s MET 65 Ca 0.35 1.98 0.05 0.00 -1.25 0.00 0.00 55.69 56.81 1hfj s MET 65 Cb 0.20 -2.98 -0.05 0.00 2.84 0.00 0.00 34.83 34.83 1hfj s MET 65 CO 0.27 -0.11 -0.03 0.95 -0.65 0.00 0.00 175.02 175.45 1hfj s THR 66 N -1.23 1.29 0.31 10.11 -4.23 -1.26 -5.04 115.64 115.58 1hfj s THR 66 Ca 0.50 -2.07 0.05 0.00 -1.18 0.00 0.00 61.69 58.99 1hfj s THR 66 Cb -0.35 -2.39 0.30 0.00 1.34 0.00 0.00 72.50 71.40 1hfj s THR 66 CO 0.45 -0.31 1.84 1.23 -0.54 0.00 0.00 174.62 177.28 1hfj h GLY 67 N 2.39 1.53 0.87 3.99 0.00 -1.98 -0.71 103.07 109.16 1hfj h GLY 67 Ca -0.39 -0.37 0.01 0.00 0.00 0.00 0.00 47.33 46.58 1hfj h GLY 67 CO 0.66 0.10 0.02 -0.55 0.00 0.00 0.00 176.54 176.77 1hfj h ASP 68 N 0.86 0.01 -0.32 0.19 3.32 -1.96 0.13 116.42 118.64 1hfj h ASP 68 Ca 0.50 0.02 -0.12 0.00 0.02 0.00 0.00 57.03 57.45 1hfj h ASP 68 Cb 0.64 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.20 1hfj h ASP 68 CO -0.27 0.03 -0.23 0.58 -1.72 0.00 0.00 179.24 177.63 1hfj h VAL 69 N 0.08 1.27 -0.34 -1.35 2.07 -1.81 -2.21 116.25 113.96 1hfj h VAL 69 Ca 0.05 -1.35 -0.10 0.00 0.82 0.00 0.00 66.70 66.12 1hfj h VAL 69 Cb 0.04 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1hfj h VAL 69 CO -0.07 0.45 -0.20 0.58 0.02 0.00 0.00 177.57 178.35 1hfj h VAL 70 N 0.71 1.26 -0.29 2.57 2.07 -0.87 0.25 116.25 121.95 1hfj h VAL 70 Ca 0.10 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 1hfj h VAL 70 Cb 0.75 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1hfj h VAL 70 CO 0.06 0.41 0.06 0.25 0.02 0.00 0.00 177.57 178.38 1hfj h LEU 71 N 0.57 0.45 -0.74 2.57 5.85 -0.56 0.27 115.31 123.73 1hfj h LEU 71 Ca 0.09 -0.24 -0.09 0.00 0.84 0.00 0.00 57.88 58.48 1hfj h LEU 71 Cb 0.66 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 1hfj h LEU 71 CO 0.05 0.58 0.02 0.11 -0.34 0.00 0.00 178.44 178.86 1hfj h LYS 72 N 0.31 0.99 -0.57 1.25 1.57 -1.22 -2.09 116.57 116.80 1hfj h LYS 72 Ca 0.09 -0.29 0.01 0.00 -1.87 0.00 0.00 60.65 58.59 1hfj h LYS 72 Cb 0.31 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.48 1hfj h LYS 72 CO 0.00 0.96 0.38 1.25 -0.57 0.00 0.00 179.45 181.47 1hfj h LEU 73 N 0.91 0.66 -0.86 2.94 5.85 -0.66 0.70 115.31 124.84 1hfj h LEU 73 Ca 0.17 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.89 1hfj h LEU 73 Cb 0.50 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 1hfj h LEU 73 CO 0.02 0.47 0.57 -1.28 -0.34 0.00 0.00 178.44 177.89 1hfj h SER 74 N 0.78 0.98 -0.22 1.25 0.87 -0.59 -1.70 113.55 114.91 1hfj h SER 74 Ca 0.21 -0.02 -0.17 0.00 -1.23 0.00 0.00 61.79 60.58 1hfj h SER 74 Cb -0.09 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 61.62 1hfj h SER 74 CO -0.05 0.71 -0.50 1.56 -0.53 0.00 0.00 176.83 178.02 1hfj h GLN 75 N 1.16 0.80 -0.71 2.24 4.20 -0.88 -2.38 115.11 119.54 1hfj h GLN 75 Ca 0.32 -0.48 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1hfj h GLN 75 Cb -0.12 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 1hfj h GLN 75 CO -0.07 1.11 0.41 -0.09 -0.67 0.00 0.00 178.83 179.52 1hfj h ARG 76 N 0.63 0.98 -0.17 1.46 9.65 -0.57 -1.89 114.38 124.47 1hfj h ARG 76 Ca 0.03 -0.10 -0.10 0.00 -1.10 0.00 0.00 59.98 58.70 1hfj h ARG 76 Cb 1.09 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 29.45 1hfj h ARG 76 CO 0.11 0.71 -0.35 0.28 2.80 0.00 0.00 179.97 183.52 1hfj h VAL 77 N 0.97 1.29 -0.45 0.20 2.07 -1.24 -2.21 116.25 116.89 1hfj h VAL 77 Ca 0.25 -1.42 -0.11 0.00 0.82 0.00 0.00 66.70 66.24 1hfj h VAL 77 Cb -0.00 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1hfj h VAL 77 CO -0.04 0.44 -0.17 0.78 0.02 0.00 0.00 177.57 178.59 1hfj h ASN 78 N 0.31 0.87 0.30 0.57 2.35 -1.06 -1.31 115.58 117.61 1hfj h ASN 78 Ca 0.04 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 1hfj h ASN 78 Cb 0.77 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.90 1hfj h ASN 78 CO 0.06 1.03 -0.14 -0.33 -1.65 0.00 0.00 177.43 176.40 1hfj h GLU 79 N 0.76 -0.38 -0.71 0.81 5.08 -1.09 -2.59 114.58 116.45 1hfj h GLU 79 Ca 0.11 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 1hfj h GLU 79 Cb 0.70 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 1hfj h GLU 79 CO 0.05 -0.21 0.47 -0.07 -1.00 0.00 0.00 179.01 178.25 1hfj h LEU 80 N -0.47 0.80 -1.31 1.33 3.38 -1.35 -2.40 115.31 115.29 1hfj h LEU 80 Ca -0.04 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1hfj h LEU 80 Cb 0.35 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1hfj h LEU 80 CO 0.07 0.57 0.00 -0.07 0.09 0.00 0.00 178.44 179.10 1hfj h LEU 81 N 0.94 0.00 -0.51 1.67 4.07 -1.21 -2.63 115.31 117.64 1hfj h LEU 81 Ca 0.27 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 58.21 1hfj h LEU 81 Cb -0.08 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.66 1hfj h LEU 81 CO -0.07 0.00 -0.07 0.00 -1.08 0.00 0.00 178.44 177.22 1hfj h ALA 82 N 2.09 0.97 -2.28 1.53 0.00 -1.01 -3.45 119.26 117.10 1hfj h ALA 82 Ca 0.00 -0.07 -0.49 0.00 0.00 0.00 0.00 54.91 54.35 1hfj h ALA 82 Cb 0.42 -0.01 0.04 0.00 0.00 0.00 0.00 17.79 18.24 1hfj h ALA 82 CO 0.00 0.09 0.39 1.03 0.00 0.00 0.00 179.25 180.76 1hfj s ARG 83 N -3.35 3.66 0.29 0.00 0.52 -0.99 -4.98 118.95 114.09 1hfj s ARG 83 Ca 0.04 0.95 0.23 0.00 -0.52 0.00 0.00 55.73 56.44 1hfj s ARG 83 Cb 0.07 -2.09 0.29 0.00 0.52 0.00 0.00 34.95 33.74 1hfj s ARG 83 CO 0.64 -0.52 1.41 -0.44 0.02 0.00 0.00 175.30 176.41 1hfj h ASP 84 N 0.38 0.00 -0.44 0.23 3.32 -1.87 -3.30 116.42 114.73 1hfj h ASP 84 Ca -0.46 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1hfj h ASP 84 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1hfj h ASP 84 CO 0.60 0.02 0.00 -0.90 -1.72 0.00 0.00 179.24 177.24 1hfj n ASP 85 N -2.71 4.12 -3.88 6.45 5.75 -1.26 -4.78 116.55 120.24 1hfj n ASP 85 Ca 0.03 -2.54 -0.27 0.00 -0.01 0.00 0.00 54.79 52.00 1hfj n ASP 85 Cb 0.51 -0.58 -0.17 0.00 -1.03 0.00 0.00 41.12 39.85 1hfj n ASP 85 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1hfj s VAL 86 N -2.08 0.96 -0.08 2.12 1.01 -1.25 -4.70 120.40 116.38 1hfj s VAL 86 Ca 0.39 -0.40 0.21 0.00 0.00 0.00 0.00 61.98 62.18 1hfj s VAL 86 Cb 0.28 -1.09 -0.28 0.00 0.00 0.00 0.00 36.38 35.29 1hfj s VAL 86 CO 0.14 0.23 0.52 0.47 0.00 0.00 0.00 175.10 176.46 1hfj n ASP 87 N 4.94 0.15 -3.66 3.32 8.00 0.36 -4.86 116.55 124.80 1hfj n ASP 87 Ca -0.11 0.06 -0.03 0.00 0.71 0.00 0.00 54.79 55.41 1hfj n ASP 87 Cb 0.49 1.59 -0.01 0.00 -0.02 0.00 0.00 41.12 43.17 1hfj n ASP 87 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1hfj s GLY 88 N -4.63 -0.32 -0.01 0.44 0.00 -1.18 -4.16 107.32 97.46 1hfj s GLY 88 Ca -0.07 0.53 0.02 0.00 0.00 0.00 0.00 44.72 45.20 1hfj s GLY 88 CO 0.88 0.13 -0.07 0.14 0.00 0.00 0.00 173.10 174.18 1hfj s VAL 89 N -3.01 0.59 -0.14 1.40 1.01 -0.46 -2.40 120.40 117.38 1hfj s VAL 89 Ca 0.11 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1hfj s VAL 89 Cb 0.00 -0.50 -0.00 0.00 0.00 0.00 0.00 36.38 35.88 1hfj s VAL 89 CO -0.02 0.17 -0.17 -0.69 0.00 0.00 0.00 175.10 174.39 1hfj s VAL 90 N -0.08 2.51 -0.28 2.92 1.01 -0.35 -0.88 120.40 125.24 1hfj s VAL 90 Ca 0.02 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.12 1hfj s VAL 90 Cb -0.04 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.32 1hfj s VAL 90 CO -0.00 0.53 0.04 -0.63 0.00 0.00 0.00 175.10 175.03 1hfj s ILE 91 N 0.72 3.57 -0.00 2.22 1.01 0.18 -0.90 121.20 128.00 1hfj s ILE 91 Ca -0.08 -0.86 -0.28 0.00 0.00 0.00 0.00 60.65 59.44 1hfj s ILE 91 Cb -0.16 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 1hfj s ILE 91 CO 0.01 0.09 0.89 0.42 0.00 0.00 0.00 174.94 176.35 1hfj s THR 92 N 1.43 4.87 0.15 2.92 -4.23 -0.30 -0.81 115.64 119.66 1hfj s THR 92 Ca 0.01 1.87 -0.08 0.00 -1.18 0.00 0.00 61.69 62.31 1hfj s THR 92 Cb -0.17 -4.23 -0.01 0.00 1.34 0.00 0.00 72.50 69.43 1hfj s THR 92 CO 0.00 0.21 0.25 -2.28 -0.54 0.00 0.00 174.62 172.27 1hfj s HIS 93 N 0.77 0.37 0.78 3.99 5.04 -0.55 -1.69 115.29 124.00 1hfj s HIS 93 Ca 0.47 -0.75 -0.11 0.00 -1.54 0.00 0.00 55.06 53.13 1hfj s HIS 93 Cb -0.20 -0.08 0.06 0.00 0.04 0.00 0.00 32.58 32.40 1hfj s HIS 93 CO 0.25 -0.67 1.09 0.20 -2.34 0.00 0.00 174.74 173.27 1hfj s GLY 94 N -2.95 1.64 0.02 1.59 0.00 -1.26 -4.26 107.32 102.10 1hfj s GLY 94 Ca 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.83 1hfj s GLY 94 CO -0.02 0.35 0.92 -0.91 0.00 0.00 0.00 173.10 173.44 1hfj h THR 95 N -1.08 1.23 -0.86 0.90 1.35 -1.95 -3.25 112.91 109.26 1hfj h THR 95 Ca -0.46 -2.91 0.13 0.00 -0.55 0.00 0.00 66.41 62.61 1hfj h THR 95 Cb 1.25 2.74 -0.09 0.00 -1.73 0.00 0.00 68.15 70.32 1hfj h THR 95 CO 0.57 0.81 0.47 0.44 -0.25 0.00 0.00 175.52 177.55 1hfj h ASP 96 N 0.05 0.62 0.00 5.36 3.32 -1.94 -3.10 116.42 120.73 1hfj h ASP 96 Ca -0.20 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1hfj h ASP 96 Cb 1.97 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 41.44 1hfj h ASP 96 CO 0.15 0.30 -0.34 0.35 -1.72 0.00 0.00 179.24 177.97 1hfj n THR 97 N -4.81 1.48 0.11 0.35 -2.24 -1.26 -4.76 114.28 103.14 1hfj n THR 97 Ca 0.16 -2.06 0.04 0.00 -2.27 0.00 0.00 64.05 59.92 1hfj n THR 97 Cb 0.38 0.01 0.46 0.00 -2.10 0.00 0.00 70.33 69.09 1hfj n THR 97 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1hfj h VAL 98 N 2.18 1.11 -0.04 2.28 3.04 -1.57 -1.73 116.25 121.52 1hfj h VAL 98 Ca -0.03 -0.39 -0.06 0.00 -1.01 0.00 0.00 66.70 65.22 1hfj h VAL 98 Cb 1.16 0.90 -0.01 0.00 -2.01 0.00 0.00 31.29 31.33 1hfj h VAL 98 CO 0.01 0.14 -0.23 1.05 -1.01 0.00 0.00 177.57 177.52 1hfj h GLU 99 N 0.30 0.07 0.01 4.17 4.11 -1.86 0.11 114.58 121.49 1hfj h GLU 99 Ca 0.07 -0.02 -0.05 0.00 0.07 0.00 0.00 59.36 59.44 1hfj h GLU 99 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1hfj h GLU 99 CO -0.00 0.30 -0.19 0.93 0.07 0.00 0.00 179.01 180.12 1hfj h GLU 100 N 0.07 0.11 -0.49 1.06 5.08 -1.66 -2.69 114.58 116.05 1hfj h GLU 100 Ca 0.01 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.15 1hfj h GLU 100 Cb 0.45 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1hfj h GLU 100 CO 0.03 0.93 -0.03 0.77 -1.00 0.00 0.00 179.01 179.72 1hfj h SER 101 N -0.65 0.87 -0.37 1.42 0.02 -1.37 -2.06 113.55 111.42 1hfj h SER 101 Ca -0.03 -0.32 -0.06 0.00 -0.84 0.00 0.00 61.79 60.54 1hfj h SER 101 Cb 1.01 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 1hfj h SER 101 CO 0.04 0.98 0.03 0.00 -1.14 0.00 0.00 176.83 176.74 1hfj h ALA 102 N 0.92 1.21 -0.02 3.77 0.00 -0.89 -2.24 119.26 122.01 1hfj h ALA 102 Ca 0.14 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 1hfj h ALA 102 Cb 0.55 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1hfj h ALA 102 CO 0.03 0.52 -0.79 -0.92 0.00 0.00 0.00 179.25 178.09 1hfj h TYR 103 N 0.68 0.30 -0.09 0.00 3.20 -1.36 -1.79 116.97 117.91 1hfj h TYR 103 Ca 0.14 -0.15 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1hfj h TYR 103 Cb 0.37 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 1hfj h TYR 103 CO 0.02 0.92 0.04 0.35 -1.64 0.00 0.00 178.16 177.85 1hfj h PHE 104 N 0.13 0.13 0.00 -3.82 3.04 -1.08 -2.52 116.94 112.82 1hfj h PHE 104 Ca -0.03 -0.01 -0.07 0.00 3.98 0.00 0.00 57.97 61.84 1hfj h PHE 104 Cb 1.38 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.84 1hfj h PHE 104 CO 0.03 0.20 -0.32 -0.07 -2.02 0.00 0.00 178.31 176.13 1hfj h LEU 105 N 0.02 0.00 -1.66 0.59 4.07 -1.41 -2.24 115.31 114.68 1hfj h LEU 105 Ca 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 1hfj h LEU 105 Cb 0.12 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.85 1hfj h LEU 105 CO -0.00 0.32 0.08 -0.74 -1.08 0.00 0.00 178.44 177.02 1hfj h HIS 106 N 0.00 0.30 0.00 1.13 2.76 -0.96 -1.26 115.15 117.12 1hfj h HIS 106 Ca -0.00 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1hfj h HIS 106 Cb 0.73 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.59 1hfj h HIS 106 CO 0.00 0.25 -1.26 1.28 -1.30 0.00 0.00 177.93 176.89 1hfj n LEU 107 N -4.44 0.54 -0.01 0.26 4.77 -0.98 -0.75 117.00 116.39 1hfj n LEU 107 Ca 0.00 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1hfj n LEU 107 Cb 0.13 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.15 1hfj n LEU 107 CO 0.36 -0.03 0.10 0.35 -1.33 0.00 0.00 177.39 176.83 1hfj n THR 108 N -2.23 0.00 -2.91 -5.08 -2.24 -0.88 -4.38 114.28 96.55 1hfj n THR 108 Ca -0.00 -0.49 -0.41 0.00 -2.27 0.00 0.00 64.05 60.87 1hfj n THR 108 Cb 0.50 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.69 1hfj n THR 108 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1hfj s VAL 109 N -0.66 4.88 -1.12 2.28 1.01 -0.51 -4.70 120.40 121.58 1hfj s VAL 109 Ca 0.00 1.56 -0.03 0.00 0.00 0.00 0.00 61.98 63.52 1hfj s VAL 109 Cb 0.00 -4.11 0.27 0.00 0.00 0.00 0.00 36.38 32.54 1hfj s VAL 109 CO 0.01 0.00 1.89 0.29 0.00 0.00 0.00 175.10 177.30 1hfj n LYS 110 N 5.48 5.00 -3.57 2.72 4.76 -1.26 -3.73 118.16 127.56 1hfj n LYS 110 Ca 0.04 -4.33 -0.13 0.00 -2.87 0.00 0.00 58.31 51.03 1hfj n LYS 110 Cb 0.48 -2.54 -0.05 0.00 -1.84 0.00 0.00 35.03 31.09 1hfj n LYS 110 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1hfj s SER 111 N -0.93 -0.41 0.03 4.39 0.15 -1.26 -4.85 113.70 110.82 1hfj s SER 111 Ca 0.41 0.06 0.23 0.00 0.70 0.00 0.00 55.95 57.35 1hfj s SER 111 Cb 0.16 0.50 0.21 0.00 -1.71 0.00 0.00 66.02 65.17 1hfj s SER 111 CO -0.07 -0.77 1.18 0.47 1.20 0.00 0.00 173.24 175.25 1hfj n ASP 112 N 0.20 0.64 -4.77 5.45 9.92 -1.26 -4.40 116.55 122.34 1hfj n ASP 112 Ca -0.18 -0.34 -0.40 0.00 -0.53 0.00 0.00 54.79 53.35 1hfj n ASP 112 Cb 0.61 0.56 0.01 0.00 -0.64 0.00 0.00 41.12 41.66 1hfj n ASP 112 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1hfj s LYS 113 N -3.08 3.84 0.21 -1.24 1.02 -1.26 -0.66 119.74 118.56 1hfj s LYS 113 Ca 0.08 2.29 -0.32 0.00 0.02 0.00 0.00 55.97 58.04 1hfj s LYS 113 Cb 0.16 -2.72 -0.12 0.00 -0.52 0.00 0.00 37.83 34.64 1hfj s LYS 113 CO 0.77 -0.65 1.70 -2.14 -0.92 0.00 0.00 175.35 174.11 1hfj s PRO 114 N -2.33 4.14 -0.25 -1.68 0.02 -1.26 -4.84 135.00 128.79 1hfj s PRO 114 Ca 0.59 2.57 0.02 0.00 0.02 0.00 0.00 61.00 64.19 1hfj s PRO 114 Cb -0.41 -3.08 0.07 0.00 0.02 0.00 0.00 34.50 31.09 1hfj s PRO 114 CO 0.53 -0.73 -0.05 0.08 -0.33 0.00 0.00 177.00 176.50 1hfj s VAL 115 N 1.12 1.74 -0.17 3.83 1.01 -1.26 -1.36 120.40 125.31 1hfj s VAL 115 Ca 0.74 -1.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 1hfj s VAL 115 Cb -0.49 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 1hfj s VAL 115 CO 0.32 -0.15 -0.11 -0.69 0.00 0.00 0.00 175.10 174.48 1hfj s VAL 116 N 1.28 2.99 -0.00 2.92 1.01 -0.06 -2.06 120.40 126.47 1hfj s VAL 116 Ca -0.05 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.13 1hfj s VAL 116 Cb -0.19 -2.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.83 1hfj s VAL 116 CO -0.07 0.49 0.44 -0.36 0.00 0.00 0.00 175.10 175.60 1hfj s PHE 117 N 0.94 3.71 0.00 5.22 0.40 0.84 0.52 117.98 129.62 1hfj s PHE 117 Ca -0.02 1.02 0.02 0.00 -0.60 0.00 0.00 56.93 57.35 1hfj s PHE 117 Cb -0.15 -2.36 -0.01 0.00 0.51 0.00 0.00 43.02 41.02 1hfj s PHE 117 CO -0.01 0.57 -0.07 0.54 0.70 0.00 0.00 175.22 176.95 1hfj s VAL 118 N -0.84 0.58 0.13 -0.44 0.11 0.00 -0.86 120.40 119.07 1hfj s VAL 118 Ca 0.25 -0.44 0.02 0.00 -2.93 0.00 0.00 61.98 58.88 1hfj s VAL 118 Cb -0.17 -0.51 -0.01 0.00 -1.53 0.00 0.00 36.38 34.16 1hfj s VAL 118 CO 0.14 0.07 0.12 0.00 -3.33 0.00 0.00 175.10 172.10 1hfj n ALA 119 N 2.65 0.20 -3.40 1.54 0.00 -1.26 -1.49 120.51 118.76 1hfj n ALA 119 Ca -0.15 -0.72 -0.15 0.00 0.00 0.00 0.00 53.44 52.43 1hfj n ALA 119 Cb 0.57 0.59 -0.08 0.00 0.00 0.00 0.00 19.45 20.52 1hfj n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hfj s ALA 120 N -2.43 -1.28 -0.23 0.00 0.00 -1.26 -4.79 121.76 111.77 1hfj s ALA 120 Ca 0.15 1.14 0.22 0.00 0.00 0.00 0.00 51.96 53.47 1hfj s ALA 120 Cb 0.01 -0.41 -0.00 0.00 0.00 0.00 0.00 23.12 22.71 1hfj s ALA 120 CO 0.10 -0.28 1.05 0.52 0.00 0.00 0.00 175.76 177.15 1hfj h MET 121 N 4.38 0.00 -6.38 0.00 2.86 -1.91 -3.37 114.93 110.50 1hfj h MET 121 Ca -0.28 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.68 1hfj h MET 121 Cb 1.17 0.00 -0.18 0.00 0.06 0.00 0.00 31.60 32.64 1hfj h MET 121 CO 0.28 0.03 -0.73 1.03 1.06 0.00 0.00 176.91 178.58 1hfj s ARG 122 N -3.31 2.40 0.84 1.72 0.52 -1.26 -5.04 118.95 114.82 1hfj s ARG 122 Ca -0.00 -0.81 -0.13 0.00 -0.52 0.00 0.00 55.73 54.27 1hfj s ARG 122 Cb 0.09 -2.40 0.09 0.00 0.52 0.00 0.00 34.95 33.25 1hfj s ARG 122 CO 0.79 0.58 1.12 -2.30 0.02 0.00 0.00 175.30 175.51 1hfj n PRO 123 N 1.51 0.00 0.25 3.54 -0.02 -1.26 -4.57 135.00 134.45 1hfj n PRO 123 Ca -0.15 0.08 0.17 0.00 -2.02 0.00 0.00 63.50 61.57 1hfj n PRO 123 Cb 0.52 -2.37 0.76 0.00 -0.02 0.00 0.00 33.50 32.39 1hfj n PRO 123 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hfj h ALA 124 N -1.16 1.00 -0.35 3.55 0.00 -1.35 -2.17 119.26 118.78 1hfj h ALA 124 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1hfj h ALA 124 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1hfj h ALA 124 CO 0.44 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.94 1hfj n THR 125 N -2.82 0.45 -3.12 0.00 -2.24 -1.26 -4.90 114.28 100.40 1hfj n THR 125 Ca -0.00 -0.59 -0.32 0.00 -2.27 0.00 0.00 64.05 60.88 1hfj n THR 125 Cb 0.21 0.58 -0.05 0.00 -2.10 0.00 0.00 70.33 68.97 1hfj n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hfj s ALA 126 N -1.55 3.39 0.12 6.98 0.00 -0.82 -3.96 121.76 125.92 1hfj s ALA 126 Ca 0.35 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 51.89 1hfj s ALA 126 Cb 0.19 -2.67 -0.09 0.00 0.00 0.00 0.00 23.12 20.56 1hfj s ALA 126 CO 0.27 0.26 1.49 0.42 0.00 0.00 0.00 175.76 178.21 1hfj s ILE 127 N -2.07 3.02 -1.07 0.00 1.01 0.18 -2.23 121.20 120.04 1hfj s ILE 127 Ca 0.52 0.69 -0.06 0.00 0.00 0.00 0.00 60.65 61.80 1hfj s ILE 127 Cb -0.10 -3.44 0.01 0.00 0.01 0.00 0.00 42.46 38.93 1hfj s ILE 127 CO 0.23 0.04 0.84 -1.20 0.00 0.00 0.00 174.94 174.85 1hfj n SER 128 N 4.25 -5.35 -4.75 3.58 7.64 -1.26 -4.94 113.62 112.80 1hfj n SER 128 Ca 0.13 -0.38 -0.41 0.00 1.01 0.00 0.00 58.87 59.21 1hfj n SER 128 Cb 0.41 -3.99 -0.02 0.00 -1.01 0.00 0.00 64.21 59.60 1hfj n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hfj s ALA 129 N -3.21 3.68 -0.50 -0.43 0.00 -0.95 -4.90 121.76 115.46 1hfj s ALA 129 Ca 0.42 1.44 0.24 0.00 0.00 0.00 0.00 51.96 54.05 1hfj s ALA 129 Cb -0.18 -3.60 0.35 0.00 0.00 0.00 0.00 23.12 19.68 1hfj s ALA 129 CO 0.52 -0.85 1.42 0.38 0.00 0.00 0.00 175.76 177.23 1hfj h ASP 130 N 4.97 0.00 -0.38 0.00 2.03 -1.87 -3.39 116.42 117.78 1hfj h ASP 130 Ca -0.46 -0.06 0.08 0.00 -0.73 0.00 0.00 57.03 55.86 1hfj h ASP 130 Cb 1.22 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 39.64 1hfj h ASP 130 CO 0.79 0.03 -0.18 1.23 -1.03 0.00 0.00 179.24 180.08 1hfj h GLY 131 N 4.24 0.11 0.35 7.15 0.00 -1.86 -2.35 103.07 110.70 1hfj h GLY 131 Ca 0.00 0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.59 1hfj h GLY 131 CO 0.00 -0.19 -0.29 -2.55 0.00 0.00 0.00 176.54 173.51 1hfj h PRO 132 N -0.11 -0.41 -0.22 4.80 0.11 -1.95 -1.12 132.00 133.10 1hfj h PRO 132 Ca 0.19 0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 1hfj h PRO 132 Cb 0.40 0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 1hfj h PRO 132 CO -0.45 -0.28 -0.09 1.98 -0.21 0.00 0.00 178.00 178.95 1hfj h MET 133 N -0.43 0.35 -0.38 1.05 1.85 -1.83 -1.69 114.93 113.84 1hfj h MET 133 Ca 0.06 -0.08 -0.03 0.00 -0.61 0.00 0.00 59.70 59.04 1hfj h MET 133 Cb 0.52 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.49 1hfj h MET 133 CO -0.25 0.45 0.12 -0.91 -0.40 0.00 0.00 176.91 175.92 1hfj h ASN 134 N 0.33 0.56 -0.55 1.39 2.35 -0.95 -1.26 115.58 117.45 1hfj h ASN 134 Ca 0.07 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.56 1hfj h ASN 134 Cb 0.38 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 1hfj h ASN 134 CO 0.02 0.61 0.14 0.25 -1.65 0.00 0.00 177.43 176.80 1hfj h LEU 135 N 0.47 0.83 -0.22 1.61 5.85 -0.91 0.28 115.31 123.22 1hfj h LEU 135 Ca 0.12 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.62 1hfj h LEU 135 Cb 0.25 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1hfj h LEU 135 CO -0.00 0.84 0.13 0.25 -0.34 0.00 0.00 178.44 179.31 1hfj h LEU 136 N 0.77 0.20 -1.13 2.25 5.85 -1.18 -1.66 115.31 120.43 1hfj h LEU 136 Ca 0.17 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.84 1hfj h LEU 136 Cb 0.34 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1hfj h LEU 136 CO 0.00 0.15 0.01 -0.33 -0.34 0.00 0.00 178.44 177.94 1hfj h GLU 137 N 0.26 0.62 -0.05 1.25 5.08 -1.00 -1.97 114.58 118.78 1hfj h GLU 137 Ca 0.08 -0.14 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1hfj h GLU 137 Cb -0.00 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 1hfj h GLU 137 CO -0.04 0.64 0.03 0.00 -1.00 0.00 0.00 179.01 178.63 1hfj h ALA 138 N 1.42 0.07 -0.72 3.43 0.00 -0.49 -1.15 119.26 121.83 1hfj h ALA 138 Ca 0.13 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1hfj h ALA 138 Cb 0.36 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1hfj h ALA 138 CO 0.01 -0.39 0.33 0.28 0.00 0.00 0.00 179.25 179.49 1hfj h VAL 139 N -0.01 1.24 -0.51 0.00 2.07 -1.18 -0.30 116.25 117.56 1hfj h VAL 139 Ca 0.02 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 66.87 1hfj h VAL 139 Cb 0.09 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.18 1hfj h VAL 139 CO -0.00 0.28 0.32 -0.09 0.02 0.00 0.00 177.57 178.10 1hfj h ARG 140 N 1.01 0.62 -0.51 1.57 2.43 -1.15 -0.74 114.38 117.61 1hfj h ARG 140 Ca 0.25 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 59.31 1hfj h ARG 140 Cb 0.14 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 1hfj h ARG 140 CO -0.03 0.41 0.04 0.28 -1.51 0.00 0.00 179.97 179.16 1hfj h VAL 141 N 0.64 1.26 -0.46 0.20 2.07 -0.81 -2.71 116.25 116.44 1hfj h VAL 141 Ca 0.20 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.67 1hfj h VAL 141 Cb -0.02 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1hfj h VAL 141 CO -0.07 0.36 0.18 0.00 0.02 0.00 0.00 177.57 178.06 1hfj h ALA 142 N 0.96 1.44 -0.01 1.67 0.00 -0.72 -2.87 119.26 119.73 1hfj h ALA 142 Ca 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1hfj h ALA 142 Cb 0.47 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1hfj h ALA 142 CO 0.02 0.42 -0.21 0.41 0.00 0.00 0.00 179.25 179.89 1hfj n GLY 143 N -1.12 -0.68 3.72 0.00 0.00 -0.31 -4.57 105.19 102.23 1hfj n GLY 143 Ca 0.03 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 1hfj n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hfj s ASP 144 N -2.48 7.06 0.38 1.61 -1.08 -1.03 -4.87 116.67 116.26 1hfj s ASP 144 Ca 0.26 1.27 0.28 0.00 -0.52 0.00 0.00 52.55 53.84 1hfj s ASP 144 Cb 0.19 -2.43 1.19 0.00 -1.46 0.00 0.00 42.92 40.41 1hfj s ASP 144 CO 0.50 -0.10 1.83 0.07 0.52 0.00 0.00 175.17 178.00 1hfj h LYS 145 N 6.53 0.00 0.00 4.34 5.09 -1.89 -2.27 116.57 128.37 1hfj h LYS 145 Ca -0.42 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.31 1hfj h LYS 145 Cb 1.20 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.53 1hfj h LYS 145 CO 0.74 0.00 -0.07 1.96 -2.09 0.00 0.00 179.45 180.00 1hfj h GLN 146 N 0.00 0.00 0.00 0.07 4.20 -1.93 -3.04 115.11 114.41 1hfj h GLN 146 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1hfj h GLN 146 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1hfj h GLN 146 CO 0.00 0.07 0.00 0.43 -0.67 0.00 0.00 178.83 178.66 1hfj n SER 147 N -3.26 0.00 -4.77 1.46 7.64 -0.85 -4.90 113.62 108.93 1hfj n SER 147 Ca -0.01 0.01 -0.38 0.00 1.01 0.00 0.00 58.87 59.50 1hfj n SER 147 Cb 0.28 -0.32 -0.01 0.00 -1.01 0.00 0.00 64.21 63.14 1hfj n SER 147 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hfj s ARG 148 N -2.65 3.86 -1.18 1.43 0.52 -1.15 -3.61 118.95 116.16 1hfj s ARG 148 Ca 0.24 1.82 0.00 0.00 -0.52 0.00 0.00 55.73 57.27 1hfj s ARG 148 Cb 0.18 -2.52 0.00 0.00 0.52 0.00 0.00 34.95 33.14 1hfj s ARG 148 CO 0.43 -0.48 0.00 0.41 0.02 0.00 0.00 175.30 175.68 1hfj n GLY 149 N 0.52 1.04 0.98 -3.53 0.00 0.16 -4.91 105.19 99.45 1hfj n GLY 149 Ca 0.06 -0.48 0.10 0.00 0.00 0.00 0.00 46.02 45.70 1hfj n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hfj n ARG 150 N -2.57 2.25 0.00 1.61 1.74 -1.24 -5.07 116.66 113.38 1hfj n ARG 150 Ca -0.12 -2.07 0.00 0.00 -0.77 0.00 0.00 57.85 54.89 1hfj n ARG 150 Cb 0.42 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 1hfj n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hfj n GLY 151 N 1.24 -0.77 3.76 -0.13 0.00 -1.26 -4.83 105.19 103.20 1hfj n GLY 151 Ca 0.16 -1.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 1hfj n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfj s VAL 152 N -1.50 3.07 0.15 1.61 1.01 -1.26 -4.71 120.40 118.77 1hfj s VAL 152 Ca 0.00 1.08 0.10 0.00 0.00 0.00 0.00 61.98 63.16 1hfj s VAL 152 Cb 0.00 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1hfj s VAL 152 CO 0.00 0.26 -0.22 -0.04 0.00 0.00 0.00 175.10 175.10 1hfj s MET 153 N -1.64 1.32 -0.16 2.72 1.00 -0.88 -1.68 119.30 120.00 1hfj s MET 153 Ca 0.47 -1.36 0.01 0.00 0.00 0.00 0.00 55.69 54.81 1hfj s MET 153 Cb -0.36 -1.60 0.01 0.00 0.00 0.00 0.00 34.83 32.88 1hfj s MET 153 CO 0.47 0.35 -0.19 0.08 0.00 0.00 0.00 175.02 175.74 1hfj s VAL 154 N -1.50 2.26 -0.15 -6.03 1.01 -0.27 -0.11 120.40 115.61 1hfj s VAL 154 Ca 0.14 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1hfj s VAL 154 Cb -0.08 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.36 1hfj s VAL 154 CO 0.07 0.53 -0.16 -0.69 0.00 0.00 0.00 175.10 174.85 1hfj s VAL 155 N 0.95 2.61 -0.21 2.92 1.01 -0.04 -1.09 120.40 126.55 1hfj s VAL 155 Ca -0.03 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 1hfj s VAL 155 Cb -0.15 -2.09 0.13 0.00 0.00 0.00 0.00 36.38 34.26 1hfj s VAL 155 CO -0.04 0.52 1.02 -0.51 0.00 0.00 0.00 175.10 176.09 1hfj s ILE 156 N 0.78 0.00 -1.36 2.22 2.07 -0.96 -4.07 121.20 119.87 1hfj s ILE 156 Ca -0.06 0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.16 1hfj s ILE 156 Cb -0.15 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.44 1hfj s ILE 156 CO 0.00 0.00 0.52 -3.20 -1.91 0.00 0.00 174.94 170.35 1hfj n ASN 157 N 1.35 -0.86 0.00 4.50 4.05 -1.26 -1.65 115.26 121.38 1hfj n ASN 157 Ca -0.11 -0.96 0.00 0.00 0.45 0.00 0.00 54.58 53.96 1hfj n ASN 157 Cb 0.57 -3.36 0.00 0.00 1.23 0.00 0.00 39.78 38.22 1hfj n ASN 157 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1hfj n ASP 158 N -2.99 -3.78 -4.54 1.20 8.00 -1.26 -4.97 116.55 108.21 1hfj n ASP 158 Ca -0.30 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 54.91 1hfj n ASP 158 Cb 0.68 -2.91 -0.11 0.00 -0.02 0.00 0.00 41.12 38.77 1hfj n ASP 158 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hfj s ARG 159 N -1.51 2.04 -0.28 -1.24 1.81 -0.66 -0.59 118.95 118.51 1hfj s ARG 159 Ca 0.00 -1.06 -0.00 0.00 -1.72 0.00 0.00 55.73 52.95 1hfj s ARG 159 Cb 0.00 -2.25 0.05 0.00 -0.45 0.00 0.00 34.95 32.30 1hfj s ARG 159 CO 0.00 0.51 -0.04 0.42 -0.68 0.00 0.00 175.30 175.50 1hfj s ILE 160 N -1.16 2.74 0.10 1.52 1.01 0.21 -2.27 121.20 123.36 1hfj s ILE 160 Ca 0.20 -1.38 0.07 0.00 0.00 0.00 0.00 60.65 59.53 1hfj s ILE 160 Cb -0.11 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 1hfj s ILE 160 CO 0.12 -0.03 -0.10 -0.83 0.00 0.00 0.00 174.94 174.10 1hfj s GLY 161 N 1.23 1.80 0.23 6.18 0.00 -0.25 -0.23 107.32 116.27 1hfj s GLY 161 Ca -0.05 -1.24 -0.30 0.00 0.00 0.00 0.00 44.72 43.13 1hfj s GLY 161 CO -0.03 -1.22 1.04 -0.45 0.00 0.00 0.00 173.10 172.45 1hfj s SER 162 N -2.20 7.40 0.57 1.64 0.15 -1.26 -1.11 113.70 118.89 1hfj s SER 162 Ca 0.21 2.10 0.27 0.00 0.70 0.00 0.00 55.95 59.23 1hfj s SER 162 Cb -0.11 -2.61 1.63 0.00 -1.71 0.00 0.00 66.02 63.22 1hfj s SER 162 CO 0.14 -0.06 2.16 0.00 1.20 0.00 0.00 173.24 176.67 1hfj h ALA 163 N 4.33 1.79 -0.01 5.45 0.00 -1.65 0.07 119.26 129.24 1hfj h ALA 163 Ca -0.45 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.28 1hfj h ALA 163 Cb 1.21 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1hfj h ALA 163 CO 0.69 -0.17 -0.79 -0.09 0.00 0.00 0.00 179.25 178.89 1hfj h ARG 164 N 0.00 0.13 0.00 0.00 9.65 -1.91 -3.39 114.38 118.86 1hfj h ARG 164 Ca 0.05 -0.13 -0.23 0.00 -1.10 0.00 0.00 59.98 58.57 1hfj h ARG 164 Cb 0.27 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 28.84 1hfj h ARG 164 CO -0.00 0.85 -1.89 0.66 2.80 0.00 0.00 179.97 182.40 1hfj n TYR 165 N -3.69 0.00 -1.97 2.20 4.01 -0.85 -4.97 117.16 111.90 1hfj n TYR 165 Ca -0.02 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.33 1hfj n TYR 165 Cb 0.75 -0.62 0.01 0.00 -0.31 0.00 0.00 39.34 39.17 1hfj n TYR 165 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 1hfj s ILE 166 N -2.31 2.45 0.11 -0.72 1.10 -0.05 -4.61 121.20 117.17 1hfj s ILE 166 Ca -0.12 0.37 -0.19 0.00 -0.51 0.00 0.00 60.65 60.21 1hfj s ILE 166 Cb 0.04 -3.21 0.05 0.00 0.15 0.00 0.00 42.46 39.49 1hfj s ILE 166 CO 0.46 0.03 0.46 0.28 -2.11 0.00 0.00 174.94 174.07 1hfj s THR 167 N -1.31 0.05 -0.49 4.00 -1.32 -1.10 -4.88 115.64 110.58 1hfj s THR 167 Ca 0.63 -0.39 -0.24 0.00 -1.21 0.00 0.00 61.69 60.48 1hfj s THR 167 Cb -0.38 -1.08 0.03 0.00 -1.51 0.00 0.00 72.50 69.56 1hfj s THR 167 CO 0.47 -0.21 0.88 -0.75 -2.21 0.00 0.00 174.62 172.80 1hfj s LYS 168 N -3.47 3.41 0.02 7.08 2.20 -1.26 -2.36 119.74 125.35 1hfj s LYS 168 Ca 0.01 -0.10 0.23 0.00 -0.36 0.00 0.00 55.97 55.74 1hfj s LYS 168 Cb 0.01 -3.98 0.07 0.00 -1.51 0.00 0.00 37.83 32.42 1hfj s LYS 168 CO -0.10 -1.28 1.07 0.25 -0.36 0.00 0.00 175.35 174.93 1hfj n THR 169 N 6.24 0.06 -4.51 3.43 -2.24 -0.41 -4.90 114.28 111.95 1hfj n THR 169 Ca 0.03 -0.11 -0.22 0.00 -2.27 0.00 0.00 64.05 61.48 1hfj n THR 169 Cb 0.48 0.47 -0.16 0.00 -2.10 0.00 0.00 70.33 69.02 1hfj n THR 169 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1hfj s ASN 170 N -3.40 1.46 0.46 3.42 3.84 -1.25 -5.03 114.94 114.44 1hfj s ASN 170 Ca 0.07 -0.23 0.16 0.00 0.21 0.00 0.00 52.86 53.07 1hfj s ASN 170 Cb 0.16 -0.39 1.12 0.00 -0.55 0.00 0.00 41.25 41.58 1hfj s ASN 170 CO 0.80 0.09 1.99 0.00 -2.79 0.00 0.00 177.10 177.18 1hfj h ALA 171 N 6.34 2.12 -0.01 1.71 0.00 -1.97 -3.38 119.26 124.08 1hfj h ALA 171 Ca -0.33 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.42 1hfj h ALA 171 Cb 1.17 -0.05 -0.20 0.00 0.00 0.00 0.00 17.79 18.71 1hfj h ALA 171 CO 0.48 -0.26 -0.49 -1.13 0.00 0.00 0.00 179.25 177.86 1hfj n SER 172 N -4.46 -0.50 -4.91 0.00 3.41 -1.26 -5.12 113.62 100.78 1hfj n SER 172 Ca 0.10 -2.02 -0.21 0.00 -0.26 0.00 0.00 58.87 56.47 1hfj n SER 172 Cb 0.42 0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1hfj n SER 172 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1hfj s THR 173 N -0.11 4.66 0.27 6.66 -4.23 -1.26 -5.02 115.64 116.62 1hfj s THR 173 Ca 0.09 -1.17 0.05 0.00 -1.18 0.00 0.00 61.69 59.48 1hfj s THR 173 Cb 0.14 -3.58 0.02 0.00 1.34 0.00 0.00 72.50 70.42 1hfj s THR 173 CO -0.05 -0.30 1.66 -0.07 -0.54 0.00 0.00 174.62 175.32 1hfj h LEU 174 N 1.26 0.29 -2.78 4.79 3.38 -1.97 -2.96 115.31 117.32 1hfj h LEU 174 Ca -0.49 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.26 1hfj h LEU 174 Cb 1.24 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.86 1hfj h LEU 174 CO 0.60 0.71 0.11 -0.90 0.09 0.00 0.00 178.44 179.04 1hfj n ASP 175 N -3.99 3.85 -0.28 -0.43 5.75 -1.26 -4.60 116.55 115.59 1hfj n ASP 175 Ca -0.02 -2.70 0.10 0.00 -0.01 0.00 0.00 54.79 52.17 1hfj n ASP 175 Cb 0.51 -0.64 0.35 0.00 -1.03 0.00 0.00 41.12 40.31 1hfj n ASP 175 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1hfj h THR 176 N 2.01 0.87 -3.26 2.12 1.03 -1.84 -3.42 112.91 110.42 1hfj h THR 176 Ca 0.11 -0.26 -0.57 0.00 -0.01 0.00 0.00 66.41 65.67 1hfj h THR 176 Cb 1.63 0.05 -0.06 0.00 -1.07 0.00 0.00 68.15 68.70 1hfj h THR 176 CO 0.41 0.14 0.84 -0.36 -0.01 0.00 0.00 175.52 176.55 1hfj s PHE 177 N -5.73 3.16 0.13 0.00 0.08 -1.26 -1.29 117.98 113.07 1hfj s PHE 177 Ca -0.10 1.23 -0.11 0.00 0.12 0.00 0.00 56.93 58.07 1hfj s PHE 177 Cb 0.22 -3.62 0.00 0.00 -0.57 0.00 0.00 43.02 39.05 1hfj s PHE 177 CO 0.79 -0.76 0.28 1.03 -0.10 0.00 0.00 175.22 176.46 1hfj s ARG 178 N 3.59 1.02 -0.46 0.44 0.52 -1.00 -4.96 118.95 118.11 1hfj s ARG 178 Ca 0.46 -0.98 0.03 0.00 -0.52 0.00 0.00 55.73 54.71 1hfj s ARG 178 Cb -0.13 0.39 0.15 0.00 0.52 0.00 0.00 34.95 35.88 1hfj s ARG 178 CO 0.14 -0.36 0.31 0.00 0.02 0.00 0.00 175.30 175.40 1hfj s ALA 179 N -3.89 2.04 0.23 2.13 0.00 -1.26 -2.73 121.76 118.29 1hfj s ALA 179 Ca 0.09 -2.66 -0.11 0.00 0.00 0.00 0.00 51.96 49.28 1hfj s ALA 179 Cb 0.03 -1.81 0.31 0.00 0.00 0.00 0.00 23.12 21.65 1hfj s ALA 179 CO -0.07 -2.05 1.62 -0.91 0.00 0.00 0.00 175.76 174.34 1hfj h ASN 180 N 6.25 -0.60 0.88 0.00 4.21 -1.91 0.18 115.58 124.58 1hfj h ASN 180 Ca 0.10 0.21 -0.07 0.00 1.21 0.00 0.00 56.30 57.76 1hfj h ASN 180 Cb 0.90 0.42 -0.01 0.00 -1.12 0.00 0.00 38.32 38.51 1hfj h ASN 180 CO 0.46 -0.23 -1.17 -0.62 -1.29 0.00 0.00 177.43 174.58 1hfj n GLU 181 N -5.45 0.61 0.00 0.81 -0.58 -1.26 -4.35 120.64 110.42 1hfj n GLU 181 Ca 0.10 0.16 0.08 0.00 -0.42 0.00 0.00 57.16 57.09 1hfj n GLU 181 Cb 0.38 -1.82 -0.04 0.00 -0.57 0.00 0.00 31.44 29.39 1hfj n GLU 181 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1hfj n GLU 182 N -2.76 1.57 -0.16 3.49 4.71 -1.04 -5.10 120.64 121.35 1hfj n GLU 182 Ca -0.04 -0.48 0.02 0.00 -0.01 0.00 0.00 57.16 56.65 1hfj n GLU 182 Cb 0.66 -1.30 -0.01 0.00 -1.01 0.00 0.00 31.44 29.79 1hfj n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1hfj n GLY 183 N 1.29 -1.09 3.90 0.62 0.00 0.60 -4.86 105.19 105.65 1hfj n GLY 183 Ca 0.05 -1.03 -0.26 0.00 0.00 0.00 0.00 46.02 44.79 1hfj n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hfj s TYR 184 N -0.26 3.37 0.28 1.61 2.02 -1.26 -4.60 117.35 118.52 1hfj s TYR 184 Ca 0.00 0.06 0.04 0.00 -0.37 0.00 0.00 57.07 56.80 1hfj s TYR 184 Cb 0.00 -1.61 0.41 0.00 -0.40 0.00 0.00 41.96 40.36 1hfj s TYR 184 CO 0.00 0.51 1.69 -0.07 -1.57 0.00 0.00 175.55 176.12 1hfj h LEU 185 N 2.15 0.38 -7.82 -1.29 3.38 -0.90 -3.39 115.31 107.81 1hfj h LEU 185 Ca -0.48 -0.15 0.31 0.00 0.09 0.00 0.00 57.88 57.65 1hfj h LEU 185 Cb 1.20 -0.10 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 1hfj h LEU 185 CO 0.66 0.71 0.83 -0.83 0.09 0.00 0.00 178.44 179.90 1hfj s GLY 186 N -4.12 -0.14 0.10 0.83 0.00 -1.07 0.27 107.32 103.19 1hfj s GLY 186 Ca -0.06 0.09 0.04 0.00 0.00 0.00 0.00 44.72 44.79 1hfj s GLY 186 CO 0.78 4.05 -0.10 -1.34 0.00 0.00 0.00 173.10 176.49 1hfj s VAL 187 N -2.13 0.94 -0.35 1.40 -7.23 -0.08 -0.62 120.40 112.33 1hfj s VAL 187 Ca 0.25 -1.69 -0.00 0.00 -1.81 0.00 0.00 61.98 58.73 1hfj s VAL 187 Cb 0.00 -1.41 0.09 0.00 0.56 0.00 0.00 36.38 35.62 1hfj s VAL 187 CO -0.00 -0.59 0.09 -0.63 -0.31 0.00 0.00 175.10 173.65 1hfj s ILE 188 N -2.57 2.87 -0.10 -0.62 1.01 0.24 -0.62 121.20 121.42 1hfj s ILE 188 Ca 0.07 -1.91 0.03 0.00 0.00 0.00 0.00 60.65 58.84 1hfj s ILE 188 Cb -0.02 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.57 1hfj s ILE 188 CO -0.00 -0.46 -0.18 -0.63 0.00 0.00 0.00 174.94 173.67 1hfj s ILE 189 N 1.11 1.65 -1.52 2.92 -1.09 -1.01 -4.75 121.20 118.50 1hfj s ILE 189 Ca 0.04 -0.76 -0.06 0.00 -2.23 0.00 0.00 60.65 57.64 1hfj s ILE 189 Cb -0.21 -1.47 0.01 0.00 -1.58 0.00 0.00 42.46 39.21 1hfj s ILE 189 CO -0.04 0.47 0.76 0.61 -1.23 0.00 0.00 174.94 175.50 1hfj n GLY 190 N 3.86 -0.53 2.42 6.18 0.00 -1.26 -2.51 105.19 113.35 1hfj n GLY 190 Ca -0.20 0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.84 1hfj n GLY 190 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hfj n ASN 191 N -2.66 -4.76 -4.35 1.61 3.02 -1.26 -5.00 115.26 101.87 1hfj n ASN 191 Ca -0.08 0.36 -0.29 0.00 -0.03 0.00 0.00 54.58 54.54 1hfj n ASN 191 Cb 0.61 -3.55 -0.14 0.00 -0.61 0.00 0.00 39.78 36.09 1hfj n ASN 191 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1hfj s ARG 192 N -3.25 1.55 -0.19 3.52 3.52 -1.05 -5.12 118.95 117.93 1hfj s ARG 192 Ca 0.00 -1.19 -0.07 0.00 -0.13 0.00 0.00 55.73 54.34 1hfj s ARG 192 Cb 0.00 -1.85 -0.04 0.00 -1.56 0.00 0.00 34.95 31.50 1hfj s ARG 192 CO 0.00 0.46 0.06 0.42 -0.81 0.00 0.00 175.30 175.43 1hfj s ILE 193 N -0.93 4.74 -0.34 4.11 1.01 -1.26 -2.42 121.20 126.12 1hfj s ILE 193 Ca 0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.71 1hfj s ILE 193 Cb -0.10 -3.14 0.08 0.00 0.01 0.00 0.00 42.46 39.31 1hfj s ILE 193 CO 0.04 0.45 0.07 -0.31 0.00 0.00 0.00 174.94 175.18 1hfj s TYR 194 N 0.48 3.45 0.04 3.97 1.51 0.21 -4.99 117.35 122.01 1hfj s TYR 194 Ca 0.03 -2.27 -0.21 0.00 -1.01 0.00 0.00 57.07 53.61 1hfj s TYR 194 Cb -0.13 -2.60 -0.06 0.00 -0.11 0.00 0.00 41.96 39.07 1hfj s TYR 194 CO 0.01 -0.89 0.63 0.71 -1.11 0.00 0.00 175.55 174.90 1hfj s TYR 195 N 1.15 3.74 0.00 2.71 2.02 -1.26 -0.90 117.35 124.81 1hfj s TYR 195 Ca 0.02 1.30 0.00 0.00 -0.37 0.00 0.00 57.07 58.02 1hfj s TYR 195 Cb -0.21 -2.64 0.00 0.00 -0.40 0.00 0.00 41.96 38.72 1hfj s TYR 195 CO -0.03 0.40 0.00 0.00 -1.57 0.00 0.00 175.55 174.35 1hfj n GLN 196 N 2.43 2.47 -4.16 -0.62 10.64 0.14 -4.95 117.38 123.33 1hfj n GLN 196 Ca -0.07 0.00 -0.10 0.00 -1.83 0.00 0.00 57.00 55.00 1hfj n GLN 196 Cb 0.51 -0.86 -0.10 0.00 -0.86 0.00 0.00 30.24 28.93 1hfj n GLN 196 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 1hfj s ASN 197 N -2.10 0.98 -0.07 2.61 0.01 -0.84 -5.04 114.94 110.49 1hfj s ASN 197 Ca 0.00 -1.03 0.01 0.00 -0.71 0.00 0.00 52.86 51.13 1hfj s ASN 197 Cb 0.00 0.13 0.02 0.00 0.41 0.00 0.00 41.25 41.81 1hfj s ASN 197 CO 0.00 -0.51 -0.07 -0.13 -1.51 0.00 0.00 177.10 174.88 1hfj s ARG 198 N -3.87 1.23 0.34 -0.60 0.52 -1.26 -4.75 118.95 110.56 1hfj s ARG 198 Ca 0.12 -0.20 -0.28 0.00 -0.52 0.00 0.00 55.73 54.85 1hfj s ARG 198 Cb 0.06 -1.21 -0.10 0.00 0.52 0.00 0.00 34.95 34.22 1hfj s ARG 198 CO -0.05 -0.13 1.27 0.96 0.02 0.00 0.00 175.30 177.37 1hfj s ILE 199 N 1.18 2.84 -0.71 1.52 -4.36 -1.26 -4.91 121.20 115.50 1hfj s ILE 199 Ca -0.06 0.82 -0.03 0.00 -0.26 0.00 0.00 60.65 61.12 1hfj s ILE 199 Cb -0.14 -3.51 0.19 0.00 1.25 0.00 0.00 42.46 40.25 1hfj s ILE 199 CO -0.02 0.18 2.41 -0.67 0.24 0.00 0.00 174.94 177.08 1hfj n ASP 200 N 0.68 7.05 -4.22 4.36 2.03 -1.26 -4.91 116.55 120.28 1hfj n ASP 200 Ca 0.01 -3.46 -0.12 0.00 0.52 0.00 0.00 54.79 51.73 1hfj n ASP 200 Cb 0.43 -1.18 -0.10 0.00 -0.72 0.00 0.00 41.12 39.55 1hfj n ASP 200 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1hfj s LYS 201 N -2.71 1.05 0.33 -0.67 -0.14 -1.26 -5.04 119.74 111.31 1hfj s LYS 201 Ca 0.55 -1.50 -0.19 0.00 -1.36 0.00 0.00 55.97 53.46 1hfj s LYS 201 Cb 0.38 -0.14 -0.10 0.00 -1.68 0.00 0.00 37.83 36.29 1hfj s LYS 201 CO -0.28 -0.16 0.82 -0.51 -0.76 0.00 0.00 175.35 174.47 1hfj s LEU 202 N -3.14 4.13 0.13 3.17 1.43 -0.23 -5.02 118.68 119.14 1hfj s LEU 202 Ca 0.23 1.51 -0.25 0.00 -1.03 0.00 0.00 54.13 54.59 1hfj s LEU 202 Cb 0.06 -4.09 0.08 0.00 0.03 0.00 0.00 46.19 42.27 1hfj s LEU 202 CO 0.03 -0.18 1.06 -1.38 0.23 0.00 0.00 176.35 176.12 1hfj s HIS 203 N -1.88 -0.03 0.00 0.29 -3.43 -1.26 -4.67 115.29 104.30 1hfj s HIS 203 Ca 0.53 -0.26 0.00 0.00 -0.80 0.00 0.00 55.06 54.53 1hfj s HIS 203 Cb -0.13 0.64 0.00 0.00 -1.43 0.00 0.00 32.58 31.67 1hfj s HIS 203 CO 0.18 -0.74 0.00 0.25 -2.00 0.00 0.00 174.74 172.43 1hfj n THR 204 N -0.58 0.00 0.28 -5.38 -2.24 0.07 -0.50 114.28 105.92 1hfj n THR 204 Ca -0.05 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.80 1hfj n THR 204 Cb 0.60 0.00 0.30 0.00 -2.10 0.00 0.00 70.33 69.13 1hfj n THR 204 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1hfj n THR 205 N 0.00 1.27 -1.02 4.28 -2.24 -1.24 -1.91 114.28 113.41 1hfj n THR 205 Ca 0.00 0.40 0.09 0.00 -2.27 0.00 0.00 64.05 62.27 1hfj n THR 205 Cb 0.00 -1.30 0.22 0.00 -2.10 0.00 0.00 70.33 67.15 1hfj n THR 205 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hfj n ARG 206 N -1.77 2.38 -3.75 -0.78 5.12 0.35 -5.00 116.66 113.21 1hfj n ARG 206 Ca 0.01 -2.76 -0.31 0.00 -1.93 0.00 0.00 57.85 52.86 1hfj n ARG 206 Cb 0.11 -1.74 -0.04 0.00 -1.16 0.00 0.00 32.46 29.63 1hfj n ARG 206 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1hfj s SER 207 N -2.25 6.44 0.00 0.55 0.15 -0.80 -4.50 113.70 113.29 1hfj s SER 207 Ca 0.39 0.47 0.25 0.00 0.70 0.00 0.00 55.95 57.76 1hfj s SER 207 Cb 0.32 -2.04 0.51 0.00 -1.71 0.00 0.00 66.02 63.10 1hfj s SER 207 CO 0.07 0.08 1.41 1.33 1.20 0.00 0.00 173.24 177.33 1hfj n VAL 208 N 0.07 0.00 -2.89 4.45 0.24 -1.26 -4.91 118.33 114.04 1hfj n VAL 208 Ca -0.03 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.34 61.80 1hfj n VAL 208 Cb 0.52 0.42 -0.04 0.00 -1.47 0.00 0.00 33.84 33.26 1hfj n VAL 208 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1hfj s PHE 209 N -2.80 3.61 -0.08 6.34 0.08 -1.26 -5.04 117.98 118.83 1hfj s PHE 209 Ca 0.16 1.46 0.01 0.00 0.12 0.00 0.00 56.93 58.68 1hfj s PHE 209 Cb 0.18 -2.95 0.02 0.00 -0.57 0.00 0.00 43.02 39.69 1hfj s PHE 209 CO 0.64 0.03 -0.10 0.34 -0.10 0.00 0.00 175.22 176.04 1hfj s ASP 210 N 0.90 1.82 0.02 1.36 -1.08 -1.26 -4.61 116.67 113.83 1hfj s ASP 210 Ca 0.44 -0.28 0.23 0.00 -0.52 0.00 0.00 52.55 52.42 1hfj s ASP 210 Cb -0.19 -0.79 0.01 0.00 -1.46 0.00 0.00 42.92 40.49 1hfj s ASP 210 CO 0.22 -0.03 1.00 1.33 0.52 0.00 0.00 175.17 178.22 1hfj n VAL 211 N 4.25 0.08 -1.75 1.11 0.24 -1.26 -4.80 118.33 116.20 1hfj n VAL 211 Ca -0.19 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.34 61.53 1hfj n VAL 211 Cb 0.51 0.42 -0.03 0.00 -1.47 0.00 0.00 33.84 33.27 1hfj n VAL 211 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1hfj s ARG 212 N -3.14 3.97 0.00 7.34 3.00 -1.26 -1.41 118.95 127.45 1hfj s ARG 212 Ca 0.05 2.38 0.00 0.00 0.00 0.00 0.00 55.73 58.16 1hfj s ARG 212 Cb 0.15 -4.16 0.00 0.00 0.00 0.00 0.00 34.95 30.95 1hfj s ARG 212 CO 0.81 -1.14 0.00 0.41 0.00 0.00 0.00 175.30 175.38 1hfj n GLY 213 N 4.67 2.87 3.84 -3.53 0.00 -1.26 -5.08 105.19 106.70 1hfj n GLY 213 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 1hfj n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hfj s LEU 214 N 0.00 4.11 0.00 0.99 1.43 -0.50 -4.96 118.68 119.75 1hfj s LEU 214 Ca 0.00 1.29 0.00 0.00 -1.03 0.00 0.00 54.13 54.39 1hfj s LEU 214 Cb 0.00 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.22 1hfj s LEU 214 CO 0.00 -0.17 0.02 0.35 0.23 0.00 0.00 176.35 176.78 1hfj n THR 215 N -0.20 0.00 -3.55 5.49 -2.24 -1.26 -5.04 114.28 107.48 1hfj n THR 215 Ca 0.03 -0.34 -0.12 0.00 -2.27 0.00 0.00 64.05 61.34 1hfj n THR 215 Cb 0.53 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.74 1hfj n THR 215 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hfj s SER 216 N -0.65 -0.40 0.24 3.42 1.04 -1.26 -5.01 113.70 111.08 1hfj s SER 216 Ca 0.00 -0.09 0.11 0.00 0.48 0.00 0.00 55.95 56.45 1hfj s SER 216 Cb 0.00 0.52 -0.05 0.00 0.10 0.00 0.00 66.02 66.60 1hfj s SER 216 CO 0.00 -0.86 -0.15 -0.76 0.98 0.00 0.00 173.24 172.45 1hfj s LEU 217 N -2.59 2.76 0.75 2.42 1.43 -1.26 -5.12 118.68 117.07 1hfj s LEU 217 Ca 0.00 -0.82 -0.15 0.00 -1.03 0.00 0.00 54.13 52.13 1hfj s LEU 217 Cb 0.00 -1.35 0.05 0.00 0.03 0.00 0.00 46.19 44.92 1hfj s LEU 217 CO -0.10 0.06 1.21 -2.84 0.23 0.00 0.00 176.35 174.91 1hfj s PRO 218 N -3.22 2.04 -0.26 1.29 0.02 -1.26 -4.96 135.00 128.64 1hfj s PRO 218 Ca 0.27 1.77 -0.20 0.00 0.02 0.00 0.00 61.00 62.86 1hfj s PRO 218 Cb -0.07 -1.82 -0.02 0.00 0.02 0.00 0.00 34.50 32.62 1hfj s PRO 218 CO 0.15 -1.92 0.63 0.21 -0.33 0.00 0.00 177.00 175.74 1hfj s LYS 219 N -3.95 4.08 -0.06 5.54 2.20 -1.26 -4.91 119.74 121.39 1hfj s LYS 219 Ca 0.74 0.51 0.02 0.00 -0.36 0.00 0.00 55.97 56.88 1hfj s LYS 219 Cb -0.29 -3.66 0.02 0.00 -1.51 0.00 0.00 37.83 32.38 1hfj s LYS 219 CO 0.46 -0.43 -0.09 0.08 -0.36 0.00 0.00 175.35 175.02 1hfj s VAL 220 N 2.51 0.85 0.31 4.02 1.01 -1.26 0.10 120.40 127.95 1hfj s VAL 220 Ca 0.26 -0.31 0.09 0.00 0.00 0.00 0.00 61.98 62.02 1hfj s VAL 220 Cb -0.15 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 1hfj s VAL 220 CO 0.09 0.29 0.04 -1.81 0.00 0.00 0.00 175.10 173.71 1hfj s ASP 221 N 0.78 4.43 -0.11 3.32 1.01 -1.09 -4.98 116.67 120.04 1hfj s ASP 221 Ca -0.13 -0.82 0.03 0.00 0.71 0.00 0.00 52.55 52.35 1hfj s ASP 221 Cb -0.15 -0.68 0.00 0.00 1.01 0.00 0.00 42.92 43.10 1hfj s ASP 221 CO 0.02 -0.17 -0.23 -0.63 0.21 0.00 0.00 175.17 174.37 1hfj s ILE 222 N -2.43 2.08 0.03 0.77 1.01 -1.26 -0.02 121.20 121.39 1hfj s ILE 222 Ca 0.34 -1.00 0.09 0.00 0.00 0.00 0.00 60.65 60.08 1hfj s ILE 222 Cb -0.03 -1.80 -0.03 0.00 0.01 0.00 0.00 42.46 40.61 1hfj s ILE 222 CO 0.20 0.56 -0.26 -0.76 0.00 0.00 0.00 174.94 174.68 1hfj s LEU 223 N 0.47 2.17 0.20 2.97 1.43 -0.36 -4.97 118.68 120.59 1hfj s LEU 223 Ca -0.15 -0.56 -0.07 0.00 -1.03 0.00 0.00 54.13 52.31 1hfj s LEU 223 Cb -0.17 -1.31 -0.06 0.00 0.03 0.00 0.00 46.19 44.68 1hfj s LEU 223 CO 0.06 0.27 0.48 -0.47 0.23 0.00 0.00 176.35 176.92 1hfj s TYR 224 N -0.77 3.45 -0.13 0.29 5.04 -1.26 -0.17 117.35 123.79 1hfj s TYR 224 Ca 0.12 0.72 -0.01 0.00 -2.44 0.00 0.00 57.07 55.46 1hfj s TYR 224 Cb -0.10 -2.14 -0.02 0.00 0.35 0.00 0.00 41.96 40.05 1hfj s TYR 224 CO 0.02 0.33 -0.11 0.20 -1.34 0.00 0.00 175.55 174.65 1hfj s GLY 225 N -2.46 1.58 0.27 8.97 0.00 -0.64 -4.87 107.32 110.17 1hfj s GLY 225 Ca 0.45 -0.87 -0.20 0.00 0.00 0.00 0.00 44.72 44.09 1hfj s GLY 225 CO 0.23 -0.19 0.84 -2.52 0.00 0.00 0.00 173.10 171.47 1hfj s TYR 226 N 0.30 -0.04 0.34 1.90 1.13 -1.26 -4.37 117.35 115.35 1hfj s TYR 226 Ca -0.08 -0.44 -0.29 0.00 -1.41 0.00 0.00 57.07 54.85 1hfj s TYR 226 Cb -0.15 0.73 -0.11 0.00 -1.10 0.00 0.00 41.96 41.33 1hfj s TYR 226 CO 0.05 -1.20 1.52 -0.65 -2.51 0.00 0.00 175.55 172.76 1hfj s GLN 227 N -3.03 4.12 -1.69 -3.49 -0.21 -1.26 -1.92 119.66 112.18 1hfj s GLN 227 Ca 0.14 2.57 0.00 0.00 0.02 0.00 0.00 55.36 58.09 1hfj s GLN 227 Cb -0.04 -2.99 0.00 0.00 1.00 0.00 0.00 33.01 30.98 1hfj s GLN 227 CO 0.07 -0.56 0.00 -0.25 -2.12 0.00 0.00 175.29 172.43 1hfj n ASP 228 N 1.12 -5.15 -4.73 5.90 8.00 -1.26 -4.94 116.55 115.50 1hfj n ASP 228 Ca 0.04 0.21 -0.42 0.00 0.71 0.00 0.00 54.79 55.33 1hfj n ASP 228 Cb 0.39 -4.21 -0.03 0.00 -0.02 0.00 0.00 41.12 37.25 1hfj n ASP 228 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1hfj s ASP 229 N -2.51 6.51 0.54 -2.24 -4.77 -0.81 -4.95 116.67 108.44 1hfj s ASP 229 Ca 0.00 2.74 -0.19 0.00 -3.30 0.00 0.00 52.55 51.80 1hfj s ASP 229 Cb 0.00 -2.61 -0.06 0.00 -1.09 0.00 0.00 42.92 39.16 1hfj s ASP 229 CO 0.00 -0.85 1.07 -2.16 0.70 0.00 0.00 175.17 173.93 1hfj s PRO 230 N 0.59 3.52 0.03 2.11 0.04 -1.26 -4.63 135.00 135.40 1hfj s PRO 230 Ca 0.68 1.38 0.14 0.00 0.04 0.00 0.00 61.00 63.24 1hfj s PRO 230 Cb -0.45 -2.05 -0.18 0.00 0.04 0.00 0.00 34.50 31.85 1hfj s PRO 230 CO 0.36 -0.67 0.82 1.49 0.04 0.00 0.00 177.00 179.04 1hfj h GLU 231 N 1.11 0.00 -0.01 4.56 4.81 -1.93 -3.36 114.58 119.76 1hfj h GLU 231 Ca -0.49 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1hfj h GLU 231 Cb 1.23 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 1hfj h GLU 231 CO 0.58 0.48 0.02 0.10 -0.73 0.00 0.00 179.01 179.45 1hfj h TYR 232 N 0.00 0.00 0.00 0.92 -0.00 -1.94 -1.10 116.97 114.85 1hfj h TYR 232 Ca -0.20 0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.47 1hfj h TYR 232 Cb 1.81 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.53 1hfj h TYR 232 CO 0.00 0.00 -0.27 -0.07 -0.00 0.00 0.00 178.16 177.82 1hfj h LEU 233 N 0.00 0.00 -0.10 0.10 3.38 -2.00 -0.49 115.31 116.20 1hfj h LEU 233 Ca 0.01 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1hfj h LEU 233 Cb 0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1hfj h LEU 233 CO -0.00 0.27 -0.30 1.88 0.09 0.00 0.00 178.44 180.38 1hfj h TYR 234 N 0.00 0.50 -0.36 1.13 -1.99 -1.45 -2.14 116.97 112.66 1hfj h TYR 234 Ca -0.00 -0.20 0.06 0.00 2.00 0.00 0.00 58.73 60.58 1hfj h TYR 234 Cb 0.61 -0.08 -0.05 0.00 2.00 0.00 0.00 36.73 39.20 1hfj h TYR 234 CO 0.00 0.92 0.05 -0.44 -0.00 0.00 0.00 178.16 178.69 1hfj h ASP 235 N -0.06 -0.03 -0.40 3.88 3.32 -1.42 -1.24 116.42 120.47 1hfj h ASP 235 Ca -0.01 0.06 0.06 0.00 0.02 0.00 0.00 57.03 57.16 1hfj h ASP 235 Cb 0.93 0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.52 1hfj h ASP 235 CO 0.07 0.02 0.10 0.00 -1.72 0.00 0.00 179.24 177.71 1hfj h ALA 236 N 1.28 0.44 -0.21 3.45 0.00 -1.03 -0.31 119.26 122.88 1hfj h ALA 236 Ca 0.17 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1hfj h ALA 236 Cb 0.21 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1hfj h ALA 236 CO -0.24 -0.30 0.10 0.00 0.00 0.00 0.00 179.25 178.81 1hfj h ALA 237 N 1.28 0.27 0.34 0.00 0.00 -0.95 -2.48 119.26 117.72 1hfj h ALA 237 Ca 0.19 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1hfj h ALA 237 Cb 0.21 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1hfj h ALA 237 CO -0.23 -0.16 -0.36 0.82 0.00 0.00 0.00 179.25 179.32 1hfj h ILE 238 N 0.20 0.26 0.00 0.00 2.04 -0.96 -1.27 117.51 117.78 1hfj h ILE 238 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.93 1hfj h ILE 238 Cb 0.13 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1hfj h ILE 238 CO -0.01 0.00 0.09 1.67 0.00 0.00 0.00 178.15 179.90 1hfj n GLN 239 N -5.46 0.03 -0.56 2.37 7.27 -0.15 -0.87 117.38 120.01 1hfj n GLN 239 Ca -0.09 0.48 0.07 0.00 0.07 0.00 0.00 57.00 57.53 1hfj n GLN 239 Cb 0.37 -1.70 0.29 0.00 2.41 0.00 0.00 30.24 31.60 1hfj n GLN 239 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1hfj n HIS 240 N -1.64 1.22 -2.65 3.69 8.25 -0.48 -4.99 115.22 118.62 1hfj n HIS 240 Ca -0.00 -0.88 -0.14 0.00 -0.26 0.00 0.00 57.72 56.43 1hfj n HIS 240 Cb 0.10 -0.37 0.02 0.00 1.12 0.00 0.00 29.99 30.85 1hfj n HIS 240 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hfj n GLY 241 N -0.30 -0.12 3.77 -1.41 0.00 -0.05 -5.01 105.19 102.07 1hfj n GLY 241 Ca 0.24 -0.22 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1hfj n GLY 241 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hfj s VAL 242 N -2.90 3.89 -0.09 1.61 -7.23 -1.18 -4.77 120.40 109.73 1hfj s VAL 242 Ca 0.16 1.70 0.15 0.00 -1.81 0.00 0.00 61.98 62.18 1hfj s VAL 242 Cb -0.07 -4.01 -0.13 0.00 0.56 0.00 0.00 36.38 32.73 1hfj s VAL 242 CO 0.20 0.26 0.93 0.11 -0.31 0.00 0.00 175.10 176.28 1hfj h LYS 243 N 3.43 0.00 -4.00 4.82 1.79 -0.71 -3.45 116.57 118.45 1hfj h LYS 243 Ca -0.47 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 57.90 1hfj h LYS 243 Cb 1.20 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.71 1hfj h LYS 243 CO 0.66 0.42 -0.48 0.20 -1.08 0.00 0.00 179.45 179.17 1hfj s GLY 244 N -4.79 0.33 -0.09 3.86 0.00 -1.10 -1.59 107.32 103.94 1hfj s GLY 244 Ca -0.02 -0.90 -0.01 0.00 0.00 0.00 0.00 44.72 43.79 1hfj s GLY 244 CO 0.80 -1.00 0.00 -0.42 0.00 0.00 0.00 173.10 172.48 1hfj s ILE 245 N -3.91 0.42 -0.22 0.90 1.01 0.27 -2.65 121.20 117.02 1hfj s ILE 245 Ca 0.09 0.03 -0.16 0.00 0.00 0.00 0.00 60.65 60.61 1hfj s ILE 245 Cb 0.06 -0.61 -0.04 0.00 0.01 0.00 0.00 42.46 41.88 1hfj s ILE 245 CO -0.08 0.22 0.42 -0.69 0.00 0.00 0.00 174.94 174.80 1hfj s VAL 246 N 1.95 5.17 -0.35 2.92 1.01 0.97 -0.77 120.40 131.31 1hfj s VAL 246 Ca 0.04 0.72 -0.12 0.00 0.00 0.00 0.00 61.98 62.62 1hfj s VAL 246 Cb -0.13 -3.74 -0.00 0.00 0.00 0.00 0.00 36.38 32.51 1hfj s VAL 246 CO -0.06 0.21 0.23 -0.47 0.00 0.00 0.00 175.10 175.01 1hfj s TYR 247 N 1.55 3.22 -1.27 5.22 5.04 0.17 -1.23 117.35 130.05 1hfj s TYR 247 Ca 0.19 -0.47 -0.14 0.00 -2.44 0.00 0.00 57.07 54.21 1hfj s TYR 247 Cb -0.15 -2.46 0.13 0.00 0.35 0.00 0.00 41.96 39.83 1hfj s TYR 247 CO 0.08 -0.46 1.68 0.00 -1.34 0.00 0.00 175.55 175.51 1hfj n ALA 248 N 5.07 4.23 -1.24 3.97 0.00 0.76 0.04 120.51 133.33 1hfj n ALA 248 Ca -0.12 -4.11 -0.29 0.00 0.00 0.00 0.00 53.44 48.91 1hfj n ALA 248 Cb 0.49 -3.24 0.16 0.00 0.00 0.00 0.00 19.45 16.86 1hfj n ALA 248 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1hfj s GLY 249 N 2.88 1.57 0.28 0.00 0.00 -0.92 -1.63 107.32 109.52 1hfj s GLY 249 Ca 0.46 -0.35 -0.29 0.00 0.00 0.00 0.00 44.72 44.53 1hfj s GLY 249 CO 0.01 0.23 1.04 1.06 0.00 0.00 0.00 173.10 175.44 1hfj s MET 250 N -5.02 4.66 3.09 2.90 -1.94 -1.24 -0.22 119.30 121.54 1hfj s MET 250 Ca 0.65 1.65 0.00 0.00 -1.71 0.00 0.00 55.69 56.28 1hfj s MET 250 Cb -0.18 -3.13 0.00 0.00 2.01 0.00 0.00 34.83 33.53 1hfj s MET 250 CO 0.57 0.28 0.00 0.41 -0.01 0.00 0.00 175.02 176.26 1hfj n GLY 251 N 1.16 2.51 2.59 -0.03 0.00 -1.26 -0.96 105.19 109.20 1hfj n GLY 251 Ca -0.01 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 1hfj n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfj n ALA 252 N 7.96 6.29 -3.38 4.61 0.00 -1.26 -4.53 120.51 130.21 1hfj n ALA 252 Ca 0.00 -3.87 -0.24 0.00 0.00 0.00 0.00 53.44 49.33 1hfj n ALA 252 Cb 0.00 -3.31 0.05 0.00 0.00 0.00 0.00 19.45 16.19 1hfj n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hfj n GLY 253 N 3.45 -0.53 3.77 0.00 0.00 -1.09 -4.80 105.19 106.00 1hfj n GLY 253 Ca 0.59 0.19 -0.38 0.00 0.00 0.00 0.00 46.02 46.42 1hfj n GLY 253 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hfj s SER 254 N -3.02 7.14 0.01 1.61 0.01 -0.13 -4.87 113.70 114.45 1hfj s SER 254 Ca 0.47 2.03 0.08 0.00 1.31 0.00 0.00 55.95 59.84 1hfj s SER 254 Cb -0.21 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.40 1hfj s SER 254 CO 0.58 -0.22 -0.24 -0.69 0.41 0.00 0.00 173.24 173.08 1hfj s VAL 255 N -1.46 1.92 0.75 3.43 1.01 -1.26 -3.59 120.40 121.20 1hfj s VAL 255 Ca 0.50 -1.18 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 1hfj s VAL 255 Cb -0.24 -1.63 0.07 0.00 0.00 0.00 0.00 36.38 34.58 1hfj s VAL 255 CO 0.31 0.41 1.09 -0.94 0.00 0.00 0.00 175.10 175.97 1hfj s SER 256 N -0.90 4.69 0.37 3.32 1.04 -1.26 -4.81 113.70 116.15 1hfj s SER 256 Ca 0.10 0.62 0.07 0.00 0.48 0.00 0.00 55.95 57.22 1hfj s SER 256 Cb -0.09 -1.21 0.78 0.00 0.10 0.00 0.00 66.02 65.60 1hfj s SER 256 CO 0.01 -1.73 1.98 -0.37 0.98 0.00 0.00 173.24 174.10 1hfj h VAL 257 N -0.81 1.03 -0.31 5.02 -1.51 -1.99 0.36 116.25 118.05 1hfj h VAL 257 Ca -0.45 -0.24 -0.10 0.00 -1.23 0.00 0.00 66.70 64.68 1hfj h VAL 257 Cb 1.32 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 30.74 1hfj h VAL 257 CO 0.63 0.13 -0.19 0.03 -1.23 0.00 0.00 177.57 176.94 1hfj h ARG 258 N 0.70 0.67 -0.51 5.19 3.08 -1.92 -2.37 114.38 119.22 1hfj h ARG 258 Ca 0.28 -0.31 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 1hfj h ARG 258 Cb 0.21 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1hfj h ARG 258 CO -0.09 0.91 -0.00 0.78 -1.07 0.00 0.00 179.97 180.50 1hfj h GLY 259 N 0.43 0.93 1.07 0.04 0.00 -1.61 -1.80 103.07 102.13 1hfj h GLY 259 Ca 0.06 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 1hfj h GLY 259 CO 0.05 0.59 0.35 -2.22 0.00 0.00 0.00 176.54 175.31 1hfj h ILE 260 N 0.80 1.26 -0.11 2.60 2.04 -0.87 -0.14 117.51 123.10 1hfj h ILE 260 Ca 0.15 -0.79 -0.00 0.00 1.00 0.00 0.00 64.86 65.22 1hfj h ILE 260 Cb 0.49 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1hfj h ILE 260 CO 0.02 0.33 0.06 0.00 0.00 0.00 0.00 178.15 178.56 1hfj h ALA 261 N 1.21 0.14 -0.63 1.87 0.00 -1.12 -0.95 119.26 119.78 1hfj h ALA 261 Ca 0.27 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1hfj h ALA 261 Cb 0.18 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1hfj h ALA 261 CO -0.03 -0.31 0.35 0.78 0.00 0.00 0.00 179.25 180.05 1hfj h GLY 262 N 0.07 0.92 0.93 0.00 0.00 -1.00 -1.97 103.07 102.03 1hfj h GLY 262 Ca 0.04 -0.39 -0.13 0.00 0.00 0.00 0.00 47.33 46.84 1hfj h GLY 262 CO -0.01 0.38 -0.39 -0.33 0.00 0.00 0.00 176.54 176.20 1hfj h MET 263 N 0.87 0.62 -0.62 4.80 2.07 -0.77 -1.72 114.93 120.19 1hfj h MET 263 Ca 0.23 -0.40 0.02 0.00 -2.07 0.00 0.00 59.70 57.48 1hfj h MET 263 Cb 0.01 0.05 -0.04 0.00 -1.87 0.00 0.00 31.60 29.75 1hfj h MET 263 CO -0.04 1.01 0.38 0.00 1.07 0.00 0.00 176.91 179.34 1hfj h ARG 264 N 0.30 0.74 -0.18 1.72 3.08 -1.02 0.20 114.38 119.23 1hfj h ARG 264 Ca 0.01 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1hfj h ARG 264 Cb 0.99 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 1hfj h ARG 264 CO 0.09 0.49 0.11 -0.22 -1.07 0.00 0.00 179.97 179.36 1hfj h LYS 265 N 0.76 0.22 -0.57 0.04 3.64 -1.28 -0.60 116.57 118.78 1hfj h LYS 265 Ca 0.24 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 1hfj h LYS 265 Cb 0.00 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1hfj h LYS 265 CO -0.09 0.14 0.36 0.00 -2.27 0.00 0.00 179.45 177.59 1hfj h ALA 266 N 1.07 1.57 -0.20 5.00 0.00 -0.82 -2.68 119.26 123.19 1hfj h ALA 266 Ca 0.07 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1hfj h ALA 266 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1hfj h ALA 266 CO -0.02 0.39 -0.02 -0.07 0.00 0.00 0.00 179.25 179.53 1hfj h LEU 267 N 0.78 0.37 0.00 0.00 3.38 -0.16 0.10 115.31 119.78 1hfj h LEU 267 Ca 0.21 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1hfj h LEU 267 Cb -0.07 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1hfj h LEU 267 CO -0.04 0.62 0.00 -1.84 0.09 0.00 0.00 178.44 177.26 1hfj n GLU 268 N -4.66 0.60 -0.08 1.13 0.28 -0.31 -1.33 120.64 116.27 1hfj n GLU 268 Ca -0.04 0.00 0.04 0.00 -0.16 0.00 0.00 57.16 57.00 1hfj n GLU 268 Cb 0.25 -1.32 0.08 0.00 1.43 0.00 0.00 31.44 31.89 1hfj n GLU 268 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1hfj n LYS 269 N -0.82 1.96 -0.88 3.44 4.76 -0.91 -4.99 118.16 120.72 1hfj n LYS 269 Ca 0.09 -1.58 0.00 0.00 -2.87 0.00 0.00 58.31 53.95 1hfj n LYS 269 Cb 0.04 -1.18 0.00 0.00 -1.84 0.00 0.00 35.03 32.05 1hfj n LYS 269 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hfj n GLY 270 N 0.30 0.51 3.73 0.72 0.00 -0.44 -5.04 105.19 104.98 1hfj n GLY 270 Ca 0.07 -0.45 -0.37 0.00 0.00 0.00 0.00 46.02 45.27 1hfj n GLY 270 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfj s VAL 271 N -2.00 5.24 -0.03 1.61 1.01 -0.03 -4.95 120.40 121.25 1hfj s VAL 271 Ca 0.00 0.74 -0.30 0.00 0.00 0.00 0.00 61.98 62.42 1hfj s VAL 271 Cb 0.00 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1hfj s VAL 271 CO 0.00 0.38 1.01 -0.69 0.00 0.00 0.00 175.10 175.80 1hfj s VAL 272 N 0.42 4.76 -0.22 2.92 1.01 -0.62 -4.07 120.40 124.60 1hfj s VAL 272 Ca 0.21 2.00 -0.05 0.00 0.00 0.00 0.00 61.98 64.14 1hfj s VAL 272 Cb -0.14 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 31.94 1hfj s VAL 272 CO 0.07 0.11 -0.01 -0.69 0.00 0.00 0.00 175.10 174.58 1hfj s VAL 273 N 1.34 3.67 -0.32 2.92 1.01 -1.26 -0.56 120.40 127.20 1hfj s VAL 273 Ca 0.52 -0.40 -0.03 0.00 0.00 0.00 0.00 61.98 62.07 1hfj s VAL 273 Cb -0.21 -2.68 0.05 0.00 0.00 0.00 0.00 36.38 33.54 1hfj s VAL 273 CO 0.25 0.41 0.04 -0.32 0.00 0.00 0.00 175.10 175.48 1hfj s MET 274 N 1.37 2.48 -0.23 2.72 1.75 0.05 -0.40 119.30 127.05 1hfj s MET 274 Ca 0.05 -1.25 -0.27 0.00 -1.25 0.00 0.00 55.69 52.97 1hfj s MET 274 Cb -0.14 -3.28 0.00 0.00 2.84 0.00 0.00 34.83 34.24 1hfj s MET 274 CO -0.01 -0.65 0.92 1.03 -0.65 0.00 0.00 175.02 175.67 1hfj s ARG 275 N 1.30 4.23 0.00 4.11 0.52 0.58 -0.66 118.95 129.03 1hfj s ARG 275 Ca -0.04 1.13 0.00 0.00 -0.52 0.00 0.00 55.73 56.30 1hfj s ARG 275 Cb -0.20 -3.63 0.00 0.00 0.52 0.00 0.00 34.95 31.64 1hfj s ARG 275 CO 0.00 -0.54 0.00 0.45 0.02 0.00 0.00 175.30 175.23 1hfj n SER 276 N 6.04 1.78 -4.09 0.23 2.88 0.11 -1.51 113.62 119.05 1hfj n SER 276 Ca 0.08 -0.05 -0.16 0.00 -1.33 0.00 0.00 58.87 57.40 1hfj n SER 276 Cb 0.47 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.81 1hfj n SER 276 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1hfj s THR 277 N 0.68 0.80 -0.44 2.46 -1.32 -1.26 -2.16 115.64 114.40 1hfj s THR 277 Ca 0.00 -1.00 0.23 0.00 -1.21 0.00 0.00 61.69 59.71 1hfj s THR 277 Cb 0.00 -0.78 -0.01 0.00 -1.51 0.00 0.00 72.50 70.20 1hfj s THR 277 CO 0.00 -0.18 1.14 -2.11 -2.21 0.00 0.00 174.62 171.25 1hfj n ARG 278 N 1.72 0.44 -0.22 7.08 1.85 0.70 -4.34 116.66 123.88 1hfj n ARG 278 Ca -0.20 0.09 0.03 0.00 -1.00 0.00 0.00 57.85 56.77 1hfj n ARG 278 Cb 0.55 -1.73 0.14 0.00 -1.05 0.00 0.00 32.46 30.37 1hfj n ARG 278 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1hfj h THR 279 N 0.00 0.54 0.00 8.89 1.35 -1.84 -3.47 112.91 118.38 1hfj h THR 279 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1hfj h THR 279 Cb 0.86 0.29 0.00 0.00 -1.73 0.00 0.00 68.15 67.58 1hfj h THR 279 CO 0.00 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 1hfj n GLY 280 N -1.35 1.75 3.57 5.82 0.00 -1.26 -5.09 105.19 108.64 1hfj n GLY 280 Ca 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1hfj n GLY 280 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hfj s ASN 281 N -1.47 -0.20 0.00 1.61 0.01 -1.26 -5.00 114.94 108.63 1hfj s ASN 281 Ca 0.00 -0.64 0.00 0.00 -0.71 0.00 0.00 52.86 51.51 1hfj s ASN 281 Cb 0.00 0.59 0.00 0.00 0.41 0.00 0.00 41.25 42.25 1hfj s ASN 281 CO 0.00 -1.11 0.00 0.61 -1.51 0.00 0.00 177.10 175.09 1hfj n GLY 282 N -0.36 0.95 3.66 0.66 0.00 -1.26 -5.02 105.19 103.82 1hfj n GLY 282 Ca -0.07 -2.09 -0.35 0.00 0.00 0.00 0.00 46.02 43.52 1hfj n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hfj s ILE 283 N -1.47 4.79 -0.44 -0.61 -1.09 -1.26 -4.21 121.20 116.91 1hfj s ILE 283 Ca 0.00 -0.04 -0.15 0.00 -2.23 0.00 0.00 60.65 58.23 1hfj s ILE 283 Cb 0.00 -3.14 0.05 0.00 -1.58 0.00 0.00 42.46 37.79 1hfj s ILE 283 CO 0.00 0.49 0.35 -0.69 -1.23 0.00 0.00 174.94 173.86 1hfj s VAL 284 N 0.15 5.18 0.67 2.92 1.01 -0.78 -4.90 120.40 124.64 1hfj s VAL 284 Ca 0.05 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.99 1hfj s VAL 284 Cb -0.12 -4.02 -0.01 0.00 0.00 0.00 0.00 36.38 32.23 1hfj s VAL 284 CO 0.01 -0.47 1.06 -2.16 0.00 0.00 0.00 175.10 173.54 1hfj s PRO 285 N 1.64 3.16 0.57 2.72 0.04 -1.26 -3.54 135.00 138.33 1hfj s PRO 285 Ca 0.04 0.70 -0.19 0.00 0.04 0.00 0.00 61.00 61.59 1hfj s PRO 285 Cb -0.22 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 1hfj s PRO 285 CO 0.08 -0.88 1.19 -2.14 0.04 0.00 0.00 177.00 175.30 1hfj s PRO 286 N -5.20 3.14 -0.24 0.56 0.02 -1.26 -4.92 135.00 127.10 1hfj s PRO 286 Ca 0.57 1.80 -0.04 0.00 0.02 0.00 0.00 61.00 63.35 1hfj s PRO 286 Cb -0.12 -2.01 0.13 0.00 0.02 0.00 0.00 34.50 32.52 1hfj s PRO 286 CO 0.54 -1.07 0.41 0.34 -0.33 0.00 0.00 177.00 176.89 1hfj s ASP 287 N -1.58 -0.03 0.49 2.53 -1.08 -1.26 -5.03 116.67 110.72 1hfj s ASP 287 Ca 0.75 0.47 0.28 0.00 -0.52 0.00 0.00 52.55 53.54 1hfj s ASP 287 Cb -0.29 1.27 0.97 0.00 -1.46 0.00 0.00 42.92 43.41 1hfj s ASP 287 CO 0.33 -0.28 1.84 1.05 0.52 0.00 0.00 175.17 178.62 1hfj h GLU 288 N 8.16 0.00 0.00 4.34 4.11 -1.97 -2.93 114.58 126.29 1hfj h GLU 288 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.24 1hfj h GLU 288 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1hfj h GLU 288 CO 0.23 0.06 0.00 0.93 0.07 0.00 0.00 179.01 180.31 1hfj h GLU 289 N 0.00 0.00 -6.39 1.06 4.39 -2.01 -3.44 114.58 108.19 1hfj h GLU 289 Ca -0.00 0.00 -0.61 0.00 0.34 0.00 0.00 59.36 59.09 1hfj h GLU 289 Cb 0.72 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 29.24 1hfj h GLU 289 CO 0.01 0.00 -0.70 -0.51 -1.16 0.00 0.00 179.01 176.65 1hfj s LEU 290 N -6.06 3.08 0.69 1.33 1.43 -1.11 -5.13 118.68 112.90 1hfj s LEU 290 Ca -0.01 -0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 52.44 1hfj s LEU 290 Cb 0.10 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.59 1hfj s LEU 290 CO 0.49 0.09 1.06 -2.16 0.23 0.00 0.00 176.35 176.06 1hfj s PRO 291 N -2.95 3.02 0.03 1.29 0.04 -1.26 -4.91 135.00 130.24 1hfj s PRO 291 Ca 0.26 0.83 0.00 0.00 0.04 0.00 0.00 61.00 62.14 1hfj s PRO 291 Cb -0.09 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.45 1hfj s PRO 291 CO 0.17 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.60 1hfj n GLY 292 N -2.27 -1.75 3.96 0.56 0.00 -1.26 -4.87 105.19 99.55 1hfj n GLY 292 Ca 0.07 -1.49 -0.22 0.00 0.00 0.00 0.00 46.02 44.37 1hfj n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hfj s LEU 293 N -4.17 3.13 0.04 0.99 1.43 0.47 -4.89 118.68 115.69 1hfj s LEU 293 Ca 0.00 0.11 0.07 0.00 -1.03 0.00 0.00 54.13 53.28 1hfj s LEU 293 Cb 0.00 -2.92 -0.03 0.00 0.03 0.00 0.00 46.19 43.27 1hfj s LEU 293 CO 0.00 -1.29 -0.19 0.68 0.23 0.00 0.00 176.35 175.78 1hfj s VAL 294 N -2.91 2.70 -1.92 -1.59 -7.23 -1.26 -0.31 120.40 107.89 1hfj s VAL 294 Ca 0.58 -1.22 0.07 0.00 -1.81 0.00 0.00 61.98 59.60 1hfj s VAL 294 Cb -0.10 -2.13 0.20 0.00 0.56 0.00 0.00 36.38 34.91 1hfj s VAL 294 CO 0.40 0.34 1.14 -1.54 -0.31 0.00 0.00 175.10 175.13 1hfj n SER 295 N 1.56 1.27 0.00 4.85 3.41 -0.57 -4.89 113.62 119.26 1hfj n SER 295 Ca -0.16 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.43 1hfj n SER 295 Cb 0.52 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1hfj n SER 295 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1hfj n ASP 296 N 0.15 0.00 -1.10 4.04 -0.08 -1.23 -1.16 116.55 117.17 1hfj n ASP 296 Ca 0.07 0.00 0.10 0.00 -1.51 0.00 0.00 54.79 53.45 1hfj n ASP 296 Cb 0.21 0.00 0.27 0.00 2.34 0.00 0.00 41.12 43.94 1hfj n ASP 296 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1hfj n SER 297 N 3.04 3.20 -4.72 1.67 3.41 -1.26 -1.87 113.62 117.09 1hfj n SER 297 Ca 0.00 -1.99 -0.42 0.00 -0.26 0.00 0.00 58.87 56.20 1hfj n SER 297 Cb 0.00 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.53 1hfj n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1hfj s LEU 298 N -1.04 4.38 0.71 1.04 2.01 -0.31 -4.78 118.68 120.69 1hfj s LEU 298 Ca 0.40 2.11 -0.10 0.00 0.01 0.00 0.00 54.13 56.56 1hfj s LEU 298 Cb 0.21 -3.58 0.04 0.00 0.01 0.00 0.00 46.19 42.87 1hfj s LEU 298 CO 0.28 -0.49 1.07 0.54 1.01 0.00 0.00 176.35 178.75 1hfj s ASN 299 N 0.93 5.10 0.24 2.29 4.22 -1.26 -4.66 114.94 121.79 1hfj s ASN 299 Ca 0.59 0.84 -0.11 0.00 -2.14 0.00 0.00 52.86 52.04 1hfj s ASN 299 Cb -0.31 -1.56 0.33 0.00 1.28 0.00 0.00 41.25 40.98 1hfj s ASN 299 CO 0.30 -1.49 1.60 -0.65 -2.04 0.00 0.00 177.10 174.82 1hfj h PRO 300 N -0.67 0.00 -0.55 3.55 0.11 -1.95 0.28 132.00 132.78 1hfj h PRO 300 Ca -0.45 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1hfj h PRO 300 Cb 1.29 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.37 1hfj h PRO 300 CO 0.63 0.00 0.29 0.00 -0.21 0.00 0.00 178.00 178.72 1hfj h ALA 301 N 1.77 0.70 -0.17 -0.75 0.00 -1.96 -1.50 119.26 117.34 1hfj h ALA 301 Ca 0.37 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.07 1hfj h ALA 301 Cb 0.57 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1hfj h ALA 301 CO -0.79 0.23 -0.32 0.45 0.00 0.00 0.00 179.25 178.82 1hfj h HIS 302 N 0.73 0.65 -0.58 0.00 3.86 -1.69 -3.17 115.15 114.96 1hfj h HIS 302 Ca 0.19 -0.23 0.07 0.00 -1.16 0.00 0.00 60.37 59.24 1hfj h HIS 302 Cb 0.06 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 1hfj h HIS 302 CO -0.01 0.95 0.39 0.00 0.86 0.00 0.00 177.93 180.12 1hfj h ALA 303 N 0.58 1.86 -0.49 2.45 0.00 -0.34 -1.34 119.26 121.97 1hfj h ALA 303 Ca 0.01 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1hfj h ALA 303 Cb 0.91 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1hfj h ALA 303 CO 0.07 0.04 -0.13 -0.09 0.00 0.00 0.00 179.25 179.14 1hfj h ARG 304 N 0.53 0.95 -0.29 0.00 2.43 -1.26 -1.51 114.38 115.23 1hfj h ARG 304 Ca 0.25 -0.37 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 1hfj h ARG 304 Cb 0.32 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1hfj h ARG 304 CO -0.07 1.04 0.10 0.82 -1.51 0.00 0.00 179.97 180.34 1hfj h ILE 305 N 0.81 1.19 -0.10 1.20 1.08 -1.25 -1.28 117.51 119.16 1hfj h ILE 305 Ca 0.12 -0.61 -0.10 0.00 -0.39 0.00 0.00 64.86 63.89 1hfj h ILE 305 Cb 0.69 1.06 -0.01 0.00 -3.07 0.00 0.00 36.82 35.49 1hfj h ILE 305 CO 0.05 0.20 -0.38 0.25 -0.69 0.00 0.00 178.15 177.59 1hfj h LEU 306 N 0.30 0.21 -0.47 1.44 5.85 -1.36 -2.59 115.31 118.70 1hfj h LEU 306 Ca 0.09 -0.08 -0.16 0.00 0.84 0.00 0.00 57.88 58.57 1hfj h LEU 306 Cb 0.22 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 1hfj h LEU 306 CO -0.00 0.57 -0.52 0.25 -0.34 0.00 0.00 178.44 178.40 1hfj h LEU 307 N 0.17 0.74 -0.54 2.25 5.85 -1.09 -0.25 115.31 122.44 1hfj h LEU 307 Ca 0.02 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 1hfj h LEU 307 Cb 0.75 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1hfj h LEU 307 CO 0.06 1.12 0.16 0.24 -0.34 0.00 0.00 178.44 179.68 1hfj h MET 308 N 0.52 0.84 -0.28 1.25 2.86 -1.04 -2.40 114.93 116.67 1hfj h MET 308 Ca 0.02 -0.18 -0.16 0.00 -2.06 0.00 0.00 59.70 57.31 1hfj h MET 308 Cb 1.08 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.62 1hfj h MET 308 CO 0.11 0.78 -0.46 -0.07 1.06 0.00 0.00 176.91 178.32 1hfj h LEU 309 N 0.75 0.89 -1.08 1.22 3.38 -1.40 -3.11 115.31 115.96 1hfj h LEU 309 Ca 0.17 -0.52 0.06 0.00 0.09 0.00 0.00 57.88 57.68 1hfj h LEU 309 Cb 0.29 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 1hfj h LEU 309 CO -0.00 1.24 0.62 0.00 0.09 0.00 0.00 178.44 180.38 1hfj h ALA 310 N 0.68 1.44 0.00 1.53 0.00 -0.97 -0.75 119.26 121.19 1hfj h ALA 310 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1hfj h ALA 310 Cb 1.06 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1hfj h ALA 310 CO 0.10 0.44 0.00 1.28 0.00 0.00 0.00 179.25 181.07 1hfj n LEU 311 N -4.48 0.22 -0.50 0.00 4.77 -0.91 -1.05 117.00 115.05 1hfj n LEU 311 Ca 0.14 0.55 0.06 0.00 -0.03 0.00 0.00 56.01 56.73 1hfj n LEU 311 Cb 0.16 -0.52 0.20 0.00 -2.33 0.00 0.00 43.42 40.93 1hfj n LEU 311 CO 0.33 -0.35 0.66 0.35 -1.33 0.00 0.00 177.39 177.05 1hfj n THR 312 N -1.74 0.32 0.00 -5.08 -2.24 -0.29 -4.12 114.28 101.13 1hfj n THR 312 Ca 0.03 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1hfj n THR 312 Cb 0.19 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1hfj n THR 312 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hfj n ARG 313 N 0.26 0.03 -3.88 -0.78 1.74 -0.22 -5.06 116.66 108.75 1hfj n ARG 313 Ca 0.11 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.10 1hfj n ARG 313 Cb 0.25 -0.72 -0.00 0.00 -1.02 0.00 0.00 32.46 30.96 1hfj n ARG 313 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1hfj s THR 314 N -1.45 0.00 0.00 0.55 -1.32 -0.54 -5.02 115.64 107.87 1hfj s THR 314 Ca 0.00 -1.12 0.00 0.00 -1.21 0.00 0.00 61.69 59.36 1hfj s THR 314 Cb 0.00 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.47 1hfj s THR 314 CO 0.00 0.00 0.53 -1.54 -2.21 0.00 0.00 174.62 171.40 1hfj n SER 315 N -1.03 0.41 -4.62 8.08 3.41 -1.26 -3.95 113.62 114.66 1hfj n SER 315 Ca -0.05 -1.19 -0.43 0.00 -0.26 0.00 0.00 58.87 56.94 1hfj n SER 315 Cb 0.60 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.53 1hfj n SER 315 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hfj s ASP 316 N -0.19 6.28 0.37 4.04 -1.08 -1.26 -4.89 116.67 119.94 1hfj s ASP 316 Ca 0.00 1.37 0.10 0.00 -0.52 0.00 0.00 52.55 53.50 1hfj s ASP 316 Cb 0.00 -2.53 0.87 0.00 -1.46 0.00 0.00 42.92 39.79 1hfj s ASP 316 CO 0.00 -1.38 1.87 1.55 0.52 0.00 0.00 175.17 177.73 1hfj h PRO 317 N 11.10 0.62 -0.63 4.34 0.13 -1.99 -1.40 132.00 144.16 1hfj h PRO 317 Ca -0.32 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.69 1hfj h PRO 317 Cb 1.14 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 1hfj h PRO 317 CO 1.03 0.41 0.08 -0.22 -0.23 0.00 0.00 178.00 179.06 1hfj h LYS 318 N 0.64 1.07 -0.08 0.86 3.11 -2.00 -1.44 116.57 118.73 1hfj h LYS 318 Ca 0.45 -0.30 -0.23 0.00 -2.81 0.00 0.00 60.65 57.76 1hfj h LYS 318 Cb 0.80 -0.12 0.01 0.00 -1.00 0.00 0.00 32.23 31.92 1hfj h LYS 318 CO -0.20 1.00 -0.85 0.28 -2.81 0.00 0.00 179.45 176.86 1hfj h VAL 319 N 0.98 1.31 -0.54 2.00 2.07 -1.70 -2.94 116.25 117.43 1hfj h VAL 319 Ca 0.19 -2.13 -0.06 0.00 0.82 0.00 0.00 66.70 65.52 1hfj h VAL 319 Cb 0.47 2.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 1hfj h VAL 319 CO 0.02 0.66 0.08 0.40 0.02 0.00 0.00 177.57 178.75 1hfj h ILE 320 N 0.42 1.25 -0.36 4.57 2.04 -1.26 -1.65 117.51 122.52 1hfj h ILE 320 Ca -0.07 -0.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 1hfj h ILE 320 Cb 1.48 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 1hfj h ILE 320 CO 0.16 0.35 0.19 -0.61 0.00 0.00 0.00 178.15 178.24 1hfj h GLN 321 N 0.78 0.49 -0.08 2.37 5.75 -1.29 -1.78 115.11 121.35 1hfj h GLN 321 Ca 0.16 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 1hfj h GLN 321 Cb 0.41 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 28.86 1hfj h GLN 321 CO 0.01 0.37 0.01 0.93 -2.65 0.00 0.00 178.83 177.51 1hfj h GLU 322 N 0.50 0.14 -0.33 1.69 4.39 -1.21 -3.01 114.58 116.75 1hfj h GLU 322 Ca 0.13 -0.04 0.07 0.00 0.34 0.00 0.00 59.36 59.87 1hfj h GLU 322 Cb 0.03 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 28.58 1hfj h GLU 322 CO -0.02 0.36 -0.24 1.88 -1.16 0.00 0.00 179.01 179.83 1hfj h TYR 323 N -0.10 -0.63 0.00 4.33 0.05 -0.64 -0.83 116.97 119.15 1hfj h TYR 323 Ca 0.03 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1hfj h TYR 323 Cb 0.29 0.33 0.00 0.00 1.01 0.00 0.00 36.73 38.35 1hfj h TYR 323 CO 0.02 -0.32 0.14 0.74 -1.05 0.00 0.00 178.16 177.69 1hfj h PHE 324 N -0.20 0.00 0.00 4.88 -1.00 -1.24 0.14 116.94 119.52 1hfj h PHE 324 Ca 0.17 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.95 1hfj h PHE 324 Cb 0.46 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.02 1hfj h PHE 324 CO -0.43 0.00 -1.22 0.72 -1.61 0.00 0.00 178.31 175.76 1hfj n HIS 325 N -2.69 0.01 0.05 -0.55 8.25 -0.37 -4.52 115.22 115.41 1hfj n HIS 325 Ca -0.02 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.47 1hfj n HIS 325 Cb 0.19 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.11 1hfj n HIS 325 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1hfj n THR 326 N -1.70 0.00 0.82 1.59 -2.24 -0.06 -5.05 114.28 107.64 1hfj n THR 326 Ca 0.02 -0.18 0.10 0.00 -2.27 0.00 0.00 64.05 61.72 1hfj n THR 326 Cb 0.39 0.49 0.08 0.00 -2.10 0.00 0.00 70.33 69.20 1hfj n THR 326 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28