#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hfw s PRO 5 N 0.00 2.70 -0.38 1.96 0.02 -1.26 -4.58 135.00 133.46 1hfw s PRO 5 Ca 0.00 1.74 -0.15 0.00 0.02 0.00 0.00 61.00 62.60 1hfw s PRO 5 Cb 0.00 -1.90 0.01 0.00 0.02 0.00 0.00 34.50 32.62 1hfw s PRO 5 CO 0.00 -1.40 0.35 -0.80 -0.33 0.00 0.00 177.00 174.83 1hfw s ASN 6 N -1.88 6.15 -0.04 2.53 0.01 -1.26 -0.51 114.94 119.94 1hfw s ASN 6 Ca 0.75 -0.56 0.07 0.00 -0.71 0.00 0.00 52.86 52.41 1hfw s ASN 6 Cb -0.28 -2.19 -0.01 0.00 0.41 0.00 0.00 41.25 39.17 1hfw s ASN 6 CO 0.38 -0.42 -0.25 -0.63 -1.51 0.00 0.00 177.10 174.66 1hfw s ILE 7 N 1.93 2.06 -0.13 0.60 -1.09 -0.77 -1.12 121.20 122.68 1hfw s ILE 7 Ca 0.09 -1.08 -0.04 0.00 -2.23 0.00 0.00 60.65 57.39 1hfw s ILE 7 Cb -0.17 -1.73 -0.03 0.00 -1.58 0.00 0.00 42.46 38.95 1hfw s ILE 7 CO 0.12 0.57 0.01 -0.69 -1.23 0.00 0.00 174.94 173.73 1hfw s VAL 8 N -0.34 4.38 -0.34 2.92 1.01 -1.01 -1.86 120.40 125.16 1hfw s VAL 8 Ca 0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 61.72 1hfw s VAL 8 Cb -0.12 -2.91 0.03 0.00 0.00 0.00 0.00 36.38 33.38 1hfw s VAL 8 CO 0.02 0.54 0.13 -0.63 0.00 0.00 0.00 175.10 175.16 1hfw s ILE 9 N -0.20 4.07 -0.28 2.22 1.01 0.19 -1.09 121.20 127.12 1hfw s ILE 9 Ca 0.06 -0.96 -0.13 0.00 0.00 0.00 0.00 60.65 59.61 1hfw s ILE 9 Cb -0.12 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 1hfw s ILE 9 CO 0.02 -0.15 0.30 -0.76 0.00 0.00 0.00 174.94 174.35 1hfw s LEU 10 N 1.47 4.05 -0.19 2.97 1.02 0.34 -1.25 118.68 127.09 1hfw s LEU 10 Ca 0.00 0.14 -0.13 0.00 0.02 0.00 0.00 54.13 54.16 1hfw s LEU 10 Cb -0.19 -2.30 -0.05 0.00 0.02 0.00 0.00 46.19 43.68 1hfw s LEU 10 CO 0.04 -0.14 0.27 0.00 0.02 0.00 0.00 176.35 176.55 1hfw s ALA 11 N 1.94 3.60 -0.06 4.21 0.00 -0.57 -1.54 121.76 129.35 1hfw s ALA 11 Ca 0.12 -0.57 0.04 0.00 0.00 0.00 0.00 51.96 51.55 1hfw s ALA 11 Cb -0.16 -2.41 -0.06 0.00 0.00 0.00 0.00 23.12 20.49 1hfw s ALA 11 CO 0.10 -0.04 0.12 0.25 0.00 0.00 0.00 175.76 176.20 1hfw n THR 12 N 3.87 0.00 -0.36 0.00 -2.24 -1.02 -0.89 114.28 113.64 1hfw n THR 12 Ca -0.12 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1hfw n THR 12 Cb 0.52 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 1hfw n THR 12 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hfw n GLY 13 N 1.96 0.62 0.00 3.38 0.00 -1.24 -2.02 105.19 107.90 1hfw n GLY 13 Ca -0.00 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.42 1hfw n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hfw n GLY 14 N 0.00 1.56 0.23 -0.02 0.00 -1.22 -3.55 105.19 102.18 1hfw n GLY 14 Ca 0.00 -1.73 0.15 0.00 0.00 0.00 0.00 46.02 44.44 1hfw n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfw h THR 15 N 0.00 0.00 -0.73 2.61 1.03 -1.87 -2.96 112.91 110.99 1hfw h THR 15 Ca 0.00 -0.39 -0.01 0.00 -0.01 0.00 0.00 66.41 66.00 1hfw h THR 15 Cb 0.00 1.29 -0.03 0.00 -1.07 0.00 0.00 68.15 68.34 1hfw h THR 15 CO 0.00 0.00 0.42 -0.29 -0.01 0.00 0.00 175.52 175.64 1hfw h ILE 16 N 0.00 1.22 0.00 0.00 2.10 -1.84 -3.27 117.51 115.71 1hfw h ILE 16 Ca 0.00 -0.51 0.00 0.00 1.08 0.00 0.00 64.86 65.43 1hfw h ILE 16 Cb 0.44 0.22 0.00 0.00 -1.09 0.00 0.00 36.82 36.39 1hfw h ILE 16 CO 0.00 0.23 0.00 0.00 -1.08 0.00 0.00 178.15 177.30 1hfw n ALA 17 N -2.34 1.87 0.00 0.18 0.00 -1.12 -4.72 120.51 114.38 1hfw n ALA 17 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1hfw n ALA 17 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.52 1hfw n ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hfw n ALA 33 N -1.26 0.00 -2.58 0.00 0.00 -1.25 -4.66 120.51 110.75 1hfw n ALA 33 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1hfw n ALA 33 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1hfw n ALA 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1hfw s LEU 34 N 0.00 4.17 0.21 0.00 1.02 -1.26 -5.02 118.68 117.80 1hfw s LEU 34 Ca 0.00 0.67 -0.29 0.00 0.02 0.00 0.00 54.13 54.52 1hfw s LEU 34 Cb 0.00 -3.44 -0.16 0.00 0.02 0.00 0.00 46.19 42.61 1hfw s LEU 34 CO 0.00 -0.07 0.79 0.61 0.02 0.00 0.00 176.35 177.70 1hfw n GLY 35 N -0.40 -0.98 0.29 -3.19 0.00 -1.26 -4.79 105.19 94.86 1hfw n GLY 35 Ca -0.02 0.39 0.15 0.00 0.00 0.00 0.00 46.02 46.54 1hfw n GLY 35 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1hfw h VAL 36 N 1.64 0.45 -0.06 1.61 3.04 -1.94 -1.45 116.25 119.55 1hfw h VAL 36 Ca -0.35 -0.20 -0.13 0.00 -1.01 0.00 0.00 66.70 65.01 1hfw h VAL 36 Cb 1.40 1.13 0.01 0.00 -2.01 0.00 0.00 31.29 31.82 1hfw h VAL 36 CO 0.60 0.04 -0.47 0.44 -1.01 0.00 0.00 177.57 177.17 1hfw h ASP 37 N 0.00 0.51 -0.02 3.17 3.32 -1.94 -2.72 116.42 118.74 1hfw h ASP 37 Ca -0.00 -0.69 0.01 0.00 0.02 0.00 0.00 57.03 56.37 1hfw h ASP 37 Cb 0.13 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 1hfw h ASP 37 CO 0.01 1.12 0.01 0.74 -1.72 0.00 0.00 179.24 179.40 1hfw h THR 38 N -0.06 0.96 -0.31 0.35 2.02 -1.63 -0.71 112.91 113.53 1hfw h THR 38 Ca -0.04 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 67.04 1hfw h THR 38 Cb 1.14 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 1hfw h THR 38 CO 0.10 0.00 -0.20 0.25 0.37 0.00 0.00 175.52 176.04 1hfw h LEU 39 N 0.00 0.71 -0.39 2.58 6.46 -1.23 -1.76 115.31 121.68 1hfw h LEU 39 Ca 0.01 -0.43 -0.12 0.00 -0.12 0.00 0.00 57.88 57.22 1hfw h LEU 39 Cb 0.04 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.76 1hfw h LEU 39 CO -0.00 0.99 -0.23 0.40 -0.62 0.00 0.00 178.44 178.98 1hfw h ILE 40 N 0.44 1.28 0.00 4.05 2.04 -0.97 -2.76 117.51 121.58 1hfw h ILE 40 Ca 0.06 -1.37 -0.03 0.00 1.00 0.00 0.00 64.86 64.51 1hfw h ILE 40 Cb 0.74 1.31 -0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1hfw h ILE 40 CO 0.05 0.46 -0.17 0.78 0.00 0.00 0.00 178.15 179.28 1hfw h ASN 41 N 0.65 0.00 0.77 1.72 2.35 -1.17 -2.67 115.58 117.24 1hfw h ASN 41 Ca 0.08 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.69 1hfw h ASN 41 Cb 0.79 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.14 1hfw h ASN 41 CO 0.06 0.17 -0.68 0.00 -1.65 0.00 0.00 177.43 175.33 1hfw h ALA 42 N 1.83 0.81 -2.18 -0.83 0.00 -1.04 -3.32 119.26 114.53 1hfw h ALA 42 Ca -0.00 -0.62 -0.58 0.00 0.00 0.00 0.00 54.91 53.71 1hfw h ALA 42 Cb 0.57 -0.11 -0.41 0.00 0.00 0.00 0.00 17.79 17.84 1hfw h ALA 42 CO 0.02 0.85 -0.75 0.28 0.00 0.00 0.00 179.25 179.65 1hfw n VAL 43 N -3.64 1.93 -0.03 0.00 0.31 -1.02 -4.95 118.33 110.93 1hfw n VAL 43 Ca -0.01 -5.12 0.24 0.00 -0.01 0.00 0.00 64.34 59.44 1hfw n VAL 43 Cb 0.69 -1.61 0.71 0.00 -0.91 0.00 0.00 33.84 32.72 1hfw n VAL 43 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1hfw h PRO 44 N 3.58 0.00 -0.48 5.55 0.13 -1.64 -2.50 132.00 136.65 1hfw h PRO 44 Ca 0.15 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.41 1hfw h PRO 44 Cb 0.67 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 1hfw h PRO 44 CO 0.74 0.00 0.38 0.93 -0.23 0.00 0.00 178.00 179.82 1hfw h GLU 45 N 0.00 0.00 -0.01 0.86 3.07 -1.92 -0.25 114.58 116.33 1hfw h GLU 45 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 1hfw h GLU 45 Cb 1.50 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.41 1hfw h GLU 45 CO -0.00 0.00 0.01 -0.39 -1.40 0.00 0.00 179.01 177.22 1hfw h VAL 46 N 0.00 0.96 0.00 3.13 -1.51 -1.79 -1.52 116.25 115.52 1hfw h VAL 46 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.70 1hfw h VAL 46 Cb 0.99 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.15 1hfw h VAL 46 CO -0.00 0.00 0.00 0.29 -1.23 0.00 0.00 177.57 176.63 1hfw n LYS 47 N -4.49 0.12 0.00 5.19 5.02 -0.10 -1.55 118.16 122.35 1hfw n LYS 47 Ca -0.03 0.21 0.09 0.00 -2.02 0.00 0.00 58.31 56.56 1hfw n LYS 47 Cb 0.10 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.64 1hfw n LYS 47 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1hfw n LYS 48 N -1.34 1.57 -0.05 1.97 2.85 -0.57 -4.31 118.16 118.29 1hfw n LYS 48 Ca 0.05 -1.17 -0.00 0.00 -1.05 0.00 0.00 58.31 56.13 1hfw n LYS 48 Cb 0.10 -1.33 -0.15 0.00 -0.65 0.00 0.00 35.03 33.01 1hfw n LYS 48 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1hfw n LEU 49 N 0.40 0.00 -3.67 -5.58 4.77 -0.60 -5.06 117.00 107.26 1hfw n LEU 49 Ca 0.09 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.05 1hfw n LEU 49 Cb 0.40 0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.72 1hfw n LEU 49 CO 0.17 0.24 0.88 0.00 -1.33 0.00 0.00 177.39 177.35 1hfw s ALA 50 N -2.85 -1.94 -0.62 -1.18 0.00 -1.08 -4.45 121.76 109.64 1hfw s ALA 50 Ca -0.08 0.51 -0.22 0.00 0.00 0.00 0.00 51.96 52.17 1hfw s ALA 50 Cb 0.09 0.46 0.07 0.00 0.00 0.00 0.00 23.12 23.74 1hfw s ALA 50 CO 0.76 -1.00 0.89 -0.80 0.00 0.00 0.00 175.76 175.61 1hfw s ASN 51 N -2.89 6.20 0.02 0.00 0.01 0.34 -4.43 114.94 114.18 1hfw s ASN 51 Ca 0.12 -0.99 -0.05 0.00 -0.71 0.00 0.00 52.86 51.24 1hfw s ASN 51 Cb 0.01 -2.39 -0.05 0.00 0.41 0.00 0.00 41.25 39.24 1hfw s ASN 51 CO -0.01 -1.31 0.25 0.68 -1.51 0.00 0.00 177.10 175.20 1hfw s VAL 52 N 3.68 5.33 -0.05 1.60 -7.23 -1.26 -1.84 120.40 120.63 1hfw s VAL 52 Ca 0.21 0.04 0.01 0.00 -1.81 0.00 0.00 61.98 60.43 1hfw s VAL 52 Cb -0.18 -3.57 0.02 0.00 0.56 0.00 0.00 36.38 33.21 1hfw s VAL 52 CO 0.11 0.31 -0.04 -0.54 -0.31 0.00 0.00 175.10 174.63 1hfw s LYS 53 N -1.93 0.80 0.17 4.82 1.02 -0.78 -4.99 119.74 118.85 1hfw s LYS 53 Ca 0.29 -0.07 -0.02 0.00 0.02 0.00 0.00 55.97 56.20 1hfw s LYS 53 Cb -0.13 -0.87 -0.05 0.00 -0.52 0.00 0.00 37.83 36.26 1hfw s LYS 53 CO 0.18 -0.13 0.38 0.20 -0.92 0.00 0.00 175.35 175.06 1hfw s GLY 54 N 1.13 1.96 -0.10 -3.33 0.00 -1.26 -0.64 107.32 105.08 1hfw s GLY 54 Ca -0.08 -0.74 -0.04 0.00 0.00 0.00 0.00 44.72 43.86 1hfw s GLY 54 CO -0.01 -0.69 0.22 1.85 0.00 0.00 0.00 173.10 174.47 1hfw s GLU 55 N -3.06 0.15 -0.62 2.90 2.12 -0.38 -4.91 118.70 114.89 1hfw s GLU 55 Ca 0.39 0.56 -0.22 0.00 0.36 0.00 0.00 54.97 56.06 1hfw s GLU 55 Cb -0.11 -0.13 0.07 0.00 0.26 0.00 0.00 34.13 34.21 1hfw s GLU 55 CO 0.28 -0.22 0.90 -1.14 -0.54 0.00 0.00 175.26 174.54 1hfw s GLN 56 N 1.69 3.14 -0.05 4.30 2.00 -1.26 -1.51 119.66 127.96 1hfw s GLN 56 Ca -0.05 -0.81 -0.22 0.00 -2.00 0.00 0.00 55.36 52.29 1hfw s GLN 56 Cb -0.11 -4.19 -0.31 0.00 0.80 0.00 0.00 33.01 29.19 1hfw s GLN 56 CO -0.08 -1.68 0.88 0.35 -0.50 0.00 0.00 175.29 174.26 1hfw h PHE 57 N 9.44 0.53 -2.75 1.67 3.57 -1.38 -3.48 116.94 124.54 1hfw h PHE 57 Ca -0.28 -0.39 0.08 0.00 3.53 0.00 0.00 57.97 60.91 1hfw h PHE 57 Cb 1.07 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.78 1hfw h PHE 57 CO 0.93 1.31 0.44 -1.54 -2.23 0.00 0.00 178.31 177.22 1hfw s SER 58 N -6.96 -0.00 -0.46 0.41 1.04 -0.87 -5.00 113.70 101.86 1hfw s SER 58 Ca -0.14 -0.88 0.06 0.00 0.48 0.00 0.00 55.95 55.46 1hfw s SER 58 Cb 0.01 0.66 0.18 0.00 0.10 0.00 0.00 66.02 66.97 1hfw s SER 58 CO 0.83 -1.31 0.56 0.21 0.98 0.00 0.00 173.24 174.50 1hfw s ASN 59 N -3.24 -0.23 0.07 7.02 2.47 -1.04 -3.61 114.94 116.38 1hfw s ASN 59 Ca 0.19 -2.11 -0.07 0.00 0.42 0.00 0.00 52.86 51.29 1hfw s ASN 59 Cb -0.04 0.99 -0.01 0.00 -1.45 0.00 0.00 41.25 40.74 1hfw s ASN 59 CO 0.08 -0.12 0.13 0.00 -3.72 0.00 0.00 177.10 173.47 1hfw s MET 60 N 0.72 0.74 0.30 0.43 0.23 -0.86 -4.92 119.30 115.94 1hfw s MET 60 Ca 0.29 -0.95 -0.29 0.00 -1.03 0.00 0.00 55.69 53.70 1hfw s MET 60 Cb -0.01 0.29 -0.10 0.00 -1.53 0.00 0.00 34.83 33.49 1hfw s MET 60 CO -0.10 -0.21 1.23 0.00 -2.03 0.00 0.00 175.02 173.91 1hfw s ALA 61 N -3.58 3.47 0.61 3.16 0.00 -1.26 -3.40 121.76 120.76 1hfw s ALA 61 Ca 0.03 1.11 0.33 0.00 0.00 0.00 0.00 51.96 53.43 1hfw s ALA 61 Cb 0.04 -3.42 1.90 0.00 0.00 0.00 0.00 23.12 21.64 1hfw s ALA 61 CO -0.09 -0.45 2.21 0.66 0.00 0.00 0.00 175.76 178.09 1hfw h SER 62 N 3.79 0.00 0.40 0.00 4.64 -1.95 0.00 113.55 120.42 1hfw h SER 62 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1hfw h SER 62 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1hfw h SER 62 CO 0.67 0.00 0.00 1.05 -0.87 0.00 0.00 176.83 177.68 1hfw h GLU 63 N 0.00 0.00 -0.50 4.77 9.09 -1.95 -1.61 114.58 124.38 1hfw h GLU 63 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.44 1hfw h GLU 63 Cb 0.20 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.30 1hfw h GLU 63 CO -0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 1hfw n ASN 64 N -2.40 3.37 -4.75 3.06 3.02 -0.01 -4.98 115.26 112.56 1hfw n ASN 64 Ca 0.00 -1.98 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 1hfw n ASN 64 Cb 0.14 -0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 38.94 1hfw n ASN 64 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1hfw s MET 65 N -1.03 4.60 0.26 3.52 1.75 -0.61 -4.99 119.30 122.81 1hfw s MET 65 Ca 0.35 1.79 0.12 0.00 -1.25 0.00 0.00 55.69 56.69 1hfw s MET 65 Cb 0.18 -3.23 -0.05 0.00 2.84 0.00 0.00 34.83 34.58 1hfw s MET 65 CO 0.24 0.11 -0.21 0.95 -0.65 0.00 0.00 175.02 175.47 1hfw s THR 66 N -0.65 2.44 0.28 10.11 -4.23 -1.26 -5.03 115.64 117.31 1hfw s THR 66 Ca 0.48 -2.34 0.01 0.00 -1.18 0.00 0.00 61.69 58.66 1hfw s THR 66 Cb -0.31 -2.26 0.27 0.00 1.34 0.00 0.00 72.50 71.53 1hfw s THR 66 CO 0.38 -0.36 1.81 1.23 -0.54 0.00 0.00 174.62 177.14 1hfw h GLY 67 N 2.43 1.59 2.00 3.99 0.00 -1.98 0.50 103.07 111.60 1hfw h GLY 67 Ca -0.41 -0.37 -0.06 0.00 0.00 0.00 0.00 47.33 46.49 1hfw h GLY 67 CO 0.58 0.07 -0.28 1.29 0.00 0.00 0.00 176.54 178.20 1hfw h ASP 68 N 0.86 0.00 0.02 0.19 2.03 -1.96 0.79 116.42 118.35 1hfw h ASP 68 Ca 0.50 0.00 -0.17 0.00 -0.73 0.00 0.00 57.03 56.63 1hfw h ASP 68 Cb 0.59 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 39.10 1hfw h ASP 68 CO -0.31 0.28 -0.67 0.58 -1.03 0.00 0.00 179.24 178.10 1hfw h VAL 69 N 0.00 1.43 -0.35 4.15 2.07 -1.42 -2.77 116.25 119.36 1hfw h VAL 69 Ca -0.00 -2.16 -0.05 0.00 0.82 0.00 0.00 66.70 65.31 1hfw h VAL 69 Cb 0.50 2.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.94 1hfw h VAL 69 CO 0.04 0.63 0.03 0.58 0.02 0.00 0.00 177.57 178.86 1hfw h VAL 70 N -0.11 1.19 -0.44 2.57 2.07 -0.74 -1.47 116.25 119.31 1hfw h VAL 70 Ca -0.09 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 1hfw h VAL 70 Cb 1.39 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1hfw h VAL 70 CO 0.13 0.26 0.27 0.25 0.02 0.00 0.00 177.57 178.50 1hfw h LEU 71 N 0.52 0.53 -0.94 2.57 5.85 -0.85 -1.78 115.31 121.20 1hfw h LEU 71 Ca 0.11 -0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.72 1hfw h LEU 71 Cb 0.30 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1hfw h LEU 71 CO 0.01 0.42 0.02 0.11 -0.34 0.00 0.00 178.44 178.66 1hfw h LYS 72 N 0.59 0.79 -0.65 1.25 1.57 -1.10 -2.61 116.57 116.41 1hfw h LYS 72 Ca 0.16 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 1hfw h LYS 72 Cb -0.01 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.17 1hfw h LYS 72 CO -0.03 0.79 0.19 1.25 -0.57 0.00 0.00 179.45 181.07 1hfw h LEU 73 N 0.75 0.96 -0.10 2.94 5.85 -0.87 -1.51 115.31 123.33 1hfw h LEU 73 Ca 0.15 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.65 1hfw h LEU 73 Cb 0.42 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 1hfw h LEU 73 CO 0.02 0.92 0.06 -1.28 -0.34 0.00 0.00 178.44 177.82 1hfw h SER 74 N 0.95 0.12 -0.84 1.25 0.87 -1.16 -0.75 113.55 113.99 1hfw h SER 74 Ca 0.21 -0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.71 1hfw h SER 74 Cb 0.32 -0.03 -0.05 0.00 -0.44 0.00 0.00 62.40 62.20 1hfw h SER 74 CO -0.00 0.17 0.55 1.56 -0.53 0.00 0.00 176.83 178.57 1hfw h GLN 75 N 0.07 1.07 -0.57 2.24 4.20 -1.32 -0.83 115.11 119.97 1hfw h GLN 75 Ca 0.04 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 1hfw h GLN 75 Cb 0.07 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1hfw h GLN 75 CO -0.01 0.71 -0.06 -0.09 -0.67 0.00 0.00 178.83 178.71 1hfw h ARG 76 N 1.10 1.05 -0.39 1.46 9.65 -1.06 -2.33 114.38 123.86 1hfw h ARG 76 Ca 0.32 -0.36 -0.12 0.00 -1.10 0.00 0.00 59.98 58.73 1hfw h ARG 76 Cb -0.07 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.41 1hfw h ARG 76 CO -0.09 1.05 -0.22 0.28 2.80 0.00 0.00 179.97 183.79 1hfw h VAL 77 N 0.94 1.27 -0.20 0.20 2.07 -0.64 -1.59 116.25 118.30 1hfw h VAL 77 Ca 0.16 -1.34 -0.04 0.00 0.82 0.00 0.00 66.70 66.30 1hfw h VAL 77 Cb 0.62 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1hfw h VAL 77 CO 0.04 0.45 -0.06 0.78 0.02 0.00 0.00 177.57 178.80 1hfw h ASN 78 N 0.67 0.28 -0.18 0.57 2.35 -1.01 -1.40 115.58 116.86 1hfw h ASN 78 Ca 0.09 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.72 1hfw h ASN 78 Cb 0.73 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 39.03 1hfw h ASN 78 CO 0.06 0.39 -0.20 -0.08 -1.65 0.00 0.00 177.43 175.94 1hfw h GLU 79 N 0.29 0.45 -0.06 0.81 4.81 -0.92 -2.95 114.58 117.01 1hfw h GLU 79 Ca 0.06 -0.25 -0.01 0.00 -0.13 0.00 0.00 59.36 59.04 1hfw h GLU 79 Cb 0.30 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1hfw h GLU 79 CO 0.01 0.82 0.01 -0.07 -0.73 0.00 0.00 179.01 179.06 1hfw h LEU 80 N 0.11 0.09 -0.42 1.64 4.07 -1.04 -3.05 115.31 116.70 1hfw h LEU 80 Ca 0.03 -0.23 0.00 0.00 0.08 0.00 0.00 57.88 57.75 1hfw h LEU 80 Cb 0.75 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 42.47 1hfw h LEU 80 CO 0.05 0.30 0.00 0.18 -1.08 0.00 0.00 178.44 177.89 1hfw n LEU 81 N -4.92 0.30 0.12 1.67 4.77 -0.55 -2.07 117.00 116.32 1hfw n LEU 81 Ca -0.07 0.59 0.13 0.00 -0.03 0.00 0.00 56.01 56.63 1hfw n LEU 81 Cb 0.15 -0.57 0.41 0.00 -2.33 0.00 0.00 43.42 41.08 1hfw n LEU 81 CO 0.34 -0.48 0.88 0.00 -1.33 0.00 0.00 177.39 176.80 1hfw h ALA 82 N 2.29 1.00 -2.37 -1.18 0.00 -1.40 -3.45 119.26 114.15 1hfw h ALA 82 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 1hfw h ALA 82 Cb 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1hfw h ALA 82 CO 0.00 0.00 0.34 1.03 0.00 0.00 0.00 179.25 180.62 1hfw s ARG 83 N -3.15 4.51 0.41 0.00 0.52 -0.88 -4.97 118.95 115.40 1hfw s ARG 83 Ca 0.09 1.29 0.23 0.00 -0.52 0.00 0.00 55.73 56.81 1hfw s ARG 83 Cb 0.11 -2.67 0.62 0.00 0.52 0.00 0.00 34.95 33.53 1hfw s ARG 83 CO 0.56 0.21 1.70 -0.44 0.02 0.00 0.00 175.30 177.35 1hfw h ASP 84 N 2.91 0.00 -0.37 0.23 3.32 -1.88 -3.13 116.42 117.49 1hfw h ASP 84 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1hfw h ASP 84 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1hfw h ASP 84 CO 0.64 0.22 0.00 -0.90 -1.72 0.00 0.00 179.24 177.48 1hfw n ASP 85 N -3.25 2.30 -4.05 6.45 5.68 -1.26 -4.78 116.55 117.64 1hfw n ASP 85 Ca 0.02 -2.09 -0.31 0.00 -0.50 0.00 0.00 54.79 51.91 1hfw n ASP 85 Cb 0.52 -0.32 -0.16 0.00 -1.14 0.00 0.00 41.12 40.02 1hfw n ASP 85 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1hfw s VAL 86 N -1.57 1.70 -0.12 2.12 1.01 -1.19 -4.77 120.40 117.58 1hfw s VAL 86 Ca 0.26 -0.72 0.22 0.00 0.00 0.00 0.00 61.98 61.75 1hfw s VAL 86 Cb 0.15 -1.57 -0.22 0.00 0.00 0.00 0.00 36.38 34.74 1hfw s VAL 86 CO 0.16 0.48 0.69 0.47 0.00 0.00 0.00 175.10 176.90 1hfw n ASP 87 N 4.66 0.31 -3.58 3.32 8.00 -0.27 -4.85 116.55 124.14 1hfw n ASP 87 Ca -0.18 0.11 0.03 0.00 0.71 0.00 0.00 54.79 55.45 1hfw n ASP 87 Cb 0.50 1.43 -0.00 0.00 -0.02 0.00 0.00 41.12 43.03 1hfw n ASP 87 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1hfw s GLY 88 N -4.44 -0.46 0.04 0.44 0.00 -1.20 -4.23 107.32 97.46 1hfw s GLY 88 Ca -0.05 0.91 0.03 0.00 0.00 0.00 0.00 44.72 45.61 1hfw s GLY 88 CO 0.87 0.18 -0.10 0.14 0.00 0.00 0.00 173.10 174.18 1hfw s VAL 89 N -2.17 0.76 -0.09 1.40 1.01 -0.53 -2.39 120.40 118.38 1hfw s VAL 89 Ca 0.14 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.18 1hfw s VAL 89 Cb 0.06 -0.75 0.01 0.00 0.00 0.00 0.00 36.38 35.70 1hfw s VAL 89 CO -0.06 -0.19 -0.17 -0.69 0.00 0.00 0.00 175.10 173.99 1hfw s VAL 90 N -1.05 1.57 -0.21 2.92 1.01 -0.25 -1.50 120.40 122.89 1hfw s VAL 90 Ca -0.04 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.22 1hfw s VAL 90 Cb -0.08 -1.39 0.03 0.00 0.00 0.00 0.00 36.38 34.94 1hfw s VAL 90 CO 0.01 0.45 -0.15 -0.63 0.00 0.00 0.00 175.10 174.78 1hfw s ILE 91 N 0.58 2.29 0.19 2.22 1.01 0.52 -0.50 121.20 127.51 1hfw s ILE 91 Ca -0.15 -1.08 -0.26 0.00 0.00 0.00 0.00 60.65 59.16 1hfw s ILE 91 Cb -0.17 -2.09 -0.08 0.00 0.01 0.00 0.00 42.46 40.13 1hfw s ILE 91 CO 0.05 0.35 0.81 0.42 0.00 0.00 0.00 174.94 176.57 1hfw s THR 92 N 1.26 4.33 0.18 2.92 -4.23 -0.59 -1.27 115.64 118.24 1hfw s THR 92 Ca 0.01 1.73 -0.21 0.00 -1.18 0.00 0.00 61.69 62.04 1hfw s THR 92 Cb -0.15 -4.14 0.05 0.00 1.34 0.00 0.00 72.50 69.61 1hfw s THR 92 CO -0.09 0.47 0.58 -2.28 -0.54 0.00 0.00 174.62 172.76 1hfw s HIS 93 N -1.21 -0.39 0.65 3.99 5.04 -0.92 -2.44 115.29 119.99 1hfw s HIS 93 Ca 0.38 0.12 -0.13 0.00 -1.54 0.00 0.00 55.06 53.88 1hfw s HIS 93 Cb -0.23 0.52 -0.01 0.00 0.04 0.00 0.00 32.58 32.90 1hfw s HIS 93 CO 0.26 -0.89 1.06 0.20 -2.34 0.00 0.00 174.74 173.03 1hfw s GLY 94 N -2.80 1.91 0.16 1.59 0.00 -1.26 -4.39 107.32 102.54 1hfw s GLY 94 Ca 0.04 0.26 0.00 0.00 0.00 0.00 0.00 44.72 45.02 1hfw s GLY 94 CO -0.09 0.58 1.37 -0.91 0.00 0.00 0.00 173.10 174.04 1hfw h THR 95 N -0.12 1.45 -0.62 0.90 1.35 -1.95 -3.25 112.91 110.67 1hfw h THR 95 Ca -0.45 -2.50 0.11 0.00 -0.55 0.00 0.00 66.41 63.02 1hfw h THR 95 Cb 1.22 2.40 -0.09 0.00 -1.73 0.00 0.00 68.15 69.95 1hfw h THR 95 CO 0.57 0.74 0.16 0.44 -0.25 0.00 0.00 175.52 177.17 1hfw h ASP 96 N 0.16 0.06 0.00 5.36 3.32 -1.94 -3.13 116.42 120.25 1hfw h ASP 96 Ca -0.05 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.10 1hfw h ASP 96 Cb 1.49 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 41.17 1hfw h ASP 96 CO 0.14 0.03 -0.21 0.35 -1.72 0.00 0.00 179.24 177.83 1hfw n THR 97 N -5.10 1.83 0.21 0.35 -2.24 -1.26 -4.75 114.28 103.31 1hfw n THR 97 Ca 0.09 -2.42 0.06 0.00 -2.27 0.00 0.00 64.05 59.51 1hfw n THR 97 Cb 0.33 -0.16 0.52 0.00 -2.10 0.00 0.00 70.33 68.91 1hfw n THR 97 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1hfw h VAL 98 N 0.90 1.10 0.00 2.28 3.04 -1.58 -1.73 116.25 120.26 1hfw h VAL 98 Ca -0.01 -0.45 -0.05 0.00 -1.01 0.00 0.00 66.70 65.19 1hfw h VAL 98 Cb 1.05 1.17 -0.01 0.00 -2.01 0.00 0.00 31.29 31.50 1hfw h VAL 98 CO 0.00 0.13 -0.23 1.05 -1.01 0.00 0.00 177.57 177.52 1hfw h GLU 99 N 0.07 0.00 0.03 4.17 4.11 -1.85 0.20 114.58 121.31 1hfw h GLU 99 Ca 0.01 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.39 1hfw h GLU 99 Cb 0.22 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.47 1hfw h GLU 99 CO 0.01 0.23 -0.22 0.93 0.07 0.00 0.00 179.01 180.03 1hfw h GLU 100 N 0.00 0.09 -0.70 1.06 5.08 -1.68 -2.79 114.58 115.65 1hfw h GLU 100 Ca -0.00 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1hfw h GLU 100 Cb 0.53 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1hfw h GLU 100 CO 0.03 1.04 0.22 0.77 -1.00 0.00 0.00 179.01 180.06 1hfw h SER 101 N -0.79 1.02 -0.52 1.42 0.02 -1.28 -2.33 113.55 111.09 1hfw h SER 101 Ca -0.04 -0.21 -0.10 0.00 -0.84 0.00 0.00 61.79 60.60 1hfw h SER 101 Cb 1.14 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 1hfw h SER 101 CO 0.04 0.96 -0.05 0.00 -1.14 0.00 0.00 176.83 176.64 1hfw h ALA 102 N 1.10 0.88 -0.00 3.77 0.00 -0.72 -2.74 119.26 121.54 1hfw h ALA 102 Ca 0.22 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1hfw h ALA 102 Cb 0.31 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1hfw h ALA 102 CO -0.01 0.65 -0.56 -0.92 0.00 0.00 0.00 179.25 178.42 1hfw h TYR 103 N 0.89 0.02 -0.16 0.00 3.20 -1.39 -1.61 116.97 117.93 1hfw h TYR 103 Ca 0.15 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1hfw h TYR 103 Cb 0.59 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1hfw h TYR 103 CO 0.04 0.57 0.05 0.35 -1.64 0.00 0.00 178.16 177.52 1hfw h PHE 104 N 0.01 0.26 -0.02 -3.82 3.04 -1.23 -2.80 116.94 112.38 1hfw h PHE 104 Ca -0.01 -0.03 -0.11 0.00 3.98 0.00 0.00 57.97 61.81 1hfw h PHE 104 Cb 0.99 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.41 1hfw h PHE 104 CO 0.00 0.37 -0.51 -0.07 -2.02 0.00 0.00 178.31 176.08 1hfw h LEU 105 N 0.08 0.05 -1.67 0.59 4.07 -1.41 -2.66 115.31 114.36 1hfw h LEU 105 Ca 0.05 -0.03 0.10 0.00 0.08 0.00 0.00 57.88 58.09 1hfw h LEU 105 Cb 0.23 -0.02 -0.04 0.00 1.08 0.00 0.00 40.66 41.92 1hfw h LEU 105 CO -0.00 0.56 0.40 -0.74 -1.08 0.00 0.00 178.44 177.58 1hfw h HIS 106 N 0.04 0.40 0.00 1.13 2.76 -1.08 -0.44 115.15 117.96 1hfw h HIS 106 Ca -0.00 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 1hfw h HIS 106 Cb 0.92 -0.13 0.00 0.00 1.55 0.00 0.00 27.41 29.75 1hfw h HIS 106 CO 0.00 0.18 -1.25 1.28 -1.30 0.00 0.00 177.93 176.85 1hfw n LEU 107 N -4.46 0.54 -0.04 0.26 4.77 -1.06 -1.46 117.00 115.53 1hfw n LEU 107 Ca 0.10 0.04 0.01 0.00 -0.03 0.00 0.00 56.01 56.14 1hfw n LEU 107 Cb 0.40 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.42 1hfw n LEU 107 CO 0.34 -0.01 0.12 0.35 -1.33 0.00 0.00 177.39 176.86 1hfw n THR 108 N -2.17 0.00 -2.92 -5.08 -2.24 -0.84 -4.37 114.28 96.66 1hfw n THR 108 Ca 0.00 -0.47 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 1hfw n THR 108 Cb 0.49 1.02 -0.05 0.00 -2.10 0.00 0.00 70.33 69.70 1hfw n THR 108 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1hfw s VAL 109 N -0.80 4.84 -1.16 2.28 1.01 -0.23 -4.80 120.40 121.54 1hfw s VAL 109 Ca 0.02 1.47 -0.03 0.00 0.00 0.00 0.00 61.98 63.43 1hfw s VAL 109 Cb 0.02 -4.11 0.24 0.00 0.00 0.00 0.00 36.38 32.53 1hfw s VAL 109 CO 0.07 -0.10 2.01 0.29 0.00 0.00 0.00 175.10 177.38 1hfw n LYS 110 N 6.02 4.98 -3.59 2.72 4.76 -1.26 -3.81 118.16 127.99 1hfw n LYS 110 Ca 0.05 -4.16 -0.14 0.00 -2.87 0.00 0.00 58.31 51.19 1hfw n LYS 110 Cb 0.48 -2.56 -0.06 0.00 -1.84 0.00 0.00 35.03 31.06 1hfw n LYS 110 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1hfw s SER 111 N -0.63 -0.43 0.00 4.39 0.15 -1.26 -4.85 113.70 111.06 1hfw s SER 111 Ca 0.44 0.19 0.25 0.00 0.70 0.00 0.00 55.95 57.53 1hfw s SER 111 Cb 0.17 0.48 0.52 0.00 -1.71 0.00 0.00 66.02 65.48 1hfw s SER 111 CO -0.09 -0.70 1.43 0.47 1.20 0.00 0.00 173.24 175.55 1hfw n ASP 112 N 0.47 1.89 -4.78 5.45 8.00 -1.26 -4.43 116.55 121.88 1hfw n ASP 112 Ca -0.18 -1.48 -0.35 0.00 0.71 0.00 0.00 54.79 53.48 1hfw n ASP 112 Cb 0.60 0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 41.82 1hfw n ASP 112 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1hfw s LYS 113 N -2.23 3.73 0.24 -1.24 1.02 -1.26 -1.09 119.74 118.90 1hfw s LYS 113 Ca 0.28 1.55 -0.30 0.00 0.02 0.00 0.00 55.97 57.51 1hfw s LYS 113 Cb 0.20 -2.21 -0.10 0.00 -0.52 0.00 0.00 37.83 35.19 1hfw s LYS 113 CO 0.43 -0.53 1.52 -2.14 -0.92 0.00 0.00 175.35 173.71 1hfw s PRO 114 N -3.01 4.21 -0.24 -1.68 0.02 -1.26 -4.84 135.00 128.20 1hfw s PRO 114 Ca 0.66 2.40 0.01 0.00 0.02 0.00 0.00 61.00 64.10 1hfw s PRO 114 Cb -0.22 -3.09 0.06 0.00 0.02 0.00 0.00 34.50 31.27 1hfw s PRO 114 CO 0.26 -0.53 -0.06 0.08 -0.33 0.00 0.00 177.00 176.42 1hfw s VAL 115 N 0.28 1.60 -0.18 3.83 1.01 -1.26 -1.46 120.40 124.22 1hfw s VAL 115 Ca 0.63 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1hfw s VAL 115 Cb -0.44 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1hfw s VAL 115 CO 0.42 -0.11 -0.18 -0.69 0.00 0.00 0.00 175.10 174.54 1hfw s VAL 116 N 1.36 2.28 0.08 2.92 1.01 -0.56 -2.21 120.40 125.29 1hfw s VAL 116 Ca -0.06 -0.87 -0.15 0.00 0.00 0.00 0.00 61.98 60.90 1hfw s VAL 116 Cb -0.19 -1.97 -0.06 0.00 0.00 0.00 0.00 36.38 34.16 1hfw s VAL 116 CO -0.06 0.52 0.50 -0.36 0.00 0.00 0.00 175.10 175.70 1hfw s PHE 117 N 1.22 3.69 0.02 5.22 0.40 -0.09 -0.36 117.98 128.08 1hfw s PHE 117 Ca 0.03 1.07 0.00 0.00 -0.60 0.00 0.00 56.93 57.43 1hfw s PHE 117 Cb -0.14 -2.36 -0.02 0.00 0.51 0.00 0.00 43.02 41.01 1hfw s PHE 117 CO -0.09 0.54 -0.03 0.54 0.70 0.00 0.00 175.22 176.87 1hfw s VAL 118 N -1.26 0.14 0.38 -0.44 0.11 -0.40 -1.22 120.40 117.72 1hfw s VAL 118 Ca 0.31 -0.88 -0.09 0.00 -2.93 0.00 0.00 61.98 58.40 1hfw s VAL 118 Cb -0.17 -0.28 0.04 0.00 -1.53 0.00 0.00 36.38 34.44 1hfw s VAL 118 CO 0.17 -0.46 0.66 0.00 -3.33 0.00 0.00 175.10 172.14 1hfw n ALA 119 N 1.67 -1.13 -3.11 1.54 0.00 -1.26 -2.17 120.51 116.05 1hfw n ALA 119 Ca -0.23 -1.45 -0.13 0.00 0.00 0.00 0.00 53.44 51.63 1hfw n ALA 119 Cb 0.55 1.17 -0.13 0.00 0.00 0.00 0.00 19.45 21.03 1hfw n ALA 119 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hfw s ALA 120 N -2.42 -0.23 -0.32 0.00 0.00 -1.26 -4.79 121.76 112.74 1hfw s ALA 120 Ca 0.22 0.33 0.22 0.00 0.00 0.00 0.00 51.96 52.73 1hfw s ALA 120 Cb -0.03 -0.20 0.15 0.00 0.00 0.00 0.00 23.12 23.04 1hfw s ALA 120 CO 0.16 -0.06 1.32 0.52 0.00 0.00 0.00 175.76 177.70 1hfw h MET 121 N 6.23 0.00 -6.48 0.00 2.86 -1.93 -3.43 114.93 112.17 1hfw h MET 121 Ca -0.28 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 56.68 1hfw h MET 121 Cb 1.19 0.00 -0.20 0.00 0.06 0.00 0.00 31.60 32.65 1hfw h MET 121 CO 0.45 0.06 -0.77 1.03 1.06 0.00 0.00 176.91 178.73 1hfw s ARG 122 N -3.24 2.23 0.71 1.72 0.52 -1.26 -5.04 118.95 114.59 1hfw s ARG 122 Ca 0.03 -0.90 -0.14 0.00 -0.52 0.00 0.00 55.73 54.20 1hfw s ARG 122 Cb 0.07 -2.29 0.03 0.00 0.52 0.00 0.00 34.95 33.28 1hfw s ARG 122 CO 0.73 0.56 1.15 -1.25 0.02 0.00 0.00 175.30 176.51 1hfw s PRO 123 N -1.43 2.40 0.61 3.54 0.04 -1.26 -4.59 135.00 134.31 1hfw s PRO 123 Ca 0.15 1.53 0.30 0.00 0.04 0.00 0.00 61.00 63.03 1hfw s PRO 123 Cb -0.11 -1.89 1.70 0.00 0.04 0.00 0.00 34.50 34.24 1hfw s PRO 123 CO 0.06 -1.58 2.06 0.00 0.04 0.00 0.00 177.00 177.58 1hfw h ALA 124 N -0.27 1.70 -0.58 8.56 0.00 -1.85 -0.81 119.26 126.02 1hfw h ALA 124 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1hfw h ALA 124 Cb 1.27 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1hfw h ALA 124 CO 0.51 -0.34 0.00 0.25 0.00 0.00 0.00 179.25 179.67 1hfw n THR 125 N -3.55 0.91 -3.16 0.00 -2.24 -1.26 -4.91 114.28 100.06 1hfw n THR 125 Ca 0.02 -0.82 -0.30 0.00 -2.27 0.00 0.00 64.05 60.68 1hfw n THR 125 Cb 0.37 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 68.90 1hfw n THR 125 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hfw s ALA 126 N -1.30 3.49 0.08 6.98 0.00 -0.31 -5.03 121.76 125.67 1hfw s ALA 126 Ca 0.40 -0.34 -0.31 0.00 0.00 0.00 0.00 51.96 51.71 1hfw s ALA 126 Cb 0.22 -2.50 -0.07 0.00 0.00 0.00 0.00 23.12 20.77 1hfw s ALA 126 CO 0.26 0.20 1.32 0.42 0.00 0.00 0.00 175.76 177.97 1hfw s ILE 127 N -2.13 3.62 -0.95 0.00 1.01 -1.26 -2.82 121.20 118.66 1hfw s ILE 127 Ca 0.48 1.14 -0.02 0.00 0.00 0.00 0.00 60.65 62.25 1hfw s ILE 127 Cb -0.11 -3.73 0.00 0.00 0.01 0.00 0.00 42.46 38.63 1hfw s ILE 127 CO 0.28 0.08 0.80 -1.20 0.00 0.00 0.00 174.94 174.90 1hfw n SER 128 N 4.14 -2.92 -4.76 3.58 7.64 -1.26 -4.95 113.62 115.08 1hfw n SER 128 Ca 0.11 -0.46 -0.41 0.00 1.01 0.00 0.00 58.87 59.12 1hfw n SER 128 Cb 0.44 -4.02 -0.03 0.00 -1.01 0.00 0.00 64.21 59.59 1hfw n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1hfw s ALA 129 N -3.27 3.49 -0.48 -0.43 0.00 -1.13 -4.94 121.76 115.00 1hfw s ALA 129 Ca 0.12 1.12 0.24 0.00 0.00 0.00 0.00 51.96 53.44 1hfw s ALA 129 Cb -0.05 -3.44 0.28 0.00 0.00 0.00 0.00 23.12 19.90 1hfw s ALA 129 CO 0.56 -0.49 1.33 0.38 0.00 0.00 0.00 175.76 177.54 1hfw h ASP 130 N 4.14 0.00 -0.28 0.00 2.03 -1.89 -3.41 116.42 117.02 1hfw h ASP 130 Ca -0.47 -0.08 0.06 0.00 -0.73 0.00 0.00 57.03 55.81 1hfw h ASP 130 Cb 1.22 0.00 -0.08 0.00 -0.83 0.00 0.00 39.33 39.64 1hfw h ASP 130 CO 0.70 0.04 -0.38 1.23 -1.03 0.00 0.00 179.24 179.79 1hfw h GLY 131 N 4.25 -0.50 -0.22 7.15 0.00 -1.87 -2.49 103.07 109.38 1hfw h GLY 131 Ca 0.00 0.48 0.10 0.00 0.00 0.00 0.00 47.33 47.91 1hfw h GLY 131 CO 0.00 -0.21 -0.27 -2.55 0.00 0.00 0.00 176.54 173.51 1hfw h PRO 132 N -0.37 -0.15 -0.66 4.80 0.11 -1.94 -0.02 132.00 133.77 1hfw h PRO 132 Ca 0.12 0.01 -0.08 0.00 0.11 0.00 0.00 66.00 66.17 1hfw h PRO 132 Cb 0.58 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.70 1hfw h PRO 132 CO -0.48 -0.10 0.11 1.98 -0.21 0.00 0.00 178.00 179.30 1hfw h MET 133 N -0.16 1.09 -0.81 1.05 1.85 -1.85 -1.92 114.93 114.17 1hfw h MET 133 Ca 0.22 -0.29 0.01 0.00 -0.61 0.00 0.00 59.70 59.03 1hfw h MET 133 Cb 0.51 -0.13 -0.04 0.00 0.43 0.00 0.00 31.60 32.37 1hfw h MET 133 CO -0.59 1.00 0.54 -0.91 -0.40 0.00 0.00 176.91 176.55 1hfw h ASN 134 N 1.01 0.94 -0.40 1.39 2.35 -0.89 -1.21 115.58 118.77 1hfw h ASN 134 Ca 0.20 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.87 1hfw h ASN 134 Cb 0.43 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1hfw h ASN 134 CO 0.01 0.68 0.03 0.25 -1.65 0.00 0.00 177.43 176.75 1hfw h LEU 135 N 1.10 0.66 -0.84 1.61 5.85 -0.77 -1.41 115.31 121.51 1hfw h LEU 135 Ca 0.30 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1hfw h LEU 135 Cb -0.13 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.69 1hfw h LEU 135 CO -0.06 0.78 0.51 -0.07 -0.34 0.00 0.00 178.44 179.25 1hfw h LEU 136 N 0.51 1.01 -0.67 2.25 3.38 -1.04 -2.21 115.31 118.54 1hfw h LEU 136 Ca 0.12 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1hfw h LEU 136 Cb 0.42 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1hfw h LEU 136 CO 0.01 0.77 -0.10 -0.33 0.09 0.00 0.00 178.44 178.89 1hfw h GLU 137 N 1.15 0.93 -0.67 1.13 5.08 -1.07 -2.34 114.58 118.79 1hfw h GLU 137 Ca 0.30 -0.32 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1hfw h GLU 137 Cb -0.05 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 1hfw h GLU 137 CO -0.06 0.98 0.26 0.00 -1.00 0.00 0.00 179.01 179.19 1hfw h ALA 138 N 1.05 0.87 -0.30 3.43 0.00 -0.88 -1.03 119.26 122.39 1hfw h ALA 138 Ca 0.13 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1hfw h ALA 138 Cb 0.63 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1hfw h ALA 138 CO 0.04 0.50 -0.31 0.28 0.00 0.00 0.00 179.25 179.76 1hfw h VAL 139 N 0.95 1.28 -0.64 0.00 2.07 -1.35 -0.29 116.25 118.26 1hfw h VAL 139 Ca 0.22 -1.42 -0.08 0.00 0.82 0.00 0.00 66.70 66.24 1hfw h VAL 139 Cb 0.22 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1hfw h VAL 139 CO -0.02 0.46 0.08 -0.09 0.02 0.00 0.00 177.57 178.02 1hfw h ARG 140 N 0.55 1.08 -0.19 1.57 2.43 -1.10 -1.79 114.38 116.93 1hfw h ARG 140 Ca 0.07 -0.31 -0.04 0.00 -0.81 0.00 0.00 59.98 58.89 1hfw h ARG 140 Cb 0.80 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 1hfw h ARG 140 CO 0.07 1.01 -0.05 0.28 -1.51 0.00 0.00 179.97 179.76 1hfw h VAL 141 N 1.00 1.29 0.00 0.20 2.07 -0.92 -2.89 116.25 117.00 1hfw h VAL 141 Ca 0.19 -1.04 -0.02 0.00 0.82 0.00 0.00 66.70 66.65 1hfw h VAL 141 Cb 0.47 1.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1hfw h VAL 141 CO 0.02 0.31 -0.11 0.00 0.02 0.00 0.00 177.57 177.81 1hfw h ALA 142 N 0.72 1.46 -0.01 1.67 0.00 -0.95 -2.81 119.26 119.34 1hfw h ALA 142 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1hfw h ALA 142 Cb 0.50 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1hfw h ALA 142 CO 0.02 0.14 -0.27 0.41 0.00 0.00 0.00 179.25 179.55 1hfw n GLY 143 N -0.92 -0.09 3.74 0.00 0.00 -0.68 -4.59 105.19 102.65 1hfw n GLY 143 Ca -0.02 -0.53 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 1hfw n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hfw s ASP 144 N -2.36 7.07 0.53 1.61 -1.08 -1.06 -4.85 116.67 116.53 1hfw s ASP 144 Ca 0.24 1.28 0.23 0.00 -0.52 0.00 0.00 52.55 53.79 1hfw s ASP 144 Cb 0.19 -2.42 1.47 0.00 -1.46 0.00 0.00 42.92 40.71 1hfw s ASP 144 CO 0.49 0.01 2.15 0.07 0.52 0.00 0.00 175.17 178.41 1hfw h LYS 145 N 5.93 0.00 0.00 4.34 -0.00 -1.91 -1.72 116.57 123.21 1hfw h LYS 145 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.21 1hfw h LYS 145 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.43 1hfw h LYS 145 CO 0.72 0.05 0.00 1.04 -0.00 0.00 0.00 179.45 181.26 1hfw n GLN 146 N -4.07 0.02 0.00 0.07 6.02 -1.26 -3.22 117.38 114.95 1hfw n GLN 146 Ca -0.03 0.15 0.14 0.00 -0.01 0.00 0.00 57.00 57.25 1hfw n GLN 146 Cb 0.14 -1.50 0.52 0.00 1.02 0.00 0.00 30.24 30.42 1hfw n GLN 146 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1hfw n SER 147 N -1.48 0.22 -4.77 1.08 7.64 -0.65 -4.92 113.62 110.74 1hfw n SER 147 Ca 0.05 0.08 -0.37 0.00 1.01 0.00 0.00 58.87 59.64 1hfw n SER 147 Cb 0.23 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 1hfw n SER 147 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1hfw s ARG 148 N -2.89 3.64 -1.57 1.43 0.52 -1.20 -3.74 118.95 115.15 1hfw s ARG 148 Ca 0.16 1.89 0.00 0.00 -0.52 0.00 0.00 55.73 57.26 1hfw s ARG 148 Cb 0.19 -2.39 0.00 0.00 0.52 0.00 0.00 34.95 33.26 1hfw s ARG 148 CO 0.57 -0.68 0.00 0.41 0.02 0.00 0.00 175.30 175.62 1hfw n GLY 149 N 0.52 0.06 0.61 -3.53 0.00 -0.25 -4.90 105.19 97.70 1hfw n GLY 149 Ca 0.08 -0.16 0.07 0.00 0.00 0.00 0.00 46.02 46.01 1hfw n GLY 149 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hfw n ARG 150 N -2.64 1.21 0.00 1.61 1.74 -1.24 -5.07 116.66 112.26 1hfw n ARG 150 Ca -0.20 -1.46 0.00 0.00 -0.77 0.00 0.00 57.85 55.42 1hfw n ARG 150 Cb 0.64 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.80 1hfw n ARG 150 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hfw n GLY 151 N 0.82 -0.50 3.74 -0.13 0.00 -1.26 -4.82 105.19 103.04 1hfw n GLY 151 Ca 0.09 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1hfw n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfw s VAL 152 N -1.28 3.46 0.27 1.61 1.01 -1.26 -4.69 120.40 119.53 1hfw s VAL 152 Ca 0.00 1.26 0.12 0.00 0.00 0.00 0.00 61.98 63.35 1hfw s VAL 152 Cb 0.00 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 1hfw s VAL 152 CO 0.00 0.21 -0.19 -0.04 0.00 0.00 0.00 175.10 175.09 1hfw s MET 153 N -0.40 1.72 -0.14 2.72 1.00 -0.94 -1.90 119.30 121.37 1hfw s MET 153 Ca 0.52 -1.72 0.01 0.00 0.00 0.00 0.00 55.69 54.51 1hfw s MET 153 Cb -0.33 -1.81 0.02 0.00 0.00 0.00 0.00 34.83 32.70 1hfw s MET 153 CO 0.38 0.34 -0.15 0.08 0.00 0.00 0.00 175.02 175.67 1hfw s VAL 154 N -2.42 1.59 -0.17 -6.03 1.01 -0.04 -0.91 120.40 113.43 1hfw s VAL 154 Ca 0.29 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1hfw s VAL 154 Cb -0.05 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1hfw s VAL 154 CO 0.15 0.46 -0.09 -0.69 0.00 0.00 0.00 175.10 174.93 1hfw s VAL 155 N 1.32 3.24 -0.28 2.92 1.01 -0.35 -1.40 120.40 126.85 1hfw s VAL 155 Ca 0.01 -0.57 -0.25 0.00 0.00 0.00 0.00 61.98 61.17 1hfw s VAL 155 Cb -0.13 -2.41 0.15 0.00 0.00 0.00 0.00 36.38 33.98 1hfw s VAL 155 CO -0.08 0.48 1.17 -0.51 0.00 0.00 0.00 175.10 176.17 1hfw s ILE 156 N 0.80 0.00 -1.33 2.22 2.07 -1.08 -4.18 121.20 119.71 1hfw s ILE 156 Ca -0.03 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.15 1hfw s ILE 156 Cb -0.15 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.46 1hfw s ILE 156 CO 0.01 0.00 1.05 -3.20 -1.91 0.00 0.00 174.94 170.90 1hfw n ASN 157 N 1.94 -4.32 0.00 4.50 5.15 -1.26 -2.27 115.26 119.00 1hfw n ASN 157 Ca -0.11 -0.63 0.00 0.00 -0.60 0.00 0.00 54.58 53.24 1hfw n ASN 157 Cb 0.56 -4.81 0.00 0.00 -0.53 0.00 0.00 39.78 35.00 1hfw n ASN 157 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 1hfw n ASP 158 N -3.03 -0.67 -4.72 1.20 8.00 -1.26 -4.99 116.55 111.08 1hfw n ASP 158 Ca -0.11 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.11 1hfw n ASP 158 Cb 0.60 -1.58 -0.07 0.00 -0.02 0.00 0.00 41.12 40.05 1hfw n ASP 158 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1hfw s ARG 159 N -0.67 2.65 -0.21 -1.24 1.81 -0.96 -0.32 118.95 120.01 1hfw s ARG 159 Ca 0.00 -0.90 0.01 0.00 -1.72 0.00 0.00 55.73 53.12 1hfw s ARG 159 Cb 0.00 -2.55 0.03 0.00 -0.45 0.00 0.00 34.95 31.98 1hfw s ARG 159 CO 0.00 0.51 -0.15 0.42 -0.68 0.00 0.00 175.30 175.39 1hfw s ILE 160 N -1.55 2.25 0.12 1.52 1.01 -0.45 -2.63 121.20 121.46 1hfw s ILE 160 Ca 0.28 -1.11 0.11 0.00 0.00 0.00 0.00 60.65 59.92 1hfw s ILE 160 Cb -0.11 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.25 1hfw s ILE 160 CO 0.20 0.34 -0.26 -0.83 0.00 0.00 0.00 174.94 174.40 1hfw s GLY 161 N 1.25 1.57 0.21 6.18 0.00 -0.49 -0.80 107.32 115.24 1hfw s GLY 161 Ca 0.01 -1.43 -0.30 0.00 0.00 0.00 0.00 44.72 43.00 1hfw s GLY 161 CO -0.09 -1.40 0.99 -0.45 0.00 0.00 0.00 173.10 172.15 1hfw s SER 162 N -1.96 7.50 0.58 1.64 0.15 -1.26 -0.86 113.70 119.49 1hfw s SER 162 Ca 0.14 1.98 0.27 0.00 0.70 0.00 0.00 55.95 59.05 1hfw s SER 162 Cb -0.10 -2.61 1.63 0.00 -1.71 0.00 0.00 66.02 63.23 1hfw s SER 162 CO 0.06 0.01 2.13 0.00 1.20 0.00 0.00 173.24 176.63 1hfw h ALA 163 N 4.57 1.82 0.00 5.45 0.00 -1.72 0.27 119.26 129.66 1hfw h ALA 163 Ca -0.45 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.31 1hfw h ALA 163 Cb 1.21 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1hfw h ALA 163 CO 0.69 -0.24 -0.71 -0.09 0.00 0.00 0.00 179.25 178.91 1hfw h ARG 164 N 0.00 0.00 0.00 0.00 9.65 -1.92 -3.39 114.38 118.72 1hfw h ARG 164 Ca 0.07 0.00 -0.21 0.00 -1.10 0.00 0.00 59.98 58.75 1hfw h ARG 164 Cb 0.38 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 28.93 1hfw h ARG 164 CO -0.00 0.71 -1.78 0.66 2.80 0.00 0.00 179.97 182.36 1hfw n TYR 165 N -3.61 0.00 -2.07 2.20 4.01 -0.79 -4.96 117.16 111.94 1hfw n TYR 165 Ca -0.01 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.36 1hfw n TYR 165 Cb 0.71 -0.55 0.01 0.00 -0.31 0.00 0.00 39.34 39.21 1hfw n TYR 165 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 1hfw s ILE 166 N -2.27 2.71 0.01 -0.72 1.10 0.02 -4.65 121.20 117.39 1hfw s ILE 166 Ca -0.10 0.52 -0.29 0.00 -0.51 0.00 0.00 60.65 60.27 1hfw s ILE 166 Cb 0.04 -3.25 0.07 0.00 0.15 0.00 0.00 42.46 39.46 1hfw s ILE 166 CO 0.42 -0.02 0.65 0.28 -2.11 0.00 0.00 174.94 174.16 1hfw s THR 167 N -1.48 0.00 -0.42 4.00 -1.32 -1.20 -4.90 115.64 110.32 1hfw s THR 167 Ca 0.68 -0.01 -0.29 0.00 -1.21 0.00 0.00 61.69 60.87 1hfw s THR 167 Cb -0.33 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.69 1hfw s THR 167 CO 0.39 -0.00 1.18 -0.75 -2.21 0.00 0.00 174.62 173.22 1hfw s LYS 168 N -1.94 3.79 0.04 7.08 2.20 -1.26 -2.77 119.74 126.87 1hfw s LYS 168 Ca -0.08 0.77 0.23 0.00 -0.36 0.00 0.00 55.97 56.53 1hfw s LYS 168 Cb -0.00 -3.89 0.01 0.00 -1.51 0.00 0.00 37.83 32.44 1hfw s LYS 168 CO 0.03 -1.29 0.99 0.25 -0.36 0.00 0.00 175.35 174.97 1hfw n THR 169 N 6.63 0.14 -4.49 3.43 -2.24 -0.64 -4.92 114.28 112.19 1hfw n THR 169 Ca 0.13 -0.23 -0.20 0.00 -2.27 0.00 0.00 64.05 61.47 1hfw n THR 169 Cb 0.48 0.28 -0.15 0.00 -2.10 0.00 0.00 70.33 68.84 1hfw n THR 169 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1hfw s ASN 170 N -3.85 1.41 0.31 3.42 3.84 -1.25 -5.05 114.94 113.77 1hfw s ASN 170 Ca 0.04 -0.25 0.04 0.00 0.21 0.00 0.00 52.86 52.90 1hfw s ASN 170 Cb 0.15 -0.14 0.52 0.00 -0.55 0.00 0.00 41.25 41.22 1hfw s ASN 170 CO 0.81 0.13 1.79 0.00 -2.79 0.00 0.00 177.10 177.04 1hfw h ALA 171 N 5.71 1.23 0.00 1.71 0.00 -1.97 -3.40 119.26 122.54 1hfw h ALA 171 Ca -0.33 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.29 1hfw h ALA 171 Cb 1.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1hfw h ALA 171 CO 0.48 0.50 0.00 0.43 0.00 0.00 0.00 179.25 180.66 1hfw n SER 172 N -4.18 0.40 -4.94 0.00 7.64 -1.26 -5.11 113.62 106.17 1hfw n SER 172 Ca 0.00 -1.10 -0.25 0.00 1.01 0.00 0.00 58.87 58.53 1hfw n SER 172 Cb 0.34 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.53 1hfw n SER 172 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1hfw s THR 173 N -0.10 5.11 0.32 0.44 -4.23 -1.26 -5.01 115.64 110.90 1hfw s THR 173 Ca 0.00 -0.39 0.10 0.00 -1.18 0.00 0.00 61.69 60.22 1hfw s THR 173 Cb 0.00 -3.83 0.03 0.00 1.34 0.00 0.00 72.50 70.05 1hfw s THR 173 CO 0.00 -0.48 1.72 -0.07 -0.54 0.00 0.00 174.62 175.25 1hfw h LEU 174 N 1.04 0.07 -3.35 4.79 3.38 -1.97 -3.04 115.31 116.24 1hfw h LEU 174 Ca -0.49 -0.03 -0.26 0.00 0.09 0.00 0.00 57.88 57.18 1hfw h LEU 174 Cb 1.21 -0.02 -0.16 0.00 0.09 0.00 0.00 40.66 41.78 1hfw h LEU 174 CO 0.63 0.53 0.33 -0.90 0.09 0.00 0.00 178.44 179.13 1hfw n ASP 175 N -3.98 3.95 -0.32 -0.43 5.75 -1.26 -4.62 116.55 115.64 1hfw n ASP 175 Ca -0.02 -3.06 -0.04 0.00 -0.01 0.00 0.00 54.79 51.66 1hfw n ASP 175 Cb 0.50 -0.72 0.08 0.00 -1.03 0.00 0.00 41.12 39.95 1hfw n ASP 175 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1hfw h THR 176 N 1.56 1.25 -3.02 2.12 1.03 -1.86 -3.42 112.91 110.57 1hfw h THR 176 Ca 0.32 -0.59 -0.57 0.00 -0.01 0.00 0.00 66.41 65.57 1hfw h THR 176 Cb 2.17 0.06 -0.04 0.00 -1.07 0.00 0.00 68.15 69.28 1hfw h THR 176 CO 0.69 0.27 1.02 -0.36 -0.01 0.00 0.00 175.52 177.13 1hfw s PHE 177 N -5.89 2.50 0.14 0.00 0.08 -1.26 -1.62 117.98 111.94 1hfw s PHE 177 Ca -0.13 0.77 -0.10 0.00 0.12 0.00 0.00 56.93 57.59 1hfw s PHE 177 Cb 0.16 -3.92 0.00 0.00 -0.57 0.00 0.00 43.02 38.69 1hfw s PHE 177 CO 0.82 -2.11 0.29 1.03 -0.10 0.00 0.00 175.22 175.15 1hfw s ARG 178 N 4.31 1.07 -0.44 0.44 0.52 -1.12 -4.97 118.95 118.76 1hfw s ARG 178 Ca 0.61 -1.04 0.03 0.00 -0.52 0.00 0.00 55.73 54.80 1hfw s ARG 178 Cb -0.19 0.39 0.16 0.00 0.52 0.00 0.00 34.95 35.82 1hfw s ARG 178 CO 0.25 -0.39 0.31 0.00 0.02 0.00 0.00 175.30 175.49 1hfw s ALA 179 N -3.91 1.77 0.21 2.13 0.00 -1.26 -3.20 121.76 117.49 1hfw s ALA 179 Ca 0.12 -2.53 -0.15 0.00 0.00 0.00 0.00 51.96 49.40 1hfw s ALA 179 Cb 0.03 -1.73 0.23 0.00 0.00 0.00 0.00 23.12 21.65 1hfw s ALA 179 CO -0.05 -2.04 1.60 -0.91 0.00 0.00 0.00 175.76 174.37 1hfw h ASN 180 N 6.16 -0.83 1.04 0.00 2.35 -1.92 0.21 115.58 122.60 1hfw h ASN 180 Ca 0.14 0.22 -0.09 0.00 -0.55 0.00 0.00 56.30 56.02 1hfw h ASN 180 Cb 0.91 0.49 -0.02 0.00 0.05 0.00 0.00 38.32 39.75 1hfw h ASN 180 CO 0.42 -0.26 -1.00 -0.33 -1.65 0.00 0.00 177.43 174.60 1hfw h GLU 181 N -0.05 0.00 0.00 0.81 4.39 -1.98 -3.38 114.58 114.37 1hfw h GLU 181 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 1hfw h GLU 181 Cb 0.53 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 1hfw h GLU 181 CO -0.72 0.21 -1.33 0.39 -1.16 0.00 0.00 179.01 176.41 1hfw n GLU 182 N -2.90 0.85 -0.30 2.33 4.71 -1.05 -5.11 120.64 119.17 1hfw n GLU 182 Ca -0.03 -0.08 0.04 0.00 -0.01 0.00 0.00 57.16 57.07 1hfw n GLU 182 Cb 0.70 -1.39 -0.01 0.00 -1.01 0.00 0.00 31.44 29.74 1hfw n GLU 182 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1hfw n GLY 183 N 1.44 -1.69 3.93 0.62 0.00 0.72 -4.90 105.19 105.31 1hfw n GLY 183 Ca 0.00 -1.24 -0.27 0.00 0.00 0.00 0.00 46.02 44.51 1hfw n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hfw s TYR 184 N -0.63 3.49 0.29 1.61 2.02 -1.26 -4.65 117.35 118.21 1hfw s TYR 184 Ca 0.00 0.26 0.10 0.00 -0.37 0.00 0.00 57.07 57.05 1hfw s TYR 184 Cb 0.00 -1.78 0.41 0.00 -0.40 0.00 0.00 41.96 40.19 1hfw s TYR 184 CO 0.00 0.45 1.65 -0.07 -1.57 0.00 0.00 175.55 176.01 1hfw h LEU 185 N 2.19 0.05 -7.99 -1.29 3.38 -1.27 -3.39 115.31 106.98 1hfw h LEU 185 Ca -0.48 -0.03 0.35 0.00 0.09 0.00 0.00 57.88 57.81 1hfw h LEU 185 Cb 1.19 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.86 1hfw h LEU 185 CO 0.69 0.60 0.91 -0.83 0.09 0.00 0.00 178.44 179.90 1hfw s GLY 186 N -4.41 -0.12 0.06 0.83 0.00 -1.18 0.30 107.32 102.80 1hfw s GLY 186 Ca -0.02 0.01 -0.01 0.00 0.00 0.00 0.00 44.72 44.70 1hfw s GLY 186 CO 0.76 5.87 -0.04 -1.34 0.00 0.00 0.00 173.10 178.36 1hfw s VAL 187 N -2.02 0.29 -0.26 1.40 -7.23 -0.57 -1.34 120.40 110.68 1hfw s VAL 187 Ca 0.30 -1.78 0.03 0.00 -1.81 0.00 0.00 61.98 58.72 1hfw s VAL 187 Cb -0.01 -1.48 0.06 0.00 0.56 0.00 0.00 36.38 35.52 1hfw s VAL 187 CO -0.01 -0.95 -0.10 -0.63 -0.31 0.00 0.00 175.10 173.11 1hfw s ILE 188 N -3.74 2.11 -0.02 -0.62 1.01 0.57 -0.74 121.20 119.77 1hfw s ILE 188 Ca 0.06 -1.63 0.03 0.00 0.00 0.00 0.00 60.65 59.12 1hfw s ILE 188 Cb 0.07 -2.25 -0.00 0.00 0.01 0.00 0.00 42.46 40.29 1hfw s ILE 188 CO -0.09 -0.07 -0.11 -0.63 0.00 0.00 0.00 174.94 174.04 1hfw s ILE 189 N 1.12 0.95 -1.45 2.92 -1.09 -0.73 -4.75 121.20 118.17 1hfw s ILE 189 Ca -0.08 -0.47 -0.10 0.00 -2.23 0.00 0.00 60.65 57.77 1hfw s ILE 189 Cb -0.20 -0.82 0.05 0.00 -1.58 0.00 0.00 42.46 39.91 1hfw s ILE 189 CO -0.05 0.28 1.00 0.61 -1.23 0.00 0.00 174.94 175.55 1hfw n GLY 190 N 3.12 -0.48 2.40 6.18 0.00 -1.26 -1.50 105.19 113.65 1hfw n GLY 190 Ca -0.17 0.20 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1hfw n GLY 190 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1hfw n ASN 191 N -2.92 -4.97 -4.19 1.61 5.03 -1.26 -4.97 115.26 103.59 1hfw n ASN 191 Ca -0.02 0.27 -0.25 0.00 0.87 0.00 0.00 54.58 55.45 1hfw n ASN 191 Cb 0.56 -4.32 -0.15 0.00 -1.02 0.00 0.00 39.78 34.85 1hfw n ASN 191 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1hfw s ARG 192 N -4.22 1.43 -0.15 3.52 3.52 -0.56 -5.13 118.95 117.36 1hfw s ARG 192 Ca 0.00 -0.70 -0.16 0.00 -0.13 0.00 0.00 55.73 54.73 1hfw s ARG 192 Cb 0.00 -1.41 -0.04 0.00 -1.56 0.00 0.00 34.95 31.94 1hfw s ARG 192 CO 0.00 0.38 0.41 0.42 -0.81 0.00 0.00 175.30 175.70 1hfw s ILE 193 N -0.51 5.23 -0.38 4.11 1.01 -1.26 -1.77 121.20 127.63 1hfw s ILE 193 Ca 0.07 0.78 0.02 0.00 0.00 0.00 0.00 60.65 61.52 1hfw s ILE 193 Cb -0.07 -3.74 0.11 0.00 0.01 0.00 0.00 42.46 38.76 1hfw s ILE 193 CO -0.00 0.33 0.12 -0.31 0.00 0.00 0.00 174.94 175.07 1hfw s TYR 194 N 0.71 3.66 0.07 3.97 2.02 0.08 -5.00 117.35 122.87 1hfw s TYR 194 Ca 0.22 -2.89 -0.28 0.00 -0.37 0.00 0.00 57.07 53.74 1hfw s TYR 194 Cb -0.14 -2.99 -0.05 0.00 -0.40 0.00 0.00 41.96 38.37 1hfw s TYR 194 CO 0.08 -0.93 0.90 0.71 -1.57 0.00 0.00 175.55 174.74 1hfw s TYR 195 N 0.80 3.76 -0.11 2.71 2.02 -1.26 -1.51 117.35 123.76 1hfw s TYR 195 Ca 0.11 1.68 -0.00 0.00 -0.37 0.00 0.00 57.07 58.49 1hfw s TYR 195 Cb -0.21 -2.99 -0.07 0.00 -0.40 0.00 0.00 41.96 38.29 1hfw s TYR 195 CO -0.06 0.19 -0.11 1.04 -1.57 0.00 0.00 175.55 175.04 1hfw n GLN 196 N 3.00 0.27 -4.29 -0.62 6.02 0.15 -4.95 117.38 116.95 1hfw n GLN 196 Ca 0.01 0.07 -0.16 0.00 -0.01 0.00 0.00 57.00 56.92 1hfw n GLN 196 Cb 0.50 -1.17 -0.10 0.00 1.02 0.00 0.00 30.24 30.48 1hfw n GLN 196 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1hfw s ASN 197 N -5.21 1.27 -0.05 1.08 0.01 -0.82 -5.03 114.94 106.18 1hfw s ASN 197 Ca -0.15 -1.30 0.00 0.00 -0.71 0.00 0.00 52.86 50.71 1hfw s ASN 197 Cb 0.04 0.13 0.02 0.00 0.41 0.00 0.00 41.25 41.86 1hfw s ASN 197 CO 0.25 -0.65 -0.02 -0.13 -1.51 0.00 0.00 177.10 175.03 1hfw s ARG 198 N -3.98 0.63 0.45 -0.60 0.52 -1.26 -4.78 118.95 109.94 1hfw s ARG 198 Ca 0.32 0.00 -0.23 0.00 -0.52 0.00 0.00 55.73 55.30 1hfw s ARG 198 Cb 0.07 -0.79 -0.07 0.00 0.52 0.00 0.00 34.95 34.68 1hfw s ARG 198 CO 0.10 -0.16 1.20 0.96 0.02 0.00 0.00 175.30 177.42 1hfw s ILE 199 N 1.24 2.95 -0.96 1.52 -4.36 -1.26 -4.94 121.20 115.39 1hfw s ILE 199 Ca -0.06 0.74 -0.01 0.00 -0.26 0.00 0.00 60.65 61.05 1hfw s ILE 199 Cb -0.14 -3.39 0.33 0.00 1.25 0.00 0.00 42.46 40.52 1hfw s ILE 199 CO -0.02 0.02 1.89 -0.67 0.24 0.00 0.00 174.94 176.40 1hfw n ASP 200 N -0.40 7.40 -4.06 4.36 -0.08 -1.26 -4.94 116.55 117.57 1hfw n ASP 200 Ca 0.07 -3.74 -0.08 0.00 -1.51 0.00 0.00 54.79 49.52 1hfw n ASP 200 Cb 0.47 -1.13 -0.09 0.00 2.34 0.00 0.00 41.12 42.71 1hfw n ASP 200 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1hfw s LYS 201 N -4.24 0.78 0.34 -0.67 -0.14 -1.26 -5.06 119.74 109.49 1hfw s LYS 201 Ca 0.44 -1.23 -0.24 0.00 -1.36 0.00 0.00 55.97 53.58 1hfw s LYS 201 Cb 0.28 0.25 -0.10 0.00 -1.68 0.00 0.00 37.83 36.58 1hfw s LYS 201 CO -0.23 -0.20 0.92 -0.51 -0.76 0.00 0.00 175.35 174.56 1hfw s LEU 202 N -2.95 4.22 0.17 3.17 1.43 -0.48 -5.03 118.68 119.22 1hfw s LEU 202 Ca 0.12 1.73 -0.24 0.00 -1.03 0.00 0.00 54.13 54.72 1hfw s LEU 202 Cb 0.07 -4.11 0.07 0.00 0.03 0.00 0.00 46.19 42.24 1hfw s LEU 202 CO -0.06 -0.14 0.98 -1.38 0.23 0.00 0.00 176.35 175.98 1hfw s HIS 203 N -1.77 -0.06 0.00 0.29 -3.43 -1.26 -4.66 115.29 104.40 1hfw s HIS 203 Ca 0.53 -0.29 0.00 0.00 -0.80 0.00 0.00 55.06 54.50 1hfw s HIS 203 Cb -0.16 0.66 0.00 0.00 -1.43 0.00 0.00 32.58 31.66 1hfw s HIS 203 CO 0.20 -0.87 0.00 0.25 -2.00 0.00 0.00 174.74 172.32 1hfw n THR 204 N -0.54 0.00 0.32 -5.38 -2.24 -0.54 -0.95 114.28 104.96 1hfw n THR 204 Ca -0.05 0.00 0.20 0.00 -2.27 0.00 0.00 64.05 61.93 1hfw n THR 204 Cb 0.60 0.00 1.11 0.00 -2.10 0.00 0.00 70.33 69.94 1hfw n THR 204 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1hfw h THR 205 N 0.00 0.19 -0.43 4.28 1.35 -1.78 -2.01 112.91 114.51 1hfw h THR 205 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.83 1hfw h THR 205 Cb 0.00 0.99 -0.02 0.00 -1.73 0.00 0.00 68.15 67.40 1hfw h THR 205 CO 0.00 0.00 0.02 0.54 -0.25 0.00 0.00 175.52 175.83 1hfw n ARG 206 N -3.35 3.72 -3.84 4.72 1.74 -0.12 -4.97 116.66 114.55 1hfw n ARG 206 Ca -0.03 -3.01 -0.36 0.00 -0.77 0.00 0.00 57.85 53.69 1hfw n ARG 206 Cb 0.08 -2.04 -0.06 0.00 -1.02 0.00 0.00 32.46 29.43 1hfw n ARG 206 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1hfw s SER 207 N -1.45 6.43 0.05 0.55 0.15 -0.76 -4.57 113.70 114.10 1hfw s SER 207 Ca 0.48 0.49 0.27 0.00 0.70 0.00 0.00 55.95 57.89 1hfw s SER 207 Cb 0.38 -2.07 0.89 0.00 -1.71 0.00 0.00 66.02 63.52 1hfw s SER 207 CO 0.12 0.34 1.72 1.33 1.20 0.00 0.00 173.24 177.94 1hfw n VAL 208 N 1.56 0.15 -2.49 4.45 0.24 -1.26 -4.83 118.33 116.15 1hfw n VAL 208 Ca -0.16 -0.08 -0.42 0.00 -2.04 0.00 0.00 64.34 61.63 1hfw n VAL 208 Cb 0.54 -0.31 -0.03 0.00 -1.47 0.00 0.00 33.84 32.58 1hfw n VAL 208 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1hfw s PHE 209 N -3.04 3.24 -0.17 6.34 0.08 -1.26 -5.00 117.98 118.17 1hfw s PHE 209 Ca 0.12 1.27 -0.04 0.00 0.12 0.00 0.00 56.93 58.40 1hfw s PHE 209 Cb 0.17 -3.39 0.06 0.00 -0.57 0.00 0.00 43.02 39.28 1hfw s PHE 209 CO 0.60 -1.17 0.06 0.34 -0.10 0.00 0.00 175.22 174.95 1hfw s ASP 210 N 1.42 2.51 0.00 1.36 2.15 -1.26 -4.60 116.67 118.26 1hfw s ASP 210 Ca 0.55 -0.66 0.17 0.00 0.43 0.00 0.00 52.55 53.05 1hfw s ASP 210 Cb -0.24 -0.40 0.38 0.00 -0.30 0.00 0.00 42.92 42.36 1hfw s ASP 210 CO 0.22 -0.32 1.29 1.33 -0.17 0.00 0.00 175.17 177.52 1hfw n VAL 211 N 5.17 0.68 -2.01 1.11 0.24 -1.26 -4.92 118.33 117.34 1hfw n VAL 211 Ca -0.08 -0.84 -0.43 0.00 -2.04 0.00 0.00 64.34 60.96 1hfw n VAL 211 Cb 0.48 0.78 -0.03 0.00 -1.47 0.00 0.00 33.84 33.61 1hfw n VAL 211 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1hfw s ARG 212 N -1.15 3.92 0.00 7.34 3.00 -1.26 -1.37 118.95 129.43 1hfw s ARG 212 Ca 0.32 1.96 0.00 0.00 0.00 0.00 0.00 55.73 58.01 1hfw s ARG 212 Cb 0.18 -4.05 0.00 0.00 0.00 0.00 0.00 34.95 31.08 1hfw s ARG 212 CO 0.24 -1.15 0.00 0.41 0.00 0.00 0.00 175.30 174.80 1hfw n GLY 213 N 4.52 1.15 3.87 -3.53 0.00 -1.26 -5.09 105.19 104.84 1hfw n GLY 213 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1hfw n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hfw s LEU 214 N 0.00 4.15 0.00 0.99 1.43 -0.47 -4.99 118.68 119.78 1hfw s LEU 214 Ca 0.00 1.03 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 1hfw s LEU 214 Cb 0.00 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.44 1hfw s LEU 214 CO 0.00 -0.10 0.00 0.35 0.23 0.00 0.00 176.35 176.83 1hfw n THR 215 N -0.16 0.00 -4.07 5.49 -2.24 -1.26 -5.03 114.28 107.00 1hfw n THR 215 Ca 0.01 -0.19 -0.08 0.00 -2.27 0.00 0.00 64.05 61.52 1hfw n THR 215 Cb 0.53 0.69 -0.09 0.00 -2.10 0.00 0.00 70.33 69.35 1hfw n THR 215 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1hfw s SER 216 N -1.23 0.34 0.10 3.42 1.04 -1.26 -4.96 113.70 111.15 1hfw s SER 216 Ca 0.00 -1.03 0.08 0.00 0.48 0.00 0.00 55.95 55.48 1hfw s SER 216 Cb 0.00 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.36 1hfw s SER 216 CO 0.00 -0.69 -0.20 -0.76 0.98 0.00 0.00 173.24 172.58 1hfw s LEU 217 N -2.96 2.30 0.56 2.42 1.43 -1.26 -5.12 118.68 116.05 1hfw s LEU 217 Ca 0.14 -0.69 -0.21 0.00 -1.03 0.00 0.00 54.13 52.34 1hfw s LEU 217 Cb 0.07 -0.83 -0.04 0.00 0.03 0.00 0.00 46.19 45.42 1hfw s LEU 217 CO -0.05 0.03 1.31 -2.84 0.23 0.00 0.00 176.35 175.03 1hfw s PRO 218 N -1.94 3.09 -0.10 1.29 0.02 -1.26 -4.96 135.00 131.14 1hfw s PRO 218 Ca 0.06 2.11 -0.27 0.00 0.02 0.00 0.00 61.00 62.92 1hfw s PRO 218 Cb -0.10 -2.16 -0.02 0.00 0.02 0.00 0.00 34.50 32.24 1hfw s PRO 218 CO 0.04 -1.19 0.88 0.21 -0.33 0.00 0.00 177.00 176.61 1hfw s LYS 219 N -3.01 4.41 -0.03 5.54 2.20 -1.26 -4.90 119.74 122.68 1hfw s LYS 219 Ca 0.73 1.18 -0.00 0.00 -0.36 0.00 0.00 55.97 57.52 1hfw s LYS 219 Cb -0.37 -3.52 0.03 0.00 -1.51 0.00 0.00 37.83 32.46 1hfw s LYS 219 CO 0.43 -0.19 0.01 0.08 -0.36 0.00 0.00 175.35 175.32 1hfw s VAL 220 N 1.62 0.13 0.31 4.02 1.01 -1.26 -0.90 120.40 125.32 1hfw s VAL 220 Ca 0.44 0.15 0.10 0.00 0.00 0.00 0.00 61.98 62.67 1hfw s VAL 220 Cb -0.18 -0.26 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 1hfw s VAL 220 CO 0.18 0.16 -0.04 -1.81 0.00 0.00 0.00 175.10 173.59 1hfw s ASP 221 N 1.29 4.16 -0.12 3.32 1.01 -1.08 -4.99 116.67 120.26 1hfw s ASP 221 Ca -0.06 -0.90 0.03 0.00 0.71 0.00 0.00 52.55 52.33 1hfw s ASP 221 Cb -0.13 -0.57 0.00 0.00 1.01 0.00 0.00 42.92 43.23 1hfw s ASP 221 CO -0.02 -0.11 -0.22 -0.63 0.21 0.00 0.00 175.17 174.40 1hfw s ILE 222 N -2.46 2.21 -0.02 0.77 1.01 -1.26 -0.71 121.20 120.74 1hfw s ILE 222 Ca 0.33 -0.95 0.07 0.00 0.00 0.00 0.00 60.65 60.09 1hfw s ILE 222 Cb -0.03 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 1hfw s ILE 222 CO 0.19 0.55 -0.21 -0.76 0.00 0.00 0.00 174.94 174.70 1hfw s LEU 223 N 0.48 2.33 0.30 2.97 1.43 -0.31 -4.97 118.68 120.92 1hfw s LEU 223 Ca -0.14 -0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 52.47 1hfw s LEU 223 Cb -0.17 -1.42 -0.07 0.00 0.03 0.00 0.00 46.19 44.56 1hfw s LEU 223 CO 0.06 0.32 0.64 -0.47 0.23 0.00 0.00 176.35 177.13 1hfw s TYR 224 N -0.69 3.43 -0.13 0.29 5.04 -1.26 -0.91 117.35 123.12 1hfw s TYR 224 Ca 0.11 0.96 -0.01 0.00 -2.44 0.00 0.00 57.07 55.69 1hfw s TYR 224 Cb -0.10 -2.34 -0.02 0.00 0.35 0.00 0.00 41.96 39.85 1hfw s TYR 224 CO 0.00 0.13 -0.11 0.20 -1.34 0.00 0.00 175.55 174.43 1hfw s GLY 225 N -2.65 1.59 0.20 8.97 0.00 -0.56 -4.88 107.32 109.98 1hfw s GLY 225 Ca 0.49 -0.87 -0.24 0.00 0.00 0.00 0.00 44.72 44.10 1hfw s GLY 225 CO 0.24 -0.21 0.90 -2.52 0.00 0.00 0.00 173.10 171.50 1hfw s TYR 226 N 0.24 -0.13 0.33 1.90 1.13 -1.26 -4.45 117.35 115.11 1hfw s TYR 226 Ca -0.07 -0.24 -0.29 0.00 -1.41 0.00 0.00 57.07 55.06 1hfw s TYR 226 Cb -0.15 0.67 -0.11 0.00 -1.10 0.00 0.00 41.96 41.26 1hfw s TYR 226 CO 0.05 -0.97 1.57 -0.65 -2.51 0.00 0.00 175.55 173.04 1hfw s GLN 227 N -3.37 4.10 -1.00 -3.49 -0.21 -1.26 -2.18 119.66 112.24 1hfw s GLN 227 Ca 0.12 2.60 0.00 0.00 0.02 0.00 0.00 55.36 58.11 1hfw s GLN 227 Cb -0.03 -3.00 0.00 0.00 1.00 0.00 0.00 33.01 30.99 1hfw s GLN 227 CO 0.04 -0.62 0.00 -0.25 -2.12 0.00 0.00 175.29 172.34 1hfw n ASP 228 N 1.53 -4.27 -4.72 5.90 8.00 -1.26 -4.97 116.55 116.76 1hfw n ASP 228 Ca 0.06 0.23 -0.43 0.00 0.71 0.00 0.00 54.79 55.36 1hfw n ASP 228 Cb 0.38 -2.60 -0.02 0.00 -0.02 0.00 0.00 41.12 38.85 1hfw n ASP 228 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1hfw n ASP 229 N 0.25 3.54 -4.76 -2.24 5.75 -0.93 -4.95 116.55 113.21 1hfw n ASP 229 Ca -0.09 1.13 -0.39 0.00 -0.01 0.00 0.00 54.79 55.43 1hfw n ASP 229 Cb 0.33 -1.54 -0.06 0.00 -1.03 0.00 0.00 41.12 38.83 1hfw n ASP 229 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 1hfw s PRO 230 N -0.23 4.74 0.19 0.11 0.04 -1.26 -4.67 135.00 133.93 1hfw s PRO 230 Ca 0.67 1.49 0.07 0.00 0.04 0.00 0.00 61.00 63.27 1hfw s PRO 230 Cb -0.55 -3.13 0.08 0.00 0.04 0.00 0.00 34.50 30.95 1hfw s PRO 230 CO 0.47 0.40 1.44 1.49 0.04 0.00 0.00 177.00 180.84 1hfw h GLU 231 N 3.81 0.08 0.00 4.56 4.81 -1.93 -3.29 114.58 122.62 1hfw h GLU 231 Ca -0.46 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1hfw h GLU 231 Cb 1.20 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1hfw h GLU 231 CO 0.67 0.84 0.00 0.10 -0.73 0.00 0.00 179.01 179.89 1hfw h TYR 232 N 0.04 0.00 -0.04 0.92 -0.00 -1.94 -1.89 116.97 114.07 1hfw h TYR 232 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.59 1hfw h TYR 232 Cb 1.41 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 38.12 1hfw h TYR 232 CO 0.01 0.00 -0.52 -0.07 -0.00 0.00 0.00 178.16 177.58 1hfw h LEU 233 N 0.00 0.11 -0.23 0.10 3.38 -2.00 -1.45 115.31 115.23 1hfw h LEU 233 Ca 0.00 -0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1hfw h LEU 233 Cb 0.04 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1hfw h LEU 233 CO 0.00 0.61 -0.27 1.88 0.09 0.00 0.00 178.44 180.74 1hfw h TYR 234 N 0.08 0.71 -0.88 1.13 -1.99 -1.57 -2.46 116.97 111.99 1hfw h TYR 234 Ca -0.00 -0.23 -0.01 0.00 2.00 0.00 0.00 58.73 60.50 1hfw h TYR 234 Cb 0.94 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 39.48 1hfw h TYR 234 CO 0.01 0.94 0.53 -0.44 -0.00 0.00 0.00 178.16 179.19 1hfw h ASP 235 N 0.28 1.07 -0.26 3.88 3.32 -1.48 -1.07 116.42 122.15 1hfw h ASP 235 Ca 0.03 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1hfw h ASP 235 Cb 0.84 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.11 1hfw h ASP 235 CO 0.07 0.83 0.13 0.00 -1.72 0.00 0.00 179.24 178.54 1hfw h ALA 236 N 1.29 0.34 -0.59 3.45 0.00 -1.22 -0.54 119.26 121.98 1hfw h ALA 236 Ca 0.32 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1hfw h ALA 236 Cb -0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1hfw h ALA 236 CO -0.06 -0.10 0.39 0.00 0.00 0.00 0.00 179.25 179.48 1hfw h ALA 237 N 0.99 0.75 -0.54 0.00 0.00 -1.09 -2.20 119.26 117.17 1hfw h ALA 237 Ca 0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1hfw h ALA 237 Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1hfw h ALA 237 CO -0.01 0.18 0.24 0.82 0.00 0.00 0.00 179.25 180.49 1hfw h ILE 238 N 0.80 1.21 -0.19 0.00 2.04 -0.98 -2.46 117.51 117.92 1hfw h ILE 238 Ca 0.22 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.50 1hfw h ILE 238 Cb -0.09 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1hfw h ILE 238 CO -0.05 0.24 0.13 1.56 0.00 0.00 0.00 178.15 180.03 1hfw h GLN 239 N 0.72 0.17 -0.84 2.37 4.20 -0.74 -2.40 115.11 118.59 1hfw h GLN 239 Ca 0.18 -0.01 -0.19 0.00 0.06 0.00 0.00 58.65 58.70 1hfw h GLN 239 Cb 0.14 -0.04 -0.11 0.00 0.30 0.00 0.00 27.48 27.78 1hfw h GLN 239 CO -0.02 0.11 0.24 0.72 -0.67 0.00 0.00 178.83 179.21 1hfw n HIS 240 N -4.50 1.88 -2.90 2.96 8.25 -0.86 -4.95 115.22 115.09 1hfw n HIS 240 Ca 0.01 -1.00 -0.21 0.00 -0.26 0.00 0.00 57.72 56.26 1hfw n HIS 240 Cb 0.15 -0.58 0.03 0.00 1.12 0.00 0.00 29.99 30.71 1hfw n HIS 240 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1hfw n GLY 241 N -0.11 -0.43 3.79 -1.41 0.00 -0.90 -5.00 105.19 101.12 1hfw n GLY 241 Ca 0.32 0.05 -0.34 0.00 0.00 0.00 0.00 46.02 46.04 1hfw n GLY 241 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hfw s VAL 242 N -3.12 3.55 -0.29 1.61 -7.23 -1.16 -4.80 120.40 108.95 1hfw s VAL 242 Ca 0.25 0.93 0.18 0.00 -1.81 0.00 0.00 61.98 61.53 1hfw s VAL 242 Cb -0.11 -3.37 -0.25 0.00 0.56 0.00 0.00 36.38 33.21 1hfw s VAL 242 CO 0.31 -0.24 0.51 0.29 -0.31 0.00 0.00 175.10 175.66 1hfw n LYS 243 N -1.25 0.79 -3.74 4.82 4.76 -0.08 -4.83 118.16 118.62 1hfw n LYS 243 Ca 0.10 -0.11 -0.13 0.00 -2.87 0.00 0.00 58.31 55.30 1hfw n LYS 243 Cb 0.52 -1.39 -0.08 0.00 -1.84 0.00 0.00 35.03 32.24 1hfw n LYS 243 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1hfw s GLY 244 N -3.58 -0.17 -0.07 0.72 0.00 -1.11 -2.03 107.32 101.08 1hfw s GLY 244 Ca -0.02 0.25 0.01 0.00 0.00 0.00 0.00 44.72 44.96 1hfw s GLY 244 CO 0.73 0.03 -0.07 -0.42 0.00 0.00 0.00 173.10 173.38 1hfw s ILE 245 N -1.82 0.80 -0.22 0.90 1.01 -0.16 -2.64 121.20 119.07 1hfw s ILE 245 Ca -0.10 -0.22 -0.09 0.00 0.00 0.00 0.00 60.65 60.24 1hfw s ILE 245 Cb -0.03 -0.81 -0.05 0.00 0.01 0.00 0.00 42.46 41.58 1hfw s ILE 245 CO 0.01 0.30 0.12 -0.69 0.00 0.00 0.00 174.94 174.69 1hfw s VAL 246 N 1.23 5.11 -0.32 2.92 1.01 0.12 -1.34 120.40 129.12 1hfw s VAL 246 Ca -0.05 0.09 -0.10 0.00 0.00 0.00 0.00 61.98 61.92 1hfw s VAL 246 Cb -0.14 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1hfw s VAL 246 CO -0.02 0.38 0.15 -0.47 0.00 0.00 0.00 175.10 175.15 1hfw s TYR 247 N 0.88 3.19 -1.21 5.22 5.04 0.07 -1.16 117.35 129.37 1hfw s TYR 247 Ca 0.06 -0.71 -0.16 0.00 -2.44 0.00 0.00 57.07 53.82 1hfw s TYR 247 Cb -0.13 -2.36 0.12 0.00 0.35 0.00 0.00 41.96 39.94 1hfw s TYR 247 CO 0.03 -0.51 1.53 0.00 -1.34 0.00 0.00 175.55 175.26 1hfw s ALA 248 N 1.58 3.62 0.82 3.97 0.00 -0.09 -0.41 121.76 131.26 1hfw s ALA 248 Ca 0.04 -3.09 -0.12 0.00 0.00 0.00 0.00 51.96 48.79 1hfw s ALA 248 Cb -0.18 -4.35 0.09 0.00 0.00 0.00 0.00 23.12 18.68 1hfw s ALA 248 CO 0.06 -3.04 1.14 0.20 0.00 0.00 0.00 175.76 174.12 1hfw s GLY 249 N 3.55 1.60 0.25 0.00 0.00 -1.00 -1.50 107.32 110.21 1hfw s GLY 249 Ca 0.47 -0.49 -0.30 0.00 0.00 0.00 0.00 44.72 44.40 1hfw s GLY 249 CO 0.02 -0.01 1.11 1.06 0.00 0.00 0.00 173.10 175.28 1hfw s MET 250 N -5.38 4.61 3.26 2.90 -1.94 -1.24 -0.20 119.30 121.31 1hfw s MET 250 Ca 0.62 1.79 0.00 0.00 -1.71 0.00 0.00 55.69 56.39 1hfw s MET 250 Cb -0.13 -3.21 0.00 0.00 2.01 0.00 0.00 34.83 33.50 1hfw s MET 250 CO 0.52 0.15 0.00 0.41 -0.01 0.00 0.00 175.02 176.09 1hfw n GLY 251 N 1.49 2.53 2.24 -0.03 0.00 -1.26 -0.92 105.19 109.24 1hfw n GLY 251 Ca 0.00 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 1hfw n GLY 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hfw n ALA 252 N 8.04 7.07 -1.88 4.61 0.00 -1.26 -4.55 120.51 132.53 1hfw n ALA 252 Ca 0.00 -3.02 -0.12 0.00 0.00 0.00 0.00 53.44 50.30 1hfw n ALA 252 Cb 0.00 -2.92 -0.02 0.00 0.00 0.00 0.00 19.45 16.51 1hfw n ALA 252 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hfw n GLY 253 N 2.91 0.42 3.75 0.00 0.00 -0.99 -4.74 105.19 106.54 1hfw n GLY 253 Ca 0.64 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1hfw n GLY 253 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hfw s SER 254 N -2.63 5.10 -0.00 1.61 0.01 -0.09 -4.83 113.70 112.87 1hfw s SER 254 Ca 0.00 2.36 0.04 0.00 1.31 0.00 0.00 55.95 59.66 1hfw s SER 254 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 1hfw s SER 254 CO 0.00 -1.65 -0.12 -0.69 0.41 0.00 0.00 173.24 171.19 1hfw s VAL 255 N -1.68 0.97 0.78 3.43 1.01 -1.26 -3.66 120.40 119.99 1hfw s VAL 255 Ca 0.76 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 1hfw s VAL 255 Cb -0.29 -0.83 0.08 0.00 0.00 0.00 0.00 36.38 35.34 1hfw s VAL 255 CO 0.34 0.21 1.12 -0.94 0.00 0.00 0.00 175.10 175.84 1hfw s SER 256 N -0.45 4.50 0.52 3.32 1.04 -1.26 -4.83 113.70 116.53 1hfw s SER 256 Ca 0.04 0.58 0.20 0.00 0.48 0.00 0.00 55.95 57.25 1hfw s SER 256 Cb -0.05 -1.09 1.34 0.00 0.10 0.00 0.00 66.02 66.31 1hfw s SER 256 CO -0.00 -1.86 2.12 -0.37 0.98 0.00 0.00 173.24 174.11 1hfw h VAL 257 N -0.92 0.89 0.11 5.02 -1.51 -1.99 -0.90 116.25 116.94 1hfw h VAL 257 Ca -0.45 -0.23 -0.28 0.00 -1.23 0.00 0.00 66.70 64.51 1hfw h VAL 257 Cb 1.31 1.13 0.02 0.00 -2.13 0.00 0.00 31.29 31.62 1hfw h VAL 257 CO 0.61 0.06 -1.19 0.03 -1.23 0.00 0.00 177.57 175.85 1hfw h ARG 258 N 0.00 0.45 -0.26 5.19 3.08 -1.93 -2.96 114.38 117.96 1hfw h ARG 258 Ca -0.00 -0.63 -0.14 0.00 0.07 0.00 0.00 59.98 59.28 1hfw h ARG 258 Cb 0.13 0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1hfw h ARG 258 CO 0.01 1.27 -0.42 0.78 -1.07 0.00 0.00 179.97 180.53 1hfw h GLY 259 N 0.93 0.68 1.19 0.04 0.00 -1.67 -2.17 103.07 102.07 1hfw h GLY 259 Ca -0.15 -0.70 -0.09 0.00 0.00 0.00 0.00 47.33 46.39 1hfw h GLY 259 CO 0.21 0.63 0.00 1.19 0.00 0.00 0.00 176.54 178.58 1hfw h ILE 260 N 0.51 1.26 -0.75 2.60 2.10 -1.26 0.78 117.51 122.75 1hfw h ILE 260 Ca 0.04 -1.10 -0.05 0.00 1.08 0.00 0.00 64.86 64.83 1hfw h ILE 260 Cb 0.95 0.82 -0.03 0.00 -1.09 0.00 0.00 36.82 37.46 1hfw h ILE 260 CO 0.09 0.40 0.28 0.00 -1.08 0.00 0.00 178.15 177.83 1hfw h ALA 261 N 1.10 0.98 -0.40 0.18 0.00 -1.37 -0.00 119.26 119.74 1hfw h ALA 261 Ca 0.16 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1hfw h ALA 261 Cb 0.52 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1hfw h ALA 261 CO 0.03 0.62 0.03 0.78 0.00 0.00 0.00 179.25 180.71 1hfw h GLY 262 N 1.09 0.74 1.40 0.00 0.00 -0.89 -2.47 103.07 102.94 1hfw h GLY 262 Ca 0.25 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 1hfw h GLY 262 CO -0.02 0.48 -0.09 -0.33 0.00 0.00 0.00 176.54 176.59 1hfw h MET 263 N 0.53 0.72 -0.24 4.80 2.07 -0.55 -2.39 114.93 119.87 1hfw h MET 263 Ca 0.12 -0.22 -0.09 0.00 -2.07 0.00 0.00 59.70 57.43 1hfw h MET 263 Cb 0.42 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 30.07 1hfw h MET 263 CO 0.01 0.80 -0.24 0.00 1.07 0.00 0.00 176.91 178.55 1hfw h ARG 264 N 0.66 0.46 -0.42 1.72 3.08 -0.89 -1.63 114.38 117.37 1hfw h ARG 264 Ca 0.12 -0.17 -0.14 0.00 0.07 0.00 0.00 59.98 59.86 1hfw h ARG 264 Cb 0.54 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1hfw h ARG 264 CO 0.03 0.67 -0.29 0.87 -1.07 0.00 0.00 179.97 180.19 1hfw h LYS 265 N 0.41 0.91 -0.36 0.04 1.57 -1.21 -1.88 116.57 116.04 1hfw h LYS 265 Ca 0.06 -0.42 -0.02 0.00 -1.87 0.00 0.00 60.65 58.40 1hfw h LYS 265 Cb 0.65 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 1hfw h LYS 265 CO 0.05 1.07 0.15 0.00 -0.57 0.00 0.00 179.45 180.15 1hfw h ALA 266 N 0.90 0.47 -0.65 3.86 0.00 -1.15 -2.35 119.26 120.34 1hfw h ALA 266 Ca 0.09 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1hfw h ALA 266 Cb 0.86 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1hfw h ALA 266 CO 0.08 0.06 0.15 -0.07 0.00 0.00 0.00 179.25 179.47 1hfw h LEU 267 N 0.43 0.97 -1.99 0.00 3.38 -1.25 -1.04 115.31 115.81 1hfw h LEU 267 Ca 0.12 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1hfw h LEU 267 Cb 0.17 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1hfw h LEU 267 CO -0.01 0.94 -0.07 -0.08 0.09 0.00 0.00 178.44 179.31 1hfw h GLU 268 N 0.98 0.00 -0.64 1.13 4.81 -1.11 -2.22 114.58 117.54 1hfw h GLU 268 Ca 0.21 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1hfw h GLU 268 Cb 0.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.74 1hfw h GLU 268 CO 0.00 0.07 0.00 1.63 -0.73 0.00 0.00 179.01 179.98 1hfw n LYS 269 N -4.21 4.00 -0.87 1.92 4.76 -0.71 -4.94 118.16 118.11 1hfw n LYS 269 Ca -0.03 -2.74 0.00 0.00 -2.87 0.00 0.00 58.31 52.68 1hfw n LYS 269 Cb 0.15 -2.01 0.00 0.00 -1.84 0.00 0.00 35.03 31.33 1hfw n LYS 269 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hfw n GLY 270 N 0.84 0.66 3.79 0.72 0.00 -0.83 -5.05 105.19 105.32 1hfw n GLY 270 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1hfw n GLY 270 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hfw s VAL 271 N -2.45 4.48 -0.12 1.61 1.01 -0.48 -4.98 120.40 119.47 1hfw s VAL 271 Ca 0.00 1.55 -0.19 0.00 0.00 0.00 0.00 61.98 63.34 1hfw s VAL 271 Cb 0.00 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1hfw s VAL 271 CO 0.00 0.51 0.52 -0.69 0.00 0.00 0.00 175.10 175.44 1hfw s VAL 272 N -1.16 5.16 -0.17 2.92 1.01 -0.86 -4.06 120.40 123.23 1hfw s VAL 272 Ca 0.34 1.02 -0.05 0.00 0.00 0.00 0.00 61.98 63.30 1hfw s VAL 272 Cb -0.22 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.28 1hfw s VAL 272 CO 0.24 0.29 -0.00 -0.69 0.00 0.00 0.00 175.10 174.94 1hfw s VAL 273 N 0.80 4.19 -0.17 2.92 1.01 -1.26 -0.99 120.40 126.90 1hfw s VAL 273 Ca 0.27 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.01 1hfw s VAL 273 Cb -0.15 -2.86 0.02 0.00 0.00 0.00 0.00 36.38 33.39 1hfw s VAL 273 CO 0.11 0.47 -0.16 -0.32 0.00 0.00 0.00 175.10 175.21 1hfw s MET 274 N 0.46 2.50 -0.29 2.72 0.00 -0.45 -0.81 119.30 123.41 1hfw s MET 274 Ca -0.01 -0.69 -0.18 0.00 0.00 0.00 0.00 55.69 54.82 1hfw s MET 274 Cb -0.14 -2.30 -0.02 0.00 0.00 0.00 0.00 34.83 32.38 1hfw s MET 274 CO 0.02 -0.25 0.50 1.03 0.00 0.00 0.00 175.02 176.32 1hfw s ARG 275 N 1.41 3.92 0.00 4.11 0.52 0.87 -0.75 118.95 129.02 1hfw s ARG 275 Ca 0.04 0.14 0.00 0.00 -0.52 0.00 0.00 55.73 55.39 1hfw s ARG 275 Cb -0.13 -3.71 0.00 0.00 0.52 0.00 0.00 34.95 31.63 1hfw s ARG 275 CO -0.11 -0.45 0.00 0.45 0.02 0.00 0.00 175.30 175.21 1hfw n SER 276 N 5.60 1.34 -3.95 0.23 2.88 0.45 -1.57 113.62 118.60 1hfw n SER 276 Ca -0.05 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.39 1hfw n SER 276 Cb 0.50 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.84 1hfw n SER 276 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1hfw s THR 277 N 1.35 0.12 -0.76 2.46 -1.32 -1.26 -2.38 115.64 113.85 1hfw s THR 277 Ca 0.00 -0.64 0.25 0.00 -1.21 0.00 0.00 61.69 60.08 1hfw s THR 277 Cb 0.00 -0.22 0.06 0.00 -1.51 0.00 0.00 72.50 70.83 1hfw s THR 277 CO 0.00 -0.33 1.41 -2.11 -2.21 0.00 0.00 174.62 171.38 1hfw n ARG 278 N 2.05 0.20 -0.27 7.08 1.85 0.72 -4.36 116.66 123.93 1hfw n ARG 278 Ca -0.20 0.07 0.07 0.00 -1.00 0.00 0.00 57.85 56.79 1hfw n ARG 278 Cb 0.56 -1.63 0.31 0.00 -1.05 0.00 0.00 32.46 30.65 1hfw n ARG 278 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1hfw h THR 279 N 0.00 0.97 0.00 8.89 1.35 -1.84 -3.47 112.91 118.80 1hfw h THR 279 Ca 0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1hfw h THR 279 Cb 0.67 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.12 1hfw h THR 279 CO 0.00 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 1hfw n GLY 280 N -1.41 1.82 3.44 5.82 0.00 -1.26 -5.08 105.19 108.52 1hfw n GLY 280 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 1hfw n GLY 280 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hfw s ASN 281 N -1.29 -0.07 0.00 1.61 0.01 -1.26 -4.98 114.94 108.96 1hfw s ASN 281 Ca 0.00 -0.79 0.00 0.00 -0.71 0.00 0.00 52.86 51.36 1hfw s ASN 281 Cb 0.00 0.51 0.00 0.00 0.41 0.00 0.00 41.25 42.17 1hfw s ASN 281 CO 0.00 -0.99 0.00 0.61 -1.51 0.00 0.00 177.10 175.21 1hfw n GLY 282 N -0.29 -0.05 3.79 0.66 0.00 -1.26 -5.00 105.19 103.04 1hfw n GLY 282 Ca -0.06 -1.92 -0.37 0.00 0.00 0.00 0.00 46.02 43.67 1hfw n GLY 282 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hfw s ILE 283 N -1.17 5.26 -0.42 -0.61 -1.09 -1.26 -4.21 121.20 117.70 1hfw s ILE 283 Ca 0.00 0.58 -0.12 0.00 -2.23 0.00 0.00 60.65 58.88 1hfw s ILE 283 Cb 0.00 -3.62 0.06 0.00 -1.58 0.00 0.00 42.46 37.32 1hfw s ILE 283 CO 0.00 0.48 0.29 -0.69 -1.23 0.00 0.00 174.94 173.79 1hfw s VAL 284 N -0.25 4.66 0.58 2.92 1.01 -0.86 -4.91 120.40 123.55 1hfw s VAL 284 Ca 0.19 -1.13 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1hfw s VAL 284 Cb -0.14 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1hfw s VAL 284 CO 0.07 -0.45 1.02 -2.16 0.00 0.00 0.00 175.10 173.57 1hfw s PRO 285 N 1.53 3.68 0.66 2.72 0.04 -1.26 -3.69 135.00 138.68 1hfw s PRO 285 Ca 0.03 0.90 -0.18 0.00 0.04 0.00 0.00 61.00 61.79 1hfw s PRO 285 Cb -0.22 -2.09 -0.00 0.00 0.04 0.00 0.00 34.50 32.22 1hfw s PRO 285 CO 0.05 -0.50 1.29 -2.14 0.04 0.00 0.00 177.00 175.74 1hfw s PRO 286 N -4.58 2.48 -0.29 0.56 0.02 -1.26 -4.96 135.00 126.97 1hfw s PRO 286 Ca 0.58 2.06 0.05 0.00 0.02 0.00 0.00 61.00 63.71 1hfw s PRO 286 Cb -0.11 -1.84 0.19 0.00 0.02 0.00 0.00 34.50 32.76 1hfw s PRO 286 CO 0.42 -1.65 0.56 0.34 -0.33 0.00 0.00 177.00 176.34 1hfw s ASP 287 N -1.42 -1.28 0.00 2.53 -1.08 -1.26 -5.03 116.67 109.13 1hfw s ASP 287 Ca 0.82 0.13 0.17 0.00 -0.52 0.00 0.00 52.55 53.15 1hfw s ASP 287 Cb -0.37 1.89 0.90 0.00 -1.46 0.00 0.00 42.92 43.87 1hfw s ASP 287 CO 0.41 -0.31 1.45 -0.62 0.52 0.00 0.00 175.17 176.62 1hfw n GLU 288 N 5.41 0.35 0.08 4.34 -0.58 -1.26 -2.19 120.64 126.80 1hfw n GLU 288 Ca 0.04 0.08 -0.02 0.00 -0.42 0.00 0.00 57.16 56.84 1hfw n GLU 288 Cb 0.53 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.85 1hfw n GLU 288 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1hfw h GLU 289 N 0.00 0.00 -6.06 3.49 4.39 -2.01 -3.46 114.58 110.93 1hfw h GLU 289 Ca 0.00 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.16 1hfw h GLU 289 Cb 0.09 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 1hfw h GLU 289 CO 0.00 0.64 -0.47 -0.51 -1.16 0.00 0.00 179.01 177.51 1hfw s LEU 290 N -6.42 4.29 0.62 1.33 1.43 -0.93 -5.11 118.68 113.89 1hfw s LEU 290 Ca 0.01 0.14 -0.09 0.00 -1.03 0.00 0.00 54.13 53.17 1hfw s LEU 290 Cb 0.09 -2.87 -0.01 0.00 0.03 0.00 0.00 46.19 43.43 1hfw s LEU 290 CO 0.79 0.05 0.99 -2.16 0.23 0.00 0.00 176.35 176.25 1hfw s PRO 291 N -3.23 3.19 0.00 1.29 0.04 -1.26 -4.92 135.00 130.11 1hfw s PRO 291 Ca 0.34 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.79 1hfw s PRO 291 Cb -0.11 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1hfw s PRO 291 CO 0.28 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 177.03 1hfw n GLY 292 N -2.73 -0.74 3.99 0.56 0.00 -1.26 -4.90 105.19 100.11 1hfw n GLY 292 Ca 0.05 -1.72 -0.19 0.00 0.00 0.00 0.00 46.02 44.17 1hfw n GLY 292 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hfw s LEU 293 N -1.88 3.39 0.08 0.99 1.43 0.01 -4.92 118.68 117.78 1hfw s LEU 293 Ca 0.00 -0.65 0.10 0.00 -1.03 0.00 0.00 54.13 52.55 1hfw s LEU 293 Cb 0.00 -2.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1hfw s LEU 293 CO 0.00 -0.94 -0.26 0.68 0.23 0.00 0.00 176.35 176.06 1hfw s VAL 294 N -2.49 2.23 -1.86 -1.59 -7.23 -1.26 -0.09 120.40 108.10 1hfw s VAL 294 Ca 0.55 -1.55 0.08 0.00 -1.81 0.00 0.00 61.98 59.25 1hfw s VAL 294 Cb -0.07 -1.93 0.26 0.00 0.56 0.00 0.00 36.38 35.20 1hfw s VAL 294 CO 0.33 0.24 1.19 -1.54 -0.31 0.00 0.00 175.10 175.01 1hfw n SER 295 N 1.37 1.68 0.00 4.85 3.41 -0.61 -4.88 113.62 119.44 1hfw n SER 295 Ca -0.17 -2.04 0.00 0.00 -0.26 0.00 0.00 58.87 56.40 1hfw n SER 295 Cb 0.52 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1hfw n SER 295 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1hfw n ASP 296 N 0.33 0.00 -1.21 4.04 -0.08 -1.24 -1.28 116.55 117.11 1hfw n ASP 296 Ca 0.10 0.00 0.09 0.00 -1.51 0.00 0.00 54.79 53.47 1hfw n ASP 296 Cb 0.28 0.00 0.28 0.00 2.34 0.00 0.00 41.12 44.02 1hfw n ASP 296 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1hfw n SER 297 N 2.76 3.53 -4.71 1.67 3.41 -1.26 -2.02 113.62 116.99 1hfw n SER 297 Ca 0.00 -2.14 -0.42 0.00 -0.26 0.00 0.00 58.87 56.05 1hfw n SER 297 Cb 0.00 -0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 63.47 1hfw n SER 297 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1hfw s LEU 298 N -1.24 4.37 0.86 1.04 2.01 -0.40 -4.77 118.68 120.56 1hfw s LEU 298 Ca 0.41 1.95 -0.12 0.00 0.01 0.00 0.00 54.13 56.37 1hfw s LEU 298 Cb 0.23 -3.58 0.11 0.00 0.01 0.00 0.00 46.19 42.96 1hfw s LEU 298 CO 0.25 -0.42 1.15 0.54 1.01 0.00 0.00 176.35 178.87 1hfw s ASN 299 N 1.03 4.00 0.27 2.29 2.20 -1.26 -4.66 114.94 118.79 1hfw s ASN 299 Ca 0.57 0.92 -0.01 0.00 -0.94 0.00 0.00 52.86 53.41 1hfw s ASN 299 Cb -0.28 -1.48 0.57 0.00 -2.00 0.00 0.00 41.25 38.06 1hfw s ASN 299 CO 0.29 -2.24 1.73 -0.65 -2.94 0.00 0.00 177.10 173.30 1hfw h PRO 300 N -1.28 0.49 -0.36 3.55 0.11 -1.95 0.17 132.00 132.73 1hfw h PRO 300 Ca -0.48 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 1hfw h PRO 300 Cb 1.33 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1hfw h PRO 300 CO 0.63 0.33 0.09 0.00 -0.21 0.00 0.00 178.00 178.84 1hfw h ALA 301 N 1.60 0.47 -0.29 -0.75 0.00 -1.97 -2.06 119.26 116.27 1hfw h ALA 301 Ca 0.48 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 1hfw h ALA 301 Cb 0.76 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1hfw h ALA 301 CO -0.42 0.14 -0.41 0.45 0.00 0.00 0.00 179.25 179.01 1hfw h HIS 302 N 0.43 0.83 -0.81 0.00 3.86 -1.80 -3.14 115.15 114.53 1hfw h HIS 302 Ca 0.11 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 59.06 1hfw h HIS 302 Cb 0.29 -0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.55 1hfw h HIS 302 CO 0.01 0.99 0.46 0.00 0.86 0.00 0.00 177.93 180.25 1hfw h ALA 303 N 0.97 1.29 -0.66 2.45 0.00 -0.52 -2.53 119.26 120.27 1hfw h ALA 303 Ca 0.05 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1hfw h ALA 303 Cb 0.95 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1hfw h ALA 303 CO 0.09 0.59 0.12 -0.09 0.00 0.00 0.00 179.25 179.96 1hfw h ARG 304 N 1.12 1.06 -0.21 0.00 2.43 -1.33 -1.52 114.38 115.95 1hfw h ARG 304 Ca 0.29 -0.27 -0.02 0.00 -0.81 0.00 0.00 59.98 59.18 1hfw h ARG 304 Cb -0.00 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1hfw h ARG 304 CO -0.05 0.96 0.07 0.82 -1.51 0.00 0.00 179.97 180.26 1hfw h ILE 305 N 1.00 1.19 -0.20 1.20 1.08 -1.47 -1.78 117.51 118.54 1hfw h ILE 305 Ca 0.20 -0.59 -0.09 0.00 -0.39 0.00 0.00 64.86 64.00 1hfw h ILE 305 Cb 0.40 1.19 -0.01 0.00 -3.07 0.00 0.00 36.82 35.33 1hfw h ILE 305 CO 0.01 0.19 -0.26 0.25 -0.69 0.00 0.00 178.15 177.65 1hfw h LEU 306 N 0.17 0.37 -0.48 1.44 5.85 -1.36 -2.56 115.31 118.73 1hfw h LEU 306 Ca 0.07 -0.12 -0.16 0.00 0.84 0.00 0.00 57.88 58.51 1hfw h LEU 306 Cb 0.23 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 1hfw h LEU 306 CO -0.00 0.63 -0.51 0.25 -0.34 0.00 0.00 178.44 178.47 1hfw h LEU 307 N 0.33 0.74 -0.51 2.25 5.85 -1.15 -0.85 115.31 121.97 1hfw h LEU 307 Ca 0.05 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 1hfw h LEU 307 Cb 0.63 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 1hfw h LEU 307 CO 0.05 1.11 0.15 0.24 -0.34 0.00 0.00 178.44 179.65 1hfw h MET 308 N 0.52 0.80 -0.34 1.25 2.86 -1.18 -1.97 114.93 116.87 1hfw h MET 308 Ca 0.02 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.34 1hfw h MET 308 Cb 1.06 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 1hfw h MET 308 CO 0.10 0.75 -0.37 -0.07 1.06 0.00 0.00 176.91 178.38 1hfw h LEU 309 N 0.70 0.84 -1.00 1.22 3.38 -1.41 -3.11 115.31 115.92 1hfw h LEU 309 Ca 0.16 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 1hfw h LEU 309 Cb 0.29 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1hfw h LEU 309 CO -0.00 1.12 0.37 0.00 0.09 0.00 0.00 178.44 180.02 1hfw h ALA 310 N 0.93 1.22 0.00 1.53 0.00 -0.98 -2.34 119.26 119.62 1hfw h ALA 310 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1hfw h ALA 310 Cb 0.92 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1hfw h ALA 310 CO 0.08 0.60 0.00 1.28 0.00 0.00 0.00 179.25 181.21 1hfw n LEU 311 N -4.33 0.00 0.03 0.00 4.77 -0.75 -1.77 117.00 114.94 1hfw n LEU 311 Ca 0.07 0.41 0.13 0.00 -0.03 0.00 0.00 56.01 56.59 1hfw n LEU 311 Cb 0.13 -0.41 0.32 0.00 -2.33 0.00 0.00 43.42 41.13 1hfw n LEU 311 CO 0.39 -0.17 0.57 0.35 -1.33 0.00 0.00 177.39 177.20 1hfw n THR 312 N -1.41 0.16 -0.04 -5.08 -2.24 -0.88 -4.23 114.28 100.56 1hfw n THR 312 Ca 0.06 -0.11 -0.04 0.00 -2.27 0.00 0.00 64.05 61.69 1hfw n THR 312 Cb 0.17 -0.10 -0.06 0.00 -2.10 0.00 0.00 70.33 68.25 1hfw n THR 312 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1hfw n ARG 313 N -1.75 2.50 -3.82 -0.78 1.74 -0.76 -5.10 116.66 108.68 1hfw n ARG 313 Ca 0.05 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.08 1hfw n ARG 313 Cb 0.38 -1.19 -0.01 0.00 -1.02 0.00 0.00 32.46 30.61 1hfw n ARG 313 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1hfw s THR 314 N -2.18 0.00 0.00 0.55 -1.32 -0.73 -5.02 115.64 106.94 1hfw s THR 314 Ca -0.05 -0.88 0.00 0.00 -1.21 0.00 0.00 61.69 59.55 1hfw s THR 314 Cb 0.02 -2.11 0.00 0.00 -1.51 0.00 0.00 72.50 68.91 1hfw s THR 314 CO 0.29 0.00 0.75 -1.54 -2.21 0.00 0.00 174.62 171.91 1hfw n SER 315 N -0.57 1.02 -4.62 8.08 3.41 -1.26 -4.13 113.62 115.54 1hfw n SER 315 Ca -0.05 -1.50 -0.43 0.00 -0.26 0.00 0.00 58.87 56.63 1hfw n SER 315 Cb 0.60 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1hfw n SER 315 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1hfw s ASP 316 N -0.50 6.78 0.35 4.04 -1.08 -1.26 -4.94 116.67 120.05 1hfw s ASP 316 Ca 0.00 0.75 0.08 0.00 -0.52 0.00 0.00 52.55 52.86 1hfw s ASP 316 Cb 0.00 -2.52 0.78 0.00 -1.46 0.00 0.00 42.92 39.71 1hfw s ASP 316 CO 0.00 -0.98 1.88 -0.65 0.52 0.00 0.00 175.17 175.94 1hfw h PRO 317 N 8.52 0.72 -0.42 4.34 0.11 -1.99 -1.55 132.00 141.72 1hfw h PRO 317 Ca -0.22 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.74 1hfw h PRO 317 Cb 1.06 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 1hfw h PRO 317 CO 1.05 0.47 -0.19 0.87 -0.21 0.00 0.00 178.00 179.99 1hfw h LYS 318 N 0.74 0.83 -0.11 1.05 1.79 -1.99 -1.22 116.57 117.65 1hfw h LYS 318 Ca 0.43 -0.32 -0.08 0.00 -2.18 0.00 0.00 60.65 58.50 1hfw h LYS 318 Cb 0.62 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1hfw h LYS 318 CO -0.19 0.95 -0.24 0.28 -1.08 0.00 0.00 179.45 179.17 1hfw h VAL 319 N 0.73 1.39 -0.63 0.50 2.07 -1.83 -2.78 116.25 115.69 1hfw h VAL 319 Ca 0.11 -1.53 0.02 0.00 0.82 0.00 0.00 66.70 66.11 1hfw h VAL 319 Cb 0.71 2.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.55 1hfw h VAL 319 CO 0.05 0.45 0.40 0.40 0.02 0.00 0.00 177.57 178.89 1hfw h ILE 320 N -0.07 1.11 -0.90 4.57 2.04 -1.26 -1.95 117.51 121.05 1hfw h ILE 320 Ca 0.00 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.60 1hfw h ILE 320 Cb 0.84 0.24 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1hfw h ILE 320 CO 0.05 0.14 0.59 -0.61 0.00 0.00 0.00 178.15 178.33 1hfw h GLN 321 N 0.79 1.19 -0.40 2.37 5.75 -1.23 -1.90 115.11 121.68 1hfw h GLN 321 Ca 0.24 -0.08 -0.07 0.00 -0.15 0.00 0.00 58.65 58.60 1hfw h GLN 321 Cb -0.02 -0.27 -0.02 0.00 1.07 0.00 0.00 27.48 28.24 1hfw h GLN 321 CO -0.08 0.79 -0.05 1.49 -2.65 0.00 0.00 178.83 178.33 1hfw h GLU 322 N 1.22 0.67 -0.70 1.69 4.57 -1.11 -2.62 114.58 118.31 1hfw h GLU 322 Ca 0.33 -0.19 0.01 0.00 -1.18 0.00 0.00 59.36 58.33 1hfw h GLU 322 Cb -0.13 -0.08 -0.04 0.00 -0.16 0.00 0.00 28.75 28.35 1hfw h GLU 322 CO -0.07 0.73 0.46 1.88 -1.18 0.00 0.00 179.01 180.83 1hfw h TYR 323 N 0.63 0.87 0.00 0.92 0.05 -0.63 -2.21 116.97 116.60 1hfw h TYR 323 Ca 0.12 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.92 1hfw h TYR 323 Cb 0.47 -0.29 0.00 0.00 1.01 0.00 0.00 36.73 37.92 1hfw h TYR 323 CO 0.02 0.54 0.00 0.74 -1.05 0.00 0.00 178.16 178.41 1hfw h PHE 324 N 0.94 0.00 -0.00 4.88 -1.00 -1.11 -0.93 116.94 119.72 1hfw h PHE 324 Ca 0.26 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.04 1hfw h PHE 324 Cb -0.10 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.46 1hfw h PHE 324 CO -0.03 0.00 -0.82 0.72 -1.61 0.00 0.00 178.31 176.57 1hfw n HIS 325 N -2.63 0.00 -0.00 -0.55 8.25 -0.86 -4.56 115.22 114.88 1hfw n HIS 325 Ca -0.00 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.47 1hfw n HIS 325 Cb 0.17 -0.03 -0.02 0.00 1.12 0.00 0.00 29.99 31.24 1hfw n HIS 325 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1hfw n THR 326 N -1.18 0.00 0.64 1.59 -2.24 -0.87 -5.06 114.28 107.15 1hfw n THR 326 Ca 0.05 -0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1hfw n THR 326 Cb 0.36 0.46 0.06 0.00 -2.10 0.00 0.00 70.33 69.11 1hfw n THR 326 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28