#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hfn s LEU 6 N 0.00 4.37 0.10 1.04 2.96 -1.26 -0.27 118.68 125.62 2hfn s LEU 6 Ca 0.00 2.44 0.03 0.00 -0.22 0.00 0.00 54.13 56.37 2hfn s LEU 6 Cb 0.00 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.06 2hfn s LEU 6 CO 0.00 -0.70 -0.08 -0.31 -1.32 0.00 0.00 176.35 173.94 2hfn s TYR 7 N 1.02 0.96 -0.01 5.38 1.51 0.81 -1.07 117.35 125.95 2hfn s TYR 7 Ca 0.66 -0.81 0.03 0.00 -1.01 0.00 0.00 57.07 55.94 2hfn s TYR 7 Cb -0.39 -0.54 -0.01 0.00 -0.11 0.00 0.00 41.96 40.91 2hfn s TYR 7 CO 0.31 -0.08 -0.11 0.50 -1.11 0.00 0.00 175.55 175.06 2hfn s ARG 8 N -3.46 0.95 -0.05 -0.62 3.52 -0.40 -2.11 118.95 116.77 2hfn s ARG 8 Ca 0.10 -0.40 0.02 0.00 -0.13 0.00 0.00 55.73 55.31 2hfn s ARG 8 Cb 0.02 -0.91 0.01 0.00 -1.56 0.00 0.00 34.95 32.52 2hfn s ARG 8 CO -0.03 0.23 -0.10 -1.17 -0.81 0.00 0.00 175.30 173.43 2hfn s LEU 9 N -0.21 1.57 -0.08 -0.88 0.20 0.36 -1.67 118.68 117.97 2hfn s LEU 9 Ca 0.03 -0.23 0.04 0.00 0.69 0.00 0.00 54.13 54.67 2hfn s LEU 9 Cb -0.05 -0.67 -0.00 0.00 -0.43 0.00 0.00 46.19 45.03 2hfn s LEU 9 CO -0.00 0.01 -0.23 -0.63 -0.29 0.00 0.00 176.35 175.21 2hfn s ILE 10 N 0.66 1.94 0.11 6.68 1.01 0.15 -0.56 121.20 131.19 2hfn s ILE 10 Ca -0.12 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 59.54 2hfn s ILE 10 Cb -0.14 -1.68 -0.03 0.00 0.01 0.00 0.00 42.46 40.62 2hfn s ILE 10 CO 0.02 0.54 0.07 -0.72 0.00 0.00 0.00 174.94 174.85 2hfn s TYR 11 N 0.23 0.68 0.21 3.97 1.13 -0.54 0.07 117.35 123.10 2hfn s TYR 11 Ca -0.14 -1.10 0.08 0.00 -1.41 0.00 0.00 57.07 54.50 2hfn s TYR 11 Cb -0.16 -0.38 -0.05 0.00 -1.10 0.00 0.00 41.96 40.27 2hfn s TYR 11 CO 0.07 -0.51 -0.14 -1.54 -2.51 0.00 0.00 175.55 170.92 2hfn s SER 12 N -3.00 2.57 0.28 -0.18 1.04 -0.39 -1.12 113.70 112.92 2hfn s SER 12 Ca 0.18 -1.03 -0.15 0.00 0.48 0.00 0.00 55.95 55.43 2hfn s SER 12 Cb 0.07 -0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.06 2hfn s SER 12 CO -0.02 -0.18 0.60 -0.94 0.98 0.00 0.00 173.24 173.67 2hfn s SER 13 N -3.32 -0.04 -0.29 7.02 1.04 -0.61 0.27 113.70 117.77 2hfn s SER 13 Ca 0.23 -0.90 -0.08 0.00 0.48 0.00 0.00 55.95 55.68 2hfn s SER 13 Cb -0.00 0.67 -0.00 0.00 0.10 0.00 0.00 66.02 66.79 2hfn s SER 13 CO 0.07 -1.29 0.10 -1.10 0.98 0.00 0.00 173.24 172.00 2hfn s GLN 14 N -3.68 3.28 0.52 4.02 -1.52 -0.49 -0.87 119.66 120.92 2hfn s GLN 14 Ca 0.19 -0.74 -0.21 0.00 -1.95 0.00 0.00 55.36 52.65 2hfn s GLN 14 Cb -0.03 -3.43 -0.06 0.00 -0.22 0.00 0.00 33.01 29.28 2hfn s GLN 14 CO 0.10 -0.38 1.21 0.20 -0.25 0.00 0.00 175.29 176.16 2hfn s GLY 15 N 1.56 2.77 0.68 3.09 0.00 0.16 -0.47 107.32 115.11 2hfn s GLY 15 Ca 0.04 1.02 -0.16 0.00 0.00 0.00 0.00 44.72 45.62 2hfn s GLY 15 CO 0.04 1.45 1.18 -0.26 0.00 0.00 0.00 173.10 175.51 2hfn s ILE 16 N -1.54 2.67 0.41 0.90 -4.36 -0.39 -4.86 121.20 114.02 2hfn s ILE 16 Ca 0.70 0.34 0.15 0.00 -0.26 0.00 0.00 60.65 61.58 2hfn s ILE 16 Cb -0.31 -2.93 0.36 0.00 1.25 0.00 0.00 42.46 40.83 2hfn s ILE 16 CO 0.36 -0.16 1.88 -0.65 0.24 0.00 0.00 174.94 176.60 2hfn h PRO 17 N 0.07 0.47 -0.10 0.37 0.11 -1.95 -3.18 132.00 127.79 2hfn h PRO 17 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2hfn h PRO 17 Cb 1.28 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2hfn h PRO 17 CO 0.52 0.31 0.00 0.27 -0.21 0.00 0.00 178.00 178.89 2hfn n ASN 18 N -4.51 1.24 -4.67 -2.05 2.04 -1.26 -4.97 115.26 101.07 2hfn n ASN 18 Ca 0.17 -1.57 -0.46 0.00 -0.44 0.00 0.00 54.58 52.28 2hfn n ASN 18 Cb 0.58 -0.06 -0.04 0.00 -2.53 0.00 0.00 39.78 37.74 2hfn n ASN 18 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2hfn n LEU 19 N 0.02 3.17 -4.66 -4.53 4.77 -1.20 -5.00 117.00 109.56 2hfn n LEU 19 Ca 0.17 1.09 -0.24 0.00 -0.03 0.00 0.00 56.01 56.99 2hfn n LEU 19 Cb 0.27 -1.44 -0.08 0.00 -2.33 0.00 0.00 43.42 39.85 2hfn n LEU 19 CO 0.14 -0.27 -0.28 -1.10 -1.33 0.00 0.00 177.39 174.55 2hfn s GLN 20 N 0.81 2.16 0.39 3.23 -1.52 -1.26 -4.99 119.66 118.48 2hfn s GLN 20 Ca 0.78 -1.69 0.16 0.00 -1.95 0.00 0.00 55.36 52.65 2hfn s GLN 20 Cb -0.66 -1.99 1.03 0.00 -0.22 0.00 0.00 33.01 31.16 2hfn s GLN 20 CO 0.38 0.13 1.80 -1.35 -0.25 0.00 0.00 175.29 176.01 2hfn h PRO 21 N 1.74 0.45 -0.58 2.91 0.11 -2.00 -0.35 132.00 134.29 2hfn h PRO 21 Ca -0.43 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 2hfn h PRO 21 Cb 1.25 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2hfn h PRO 21 CO 0.66 0.30 0.26 1.96 -0.21 0.00 0.00 178.00 180.97 2hfn h GLN 22 N 0.47 0.82 -0.63 1.05 1.08 -1.98 -0.65 115.11 115.27 2hfn h GLN 22 Ca 0.55 -0.11 -0.05 0.00 -1.45 0.00 0.00 58.65 57.59 2hfn h GLN 22 Cb 1.29 -0.15 -0.03 0.00 -0.05 0.00 0.00 27.48 28.54 2hfn h GLN 22 CO -0.27 0.65 0.20 -0.44 -0.95 0.00 0.00 178.83 178.02 2hfn h ASP 23 N 0.82 0.90 -0.39 1.46 3.32 -1.45 -0.19 116.42 120.89 2hfn h ASP 23 Ca 0.20 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 2hfn h ASP 23 Cb 0.11 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2hfn h ASP 23 CO -0.02 0.87 0.08 -0.07 -1.72 0.00 0.00 179.24 178.37 2hfn h LEU 24 N 0.89 0.61 -0.59 1.55 4.07 -1.18 -1.24 115.31 119.42 2hfn h LEU 24 Ca 0.20 -0.24 0.04 0.00 0.08 0.00 0.00 57.88 57.96 2hfn h LEU 24 Cb 0.28 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 41.81 2hfn h LEU 24 CO -0.01 0.69 0.33 0.50 -1.08 0.00 0.00 178.44 178.88 2hfn h LYS 25 N 0.49 0.61 -0.25 1.13 3.64 -1.01 -0.86 116.57 120.33 2hfn h LYS 25 Ca 0.12 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2hfn h LYS 25 Cb 0.33 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2hfn h LYS 25 CO 0.00 0.41 0.16 -0.44 -2.27 0.00 0.00 179.45 177.31 2hfn h ASP 26 N 0.63 0.29 -0.17 4.20 3.45 -0.70 0.02 116.42 124.14 2hfn h ASP 26 Ca 0.25 -0.02 0.03 0.00 0.43 0.00 0.00 57.03 57.73 2hfn h ASP 26 Cb 0.12 -0.07 -0.03 0.00 -0.56 0.00 0.00 39.33 38.78 2hfn h ASP 26 CO -0.15 0.23 -0.03 0.40 -1.57 0.00 0.00 179.24 178.11 2hfn h ILE 27 N 0.33 0.84 -0.37 0.35 2.04 -1.04 -0.82 117.51 118.84 2hfn h ILE 27 Ca 0.09 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 2hfn h ILE 27 Cb -0.02 0.83 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 2hfn h ILE 27 CO -0.02 0.00 0.19 0.25 0.00 0.00 0.00 178.15 178.58 2hfn h LEU 28 N 0.01 0.47 -0.50 1.44 5.85 -0.90 -0.59 115.31 121.09 2hfn h LEU 28 Ca 0.08 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.76 2hfn h LEU 28 Cb 0.12 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 2hfn h LEU 28 CO -0.17 0.43 0.23 -0.33 -0.34 0.00 0.00 178.44 178.26 2hfn h GLU 29 N 0.46 0.43 -0.04 1.25 5.08 -0.82 0.14 114.58 121.09 2hfn h GLU 29 Ca 0.13 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2hfn h GLU 29 Cb 0.08 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2hfn h GLU 29 CO -0.02 0.28 -0.03 0.77 -1.00 0.00 0.00 179.01 179.01 2hfn h SER 30 N 0.44 -0.10 -0.67 1.42 0.02 -0.89 -1.60 113.55 112.17 2hfn h SER 30 Ca 0.23 0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.14 2hfn h SER 30 Cb 0.18 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 2hfn h SER 30 CO -0.19 -0.05 0.17 0.77 -1.14 0.00 0.00 176.83 176.39 2hfn h SER 31 N -0.04 1.02 0.94 3.07 4.64 -0.59 -1.81 113.55 120.78 2hfn h SER 31 Ca 0.03 -0.21 -0.05 0.00 -0.47 0.00 0.00 61.79 61.09 2hfn h SER 31 Cb 0.08 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 2hfn h SER 31 CO -0.06 0.98 -0.23 1.56 -0.87 0.00 0.00 176.83 178.21 2hfn h GLN 32 N 1.03 0.00 -0.15 4.77 4.20 -0.61 0.81 115.11 125.15 2hfn h GLN 32 Ca 0.22 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.80 2hfn h GLN 32 Cb 0.36 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.14 2hfn h GLN 32 CO 0.00 0.23 -0.40 -0.09 -0.67 0.00 0.00 178.83 177.90 2hfn h ARG 33 N 0.00 0.55 0.10 1.46 2.43 -0.82 -3.41 114.38 114.69 2hfn h ARG 33 Ca -0.00 -0.38 -0.37 0.00 -0.81 0.00 0.00 59.98 58.42 2hfn h ARG 33 Cb 0.76 0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.34 2hfn h ARG 33 CO 0.03 1.00 -2.08 0.09 -1.51 0.00 0.00 179.97 177.50 2hfn n ASN 34 N -4.28 2.10 -0.13 -3.80 3.02 -0.72 -4.59 115.26 106.85 2hfn n ASN 34 Ca -0.07 0.15 -0.06 0.00 -0.03 0.00 0.00 54.58 54.58 2hfn n ASN 34 Cb 0.54 -0.78 0.03 0.00 -0.61 0.00 0.00 39.78 38.95 2hfn n ASN 34 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2hfn h ASN 35 N 0.04 0.27 -0.46 6.41 4.21 -1.06 -3.08 115.58 121.90 2hfn h ASN 35 Ca -0.45 0.03 0.09 0.00 1.21 0.00 0.00 56.30 57.18 2hfn h ASN 35 Cb 2.00 -0.02 -0.10 0.00 -1.12 0.00 0.00 38.32 39.09 2hfn h ASN 35 CO 0.05 0.19 -0.30 -0.65 -1.29 0.00 0.00 177.43 175.44 2hfn h PRO 36 N 0.40 -0.19 0.00 0.81 0.11 -1.78 0.11 132.00 131.46 2hfn h PRO 36 Ca 0.19 0.01 -0.04 0.00 0.11 0.00 0.00 66.00 66.28 2hfn h PRO 36 Cb 0.12 0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2hfn h PRO 36 CO -0.15 -0.12 -0.17 0.00 -0.21 0.00 0.00 178.00 177.34 2hfn h ALA 37 N 0.94 1.42 -0.01 -0.75 0.00 -1.83 -1.78 119.26 117.25 2hfn h ALA 37 Ca 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2hfn h ALA 37 Cb 0.52 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2hfn h ALA 37 CO -0.57 0.22 -0.14 0.09 0.00 0.00 0.00 179.25 178.84 2hfn n ASN 38 N -3.90 1.16 -1.27 0.00 3.02 -0.61 -4.95 115.26 108.71 2hfn n ASN 38 Ca -0.02 -1.11 -0.13 0.00 -0.03 0.00 0.00 54.58 53.30 2hfn n ASN 38 Cb 0.26 0.07 -0.02 0.00 -0.61 0.00 0.00 39.78 39.48 2hfn n ASN 38 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2hfn n GLY 39 N 1.27 0.40 3.81 7.41 0.00 0.21 -4.78 105.19 113.50 2hfn n GLY 39 Ca 0.15 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.41 2hfn n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hfn s ILE 40 N -2.57 5.04 0.21 -0.61 -1.09 -0.24 -4.45 121.20 117.49 2hfn s ILE 40 Ca 0.00 0.88 0.05 0.00 -2.23 0.00 0.00 60.65 59.35 2hfn s ILE 40 Cb 0.00 -3.74 -0.05 0.00 -1.58 0.00 0.00 42.46 37.09 2hfn s ILE 40 CO 0.00 0.52 -0.05 0.42 -1.23 0.00 0.00 174.94 174.60 2hfn s THR 41 N -0.69 1.25 -4.25 2.92 -4.23 -0.65 -4.41 115.64 105.58 2hfn s THR 41 Ca 0.24 -2.08 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2hfn s THR 41 Cb -0.16 -2.20 0.00 0.00 1.34 0.00 0.00 72.50 71.48 2hfn s THR 41 CO 0.13 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 2hfn n GLY 42 N -0.38 -0.51 3.49 3.99 0.00 -1.08 -0.56 105.19 110.14 2hfn n GLY 42 Ca -0.07 -0.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 2hfn n GLY 42 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hfn s LEU 43 N 0.00 -0.39 -0.09 0.99 2.96 -0.87 -2.70 118.68 118.58 2hfn s LEU 43 Ca 0.00 1.22 0.04 0.00 -0.22 0.00 0.00 54.13 55.17 2hfn s LEU 43 Cb 0.00 2.01 0.00 0.00 0.50 0.00 0.00 46.19 48.70 2hfn s LEU 43 CO 0.00 -0.21 -0.21 -0.22 -1.32 0.00 0.00 176.35 174.39 2hfn s LEU 44 N 0.78 1.97 0.06 -0.68 2.96 0.40 -0.92 118.68 123.25 2hfn s LEU 44 Ca -0.04 -0.48 0.07 0.00 -0.22 0.00 0.00 54.13 53.46 2hfn s LEU 44 Cb -0.05 -1.24 -0.03 0.00 0.50 0.00 0.00 46.19 45.36 2hfn s LEU 44 CO -0.06 0.14 -0.18 0.00 -1.32 0.00 0.00 176.35 174.93 2hfn s TYR 46 N -0.97 2.52 -0.47 0.00 5.04 -0.63 -1.58 117.35 121.27 2hfn s TYR 46 Ca 0.15 -1.64 0.04 0.00 -2.44 0.00 0.00 57.07 53.18 2hfn s TYR 46 Cb -0.10 -1.70 0.12 0.00 0.35 0.00 0.00 41.96 40.63 2hfn s TYR 46 CO 0.06 -0.76 0.22 0.45 -1.34 0.00 0.00 175.55 174.18 2hfn s SER 47 N 1.36 4.29 -0.19 4.32 0.15 0.37 -1.09 113.70 122.91 2hfn s SER 47 Ca -0.01 -2.77 -0.42 0.00 0.70 0.00 0.00 55.95 53.45 2hfn s SER 47 Cb -0.16 -1.53 -0.20 0.00 -1.71 0.00 0.00 66.02 62.43 2hfn s SER 47 CO -0.09 -0.27 1.32 0.29 1.20 0.00 0.00 173.24 175.70 2hfn n LYS 48 N 3.42 0.15 -0.03 5.44 4.76 -1.26 -0.56 118.16 130.08 2hfn n LYS 48 Ca 0.05 0.05 0.13 0.00 -2.87 0.00 0.00 58.31 55.67 2hfn n LYS 48 Cb 0.34 -1.57 0.42 0.00 -1.84 0.00 0.00 35.03 32.38 2hfn n LYS 48 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2hfn n PRO 49 N 2.71 1.82 -3.41 1.97 -0.04 -1.26 -5.09 135.00 131.70 2hfn n PRO 49 Ca 0.24 -1.20 -0.36 0.00 -0.04 0.00 0.00 63.50 62.15 2hfn n PRO 49 Cb 0.04 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 31.98 2hfn n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2hfn s ALA 50 N -1.93 3.62 0.06 0.55 0.00 0.28 0.39 121.76 124.73 2hfn s ALA 50 Ca 0.35 -0.17 0.02 0.00 0.00 0.00 0.00 51.96 52.16 2hfn s ALA 50 Cb 0.20 -2.47 -0.04 0.00 0.00 0.00 0.00 23.12 20.81 2hfn s ALA 50 CO 0.31 0.47 0.10 -0.06 0.00 0.00 0.00 175.76 176.59 2hfn s PHE 51 N -1.39 3.26 -0.06 0.00 0.40 -0.05 -0.48 117.98 119.66 2hfn s PHE 51 Ca 0.35 0.14 0.01 0.00 -0.60 0.00 0.00 56.93 56.82 2hfn s PHE 51 Cb -0.15 -1.67 0.02 0.00 0.51 0.00 0.00 43.02 41.73 2hfn s PHE 51 CO 0.18 0.54 -0.05 -1.17 0.70 0.00 0.00 175.22 175.42 2hfn s LEU 52 N -2.24 1.23 0.01 -0.37 2.96 -0.62 -1.57 118.68 118.08 2hfn s LEU 52 Ca 0.29 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 2hfn s LEU 52 Cb -0.12 -0.54 -0.01 0.00 0.50 0.00 0.00 46.19 46.02 2hfn s LEU 52 CO 0.21 -0.07 -0.04 -1.58 -1.32 0.00 0.00 176.35 173.54 2hfn s GLN 53 N 1.14 0.33 -0.06 1.98 0.74 -0.27 -0.17 119.66 123.36 2hfn s GLN 53 Ca -0.07 -0.35 0.05 0.00 0.05 0.00 0.00 55.36 55.04 2hfn s GLN 53 Cb -0.14 -0.20 -0.02 0.00 1.10 0.00 0.00 33.01 33.75 2hfn s GLN 53 CO -0.01 0.04 -0.20 0.54 -0.55 0.00 0.00 175.29 175.11 2hfn s VAL 54 N -0.61 2.54 -0.03 1.34 0.11 -0.10 -1.47 120.40 122.19 2hfn s VAL 54 Ca -0.04 -0.90 0.06 0.00 -2.93 0.00 0.00 61.98 58.17 2hfn s VAL 54 Cb -0.05 -1.97 -0.01 0.00 -1.53 0.00 0.00 36.38 32.82 2hfn s VAL 54 CO -0.00 0.57 -0.21 -0.76 -3.33 0.00 0.00 175.10 171.37 2hfn s LEU 55 N -0.38 2.02 0.02 2.54 1.43 0.28 -2.05 118.68 122.53 2hfn s LEU 55 Ca 0.03 -0.39 0.05 0.00 -1.03 0.00 0.00 54.13 52.79 2hfn s LEU 55 Cb -0.12 -1.10 -0.02 0.00 0.03 0.00 0.00 46.19 44.98 2hfn s LEU 55 CO 0.02 0.23 -0.15 -1.61 0.23 0.00 0.00 176.35 175.08 2hfn s GLU 56 N -0.32 1.04 0.00 1.70 2.02 0.27 -0.49 118.70 122.92 2hfn s GLU 56 Ca 0.04 -0.69 0.00 0.00 0.02 0.00 0.00 54.97 54.34 2hfn s GLU 56 Cb -0.10 -1.05 0.00 0.00 0.10 0.00 0.00 34.13 33.09 2hfn s GLU 56 CO 0.01 0.27 0.00 0.41 0.02 0.00 0.00 175.26 175.96 2hfn n GLY 57 N 2.18 -1.01 3.77 -1.39 0.00 -0.90 -1.64 105.19 106.21 2hfn n GLY 57 Ca -0.17 -1.06 -0.37 0.00 0.00 0.00 0.00 46.02 44.42 2hfn n GLY 57 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hfn s GLU 58 N -1.47 3.74 0.18 1.61 2.12 -1.26 -0.13 118.70 123.48 2hfn s GLU 58 Ca 0.00 1.79 -0.15 0.00 0.36 0.00 0.00 54.97 56.97 2hfn s GLU 58 Cb 0.00 -2.40 0.16 0.00 0.26 0.00 0.00 34.13 32.15 2hfn s GLU 58 CO 0.00 -0.57 1.67 0.00 -0.54 0.00 0.00 175.26 175.82 2hfn h GLU 60 N 0.06 0.60 -0.41 0.00 4.81 -1.92 -1.53 114.58 116.20 2hfn h GLU 60 Ca 0.24 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.35 2hfn h GLU 60 Cb 0.36 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2hfn h GLU 60 CO -0.44 0.40 -0.07 1.96 -0.73 0.00 0.00 179.01 180.13 2hfn h GLN 61 N 0.62 0.76 -0.60 1.92 1.08 -1.58 -0.16 115.11 117.15 2hfn h GLN 61 Ca 0.24 -0.28 0.02 0.00 -1.45 0.00 0.00 58.65 57.17 2hfn h GLN 61 Cb 0.08 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 2hfn h GLN 61 CO -0.13 0.88 0.38 0.28 -0.95 0.00 0.00 178.83 179.30 2hfn h VAL 62 N 0.58 1.12 -0.34 -0.54 2.07 -0.74 -1.06 116.25 117.35 2hfn h VAL 62 Ca 0.11 -0.27 -0.09 0.00 0.82 0.00 0.00 66.70 67.27 2hfn h VAL 62 Cb 0.59 0.28 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2hfn h VAL 62 CO 0.03 0.14 -0.15 0.78 0.02 0.00 0.00 177.57 178.40 2hfn h ASN 63 N 0.77 0.71 -0.26 0.57 2.35 -1.18 0.36 115.58 118.90 2hfn h ASN 63 Ca 0.23 -0.40 0.01 0.00 -0.55 0.00 0.00 56.30 55.59 2hfn h ASN 63 Cb -0.04 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.12 2hfn h ASN 63 CO -0.07 0.95 0.16 -0.08 -1.65 0.00 0.00 177.43 176.74 2hfn h GLU 64 N 0.47 0.32 -0.03 0.81 4.22 -0.80 -1.95 114.58 117.62 2hfn h GLU 64 Ca 0.08 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.50 2hfn h GLU 64 Cb 0.67 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2hfn h GLU 64 CO 0.05 0.21 0.02 1.15 -2.18 0.00 0.00 179.01 178.25 2hfn h THR 65 N 0.33 1.08 -0.01 0.32 2.02 -1.12 -2.27 112.91 113.26 2hfn h THR 65 Ca 0.10 -0.24 0.02 0.00 0.77 0.00 0.00 66.41 67.07 2hfn h THR 65 Cb -0.01 1.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 2hfn h THR 65 CO -0.04 0.07 -0.15 0.22 0.37 0.00 0.00 175.52 175.99 2hfn h TYR 66 N -0.05 -0.38 -0.09 3.16 5.03 -0.75 -0.03 116.97 123.86 2hfn h TYR 66 Ca 0.01 0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.26 2hfn h TYR 66 Cb 0.10 0.17 -0.01 0.00 1.55 0.00 0.00 36.73 38.53 2hfn h TYR 66 CO -0.04 -0.22 -0.27 0.45 -1.32 0.00 0.00 178.16 176.76 2hfn h HIS 67 N -0.24 0.17 -0.15 -3.82 3.86 -1.34 0.03 115.15 113.67 2hfn h HIS 67 Ca 0.05 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.22 2hfn h HIS 67 Cb 0.31 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 2hfn h HIS 67 CO -0.21 0.42 0.03 -0.09 0.86 0.00 0.00 177.93 178.94 2hfn h ARG 68 N 0.14 0.25 -0.73 2.45 2.43 -1.07 -3.05 114.38 114.80 2hfn h ARG 68 Ca 0.02 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.21 2hfn h ARG 68 Cb 0.56 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.01 2hfn h ARG 68 CO 0.04 0.41 0.39 0.82 -1.51 0.00 0.00 179.97 180.12 2hfn h ILE 69 N 0.04 0.90 0.00 1.20 2.04 -0.06 -1.16 117.51 120.47 2hfn h ILE 69 Ca 0.05 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 2hfn h ILE 69 Cb 0.28 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2hfn h ILE 69 CO 0.00 0.12 -0.00 -0.37 0.00 0.00 0.00 178.15 177.90 2hfn h VAL 70 N 0.68 0.27 0.00 1.67 -1.51 -0.92 -1.36 116.25 115.08 2hfn h VAL 70 Ca 0.35 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.81 2hfn h VAL 70 Cb 0.32 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.49 2hfn h VAL 70 CO -0.24 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.10 2hfn n GLN 71 N -3.48 0.39 -2.31 5.19 1.13 -0.44 -4.85 117.38 113.03 2hfn n GLN 71 Ca -0.03 0.04 -0.42 0.00 -1.94 0.00 0.00 57.00 54.65 2hfn n GLN 71 Cb 0.08 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 28.90 2hfn n GLN 71 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2hfn s ASP 72 N -2.53 6.92 0.06 1.08 3.68 -0.52 -4.91 116.67 120.46 2hfn s ASP 72 Ca 0.25 2.01 0.11 0.00 2.13 0.00 0.00 52.55 57.05 2hfn s ASP 72 Cb 0.17 -2.56 0.50 0.00 -1.45 0.00 0.00 42.92 39.58 2hfn s ASP 72 CO 0.38 -0.67 1.35 -1.84 0.13 0.00 0.00 175.17 174.53 2hfn n GLU 73 N 5.28 0.04 0.00 4.34 0.28 -1.26 -2.93 120.64 126.38 2hfn n GLU 73 Ca 0.12 0.39 0.15 0.00 -0.16 0.00 0.00 57.16 57.66 2hfn n GLU 73 Cb 0.45 -1.59 0.71 0.00 1.43 0.00 0.00 31.44 32.44 2hfn n GLU 73 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2hfn n ARG 74 N -1.66 1.04 -3.71 3.44 1.74 -1.26 -4.85 116.66 111.40 2hfn n ARG 74 Ca 0.02 -0.34 -0.10 0.00 -0.77 0.00 0.00 57.85 56.66 2hfn n ARG 74 Cb 0.11 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.01 2hfn n ARG 74 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 2hfn s HIS 75 N -2.19 -0.09 0.29 -1.55 -3.43 -1.15 -1.26 115.29 105.90 2hfn s HIS 75 Ca 0.38 -0.24 -0.03 0.00 -0.80 0.00 0.00 55.06 54.37 2hfn s HIS 75 Cb 0.21 0.26 -0.01 0.00 -1.43 0.00 0.00 32.58 31.60 2hfn s HIS 75 CO 0.40 -0.77 0.36 -3.38 -2.00 0.00 0.00 174.74 169.35 2hfn s HIS 76 N -3.85 1.04 -1.27 0.38 -3.43 0.38 -4.80 115.29 103.73 2hfn s HIS 76 Ca 0.07 -1.25 -0.03 0.00 -0.80 0.00 0.00 55.06 53.06 2hfn s HIS 76 Cb 0.01 -0.23 -0.01 0.00 -1.43 0.00 0.00 32.58 30.92 2hfn s HIS 76 CO -0.07 -0.95 0.72 0.43 -2.00 0.00 0.00 174.74 172.87 2hfn n SER 77 N -0.93 -1.94 -4.77 7.38 7.64 -1.26 -1.39 113.62 118.34 2hfn n SER 77 Ca 0.02 -0.84 -0.41 0.00 1.01 0.00 0.00 58.87 58.65 2hfn n SER 77 Cb 0.63 -4.03 -0.02 0.00 -1.01 0.00 0.00 64.21 59.78 2hfn n SER 77 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2hfn s PRO 78 N -5.88 4.31 -0.26 1.43 0.04 -1.26 -4.41 135.00 128.97 2hfn s PRO 78 Ca 0.08 2.25 0.02 0.00 0.04 0.00 0.00 61.00 63.39 2hfn s PRO 78 Cb -0.02 -3.04 0.07 0.00 0.04 0.00 0.00 34.50 31.54 2hfn s PRO 78 CO 0.81 -0.24 -0.05 -0.65 0.04 0.00 0.00 177.00 176.91 2hfn s GLN 79 N -1.86 1.71 0.02 4.56 -1.52 0.14 -4.99 119.66 117.72 2hfn s GLN 79 Ca 0.50 -1.17 -0.30 0.00 -1.95 0.00 0.00 55.36 52.43 2hfn s GLN 79 Cb -0.40 -2.69 -0.07 0.00 -0.22 0.00 0.00 33.01 29.63 2hfn s GLN 79 CO 0.54 -0.65 1.55 0.42 -0.25 0.00 0.00 175.29 176.90 2hfn s ILE 80 N 1.29 3.41 -0.18 1.08 1.01 -1.26 -1.26 121.20 125.28 2hfn s ILE 80 Ca -0.04 0.78 -0.09 0.00 0.00 0.00 0.00 60.65 61.30 2hfn s ILE 80 Cb -0.19 -3.50 -0.21 0.00 0.01 0.00 0.00 42.46 38.57 2hfn s ILE 80 CO -0.07 -0.01 0.14 -0.38 0.00 0.00 0.00 174.94 174.61 2hfn n ILE 81 N 4.84 1.65 -3.69 2.92 5.41 0.11 -4.96 119.36 125.63 2hfn n ILE 81 Ca 0.15 -0.48 -0.14 0.00 1.00 0.00 0.00 62.75 63.28 2hfn n ILE 81 Cb 0.42 -1.75 -0.09 0.00 -0.71 0.00 0.00 39.64 37.52 2hfn n ILE 81 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 2hfn s GLU 82 N -2.51 0.68 -0.11 0.38 2.12 -0.92 -4.75 118.70 113.61 2hfn s GLU 82 Ca -0.28 0.34 -0.04 0.00 0.36 0.00 0.00 54.97 55.35 2hfn s GLU 82 Cb 0.08 0.32 0.05 0.00 0.26 0.00 0.00 34.13 34.84 2hfn s GLU 82 CO 0.67 -0.15 0.21 0.00 -0.54 0.00 0.00 175.26 175.45 2hfn s MET 84 N 2.21 0.79 0.58 0.00 1.00 -0.67 -5.01 119.30 118.20 2hfn s MET 84 Ca 0.01 -0.07 -0.20 0.00 0.00 0.00 0.00 55.69 55.42 2hfn s MET 84 Cb -0.12 0.37 -0.03 0.00 0.00 0.00 0.00 34.83 35.05 2hfn s MET 84 CO -0.07 -0.30 1.34 -2.14 0.00 0.00 0.00 175.02 173.84 2hfn s PRO 85 N -2.15 2.92 0.16 2.03 0.02 -1.26 -1.27 135.00 135.44 2hfn s PRO 85 Ca 0.00 2.17 0.07 0.00 0.02 0.00 0.00 61.00 63.26 2hfn s PRO 85 Cb -0.01 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.37 2hfn s PRO 85 CO -0.03 -1.35 -0.15 0.96 -0.33 0.00 0.00 177.00 176.11 2hfn s ILE 86 N -1.34 1.56 0.03 2.83 -4.36 -0.23 -4.81 121.20 114.88 2hfn s ILE 86 Ca 0.76 -1.94 0.06 0.00 -0.26 0.00 0.00 60.65 59.27 2hfn s ILE 86 Cb -0.39 -1.79 -0.24 0.00 1.25 0.00 0.00 42.46 41.29 2hfn s ILE 86 CO 0.45 -0.47 0.95 0.03 0.24 0.00 0.00 174.94 176.14 2hfn h ARG 87 N 3.11 0.07 -2.52 0.37 2.47 -1.97 -3.43 114.38 112.49 2hfn h ARG 87 Ca -0.40 -0.12 -0.08 0.00 -1.26 0.00 0.00 59.98 58.13 2hfn h ARG 87 Cb 1.20 0.04 -0.19 0.00 -1.65 0.00 0.00 29.97 29.38 2hfn h ARG 87 CO 0.55 0.86 0.01 -0.98 0.56 0.00 0.00 179.97 180.97 2hfn s ARG 88 N -2.65 0.93 0.66 0.04 3.03 -1.26 -5.10 118.95 114.61 2hfn s ARG 88 Ca -0.04 -0.01 -0.14 0.00 2.03 0.00 0.00 55.73 57.57 2hfn s ARG 88 Cb 0.08 0.43 -0.00 0.00 -1.03 0.00 0.00 34.95 34.43 2hfn s ARG 88 CO 0.83 -0.30 1.08 1.03 -1.13 0.00 0.00 175.30 176.82 2hfn s ARG 89 N -1.56 2.89 0.00 3.89 0.52 -1.26 -4.98 118.95 118.44 2hfn s ARG 89 Ca -0.10 1.23 0.00 0.00 -0.52 0.00 0.00 55.73 56.34 2hfn s ARG 89 Cb -0.02 -1.97 0.00 0.00 0.52 0.00 0.00 34.95 33.48 2hfn s ARG 89 CO 0.05 -1.16 0.00 0.09 0.02 0.00 0.00 175.30 174.30 2hfn n ASN 90 N -2.59 3.42 -1.27 0.23 4.13 -1.26 -4.79 115.26 113.13 2hfn n ASN 90 Ca 0.09 -0.13 -0.07 0.00 1.68 0.00 0.00 54.58 56.16 2hfn n ASN 90 Cb 0.53 0.94 0.19 0.00 -1.54 0.00 0.00 39.78 39.89 2hfn n ASN 90 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2hfn n PHE 91 N -1.28 1.27 0.37 3.10 3.01 -1.26 -4.81 117.46 117.87 2hfn n PHE 91 Ca 0.00 -1.69 0.11 0.00 1.01 0.00 0.00 57.45 56.89 2hfn n PHE 91 Cb 0.00 -0.53 0.48 0.00 -0.01 0.00 0.00 39.48 39.42 2hfn n PHE 91 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2hfn n GLU 92 N -1.11 0.17 0.17 -1.08 0.00 -1.26 -3.35 120.64 114.17 2hfn n GLU 92 Ca 0.35 0.43 0.04 0.00 0.00 0.00 0.00 57.16 57.99 2hfn n GLU 92 Cb 1.05 -1.84 0.26 0.00 0.00 0.00 0.00 31.44 30.91 2hfn n GLU 92 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.13 176.74 2hfn h VAL 93 N 0.00 0.98 -3.80 3.84 -1.51 -1.96 -3.44 116.25 110.37 2hfn h VAL 93 Ca 0.00 -1.75 -0.53 0.00 -1.23 0.00 0.00 66.70 63.18 2hfn h VAL 93 Cb 0.31 2.05 -0.32 0.00 -2.13 0.00 0.00 31.29 31.20 2hfn h VAL 93 CO 0.00 0.44 -0.83 0.26 -1.23 0.00 0.00 177.57 176.21 2hfn s TRP 94 N -3.49 1.56 0.26 5.19 0.52 -1.21 -5.00 118.94 116.76 2hfn s TRP 94 Ca 0.00 -0.47 -0.02 0.00 0.02 0.00 0.00 56.10 55.64 2hfn s TRP 94 Cb 0.11 -1.07 0.45 0.00 -1.15 0.00 0.00 33.47 31.81 2hfn s TRP 94 CO 0.71 -0.18 1.84 0.66 0.02 0.00 0.00 176.95 180.00 2hfn h SER 95 N 6.40 0.86 -4.44 2.95 4.64 -1.85 -2.86 113.55 119.25 2hfn h SER 95 Ca -0.32 0.04 -0.08 0.00 -0.47 0.00 0.00 61.79 60.96 2hfn h SER 95 Cb 1.18 -0.14 -0.21 0.00 -0.31 0.00 0.00 62.40 62.92 2hfn h SER 95 CO 0.48 0.50 -0.02 -0.32 -0.87 0.00 0.00 176.83 176.60 2hfn s MET 96 N -6.01 0.78 0.06 4.77 -2.45 -1.26 -3.54 119.30 111.65 2hfn s MET 96 Ca -0.12 0.46 0.08 0.00 -1.25 0.00 0.00 55.69 54.86 2hfn s MET 96 Cb 0.20 0.37 -0.03 0.00 1.25 0.00 0.00 34.83 36.63 2hfn s MET 96 CO 0.80 -0.17 -0.22 -1.14 1.05 0.00 0.00 175.02 175.34 2hfn s GLN 97 N -0.43 1.41 -0.03 4.11 0.74 -1.10 -4.91 119.66 119.45 2hfn s GLN 97 Ca -0.06 -1.03 0.00 0.00 0.05 0.00 0.00 55.36 54.32 2hfn s GLN 97 Cb -0.03 -1.58 0.03 0.00 1.10 0.00 0.00 33.01 32.52 2hfn s GLN 97 CO 0.04 0.40 -0.00 0.00 -0.55 0.00 0.00 175.29 175.18 2hfn s ALA 98 N -0.88 0.32 -0.05 1.58 0.00 -0.43 -0.45 121.76 121.84 2hfn s ALA 98 Ca 0.08 0.16 0.01 0.00 0.00 0.00 0.00 51.96 52.21 2hfn s ALA 98 Cb -0.09 -0.31 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2hfn s ALA 98 CO 0.03 -0.06 -0.05 0.42 0.00 0.00 0.00 175.76 176.09 2hfn s ILE 99 N 0.98 0.63 0.04 0.00 -1.09 -0.27 -2.91 121.20 118.59 2hfn s ILE 99 Ca -0.10 -0.15 -0.29 0.00 -2.23 0.00 0.00 60.65 57.88 2hfn s ILE 99 Cb -0.13 -0.65 -0.05 0.00 -1.58 0.00 0.00 42.46 40.05 2hfn s ILE 99 CO -0.02 0.26 0.91 -0.89 -1.23 0.00 0.00 174.94 173.97 2hfn s THR 100 N 1.04 4.72 -0.24 2.92 2.01 -1.26 -1.60 115.64 123.23 2hfn s THR 100 Ca -0.09 1.94 0.01 0.00 0.31 0.00 0.00 61.69 63.86 2hfn s THR 100 Cb -0.14 -4.26 0.07 0.00 0.01 0.00 0.00 72.50 68.17 2hfn s THR 100 CO -0.00 0.26 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.46 2hfn s VAL 101 N 0.44 1.49 0.00 3.82 1.01 -0.25 -4.90 120.40 122.00 2hfn s VAL 101 Ca 0.47 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 61.17 2hfn s VAL 101 Cb -0.22 -1.81 0.00 0.00 0.00 0.00 0.00 36.38 34.36 2hfn s VAL 101 CO 0.27 -0.18 0.00 -0.46 0.00 0.00 0.00 175.10 174.73 2hfn n ASN 102 N 4.67 0.00 -0.04 3.32 2.04 -1.26 -4.05 115.26 119.95 2hfn n ASN 102 Ca -0.10 -0.80 0.14 0.00 -0.44 0.00 0.00 54.58 53.38 2hfn n ASN 102 Cb 0.44 0.00 0.83 0.00 -2.53 0.00 0.00 39.78 38.52 2hfn n ASN 102 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 2hfn n ASP 103 N -1.34 0.12 -0.80 0.53 9.92 -1.26 -1.14 116.55 122.57 2hfn n ASP 103 Ca 0.00 -1.13 0.12 0.00 -0.53 0.00 0.00 54.79 53.25 2hfn n ASP 103 Cb 0.00 -0.00 0.28 0.00 -0.64 0.00 0.00 41.12 40.76 2hfn n ASP 103 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2hfn n LEU 104 N -0.86 2.47 -4.75 0.64 4.77 -1.26 -4.96 117.00 113.06 2hfn n LEU 104 Ca 0.21 -0.90 -0.31 0.00 -0.03 0.00 0.00 56.01 54.99 2hfn n LEU 104 Cb 0.12 -0.06 0.11 0.00 -2.33 0.00 0.00 43.42 41.26 2hfn n LEU 104 CO 0.16 0.45 0.69 -0.44 -1.33 0.00 0.00 177.39 176.92 2hfn s SER 105 N -1.86 4.12 0.72 -1.43 0.01 -0.29 -5.01 113.70 109.96 2hfn s SER 105 Ca 0.33 1.82 -0.15 0.00 1.31 0.00 0.00 55.95 59.27 2hfn s SER 105 Cb 0.20 -2.48 0.03 0.00 0.21 0.00 0.00 66.02 63.99 2hfn s SER 105 CO 0.31 -2.28 1.19 -0.89 0.41 0.00 0.00 173.24 171.98 2hfn s THR 106 N -2.87 2.44 0.39 1.44 2.01 -1.26 -4.78 115.64 113.01 2hfn s THR 106 Ca 0.62 0.21 0.06 0.00 0.31 0.00 0.00 61.69 62.90 2hfn s THR 106 Cb -0.18 -2.78 0.24 0.00 0.01 0.00 0.00 72.50 69.79 2hfn s THR 106 CO 0.56 -0.12 2.01 -0.33 -0.69 0.00 0.00 174.62 176.06 2hfn h GLU 107 N -0.24 0.56 -0.50 4.92 4.39 -1.99 -1.03 114.58 120.70 2hfn h GLU 107 Ca -0.48 -0.05 0.06 0.00 0.34 0.00 0.00 59.36 59.23 2hfn h GLU 107 Cb 1.29 -0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.77 2hfn h GLU 107 CO 0.50 0.42 0.21 0.37 -1.16 0.00 0.00 179.01 179.35 2hfn h GLN 108 N 0.57 0.39 -0.21 2.33 4.15 -1.97 -0.00 115.11 120.37 2hfn h GLN 108 Ca 0.15 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.40 2hfn h GLN 108 Cb 0.03 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.63 2hfn h GLN 108 CO -0.02 0.26 -0.44 0.28 -1.93 0.00 0.00 178.83 176.98 2hfn h VAL 109 N 0.41 1.32 -0.86 2.39 2.07 -1.79 -2.59 116.25 117.19 2hfn h VAL 109 Ca 0.23 -1.66 0.04 0.00 0.82 0.00 0.00 66.70 66.14 2hfn h VAL 109 Cb 0.21 1.83 -0.05 0.00 -1.52 0.00 0.00 31.29 31.75 2hfn h VAL 109 CO -0.21 0.52 0.57 0.11 0.02 0.00 0.00 177.57 178.58 2hfn h LYS 110 N 0.38 1.01 -0.45 1.57 1.57 -0.96 -1.45 116.57 118.24 2hfn h LYS 110 Ca 0.01 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.64 2hfn h LYS 110 Cb 1.04 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.11 2hfn h LYS 110 CO 0.10 0.67 -0.06 1.15 -0.57 0.00 0.00 179.45 180.73 2hfn h THR 111 N 1.04 1.25 -0.47 -0.16 2.02 -0.90 -1.43 112.91 114.26 2hfn h THR 111 Ca 0.35 -1.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 2hfn h THR 111 Cb 0.08 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 2hfn h THR 111 CO -0.11 0.38 0.25 0.25 0.37 0.00 0.00 175.52 176.65 2hfn h LEU 112 N 0.71 0.60 -0.24 2.58 6.46 -0.99 0.18 115.31 124.61 2hfn h LEU 112 Ca 0.13 -0.11 0.03 0.00 -0.12 0.00 0.00 57.88 57.81 2hfn h LEU 112 Cb 0.53 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.27 2hfn h LEU 112 CO 0.03 0.53 0.05 0.58 -0.62 0.00 0.00 178.44 179.02 2hfn h VAL 113 N 0.62 0.90 -0.53 1.05 2.07 -1.02 -2.49 116.25 116.84 2hfn h VAL 113 Ca 0.16 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2hfn h VAL 113 Cb 0.08 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 2hfn h VAL 113 CO -0.02 0.03 0.24 0.25 0.02 0.00 0.00 177.57 178.09 2hfn h LEU 114 N 0.15 0.67 -1.80 2.57 5.85 -0.95 -2.47 115.31 119.33 2hfn h LEU 114 Ca 0.11 -0.07 0.14 0.00 0.84 0.00 0.00 57.88 58.90 2hfn h LEU 114 Cb 0.10 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2hfn h LEU 114 CO -0.14 0.58 0.41 0.50 -0.34 0.00 0.00 178.44 179.46 2hfn h LYS 115 N 0.75 0.20 -0.15 1.25 3.64 -0.17 -2.91 116.57 119.18 2hfn h LYS 115 Ca 0.19 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2hfn h LYS 115 Cb 0.10 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2hfn h LYS 115 CO -0.02 0.13 0.00 0.66 -2.27 0.00 0.00 179.45 177.95 2hfn n TYR 116 N -4.43 0.20 -3.84 1.91 4.02 -0.96 -5.07 117.16 108.99 2hfn n TYR 116 Ca 0.11 -0.41 -0.06 0.00 -0.01 0.00 0.00 57.90 57.52 2hfn n TYR 116 Cb 0.52 -0.03 0.02 0.00 -0.02 0.00 0.00 39.34 39.83 2hfn n TYR 116 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2hfn s SER 117 N -0.91 -0.02 0.53 7.72 1.04 -0.99 -4.83 113.70 116.24 2hfn s SER 117 Ca 0.11 -0.90 0.32 0.00 0.48 0.00 0.00 55.95 55.97 2hfn s SER 117 Cb 0.06 0.69 1.26 0.00 0.10 0.00 0.00 66.02 68.12 2hfn s SER 117 CO 0.08 -1.36 1.94 1.23 0.98 0.00 0.00 173.24 176.11 2hfn h GLY 118 N 2.00 0.00 -2.11 7.32 0.00 -1.84 -3.42 103.07 105.03 2hfn h GLY 118 Ca -0.29 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 46.81 2hfn h GLY 118 CO 0.37 0.00 -0.31 -1.36 0.00 0.00 0.00 176.54 175.24 2hfn s PHE 119 N -3.61 0.96 -1.43 5.60 0.08 -1.26 -5.04 117.98 113.28 2hfn s PHE 119 Ca 0.02 -1.20 0.29 0.00 0.12 0.00 0.00 56.93 56.16 2hfn s PHE 119 Cb 0.09 -0.20 1.19 0.00 -0.57 0.00 0.00 43.02 43.52 2hfn s PHE 119 CO 0.55 -0.94 1.85 -2.37 -0.10 0.00 0.00 175.22 174.21 2hfn n THR 120 N -0.44 0.00 -3.85 0.64 5.66 -1.26 -3.18 114.28 111.84 2hfn n THR 120 Ca 0.01 -0.03 -0.36 0.00 -3.05 0.00 0.00 64.05 60.61 2hfn n THR 120 Cb 0.63 -0.18 -0.07 0.00 -1.55 0.00 0.00 70.33 69.16 2hfn n THR 120 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2hfn s THR 121 N -2.64 5.42 -0.14 1.09 -4.23 -1.26 -4.75 115.64 109.13 2hfn s THR 121 Ca 0.24 0.18 -0.29 0.00 -1.18 0.00 0.00 61.69 60.64 2hfn s THR 121 Cb 0.20 -3.40 -0.03 0.00 1.34 0.00 0.00 72.50 70.61 2hfn s THR 121 CO 0.51 0.56 1.40 -0.22 -0.54 0.00 0.00 174.62 176.32 2hfn s LEU 122 N -0.55 4.20 -0.42 4.79 2.96 -1.26 -4.96 118.68 123.44 2hfn s LEU 122 Ca 0.12 1.83 0.02 0.00 -0.22 0.00 0.00 54.13 55.88 2hfn s LEU 122 Cb -0.12 -3.54 0.13 0.00 0.50 0.00 0.00 46.19 43.17 2hfn s LEU 122 CO 0.02 -0.85 0.22 -0.13 -1.32 0.00 0.00 176.35 174.29 2hfn s ARG 123 N 3.74 1.20 0.42 1.98 0.52 -1.26 -4.82 118.95 120.73 2hfn s ARG 123 Ca 0.61 -1.88 0.16 0.00 -0.52 0.00 0.00 55.73 54.10 2hfn s ARG 123 Cb -0.25 -2.27 1.06 0.00 0.52 0.00 0.00 34.95 34.01 2hfn s ARG 123 CO 0.20 -1.14 1.88 -1.35 0.02 0.00 0.00 175.30 174.91 2hfn h PRO 124 N 6.89 0.41 0.00 3.54 0.11 -1.93 0.06 132.00 141.08 2hfn h PRO 124 Ca -0.02 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2hfn h PRO 124 Cb 0.94 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2hfn h PRO 124 CO 0.47 0.27 0.00 -1.13 -0.21 0.00 0.00 178.00 177.40 2hfn n SER 125 N -4.50 0.12 -1.29 -2.05 3.41 -1.26 -1.96 113.62 106.09 2hfn n SER 125 Ca 0.17 0.55 0.09 0.00 -0.26 0.00 0.00 58.87 59.42 2hfn n SER 125 Cb 0.63 -0.57 0.30 0.00 -0.26 0.00 0.00 64.21 64.31 2hfn n SER 125 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2hfn n ALA 126 N -1.56 2.79 -2.63 7.33 0.00 0.01 -4.95 120.51 121.50 2hfn n ALA 126 Ca 0.01 -1.55 -0.20 0.00 0.00 0.00 0.00 53.44 51.70 2hfn n ALA 126 Cb 0.08 -0.85 -0.14 0.00 0.00 0.00 0.00 19.45 18.53 2hfn n ALA 126 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2hfn s MET 127 N -1.67 0.94 0.70 0.00 -1.94 -0.83 -4.71 119.30 111.80 2hfn s MET 127 Ca 0.44 -0.57 -0.06 0.00 -1.71 0.00 0.00 55.69 53.80 2hfn s MET 127 Cb 0.28 -0.92 0.07 0.00 2.01 0.00 0.00 34.83 36.27 2hfn s MET 127 CO 0.22 0.24 1.01 0.16 -0.01 0.00 0.00 175.02 176.64 2hfn s ASP 128 N -0.66 4.75 0.38 3.03 3.84 -1.26 -4.79 116.67 121.95 2hfn s ASP 128 Ca 0.03 0.35 0.08 0.00 -0.00 0.00 0.00 52.55 53.01 2hfn s ASP 128 Cb -0.06 -0.98 0.80 0.00 -1.38 0.00 0.00 42.92 41.30 2hfn s ASP 128 CO 0.00 -1.63 1.96 -0.65 -0.00 0.00 0.00 175.17 174.85 2hfn h PRO 129 N -0.58 0.66 -0.44 2.11 0.11 -1.97 -0.68 132.00 131.20 2hfn h PRO 129 Ca -0.44 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 2hfn h PRO 129 Cb 1.31 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 2hfn h PRO 129 CO 0.57 0.44 -0.14 1.49 -0.21 0.00 0.00 178.00 180.15 2hfn h GLU 130 N 0.68 0.83 -0.23 1.05 4.81 -1.98 -1.02 114.58 118.72 2hfn h GLU 130 Ca 0.31 -0.30 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2hfn h GLU 130 Cb 0.34 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2hfn h GLU 130 CO -0.11 0.92 -0.07 1.96 -0.73 0.00 0.00 179.01 180.98 2hfn h GLN 131 N 0.74 0.45 -0.17 1.92 4.20 -1.73 -1.05 115.11 119.49 2hfn h GLN 131 Ca 0.12 -0.18 0.03 0.00 0.06 0.00 0.00 58.65 58.68 2hfn h GLN 131 Cb 0.64 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.37 2hfn h GLN 131 CO 0.05 0.70 -0.03 0.00 -0.67 0.00 0.00 178.83 178.87 2hfn h LEU 133 N 0.01 -0.05 -0.52 0.00 5.85 -1.10 -1.02 115.31 118.48 2hfn h LEU 133 Ca 0.08 0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.68 2hfn h LEU 133 Cb 0.12 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 2hfn h LEU 133 CO -0.16 -0.01 -0.36 0.78 -0.34 0.00 0.00 178.44 178.35 2hfn h ASN 134 N 0.03 0.85 -0.15 1.25 2.35 -1.02 0.14 115.58 119.03 2hfn h ASN 134 Ca 0.05 -0.37 0.04 0.00 -0.55 0.00 0.00 56.30 55.47 2hfn h ASN 134 Cb 0.06 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 38.15 2hfn h ASN 134 CO -0.08 1.12 -0.12 0.15 -1.65 0.00 0.00 177.43 176.85 2hfn h PHE 135 N 0.67 -0.29 -0.74 1.19 3.04 -0.74 -1.15 116.94 118.91 2hfn h PHE 135 Ca 0.06 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.04 2hfn h PHE 135 Cb 0.92 0.15 -0.04 0.00 2.56 0.00 0.00 35.95 39.54 2hfn h PHE 135 CO 0.05 -0.18 0.47 -0.07 -2.02 0.00 0.00 178.31 176.57 2hfn h LEU 136 N -0.13 0.87 -0.78 0.59 3.38 -0.89 -0.88 115.31 117.47 2hfn h LEU 136 Ca 0.09 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.03 2hfn h LEU 136 Cb 0.27 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 2hfn h LEU 136 CO -0.23 0.65 0.51 -0.07 0.09 0.00 0.00 178.44 179.39 2hfn h LEU 137 N 1.01 0.90 -0.57 1.67 3.38 -0.80 -0.78 115.31 120.12 2hfn h LEU 137 Ca 0.27 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 2hfn h LEU 137 Cb -0.09 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2hfn h LEU 137 CO -0.06 0.66 -0.48 0.44 0.09 0.00 0.00 178.44 179.10 2hfn h ASP 138 N 1.06 0.64 0.23 -0.43 5.19 -0.61 -2.06 116.42 120.44 2hfn h ASP 138 Ca 0.28 -0.32 -0.23 0.00 -0.62 0.00 0.00 57.03 56.15 2hfn h ASP 138 Cb -0.10 -0.18 0.01 0.00 0.18 0.00 0.00 39.33 39.23 2hfn h ASP 138 CO -0.06 1.02 -0.92 -0.29 -3.12 0.00 0.00 179.24 175.87 2hfn h ILE 139 N 0.47 1.37 -0.86 0.35 2.10 -1.04 -2.86 117.51 117.04 2hfn h ILE 139 Ca 0.02 -2.34 0.07 0.00 1.08 0.00 0.00 64.86 63.70 2hfn h ILE 139 Cb 1.01 2.34 -0.06 0.00 -1.09 0.00 0.00 36.82 39.02 2hfn h ILE 139 CO 0.09 0.71 0.56 0.00 -1.08 0.00 0.00 178.15 178.43 2hfn h ALA 140 N 0.69 1.60 -0.09 0.18 0.00 -0.99 -1.94 119.26 118.72 2hfn h ALA 140 Ca -0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2hfn h ALA 140 Cb 1.55 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 2hfn h ALA 140 CO 0.17 0.25 -0.31 -0.22 0.00 0.00 0.00 179.25 179.14 2hfn h LYS 141 N 0.92 0.17 0.00 0.00 3.64 -1.15 -3.19 116.57 116.96 2hfn h LYS 141 Ca 0.38 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 2hfn h LYS 141 Cb 0.28 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 2hfn h LYS 141 CO -0.14 0.47 -1.03 0.44 -2.27 0.00 0.00 179.45 176.92 2hfn n ILE 142 N -4.12 0.25 -3.47 2.00 -5.35 -0.77 -4.63 119.36 103.26 2hfn n ILE 142 Ca -0.01 -0.31 -0.43 0.00 -0.27 0.00 0.00 62.75 61.73 2hfn n ILE 142 Cb 0.39 0.06 -0.08 0.00 -1.74 0.00 0.00 39.64 38.28 2hfn n ILE 142 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 2hfn s TYR 143 N -3.24 3.32 0.00 4.28 1.51 -0.94 -4.97 117.35 117.31 2hfn s TYR 143 Ca 0.03 -1.45 0.00 0.00 -1.01 0.00 0.00 57.07 54.64 2hfn s TYR 143 Cb 0.13 -3.37 0.00 0.00 -0.11 0.00 0.00 41.96 38.61 2hfn s TYR 143 CO 0.79 -0.92 0.00 -1.91 -1.11 0.00 0.00 175.55 172.40 2hfn n GLU 144 N 5.06 0.00 -3.06 -0.62 4.07 -1.26 -4.86 120.64 119.96 2hfn n GLU 144 Ca -0.11 0.00 -0.18 0.00 -0.06 0.00 0.00 57.16 56.81 2hfn n GLU 144 Cb 0.42 0.00 0.02 0.00 -0.06 0.00 0.00 31.44 31.82 2hfn n GLU 144 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2hfn s LEU 145 N 0.00 3.45 0.00 4.31 1.43 -1.26 -5.00 118.68 121.61 2hfn s LEU 145 Ca 0.00 -0.59 0.18 0.00 -1.03 0.00 0.00 54.13 52.69 2hfn s LEU 145 Cb 0.00 -2.27 0.84 0.00 0.03 0.00 0.00 46.19 44.79 2hfn s LEU 145 CO 0.00 -0.95 1.58 -1.54 0.23 0.00 0.00 176.35 175.67 2hfn n SER 146 N -1.96 0.00 -3.78 2.29 3.41 -1.26 -4.82 113.62 107.49 2hfn n SER 146 Ca 0.10 0.32 -0.07 0.00 -0.26 0.00 0.00 58.87 58.96 2hfn n SER 146 Cb 0.60 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 64.11 2hfn n SER 146 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2hfn s ASP 147 N -2.84 -0.30 -0.22 4.04 1.47 -1.26 -1.31 116.67 116.25 2hfn s ASP 147 Ca 0.12 -0.49 0.12 0.00 1.18 0.00 0.00 52.55 53.48 2hfn s ASP 147 Cb 0.12 0.69 0.43 0.00 -0.34 0.00 0.00 42.92 43.82 2hfn s ASP 147 CO 0.32 -1.25 1.30 -0.46 0.68 0.00 0.00 175.17 175.76 2hfn n ASN 148 N -0.45 2.24 0.10 2.11 6.94 -1.15 -4.71 115.26 120.35 2hfn n ASN 148 Ca -0.06 -3.64 -0.04 0.00 -0.02 0.00 0.00 54.58 50.82 2hfn n ASN 148 Cb 0.60 -0.55 0.03 0.00 -2.36 0.00 0.00 39.78 37.51 2hfn n ASN 148 CO 0.00 0.00 0.00 -0.26 -1.03 0.00 0.00 177.26 175.97 2hfn h PHE 149 N 0.89 0.00 0.00 -2.53 0.04 -1.96 -3.37 116.94 110.01 2hfn h PHE 149 Ca 0.07 0.00 -0.29 0.00 2.80 0.00 0.00 57.97 60.55 2hfn h PHE 149 Cb 1.24 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.33 2hfn h PHE 149 CO 0.68 0.79 -2.10 1.19 -0.60 0.00 0.00 178.31 178.27 2hfn n PHE 150 N -3.57 0.00 -3.73 -0.55 3.72 -1.26 -4.99 117.46 107.08 2hfn n PHE 150 Ca -0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 2hfn n PHE 150 Cb 0.77 -0.76 -0.12 0.00 -0.94 0.00 0.00 39.48 38.42 2hfn n PHE 150 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 2hfn s LEU 151 N -5.76 0.36 0.00 4.37 2.96 -1.26 -5.17 118.68 114.18 2hfn s LEU 151 Ca -0.19 0.64 0.00 0.00 -0.22 0.00 0.00 54.13 54.35 2hfn s LEU 151 Cb 0.06 0.95 0.00 0.00 0.50 0.00 0.00 46.19 47.70 2hfn s LEU 151 CO 0.53 -0.16 0.00 -0.67 -1.32 0.00 0.00 176.35 174.73 2hfn n ASP 152 N 4.00 0.00 0.00 3.68 2.03 -1.26 -4.32 116.55 120.68 2hfn n ASP 152 Ca -0.23 -0.14 0.00 0.00 0.52 0.00 0.00 54.79 54.95 2hfn n ASP 152 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 2hfn n ASP 152 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28