#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 4.34 0.16 2.46 2.96 -1.26 0.08 118.68 127.41 2hfn s LEU 6 Ca 0.00 2.26 0.04 0.00 -0.22 0.00 0.00 54.13 56.21 2hfn s LEU 6 Cb 0.00 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.08 2hfn s LEU 6 CO 0.00 -0.78 -0.08 -0.31 -1.32 0.00 0.00 176.35 173.86 2hfn s TYR 7 N 2.46 1.27 -0.01 5.38 1.51 0.83 -1.24 117.35 127.54 2hfn s TYR 7 Ca 0.68 -0.81 -0.00 0.00 -1.01 0.00 0.00 57.07 55.92 2hfn s TYR 7 Cb -0.35 -0.67 0.02 0.00 -0.11 0.00 0.00 41.96 40.85 2hfn s TYR 7 CO 0.29 0.03 0.03 0.50 -1.11 0.00 0.00 175.55 175.28 2hfn s ARG 8 N -3.78 -0.00 -0.06 -0.62 3.52 -0.59 -2.10 118.95 115.32 2hfn s ARG 8 Ca 0.18 0.11 0.04 0.00 -0.13 0.00 0.00 55.73 55.93 2hfn s ARG 8 Cb 0.03 -0.11 0.00 0.00 -1.56 0.00 0.00 34.95 33.31 2hfn s ARG 8 CO 0.01 -0.08 -0.17 -1.17 -0.81 0.00 0.00 175.30 173.08 2hfn s LEU 9 N 0.53 1.87 -0.10 -0.88 0.20 -0.22 -1.99 118.68 118.09 2hfn s LEU 9 Ca -0.04 -0.37 0.04 0.00 0.69 0.00 0.00 54.13 54.44 2hfn s LEU 9 Cb -0.06 -1.00 -0.00 0.00 -0.43 0.00 0.00 46.19 44.70 2hfn s LEU 9 CO -0.02 0.12 -0.23 -0.63 -0.29 0.00 0.00 176.35 175.30 2hfn s ILE 10 N 0.26 2.12 0.07 6.68 1.01 0.89 -0.95 121.20 131.28 2hfn s ILE 10 Ca -0.09 -1.00 -0.02 0.00 0.00 0.00 0.00 60.65 59.54 2hfn s ILE 10 Cb -0.14 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 2hfn s ILE 10 CO 0.04 0.56 0.02 -0.72 0.00 0.00 0.00 174.94 174.83 2hfn s TYR 11 N 0.37 0.53 0.20 3.97 1.13 -0.75 0.49 117.35 123.28 2hfn s TYR 11 Ca -0.18 -1.03 0.09 0.00 -1.41 0.00 0.00 57.07 54.54 2hfn s TYR 11 Cb -0.18 -0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 40.28 2hfn s TYR 11 CO 0.08 -0.43 -0.18 -1.54 -2.51 0.00 0.00 175.55 170.98 2hfn s SER 12 N -2.93 2.88 0.19 -0.18 1.04 -0.15 -1.73 113.70 112.82 2hfn s SER 12 Ca 0.10 -0.94 -0.13 0.00 0.48 0.00 0.00 55.95 55.45 2hfn s SER 12 Cb 0.07 -0.19 0.01 0.00 0.10 0.00 0.00 66.02 66.02 2hfn s SER 12 CO -0.08 -0.05 0.42 -0.44 0.98 0.00 0.00 173.24 174.06 2hfn s SER 13 N -3.03 -0.11 -0.26 7.02 0.01 -0.85 -0.20 113.70 116.27 2hfn s SER 13 Ca 0.21 -0.71 -0.09 0.00 1.31 0.00 0.00 55.95 56.67 2hfn s SER 13 Cb -0.04 0.52 -0.04 0.00 0.21 0.00 0.00 66.02 66.67 2hfn s SER 13 CO 0.09 -1.00 0.12 -1.10 0.41 0.00 0.00 173.24 171.76 2hfn s GLN 14 N -3.93 3.75 0.43 12.44 -1.52 -0.31 -1.01 119.66 129.51 2hfn s GLN 14 Ca 0.14 -0.43 -0.23 0.00 -1.95 0.00 0.00 55.36 52.90 2hfn s GLN 14 Cb 0.01 -3.46 -0.09 0.00 -0.22 0.00 0.00 33.01 29.25 2hfn s GLN 14 CO -0.00 -0.20 1.04 0.20 -0.25 0.00 0.00 175.29 176.08 2hfn s GLY 15 N 1.67 2.64 0.49 3.09 0.00 0.34 -0.24 107.32 115.32 2hfn s GLY 15 Ca 0.07 0.65 -0.23 0.00 0.00 0.00 0.00 44.72 45.21 2hfn s GLY 15 CO 0.07 1.04 1.28 0.29 0.00 0.00 0.00 173.10 175.77 2hfn n ILE 16 N -0.39 3.17 0.28 0.90 -5.35 -0.86 -4.85 119.36 112.25 2hfn n ILE 16 Ca 0.06 -0.50 0.17 0.00 -0.27 0.00 0.00 62.75 62.22 2hfn n ILE 16 Cb 0.51 -1.57 0.85 0.00 -1.74 0.00 0.00 39.64 37.69 2hfn n ILE 16 CO 0.00 0.00 0.00 -0.65 -1.76 0.00 0.00 176.55 174.14 2hfn h PRO 17 N 1.67 0.00 -0.61 6.28 0.11 -1.94 -2.99 132.00 134.52 2hfn h PRO 17 Ca -0.49 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.36 2hfn h PRO 17 Cb 1.30 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.26 2hfn h PRO 17 CO 0.58 0.00 0.22 0.09 -0.21 0.00 0.00 178.00 178.68 2hfn n ASN 18 N -3.16 3.61 -4.69 -2.05 4.13 -1.26 -5.01 115.26 106.82 2hfn n ASN 18 Ca -0.00 -3.49 -0.42 0.00 1.68 0.00 0.00 54.58 52.35 2hfn n ASN 18 Cb 0.38 -0.71 -0.03 0.00 -1.54 0.00 0.00 39.78 37.89 2hfn n ASN 18 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2hfn s LEU 19 N -3.14 4.32 0.41 3.41 1.43 -1.13 -5.04 118.68 118.93 2hfn s LEU 19 Ca 0.50 2.05 0.05 0.00 -1.03 0.00 0.00 54.13 55.70 2hfn s LEU 19 Cb 0.43 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 43.08 2hfn s LEU 19 CO 0.08 -0.64 0.57 -1.10 0.23 0.00 0.00 176.35 175.49 2hfn s GLN 20 N 2.03 2.96 0.53 1.70 -1.52 -1.26 -5.00 119.66 119.10 2hfn s GLN 20 Ca 0.61 -0.93 0.22 0.00 -1.95 0.00 0.00 55.36 53.31 2hfn s GLN 20 Cb -0.30 -2.71 1.42 0.00 -0.22 0.00 0.00 33.01 31.20 2hfn s GLN 20 CO 0.26 -0.18 2.14 -1.35 -0.25 0.00 0.00 175.29 175.91 2hfn h PRO 21 N 0.62 0.00 0.00 2.91 0.11 -2.01 -2.37 132.00 131.26 2hfn h PRO 21 Ca -0.44 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.61 2hfn h PRO 21 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2hfn h PRO 21 CO 0.52 0.05 -0.28 1.96 -0.21 0.00 0.00 178.00 180.05 2hfn h GLN 22 N 0.00 0.00 -0.39 1.05 1.08 -1.99 -2.68 115.11 112.18 2hfn h GLN 22 Ca -0.00 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.04 2hfn h GLN 22 Cb 0.11 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.54 2hfn h GLN 22 CO 0.01 0.28 -0.37 -0.44 -0.95 0.00 0.00 178.83 177.35 2hfn h ASP 23 N 0.00 0.99 -0.55 1.46 3.32 -1.82 -0.89 116.42 118.94 2hfn h ASP 23 Ca -0.00 -0.46 -0.10 0.00 0.02 0.00 0.00 57.03 56.49 2hfn h ASP 23 Cb 0.53 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2hfn h ASP 23 CO 0.04 1.25 -0.03 -0.07 -1.72 0.00 0.00 179.24 178.71 2hfn h LEU 24 N 0.75 0.99 -0.76 1.55 4.07 -1.55 -0.39 115.31 119.97 2hfn h LEU 24 Ca 0.06 -0.29 0.02 0.00 0.08 0.00 0.00 57.88 57.75 2hfn h LEU 24 Cb 0.97 -0.27 -0.04 0.00 1.08 0.00 0.00 40.66 42.40 2hfn h LEU 24 CO 0.09 1.06 0.50 0.07 -1.08 0.00 0.00 178.44 179.08 2hfn h LYS 25 N 0.92 0.97 0.07 1.13 5.09 -1.39 -1.60 116.57 121.76 2hfn h LYS 25 Ca 0.16 -0.06 -0.00 0.00 0.09 0.00 0.00 60.65 60.84 2hfn h LYS 25 Cb 0.58 -0.22 0.00 0.00 0.10 0.00 0.00 32.23 32.69 2hfn h LYS 25 CO 0.03 0.64 -0.03 -0.44 -2.09 0.00 0.00 179.45 177.56 2hfn h ASP 26 N 1.00 -0.08 -0.47 7.07 3.45 -0.76 -1.53 116.42 125.11 2hfn h ASP 26 Ca 0.29 -0.04 0.05 0.00 0.43 0.00 0.00 57.03 57.75 2hfn h ASP 26 Cb -0.08 0.02 -0.04 0.00 -0.56 0.00 0.00 39.33 38.67 2hfn h ASP 26 CO -0.08 -0.01 0.21 0.40 -1.57 0.00 0.00 179.24 178.20 2hfn h ILE 27 N -0.14 0.93 -0.70 0.35 2.04 -0.98 -2.29 117.51 116.71 2hfn h ILE 27 Ca -0.01 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 2hfn h ILE 27 Cb 0.12 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 2hfn h ILE 27 CO 0.02 0.08 0.40 0.25 0.00 0.00 0.00 178.15 178.89 2hfn h LEU 28 N 0.42 0.86 -0.69 1.44 6.46 -1.19 -2.17 115.31 120.45 2hfn h LEU 28 Ca 0.21 -0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.88 2hfn h LEU 28 Cb 0.15 -0.22 -0.03 0.00 -0.73 0.00 0.00 40.66 39.83 2hfn h LEU 28 CO -0.17 0.70 0.41 -0.33 -0.62 0.00 0.00 178.44 178.43 2hfn h GLU 29 N 0.96 0.93 -0.21 1.25 4.39 -0.92 -0.87 114.58 120.12 2hfn h GLU 29 Ca 0.25 -0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.83 2hfn h GLU 29 Cb 0.01 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.46 2hfn h GLU 29 CO -0.04 0.66 0.01 0.77 -1.16 0.00 0.00 179.01 179.25 2hfn h SER 30 N 0.94 0.36 -0.25 1.42 0.02 -1.16 -2.40 113.55 112.47 2hfn h SER 30 Ca 0.25 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.82 2hfn h SER 30 Cb -0.03 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2hfn h SER 30 CO -0.05 0.56 -0.11 0.77 -1.14 0.00 0.00 176.83 176.87 2hfn h SER 31 N 0.14 0.64 0.82 3.07 4.64 -1.31 0.13 113.55 121.68 2hfn h SER 31 Ca 0.06 -0.18 -0.04 0.00 -0.47 0.00 0.00 61.79 61.17 2hfn h SER 31 Cb 0.38 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2hfn h SER 31 CO 0.01 0.78 -0.17 1.56 -0.87 0.00 0.00 176.83 178.14 2hfn h GLN 32 N 0.60 0.00 0.14 4.77 4.20 -1.13 -0.62 115.11 123.07 2hfn h GLN 32 Ca 0.11 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.52 2hfn h GLN 32 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 2hfn h GLN 32 CO 0.03 0.17 -1.48 -0.09 -0.67 0.00 0.00 178.83 176.79 2hfn h ARG 33 N 0.00 0.29 0.16 1.46 2.43 -0.88 -3.42 114.38 114.42 2hfn h ARG 33 Ca -0.00 -0.50 -0.30 0.00 -0.81 0.00 0.00 59.98 58.37 2hfn h ARG 33 Cb 0.63 0.18 0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2hfn h ARG 33 CO 0.02 1.24 -1.48 -0.91 -1.51 0.00 0.00 179.97 177.33 2hfn h ASN 34 N -0.19 0.53 -0.92 -3.80 2.35 -0.72 -3.41 115.58 109.42 2hfn h ASN 34 Ca -0.31 -0.90 0.02 0.00 -0.55 0.00 0.00 56.30 54.56 2hfn h ASN 34 Cb 1.85 -0.17 -0.05 0.00 0.05 0.00 0.00 38.32 40.00 2hfn h ASN 34 CO 0.10 1.67 0.60 0.78 -1.65 0.00 0.00 177.43 178.93 2hfn h ASN 35 N -0.11 1.01 -0.18 5.81 4.21 -1.33 -3.22 115.58 121.77 2hfn h ASN 35 Ca -0.30 -0.02 0.03 0.00 1.21 0.00 0.00 56.30 57.23 2hfn h ASN 35 Cb 1.92 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 38.85 2hfn h ASN 35 CO 0.14 0.71 -0.01 -0.65 -1.29 0.00 0.00 177.43 176.33 2hfn h PRO 36 N 1.19 0.05 -0.18 0.81 0.11 -1.79 0.13 132.00 132.31 2hfn h PRO 36 Ca 0.35 -0.00 0.04 0.00 0.11 0.00 0.00 66.00 66.50 2hfn h PRO 36 Cb -0.06 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.03 2hfn h PRO 36 CO -0.10 0.03 0.13 0.00 -0.21 0.00 0.00 178.00 177.85 2hfn h ALA 37 N 1.16 2.12 -0.53 -0.75 0.00 -1.83 -0.52 119.26 118.93 2hfn h ALA 37 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2hfn h ALA 37 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2hfn h ALA 37 CO -0.15 -0.17 0.00 0.09 0.00 0.00 0.00 179.25 179.02 2hfn n ASN 38 N -4.49 3.02 -2.81 0.00 3.02 -0.92 -4.94 115.26 108.14 2hfn n ASN 38 Ca 0.01 -1.98 -0.21 0.00 -0.03 0.00 0.00 54.58 52.37 2hfn n ASN 38 Cb 0.24 -0.35 0.02 0.00 -0.61 0.00 0.00 39.78 39.07 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 1.41 -0.51 3.74 7.41 0.00 -0.20 -4.77 105.19 112.26 2hfn n GLY 39 Ca 0.19 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.09 5.26 0.29 -0.61 -1.09 0.31 -4.38 121.20 117.88 2hfn s ILE 40 Ca 0.19 0.67 0.06 0.00 -2.23 0.00 0.00 60.65 59.35 2hfn s ILE 40 Cb -0.09 -3.68 -0.06 0.00 -1.58 0.00 0.00 42.46 37.05 2hfn s ILE 40 CO 0.24 0.39 -0.05 0.42 -1.23 0.00 0.00 174.94 174.71 2hfn s THR 41 N 0.36 1.62 -5.00 2.92 -4.23 -0.64 -4.39 115.64 106.28 2hfn s THR 41 Ca 0.20 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 2hfn s THR 41 Cb -0.14 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2hfn s THR 41 CO 0.06 -0.27 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 2hfn n GLY 42 N -0.60 -0.24 3.37 3.99 0.00 -0.98 -0.42 105.19 110.31 2hfn n GLY 42 Ca -0.05 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 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 0.18 -0.07 0.99 2.96 -1.05 -3.52 118.68 118.16 2hfn s LEU 43 Ca 0.00 0.95 0.05 0.00 -0.22 0.00 0.00 54.13 54.91 2hfn s LEU 43 Cb 0.00 1.61 -0.01 0.00 0.50 0.00 0.00 46.19 48.29 2hfn s LEU 43 CO 0.00 -0.17 -0.24 -0.22 -1.32 0.00 0.00 176.35 174.40 2hfn s LEU 44 N 0.30 2.07 -0.04 -0.68 2.96 0.43 -1.25 118.68 122.48 2hfn s LEU 44 Ca -0.00 -0.52 0.06 0.00 -0.22 0.00 0.00 54.13 53.45 2hfn s LEU 44 Cb -0.03 -1.37 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 2hfn s LEU 44 CO -0.00 0.21 -0.22 0.00 -1.32 0.00 0.00 176.35 175.01 2hfn s TYR 46 N -0.56 3.23 -0.37 0.00 5.04 -0.27 -0.79 117.35 123.63 2hfn s TYR 46 Ca 0.08 -2.18 -0.01 0.00 -2.44 0.00 0.00 57.07 52.53 2hfn s TYR 46 Cb -0.11 -1.97 0.10 0.00 0.35 0.00 0.00 41.96 40.33 2hfn s TYR 46 CO 0.00 -0.86 0.12 0.45 -1.34 0.00 0.00 175.55 173.93 2hfn s SER 47 N 1.15 5.04 -0.32 4.32 0.15 0.27 -1.30 113.70 123.01 2hfn s SER 47 Ca -0.07 -1.94 -0.44 0.00 0.70 0.00 0.00 55.95 54.20 2hfn s SER 47 Cb -0.19 -1.75 -0.19 0.00 -1.71 0.00 0.00 66.02 62.18 2hfn s SER 47 CO -0.05 -0.45 1.50 0.29 1.20 0.00 0.00 173.24 175.73 2hfn n LYS 48 N 4.50 0.26 -0.29 5.44 4.01 -1.26 0.52 118.16 131.34 2hfn n LYS 48 Ca -0.02 0.09 0.11 0.00 -0.51 0.00 0.00 58.31 57.98 2hfn n LYS 48 Cb 0.42 -1.63 0.28 0.00 -0.51 0.00 0.00 35.03 33.58 2hfn n LYS 48 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 2hfn n PRO 49 N 3.61 2.50 -3.73 1.97 -0.04 -1.26 -5.06 135.00 132.99 2hfn n PRO 49 Ca 0.27 -2.31 -0.31 0.00 -0.04 0.00 0.00 63.50 61.11 2hfn n PRO 49 Cb 0.02 -1.51 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 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 -1.25 3.84 0.06 0.55 0.00 0.18 -0.50 121.76 124.65 2hfn s ALA 50 Ca 0.43 -0.66 0.02 0.00 0.00 0.00 0.00 51.96 51.74 2hfn s ALA 50 Cb 0.23 -2.04 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 2hfn s ALA 50 CO 0.31 0.67 0.10 -0.06 0.00 0.00 0.00 175.76 176.77 2hfn s PHE 51 N -1.66 3.26 -0.04 0.00 0.40 -0.18 -0.57 117.98 119.19 2hfn s PHE 51 Ca 0.39 0.13 -0.01 0.00 -0.60 0.00 0.00 56.93 56.85 2hfn s PHE 51 Cb -0.12 -1.67 0.03 0.00 0.51 0.00 0.00 43.02 41.77 2hfn s PHE 51 CO 0.26 0.54 0.01 -1.17 0.70 0.00 0.00 175.22 175.56 2hfn s LEU 52 N -2.26 0.81 0.01 -0.37 2.96 0.03 -2.01 118.68 117.86 2hfn s LEU 52 Ca 0.29 -0.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.19 2hfn s LEU 52 Cb -0.12 -0.26 -0.01 0.00 0.50 0.00 0.00 46.19 46.29 2hfn s LEU 52 CO 0.21 -0.15 -0.05 -1.58 -1.32 0.00 0.00 176.35 173.46 2hfn s GLN 53 N 1.49 0.35 -0.06 1.98 0.74 -0.70 0.05 119.66 123.51 2hfn s GLN 53 Ca -0.03 -0.33 0.04 0.00 0.05 0.00 0.00 55.36 55.09 2hfn s GLN 53 Cb -0.13 -0.25 -0.02 0.00 1.10 0.00 0.00 33.01 33.71 2hfn s GLN 53 CO -0.03 0.06 -0.17 0.54 -0.55 0.00 0.00 175.29 175.14 2hfn s VAL 54 N -0.54 2.81 -0.04 1.34 0.11 -0.38 -1.81 120.40 121.89 2hfn s VAL 54 Ca -0.03 -0.80 0.04 0.00 -2.93 0.00 0.00 61.98 58.25 2hfn s VAL 54 Cb -0.04 -2.09 -0.00 0.00 -1.53 0.00 0.00 36.38 32.71 2hfn s VAL 54 CO -0.00 0.58 -0.15 -0.76 -3.33 0.00 0.00 175.10 171.44 2hfn s LEU 55 N -0.49 1.86 0.05 2.54 1.43 -0.12 -2.53 118.68 121.42 2hfn s LEU 55 Ca 0.06 -0.31 0.07 0.00 -1.03 0.00 0.00 54.13 52.92 2hfn s LEU 55 Cb -0.12 -0.87 -0.03 0.00 0.03 0.00 0.00 46.19 45.21 2hfn s LEU 55 CO 0.01 0.12 -0.19 -1.61 0.23 0.00 0.00 176.35 174.91 2hfn s GLU 56 N 0.14 1.24 0.00 1.70 2.02 0.44 -1.05 118.70 123.19 2hfn s GLU 56 Ca -0.05 -0.93 0.00 0.00 0.02 0.00 0.00 54.97 54.01 2hfn s GLU 56 Cb -0.11 -1.36 0.00 0.00 0.10 0.00 0.00 34.13 32.76 2hfn s GLU 56 CO 0.02 0.34 0.00 0.41 0.02 0.00 0.00 175.26 176.05 2hfn n GLY 57 N 1.74 -1.90 3.77 -1.39 0.00 -0.89 -1.63 105.19 104.88 2hfn n GLY 57 Ca -0.18 -1.34 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 2hfn n GLY 57 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2hfn s GLU 58 N -1.96 3.49 0.22 1.61 -1.05 -1.26 -0.12 118.70 119.64 2hfn s GLU 58 Ca 0.00 1.74 -0.09 0.00 -0.15 0.00 0.00 54.97 56.47 2hfn s GLU 58 Cb 0.00 -2.19 0.34 0.00 -0.44 0.00 0.00 34.13 31.84 2hfn s GLU 58 CO 0.00 -0.76 1.67 0.00 0.95 0.00 0.00 175.26 177.12 2hfn h GLU 60 N 0.18 1.15 -0.03 0.00 4.81 -1.92 -1.36 114.58 117.41 2hfn h GLU 60 Ca 0.35 -0.10 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 2hfn h GLU 60 Cb 0.57 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2hfn h GLU 60 CO -0.51 0.80 -0.06 1.96 -0.73 0.00 0.00 179.01 180.47 2hfn h GLN 61 N 1.17 0.09 -0.68 1.92 7.50 -1.38 -1.52 115.11 122.20 2hfn h GLN 61 Ca 0.30 -0.06 0.09 0.00 0.50 0.00 0.00 58.65 59.48 2hfn h GLN 61 Cb -0.05 0.01 -0.07 0.00 0.05 0.00 0.00 27.48 27.42 2hfn h GLN 61 CO -0.06 0.66 0.33 0.28 -1.50 0.00 0.00 178.83 178.54 2hfn h VAL 62 N -0.46 0.86 -0.51 -0.54 2.07 -0.90 -0.33 116.25 116.43 2hfn h VAL 62 Ca -0.00 -0.20 -0.10 0.00 0.82 0.00 0.00 66.70 67.23 2hfn h VAL 62 Cb 0.66 0.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 2hfn h VAL 62 CO 0.01 0.10 -0.06 0.78 0.02 0.00 0.00 177.57 178.43 2hfn h ASN 63 N 0.57 0.94 -0.09 0.57 4.21 -1.25 -0.37 115.58 120.16 2hfn h ASN 63 Ca 0.33 -0.33 -0.00 0.00 1.21 0.00 0.00 56.30 57.50 2hfn h ASN 63 Cb 0.33 -0.25 -0.00 0.00 -1.12 0.00 0.00 38.32 37.28 2hfn h ASN 63 CO -0.26 1.05 0.05 -0.08 -1.29 0.00 0.00 177.43 176.90 2hfn h GLU 64 N 0.81 0.13 -0.09 0.81 4.22 -0.89 -1.92 114.58 117.64 2hfn h GLU 64 Ca 0.14 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.56 2hfn h GLU 64 Cb 0.61 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 2hfn h GLU 64 CO 0.04 0.17 0.03 1.15 -2.18 0.00 0.00 179.01 178.21 2hfn h THR 65 N 0.06 1.18 -0.12 0.32 2.02 -0.97 -2.14 112.91 113.25 2hfn h THR 65 Ca 0.03 -0.54 0.01 0.00 0.77 0.00 0.00 66.41 66.68 2hfn h THR 65 Cb 0.08 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 2hfn h THR 65 CO -0.01 0.15 0.05 0.22 0.37 0.00 0.00 175.52 176.31 2hfn h TYR 66 N -0.06 0.08 0.00 3.16 5.03 -1.07 -1.22 116.97 122.90 2hfn h TYR 66 Ca 0.03 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.30 2hfn h TYR 66 Cb 0.22 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.47 2hfn h TYR 66 CO -0.00 0.05 -0.23 0.45 -1.32 0.00 0.00 178.16 177.11 2hfn h HIS 67 N 0.11 0.00 -0.20 -3.82 3.86 -1.32 -0.68 115.15 113.10 2hfn h HIS 67 Ca 0.05 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.17 2hfn h HIS 67 Cb 0.02 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.49 2hfn h HIS 67 CO -0.10 0.23 -0.21 -0.09 0.86 0.00 0.00 177.93 178.62 2hfn h ARG 68 N 0.00 0.49 -0.72 2.45 2.43 -1.20 -3.20 114.38 114.63 2hfn h ARG 68 Ca -0.00 -0.26 0.04 0.00 -0.81 0.00 0.00 59.98 58.95 2hfn h ARG 68 Cb 0.64 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.15 2hfn h ARG 68 CO 0.03 0.84 0.44 0.82 -1.51 0.00 0.00 179.97 180.59 2hfn h ILE 69 N 0.16 1.05 -0.43 1.20 2.04 -0.23 -2.53 117.51 118.77 2hfn h ILE 69 Ca 0.03 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 2hfn h ILE 69 Cb 0.76 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 2hfn h ILE 69 CO 0.05 0.15 0.14 -0.37 0.00 0.00 0.00 178.15 178.12 2hfn h VAL 70 N 0.84 1.18 -0.70 1.67 -1.51 -1.24 -1.54 116.25 114.94 2hfn h VAL 70 Ca 0.30 -0.60 -0.65 0.00 -1.23 0.00 0.00 66.70 64.53 2hfn h VAL 70 Cb 0.09 0.71 -0.08 0.00 -2.13 0.00 0.00 31.29 29.88 2hfn h VAL 70 CO -0.14 0.22 2.38 0.00 -1.23 0.00 0.00 177.57 178.81 2hfn n GLN 71 N -4.34 3.86 -5.11 5.19 10.64 -0.95 -4.82 117.38 121.85 2hfn n GLN 71 Ca 0.03 -2.75 -0.29 0.00 -1.83 0.00 0.00 57.00 52.16 2hfn n GLN 71 Cb 0.17 -2.57 -0.16 0.00 -0.86 0.00 0.00 30.24 26.82 2hfn n GLN 71 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 2hfn s ASP 72 N 1.04 2.70 0.00 2.61 2.15 -0.58 -4.96 116.67 119.63 2hfn s ASP 72 Ca 0.61 -0.44 0.30 0.00 0.43 0.00 0.00 52.55 53.44 2hfn s ASP 72 Cb 0.22 -0.65 1.40 0.00 -0.30 0.00 0.00 42.92 43.60 2hfn s ASP 72 CO -0.09 0.22 2.00 -0.62 -0.17 0.00 0.00 175.17 176.51 2hfn n GLU 73 N 2.91 0.30 -0.01 4.34 1.02 -1.26 -3.55 120.64 124.39 2hfn n GLU 73 Ca -0.17 -0.01 0.14 0.00 -0.02 0.00 0.00 57.16 57.10 2hfn n GLU 73 Cb 0.52 -1.50 0.65 0.00 -0.02 0.00 0.00 31.44 31.10 2hfn n GLU 73 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2hfn n ARG 74 N -1.34 1.40 -3.66 3.49 1.74 -1.26 -4.86 116.66 112.18 2hfn n ARG 74 Ca 0.12 -0.59 -0.10 0.00 -0.77 0.00 0.00 57.85 56.51 2hfn n ARG 74 Cb 0.28 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 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 -1.98 -0.23 0.35 -1.55 -3.43 -1.23 -2.02 115.29 105.20 2hfn s HIS 75 Ca 0.40 -0.09 -0.00 0.00 -0.80 0.00 0.00 55.06 54.57 2hfn s HIS 75 Cb 0.20 0.43 0.00 0.00 -1.43 0.00 0.00 32.58 31.78 2hfn s HIS 75 CO 0.33 -0.89 0.46 -3.38 -2.00 0.00 0.00 174.74 169.27 2hfn s HIS 76 N -3.84 1.21 -1.21 0.38 -3.43 0.67 -4.78 115.29 104.29 2hfn s HIS 76 Ca 0.06 -1.38 -0.18 0.00 -0.80 0.00 0.00 55.06 52.76 2hfn s HIS 76 Cb -0.01 -0.17 0.00 0.00 -1.43 0.00 0.00 32.58 30.97 2hfn s HIS 76 CO -0.06 -1.13 0.69 0.43 -2.00 0.00 0.00 174.74 172.68 2hfn n SER 77 N -1.55 -4.02 -4.75 7.38 7.64 -1.26 -1.16 113.62 115.90 2hfn n SER 77 Ca 0.02 -1.05 -0.41 0.00 1.01 0.00 0.00 58.87 58.44 2hfn n SER 77 Cb 0.61 -3.08 -0.02 0.00 -1.01 0.00 0.00 64.21 60.71 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 -6.30 4.35 -0.27 1.43 0.04 -1.26 -4.41 135.00 128.58 2hfn s PRO 78 Ca 0.37 2.18 0.01 0.00 0.04 0.00 0.00 61.00 63.60 2hfn s PRO 78 Cb -0.14 -3.12 0.07 0.00 0.04 0.00 0.00 34.50 31.35 2hfn s PRO 78 CO 0.88 -0.25 -0.01 -0.65 0.04 0.00 0.00 177.00 177.01 2hfn s GLN 79 N -0.94 1.43 0.02 4.56 -1.52 0.72 -4.99 119.66 118.94 2hfn s GLN 79 Ca 0.54 -1.17 -0.30 0.00 -1.95 0.00 0.00 55.36 52.47 2hfn s GLN 79 Cb -0.39 -2.60 -0.04 0.00 -0.22 0.00 0.00 33.01 29.76 2hfn s GLN 79 CO 0.46 -0.73 1.13 -1.50 -0.25 0.00 0.00 175.29 174.39 2hfn s ILE 80 N 1.34 4.35 -0.19 1.08 2.07 -1.26 -0.97 121.20 127.62 2hfn s ILE 80 Ca 0.00 1.68 0.02 0.00 -1.41 0.00 0.00 60.65 60.94 2hfn s ILE 80 Cb -0.19 -4.08 -0.22 0.00 0.13 0.00 0.00 42.46 38.11 2hfn s ILE 80 CO -0.10 0.10 0.09 -0.38 -1.91 0.00 0.00 174.94 172.74 2hfn n ILE 81 N 4.05 1.59 -3.64 2.00 5.41 0.18 -4.96 119.36 123.99 2hfn n ILE 81 Ca 0.08 -0.65 -0.13 0.00 1.00 0.00 0.00 62.75 63.05 2hfn n ILE 81 Cb 0.48 -1.38 -0.07 0.00 -0.71 0.00 0.00 39.64 37.96 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 -2.54 0.81 -0.08 0.38 2.12 -0.98 -4.70 118.70 113.72 2hfn s GLU 82 Ca -0.25 1.00 -0.03 0.00 0.36 0.00 0.00 54.97 56.05 2hfn s GLU 82 Cb 0.08 0.38 0.04 0.00 0.26 0.00 0.00 34.13 34.89 2hfn s GLU 82 CO 0.71 -0.10 0.13 0.00 -0.54 0.00 0.00 175.26 175.45 2hfn s MET 84 N 2.25 1.12 0.64 0.00 0.23 -0.84 -5.02 119.30 117.68 2hfn s MET 84 Ca 0.04 -0.29 -0.18 0.00 -1.03 0.00 0.00 55.69 54.23 2hfn s MET 84 Cb -0.12 0.51 -0.01 0.00 -1.53 0.00 0.00 34.83 33.68 2hfn s MET 84 CO -0.05 -0.43 1.22 -2.14 -2.03 0.00 0.00 175.02 171.59 2hfn s PRO 85 N -2.83 2.69 0.11 3.16 0.02 -1.26 -1.54 135.00 135.34 2hfn s PRO 85 Ca -0.03 1.83 0.05 0.00 0.02 0.00 0.00 61.00 62.87 2hfn s PRO 85 Cb -0.00 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.59 2hfn s PRO 85 CO -0.05 -1.43 -0.12 0.96 -0.33 0.00 0.00 177.00 176.03 2hfn s ILE 86 N -1.69 1.16 0.13 2.83 -4.36 -0.37 -4.84 121.20 114.06 2hfn s ILE 86 Ca 0.77 -1.67 -0.06 0.00 -0.26 0.00 0.00 60.65 59.44 2hfn s ILE 86 Cb -0.31 -1.44 -0.18 0.00 1.25 0.00 0.00 42.46 41.78 2hfn s ILE 86 CO 0.37 -0.47 1.30 0.03 0.24 0.00 0.00 174.94 176.42 2hfn h ARG 87 N 3.57 0.47 -2.82 0.37 2.47 -1.97 -3.44 114.38 113.03 2hfn h ARG 87 Ca -0.39 -0.48 0.03 0.00 -1.26 0.00 0.00 59.98 57.88 2hfn h ARG 87 Cb 1.19 0.13 -0.11 0.00 -1.65 0.00 0.00 29.97 29.53 2hfn h ARG 87 CO 0.51 1.13 0.28 -0.98 0.56 0.00 0.00 179.97 181.47 2hfn s ARG 88 N -3.33 1.26 0.64 0.04 1.70 -1.26 -5.10 118.95 112.89 2hfn s ARG 88 Ca -0.06 -0.52 -0.13 0.00 -0.47 0.00 0.00 55.73 54.54 2hfn s ARG 88 Cb 0.09 0.54 -0.02 0.00 -0.57 0.00 0.00 34.95 34.99 2hfn s ARG 88 CO 0.87 -0.56 1.05 1.03 -1.08 0.00 0.00 175.30 176.62 2hfn s ARG 89 N -3.62 3.17 0.00 3.89 0.52 -1.26 -5.00 118.95 116.65 2hfn s ARG 89 Ca 0.04 1.05 0.00 0.00 -0.52 0.00 0.00 55.73 56.30 2hfn s ARG 89 Cb -0.02 -2.02 0.00 0.00 0.52 0.00 0.00 34.95 33.43 2hfn s ARG 89 CO -0.08 -0.92 0.00 0.09 0.02 0.00 0.00 175.30 174.41 2hfn n ASN 90 N -2.58 3.72 -0.57 0.23 4.13 -1.26 -4.76 115.26 114.17 2hfn n ASN 90 Ca 0.08 -0.11 0.06 0.00 1.68 0.00 0.00 54.58 56.29 2hfn n ASN 90 Cb 0.53 0.96 0.20 0.00 -1.54 0.00 0.00 39.78 39.93 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 -1.33 0.13 0.33 3.10 3.01 -1.26 -4.83 117.46 116.61 2hfn n PHE 91 Ca 0.00 -1.41 0.22 0.00 1.01 0.00 0.00 57.45 57.27 2hfn n PHE 91 Cb 0.00 -0.26 1.18 0.00 -0.01 0.00 0.00 39.48 40.39 2hfn n PHE 91 CO 0.00 0.00 0.00 1.05 1.01 0.00 0.00 176.76 178.82 2hfn h GLU 92 N 0.84 0.00 0.00 -1.08 9.09 -1.95 -2.63 114.58 118.85 2hfn h GLU 92 Ca 0.02 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.43 2hfn h GLU 92 Cb 1.08 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.18 2hfn h GLU 92 CO 0.04 0.00 0.00 -0.39 0.05 0.00 0.00 179.01 178.72 2hfn h VAL 93 N 0.00 0.00 -3.18 -1.06 -1.51 -1.97 -3.43 116.25 105.10 2hfn h VAL 93 Ca -0.00 -0.78 -0.64 0.00 -1.23 0.00 0.00 66.70 64.05 2hfn h VAL 93 Cb 0.02 1.77 -0.35 0.00 -2.13 0.00 0.00 31.29 30.60 2hfn h VAL 93 CO 0.00 0.00 -0.85 0.26 -1.23 0.00 0.00 177.57 175.75 2hfn s TRP 94 N -3.33 2.40 0.20 5.19 0.51 -0.99 -4.99 118.94 117.94 2hfn s TRP 94 Ca 0.06 -1.26 -0.10 0.00 -2.12 0.00 0.00 56.10 52.67 2hfn s TRP 94 Cb 0.07 -1.68 0.23 0.00 -0.81 0.00 0.00 33.47 31.28 2hfn s TRP 94 CO 0.62 -0.62 1.77 0.66 -0.51 0.00 0.00 176.95 178.87 2hfn h SER 95 N 7.59 0.36 -4.46 2.95 4.64 -1.84 -2.59 113.55 120.19 2hfn h SER 95 Ca -0.35 0.05 -0.03 0.00 -0.47 0.00 0.00 61.79 60.99 2hfn h SER 95 Cb 1.17 -0.01 -0.21 0.00 -0.31 0.00 0.00 62.40 63.04 2hfn h SER 95 CO 0.55 0.23 0.24 -0.32 -0.87 0.00 0.00 176.83 176.66 2hfn s MET 96 N -6.10 0.89 0.04 4.77 -2.45 -1.26 -3.47 119.30 111.72 2hfn s MET 96 Ca -0.13 0.48 0.04 0.00 -1.25 0.00 0.00 55.69 54.83 2hfn s MET 96 Cb 0.16 0.43 -0.02 0.00 1.25 0.00 0.00 34.83 36.64 2hfn s MET 96 CO 0.75 -0.23 -0.11 1.14 1.05 0.00 0.00 175.02 177.62 2hfn s GLN 97 N -0.63 0.73 -0.14 4.11 0.00 -1.23 -4.87 119.66 117.63 2hfn s GLN 97 Ca -0.06 -0.74 0.01 0.00 -0.00 0.00 0.00 55.36 54.57 2hfn s GLN 97 Cb -0.02 -0.67 0.02 0.00 0.00 0.00 0.00 33.01 32.34 2hfn s GLN 97 CO 0.05 0.16 -0.15 0.00 0.00 0.00 0.00 175.29 175.35 2hfn s ALA 98 N -1.02 1.85 -0.08 2.60 0.00 -1.26 -0.43 121.76 123.43 2hfn s ALA 98 Ca -0.03 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.09 2hfn s ALA 98 Cb -0.08 -1.01 -0.00 0.00 0.00 0.00 0.00 23.12 22.02 2hfn s ALA 98 CO 0.01 -0.31 -0.21 0.42 0.00 0.00 0.00 175.76 175.67 2hfn s ILE 99 N 1.37 1.80 -0.20 0.00 -1.09 -0.39 -5.02 121.20 117.67 2hfn s ILE 99 Ca 0.02 -0.89 -0.14 0.00 -2.23 0.00 0.00 60.65 57.42 2hfn s ILE 99 Cb -0.13 -1.55 -0.04 0.00 -1.58 0.00 0.00 42.46 39.15 2hfn s ILE 99 CO -0.09 0.50 0.30 0.42 -1.23 0.00 0.00 174.94 174.84 2hfn s THR 100 N 0.24 5.28 -0.24 2.92 -4.23 -1.26 -1.12 115.64 117.22 2hfn s THR 100 Ca -0.12 0.51 0.02 0.00 -1.18 0.00 0.00 61.69 60.92 2hfn s THR 100 Cb -0.16 -3.63 0.05 0.00 1.34 0.00 0.00 72.50 70.10 2hfn s THR 100 CO 0.06 0.32 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.66 2hfn s VAL 101 N 0.97 1.98 0.00 2.29 1.01 -0.42 -4.94 120.40 121.29 2hfn s VAL 101 Ca 0.15 -1.43 0.00 0.00 0.00 0.00 0.00 61.98 60.70 2hfn s VAL 101 Cb -0.14 -2.09 0.00 0.00 0.00 0.00 0.00 36.38 34.16 2hfn s VAL 101 CO 0.05 0.03 0.00 -0.46 0.00 0.00 0.00 175.10 174.72 2hfn n ASN 102 N 4.52 0.00 0.04 3.32 2.04 -1.26 -3.98 115.26 119.94 2hfn n ASN 102 Ca -0.14 -0.35 0.09 0.00 -0.44 0.00 0.00 54.58 53.74 2hfn n ASN 102 Cb 0.44 0.00 0.40 0.00 -2.53 0.00 0.00 39.78 38.08 2hfn n ASN 102 CO 0.00 0.00 0.00 -0.67 -0.44 0.00 0.00 177.26 176.15 2hfn n ASP 103 N -0.82 0.22 -0.38 0.53 4.64 -1.26 -2.26 116.55 117.22 2hfn n ASP 103 Ca 0.00 0.55 0.12 0.00 -1.38 0.00 0.00 54.79 54.08 2hfn n ASP 103 Cb 0.00 -0.60 0.16 0.00 -1.04 0.00 0.00 41.12 39.64 2hfn n ASP 103 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 2hfn n LEU 104 N -1.74 1.57 -4.58 -2.67 4.77 -1.26 -4.99 117.00 108.11 2hfn n LEU 104 Ca 0.04 -0.54 -0.29 0.00 -0.03 0.00 0.00 56.01 55.19 2hfn n LEU 104 Cb 0.22 -0.05 0.21 0.00 -2.33 0.00 0.00 43.42 41.47 2hfn n LEU 104 CO 0.18 0.30 0.58 -0.44 -1.33 0.00 0.00 177.39 176.67 2hfn s SER 105 N -2.51 1.78 0.65 -1.43 0.01 -0.96 -4.99 113.70 106.26 2hfn s SER 105 Ca 0.21 1.43 -0.18 0.00 1.31 0.00 0.00 55.95 58.73 2hfn s SER 105 Cb 0.19 -2.15 -0.01 0.00 0.21 0.00 0.00 66.02 64.25 2hfn s SER 105 CO 0.56 -3.69 1.26 -0.89 0.41 0.00 0.00 173.24 170.88 2hfn s THR 106 N -2.67 2.21 0.31 1.44 2.01 -1.26 -4.82 115.64 112.86 2hfn s THR 106 Ca 0.67 0.13 0.01 0.00 0.31 0.00 0.00 61.69 62.81 2hfn s THR 106 Cb -0.22 -2.98 0.28 0.00 0.01 0.00 0.00 72.50 69.58 2hfn s THR 106 CO 0.61 -0.03 1.93 -0.08 -0.69 0.00 0.00 174.62 176.36 2hfn h GLU 107 N 0.46 0.97 -0.17 4.92 4.57 -1.98 0.05 114.58 123.40 2hfn h GLU 107 Ca -0.50 -0.06 0.05 0.00 -1.18 0.00 0.00 59.36 57.67 2hfn h GLU 107 Cb 1.32 -0.22 -0.05 0.00 -0.16 0.00 0.00 28.75 29.64 2hfn h GLU 107 CO 0.53 0.64 -0.17 0.37 -1.18 0.00 0.00 179.01 179.20 2hfn h GLN 108 N 1.00 -0.19 -0.44 1.92 4.15 -1.99 0.56 115.11 120.12 2hfn h GLN 108 Ca 0.36 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.76 2hfn h GLN 108 Cb 0.13 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.84 2hfn h GLN 108 CO -0.12 -0.13 0.18 0.28 -1.93 0.00 0.00 178.83 177.11 2hfn h VAL 109 N -0.20 1.20 -0.51 2.39 2.07 -1.75 -1.89 116.25 117.56 2hfn h VAL 109 Ca 0.11 -0.62 0.05 0.00 0.82 0.00 0.00 66.70 67.05 2hfn h VAL 109 Cb 0.36 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 30.87 2hfn h VAL 109 CO -0.28 0.23 0.24 0.11 0.02 0.00 0.00 177.57 177.89 2hfn h LYS 110 N 0.58 0.46 -0.33 1.57 1.57 -0.76 -0.64 116.57 119.01 2hfn h LYS 110 Ca 0.15 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2hfn h LYS 110 Cb 0.19 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2hfn h LYS 110 CO -0.01 0.30 0.17 1.15 -0.57 0.00 0.00 179.45 180.49 2hfn h THR 111 N 0.47 1.11 -0.10 -0.16 2.02 -0.74 -1.63 112.91 113.89 2hfn h THR 111 Ca 0.23 -0.31 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 2hfn h THR 111 Cb 0.16 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2hfn h THR 111 CO -0.17 0.13 -0.03 0.25 0.37 0.00 0.00 175.52 176.06 2hfn h LEU 112 N 0.46 0.20 -0.69 2.58 6.46 -0.45 -0.48 115.31 123.40 2hfn h LEU 112 Ca 0.12 -0.39 0.08 0.00 -0.12 0.00 0.00 57.88 57.57 2hfn h LEU 112 Cb 0.04 -0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 39.85 2hfn h LEU 112 CO -0.02 0.54 0.37 0.58 -0.62 0.00 0.00 178.44 179.29 2hfn h VAL 113 N -0.14 0.91 -0.00 1.05 2.07 -0.91 -1.84 116.25 117.39 2hfn h VAL 113 Ca 0.02 -0.22 -0.08 0.00 0.82 0.00 0.00 66.70 67.24 2hfn h VAL 113 Cb 0.46 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 2hfn h VAL 113 CO 0.01 0.12 -0.40 0.25 0.02 0.00 0.00 177.57 177.57 2hfn h LEU 114 N 0.65 0.00 -1.91 2.57 5.85 -1.15 -2.26 115.31 119.07 2hfn h LEU 114 Ca 0.32 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.04 2hfn h LEU 114 Cb 0.27 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 2hfn h LEU 114 CO -0.22 0.40 0.00 0.50 -0.34 0.00 0.00 178.44 178.78 2hfn h LYS 115 N 0.00 0.06 -0.08 1.25 3.64 -0.20 -3.06 116.57 118.17 2hfn h LYS 115 Ca -0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2hfn h LYS 115 Cb 0.70 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2hfn h LYS 115 CO 0.05 0.06 0.00 0.66 -2.27 0.00 0.00 179.45 177.95 2hfn n TYR 116 N -4.50 0.10 -3.90 1.91 4.02 -1.01 -5.06 117.16 108.73 2hfn n TYR 116 Ca -0.02 -0.14 -0.11 0.00 -0.01 0.00 0.00 57.90 57.61 2hfn n TYR 116 Cb 0.11 -0.01 -0.00 0.00 -0.02 0.00 0.00 39.34 39.42 2hfn n TYR 116 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2hfn n SER 117 N 0.44 -1.77 0.16 7.72 3.41 -0.88 -4.90 113.62 117.80 2hfn n SER 117 Ca 0.06 -2.68 0.13 0.00 -0.26 0.00 0.00 58.87 56.13 2hfn n SER 117 Cb 0.27 3.08 0.38 0.00 -0.26 0.00 0.00 64.21 67.67 2hfn n SER 117 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2hfn h GLY 118 N 1.90 0.00 -2.56 5.00 0.00 -1.85 -3.43 103.07 102.13 2hfn h GLY 118 Ca -0.29 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.87 2hfn h GLY 118 CO 0.38 0.00 -0.45 -1.36 0.00 0.00 0.00 176.54 175.12 2hfn s PHE 119 N -3.24 0.79 -0.11 5.60 0.08 -1.26 -5.04 117.98 114.81 2hfn s PHE 119 Ca 0.07 -1.09 0.30 0.00 0.12 0.00 0.00 56.93 56.33 2hfn s PHE 119 Cb 0.09 -0.28 1.01 0.00 -0.57 0.00 0.00 43.02 43.28 2hfn s PHE 119 CO 0.58 -0.73 1.85 1.15 -0.10 0.00 0.00 175.22 177.97 2hfn h THR 120 N 2.55 0.00 -3.27 0.64 2.02 -1.89 -3.25 112.91 109.71 2hfn h THR 120 Ca -0.33 -0.67 -0.58 0.00 0.77 0.00 0.00 66.41 65.60 2hfn h THR 120 Cb 1.24 1.66 -0.08 0.00 -1.74 0.00 0.00 68.15 69.23 2hfn h THR 120 CO 0.48 0.00 -0.19 0.42 0.37 0.00 0.00 175.52 176.60 2hfn s THR 121 N -3.50 5.19 -0.12 3.16 -4.23 -1.26 -4.72 115.64 110.17 2hfn s THR 121 Ca 0.03 0.84 -0.29 0.00 -1.18 0.00 0.00 61.69 61.09 2hfn s THR 121 Cb 0.08 -3.76 -0.04 0.00 1.34 0.00 0.00 72.50 70.12 2hfn s THR 121 CO 0.58 0.38 1.55 -0.22 -0.54 0.00 0.00 174.62 176.38 2hfn s LEU 122 N 0.33 4.20 -0.33 4.79 2.96 -1.26 -4.95 118.68 124.41 2hfn s LEU 122 Ca 0.23 1.98 -0.00 0.00 -0.22 0.00 0.00 54.13 56.12 2hfn s LEU 122 Cb -0.15 -3.53 0.11 0.00 0.50 0.00 0.00 46.19 43.12 2hfn s LEU 122 CO 0.09 -0.96 0.13 -0.13 -1.32 0.00 0.00 176.35 174.16 2hfn s ARG 123 N 4.05 0.81 0.39 1.98 0.52 -1.26 -4.81 118.95 120.63 2hfn s ARG 123 Ca 0.69 -1.26 0.06 0.00 -0.52 0.00 0.00 55.73 54.70 2hfn s ARG 123 Cb -0.29 -2.03 0.79 0.00 0.52 0.00 0.00 34.95 33.94 2hfn s ARG 123 CO 0.26 -1.03 2.02 -1.35 0.02 0.00 0.00 175.30 175.22 2hfn h PRO 124 N 7.80 0.55 -0.01 3.54 0.11 -1.93 -1.96 132.00 140.10 2hfn h PRO 124 Ca -0.10 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.96 2hfn h PRO 124 Cb 1.00 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 2hfn h PRO 124 CO 0.47 0.41 0.18 0.77 -0.21 0.00 0.00 178.00 179.61 2hfn h SER 125 N 0.56 0.00 0.12 -2.05 0.02 -1.97 0.16 113.55 110.39 2hfn h SER 125 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2hfn h SER 125 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2hfn h SER 125 CO -0.02 0.00 -0.42 0.00 -1.14 0.00 0.00 176.83 175.25 2hfn n ALA 126 N -2.00 3.43 -2.61 3.77 0.00 -0.74 -4.95 120.51 117.40 2hfn n ALA 126 Ca -0.02 -0.52 -0.32 0.00 0.00 0.00 0.00 53.44 52.57 2hfn n ALA 126 Cb 0.24 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.63 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 -2.55 2.59 0.61 0.00 -1.94 0.04 -4.95 119.30 113.12 2hfn s MET 127 Ca 0.20 -0.71 -0.03 0.00 -1.71 0.00 0.00 55.69 53.44 2hfn s MET 127 Cb 0.18 -2.53 0.04 0.00 2.01 0.00 0.00 34.83 34.53 2hfn s MET 127 CO 0.57 0.60 0.89 0.16 -0.01 0.00 0.00 175.02 177.23 2hfn s ASP 128 N -1.47 5.18 0.35 3.03 3.84 -1.26 -4.85 116.67 121.49 2hfn s ASP 128 Ca 0.18 0.32 0.08 0.00 -0.00 0.00 0.00 52.55 53.13 2hfn s ASP 128 Cb -0.11 -1.16 0.78 0.00 -1.38 0.00 0.00 42.92 41.05 2hfn s ASP 128 CO 0.08 -1.28 1.89 -0.65 -0.00 0.00 0.00 175.17 175.21 2hfn h PRO 129 N -0.22 0.71 -0.41 2.11 0.11 -1.98 -1.03 132.00 131.29 2hfn h PRO 129 Ca -0.44 -0.04 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 2hfn h PRO 129 Cb 1.29 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2hfn h PRO 129 CO 0.57 0.47 -0.26 1.49 -0.21 0.00 0.00 178.00 180.07 2hfn h GLU 130 N 0.74 0.90 -0.52 1.05 4.81 -1.97 -1.37 114.58 118.22 2hfn h GLU 130 Ca 0.42 -0.42 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 2hfn h GLU 130 Cb 0.59 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 2hfn h GLU 130 CO -0.18 1.07 0.15 1.96 -0.73 0.00 0.00 179.01 181.28 2hfn h GLN 131 N 0.72 0.81 0.20 1.92 4.20 -1.79 -1.37 115.11 119.80 2hfn h GLN 131 Ca 0.08 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.62 2hfn h GLN 131 Cb 0.83 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 2hfn h GLN 131 CO 0.07 0.76 -0.18 0.00 -0.67 0.00 0.00 178.83 178.81 2hfn h LEU 133 N -0.40 0.05 -0.52 0.00 5.85 -1.17 -1.61 115.31 117.51 2hfn h LEU 133 Ca -0.00 0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.62 2hfn h LEU 133 Cb 0.38 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2hfn h LEU 133 CO -0.04 0.07 -0.32 0.78 -0.34 0.00 0.00 178.44 178.59 2hfn h ASN 134 N 0.21 0.90 -0.21 1.25 2.35 -1.22 -0.51 115.58 118.35 2hfn h ASN 134 Ca 0.15 -0.38 0.03 0.00 -0.55 0.00 0.00 56.30 55.55 2hfn h ASN 134 Cb 0.15 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 2hfn h ASN 134 CO -0.19 1.14 0.05 0.15 -1.65 0.00 0.00 177.43 176.93 2hfn h PHE 135 N 0.72 0.08 -0.74 1.19 3.04 -1.03 -0.56 116.94 119.64 2hfn h PHE 135 Ca 0.07 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 61.99 2hfn h PHE 135 Cb 0.88 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.36 2hfn h PHE 135 CO 0.05 0.03 0.29 -0.07 -2.02 0.00 0.00 178.31 176.59 2hfn h LEU 136 N 0.13 1.01 -0.58 0.59 3.38 -1.02 0.03 115.31 118.85 2hfn h LEU 136 Ca 0.10 -0.15 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 2hfn h LEU 136 Cb 0.09 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 2hfn h LEU 136 CO -0.12 0.90 0.09 -0.07 0.09 0.00 0.00 178.44 179.32 2hfn h LEU 137 N 1.07 0.94 -0.15 1.67 3.38 -0.95 -2.16 115.31 119.10 2hfn h LEU 137 Ca 0.25 -0.27 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2hfn h LEU 137 Cb 0.21 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2hfn h LEU 137 CO -0.02 0.97 -0.32 0.44 0.09 0.00 0.00 178.44 179.59 2hfn h ASP 138 N 0.87 0.54 0.09 -0.43 3.32 -0.73 -2.62 116.42 117.46 2hfn h ASP 138 Ca 0.18 -0.56 -0.07 0.00 0.02 0.00 0.00 57.03 56.59 2hfn h ASP 138 Cb 0.43 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2hfn h ASP 138 CO 0.01 1.00 -0.24 -0.29 -1.72 0.00 0.00 179.24 178.01 2hfn h ILE 139 N 0.10 1.24 -0.60 0.35 2.10 -1.06 -2.35 117.51 117.28 2hfn h ILE 139 Ca 0.00 -1.11 -0.06 0.00 1.08 0.00 0.00 64.86 64.77 2hfn h ILE 139 Cb 0.92 1.39 -0.03 0.00 -1.09 0.00 0.00 36.82 38.02 2hfn h ILE 139 CO 0.07 0.34 0.14 0.00 -1.08 0.00 0.00 178.15 177.62 2hfn h ALA 140 N 1.51 1.11 -0.48 0.18 0.00 -1.36 -2.53 119.26 117.69 2hfn h ALA 140 Ca 0.04 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2hfn h ALA 140 Cb 0.57 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2hfn h ALA 140 CO 0.04 0.60 -0.01 0.87 0.00 0.00 0.00 179.25 180.74 2hfn h LYS 141 N 0.90 0.80 0.00 0.00 1.57 -1.04 -2.64 116.57 116.16 2hfn h LYS 141 Ca 0.19 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2hfn h LYS 141 Cb 0.34 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2hfn h LYS 141 CO 0.00 0.81 0.00 0.44 -0.57 0.00 0.00 179.45 180.13 2hfn n ILE 142 N -4.21 0.15 0.50 1.86 -5.35 -1.00 -5.12 119.36 106.19 2hfn n ILE 142 Ca 0.02 -0.05 0.06 0.00 -0.27 0.00 0.00 62.75 62.52 2hfn n ILE 142 Cb 0.31 -0.54 0.05 0.00 -1.74 0.00 0.00 39.64 37.72 2hfn n ILE 142 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57