#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 4.36 0.13 2.46 2.96 -1.26 -0.31 118.68 127.02 2hfn s LEU 6 Ca 0.00 2.44 0.04 0.00 -0.22 0.00 0.00 54.13 56.39 2hfn s LEU 6 Cb 0.00 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.09 2hfn s LEU 6 CO 0.00 -0.90 -0.10 -0.31 -1.32 0.00 0.00 176.35 173.72 2hfn s TYR 7 N 3.09 1.20 0.00 5.38 1.51 0.06 -1.16 117.35 127.44 2hfn s TYR 7 Ca 0.75 -0.75 0.03 0.00 -1.01 0.00 0.00 57.07 56.09 2hfn s TYR 7 Cb -0.38 -0.62 -0.01 0.00 -0.11 0.00 0.00 41.96 40.83 2hfn s TYR 7 CO 0.32 0.05 -0.10 0.50 -1.11 0.00 0.00 175.55 175.21 2hfn s ARG 8 N -3.56 0.79 -0.06 -0.62 3.52 -0.33 -2.25 118.95 116.44 2hfn s ARG 8 Ca 0.14 -0.41 0.03 0.00 -0.13 0.00 0.00 55.73 55.35 2hfn s ARG 8 Cb 0.02 -0.76 0.01 0.00 -1.56 0.00 0.00 34.95 32.66 2hfn s ARG 8 CO -0.00 0.20 -0.13 -1.17 -0.81 0.00 0.00 175.30 173.39 2hfn s LEU 9 N -0.40 1.69 -0.10 -0.88 0.20 0.41 -1.92 118.68 117.68 2hfn s LEU 9 Ca 0.03 -0.31 0.03 0.00 0.69 0.00 0.00 54.13 54.57 2hfn s LEU 9 Cb -0.04 -0.85 -0.01 0.00 -0.43 0.00 0.00 46.19 44.85 2hfn s LEU 9 CO -0.00 0.05 -0.20 -0.63 -0.29 0.00 0.00 176.35 175.28 2hfn s ILE 10 N 0.58 2.47 0.06 6.68 1.01 0.14 -0.30 121.20 131.84 2hfn s ILE 10 Ca -0.14 -0.89 -0.04 0.00 0.00 0.00 0.00 60.65 59.59 2hfn s ILE 10 Cb -0.15 -1.97 -0.02 0.00 0.01 0.00 0.00 42.46 40.32 2hfn s ILE 10 CO 0.04 0.55 0.06 -0.72 0.00 0.00 0.00 174.94 174.87 2hfn s TYR 11 N 0.13 0.34 0.23 3.97 1.13 -0.86 -0.36 117.35 121.93 2hfn s TYR 11 Ca -0.10 -0.80 0.11 0.00 -1.41 0.00 0.00 57.07 54.87 2hfn s TYR 11 Cb -0.16 -0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.42 2hfn s TYR 11 CO 0.06 -0.42 -0.18 -1.54 -2.51 0.00 0.00 175.55 170.96 2hfn s SER 12 N -2.71 3.74 0.15 -0.18 1.04 -0.19 -1.63 113.70 113.93 2hfn s SER 12 Ca 0.03 -0.85 -0.07 0.00 0.48 0.00 0.00 55.95 55.55 2hfn s SER 12 Cb 0.05 -0.41 -0.02 0.00 0.10 0.00 0.00 66.02 65.74 2hfn s SER 12 CO -0.09 0.08 0.22 -0.44 0.98 0.00 0.00 173.24 173.99 2hfn s SER 13 N -3.08 0.12 -0.35 7.02 0.01 -0.58 -0.56 113.70 116.28 2hfn s SER 13 Ca 0.26 -0.97 -0.11 0.00 1.31 0.00 0.00 55.95 56.43 2hfn s SER 13 Cb -0.07 0.39 0.01 0.00 0.21 0.00 0.00 66.02 66.56 2hfn s SER 13 CO 0.13 -0.85 0.20 -1.10 0.41 0.00 0.00 173.24 172.04 2hfn s GLN 14 N -3.99 3.10 0.58 12.44 -1.52 -0.40 -0.98 119.66 128.89 2hfn s GLN 14 Ca 0.19 -0.90 -0.19 0.00 -1.95 0.00 0.00 55.36 52.52 2hfn s GLN 14 Cb 0.05 -3.71 -0.04 0.00 -0.22 0.00 0.00 33.01 29.09 2hfn s GLN 14 CO 0.01 -0.57 1.16 0.20 -0.25 0.00 0.00 175.29 175.84 2hfn s GLY 15 N 1.61 2.64 0.45 3.09 0.00 0.03 -0.43 107.32 114.70 2hfn s GLY 15 Ca 0.04 0.89 -0.25 0.00 0.00 0.00 0.00 44.72 45.40 2hfn s GLY 15 CO 0.07 1.26 1.31 -0.26 0.00 0.00 0.00 173.10 175.48 2hfn s ILE 16 N -1.74 2.51 0.18 0.90 -4.36 -0.22 -4.88 121.20 113.59 2hfn s ILE 16 Ca 0.74 0.43 -0.11 0.00 -0.26 0.00 0.00 60.65 61.45 2hfn s ILE 16 Cb -0.27 -3.24 0.21 0.00 1.25 0.00 0.00 42.46 40.41 2hfn s ILE 16 CO 0.31 0.04 1.13 -2.65 0.24 0.00 0.00 174.94 174.02 2hfn n PRO 17 N -0.24 -0.15 -1.46 0.37 -0.02 -1.26 -2.54 135.00 129.70 2hfn n PRO 17 Ca 0.06 1.13 -0.31 0.00 -2.02 0.00 0.00 63.50 62.35 2hfn n PRO 17 Cb 0.44 -1.67 0.03 0.00 -0.02 0.00 0.00 33.50 32.28 2hfn n PRO 17 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2hfn n ASN 18 N -5.10 7.15 -4.76 2.55 6.94 -1.26 -4.98 115.26 115.80 2hfn n ASN 18 Ca 0.08 -3.53 -0.41 0.00 -0.02 0.00 0.00 54.58 50.70 2hfn n ASN 18 Cb 0.31 -1.08 -0.03 0.00 -2.36 0.00 0.00 39.78 36.61 2hfn n ASN 18 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2hfn s LEU 19 N -3.15 4.49 0.38 -4.53 1.43 -1.05 -5.06 118.68 111.19 2hfn s LEU 19 Ca 0.53 2.40 0.08 0.00 -1.03 0.00 0.00 54.13 56.11 2hfn s LEU 19 Cb 0.41 -3.63 -0.05 0.00 0.03 0.00 0.00 46.19 42.95 2hfn s LEU 19 CO -0.18 -0.33 0.11 -1.10 0.23 0.00 0.00 176.35 175.08 2hfn s GLN 20 N -1.21 2.18 0.27 1.70 -1.52 -1.26 -5.03 119.66 114.77 2hfn s GLN 20 Ca 0.48 -1.79 -0.03 0.00 -1.95 0.00 0.00 55.36 52.07 2hfn s GLN 20 Cb -0.35 -1.96 0.38 0.00 -0.22 0.00 0.00 33.01 30.86 2hfn s GLN 20 CO 0.43 0.00 1.90 -1.00 -0.25 0.00 0.00 175.29 176.38 2hfn h PRO 21 N 1.59 1.18 -0.50 2.91 0.13 -2.01 -1.93 132.00 133.37 2hfn h PRO 21 Ca -0.43 -0.07 0.13 0.00 -0.87 0.00 0.00 66.00 64.76 2hfn h PRO 21 Cb 1.25 -0.27 -0.02 0.00 0.13 0.00 0.00 31.00 32.09 2hfn h PRO 21 CO 0.69 0.78 0.35 -0.56 -0.23 0.00 0.00 178.00 179.03 2hfn h GLN 22 N 1.22 0.08 -0.16 0.86 -0.00 -1.99 -2.27 115.11 112.85 2hfn h GLN 22 Ca 0.41 -0.00 -0.13 0.00 -0.00 0.00 0.00 58.65 58.92 2hfn h GLN 22 Cb 0.07 -0.02 0.00 0.00 -0.00 0.00 0.00 27.48 27.53 2hfn h GLN 22 CO -0.14 0.05 -0.41 -0.44 -0.00 0.00 0.00 178.83 177.89 2hfn h ASP 23 N 0.08 0.63 -0.45 0.06 3.32 -1.75 -0.37 116.42 117.94 2hfn h ASP 23 Ca 0.24 -0.58 0.07 0.00 0.02 0.00 0.00 57.03 56.77 2hfn h ASP 23 Cb 0.83 -0.18 -0.06 0.00 0.22 0.00 0.00 39.33 40.14 2hfn h ASP 23 CO -0.02 1.10 0.12 -0.07 -1.72 0.00 0.00 179.24 178.65 2hfn h LEU 24 N 0.19 0.07 -0.70 1.55 -0.00 -1.42 -0.80 115.31 114.20 2hfn h LEU 24 Ca -0.01 0.07 0.03 0.00 -0.00 0.00 0.00 57.88 57.97 2hfn h LEU 24 Cb 1.02 0.08 -0.05 0.00 -0.00 0.00 0.00 40.66 41.71 2hfn h LEU 24 CO 0.09 0.07 0.44 0.07 -0.00 0.00 0.00 178.44 179.11 2hfn h LYS 25 N 0.27 0.82 -0.81 1.13 5.09 -1.29 0.00 116.57 121.78 2hfn h LYS 25 Ca 0.22 -0.05 -0.02 0.00 0.09 0.00 0.00 60.65 60.88 2hfn h LYS 25 Cb 0.25 -0.19 -0.04 0.00 0.10 0.00 0.00 32.23 32.36 2hfn h LYS 25 CO -0.26 0.55 0.41 -0.44 -2.09 0.00 0.00 179.45 177.62 2hfn h ASP 26 N 0.85 1.04 -0.02 7.07 3.45 -0.47 0.00 116.42 128.35 2hfn h ASP 26 Ca 0.29 -0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.62 2hfn h ASP 26 Cb 0.04 -0.27 -0.00 0.00 -0.56 0.00 0.00 39.33 38.54 2hfn h ASP 26 CO -0.12 0.87 0.01 0.40 -1.57 0.00 0.00 179.24 178.83 2hfn h ILE 27 N 1.14 1.17 -0.01 0.35 2.04 -0.82 -2.07 117.51 119.31 2hfn h ILE 27 Ca 0.28 -0.50 0.02 0.00 1.00 0.00 0.00 64.86 65.66 2hfn h ILE 27 Cb 0.08 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2hfn h ILE 27 CO -0.04 0.13 -0.10 0.25 0.00 0.00 0.00 178.15 178.40 2hfn h LEU 28 N -0.17 -0.28 -0.43 1.44 6.46 -0.67 -1.09 115.31 120.57 2hfn h LEU 28 Ca 0.01 0.04 0.02 0.00 -0.12 0.00 0.00 57.88 57.83 2hfn h LEU 28 Cb 0.21 0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.23 2hfn h LEU 28 CO -0.00 -0.14 0.25 -0.33 -0.62 0.00 0.00 178.44 177.60 2hfn h GLU 29 N -0.16 0.50 -0.39 1.25 5.08 -1.03 0.25 114.58 120.07 2hfn h GLU 29 Ca 0.04 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.39 2hfn h GLU 29 Cb 0.21 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2hfn h GLU 29 CO -0.10 0.33 0.23 0.77 -1.00 0.00 0.00 179.01 179.24 2hfn h SER 30 N 0.51 0.38 -0.71 1.42 0.02 -1.22 -1.13 113.55 112.82 2hfn h SER 30 Ca 0.17 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 2hfn h SER 30 Cb 0.01 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2hfn h SER 30 CO -0.08 0.27 0.29 0.77 -1.14 0.00 0.00 176.83 176.95 2hfn h SER 31 N 0.47 0.97 0.75 3.07 4.64 -0.85 -0.56 113.55 122.04 2hfn h SER 31 Ca 0.16 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 61.28 2hfn h SER 31 Cb 0.00 -0.25 -0.00 0.00 -0.31 0.00 0.00 62.40 61.84 2hfn h SER 31 CO -0.07 0.87 -0.16 1.56 -0.87 0.00 0.00 176.83 178.16 2hfn h GLN 32 N 1.01 0.00 0.22 4.77 4.20 -0.70 -0.47 115.11 124.14 2hfn h GLN 32 Ca 0.24 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.61 2hfn h GLN 32 Cb 0.19 0.00 0.03 0.00 0.30 0.00 0.00 27.48 28.00 2hfn h GLN 32 CO -0.02 0.16 -1.55 -0.09 -0.67 0.00 0.00 178.83 176.66 2hfn h ARG 33 N 0.00 0.47 0.09 1.46 2.43 -0.66 -3.41 114.38 114.76 2hfn h ARG 33 Ca -0.00 -0.80 -0.33 0.00 -0.81 0.00 0.00 59.98 58.04 2hfn h ARG 33 Cb 0.58 0.30 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 2hfn h ARG 33 CO 0.02 1.38 -1.77 -0.91 -1.51 0.00 0.00 179.97 177.19 2hfn h ASN 34 N 0.09 0.31 -0.22 -3.80 2.35 -0.95 -3.42 115.58 109.93 2hfn h ASN 34 Ca -0.29 -0.58 -0.01 0.00 -0.55 0.00 0.00 56.30 54.88 2hfn h ASN 34 Cb 2.11 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 40.37 2hfn h ASN 34 CO 0.23 1.51 0.11 0.78 -1.65 0.00 0.00 177.43 178.40 2hfn h ASN 35 N 0.05 0.29 -0.45 5.81 4.21 -1.31 -3.24 115.58 120.95 2hfn h ASN 35 Ca -0.33 -0.12 0.09 0.00 1.21 0.00 0.00 56.30 57.15 2hfn h ASN 35 Cb 2.03 -0.07 -0.08 0.00 -1.12 0.00 0.00 38.32 39.07 2hfn h ASN 35 CO 0.11 0.33 -0.09 -0.65 -1.29 0.00 0.00 177.43 175.84 2hfn h PRO 36 N 0.23 0.02 0.00 0.81 0.11 -1.80 -0.34 132.00 131.03 2hfn h PRO 36 Ca 0.08 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 2hfn h PRO 36 Cb 0.12 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.22 2hfn h PRO 36 CO -0.01 0.01 -0.01 0.00 -0.21 0.00 0.00 178.00 177.78 2hfn h ALA 37 N 1.44 1.70 -0.17 -0.75 0.00 -1.83 -1.11 119.26 118.53 2hfn h ALA 37 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2hfn h ALA 37 Cb 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2hfn h ALA 37 CO -0.44 0.01 0.00 0.09 0.00 0.00 0.00 179.25 178.91 2hfn n ASN 38 N -4.11 2.77 -2.61 0.00 3.02 -0.52 -4.95 115.26 108.86 2hfn n ASN 38 Ca -0.03 -1.89 -0.21 0.00 -0.03 0.00 0.00 54.58 52.42 2hfn n ASN 38 Cb 0.10 -0.10 0.01 0.00 -0.61 0.00 0.00 39.78 39.17 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 1.35 -0.50 3.77 7.41 0.00 -0.42 -4.76 105.19 112.04 2hfn n GLY 39 Ca 0.17 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.10 5.27 0.20 -0.61 -1.09 -0.26 -4.38 121.20 117.23 2hfn s ILE 40 Ca 0.11 0.58 0.06 0.00 -2.23 0.00 0.00 60.65 59.17 2hfn s ILE 40 Cb -0.05 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.16 2hfn s ILE 40 CO 0.14 0.46 -0.09 0.42 -1.23 0.00 0.00 174.94 174.64 2hfn s THR 41 N -0.09 1.40 -4.40 2.92 -4.23 -0.35 -4.34 115.64 106.56 2hfn s THR 41 Ca 0.18 -2.12 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 2hfn s THR 41 Cb -0.14 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.61 2hfn s THR 41 CO 0.06 -0.56 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 2hfn n GLY 42 N -0.35 -0.90 3.24 3.99 0.00 -1.04 -0.33 105.19 109.79 2hfn n GLY 42 Ca -0.08 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.71 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 0.35 -0.08 0.99 2.96 -1.08 -3.64 118.68 118.19 2hfn s LEU 43 Ca 0.00 0.76 0.05 0.00 -0.22 0.00 0.00 54.13 54.72 2hfn s LEU 43 Cb 0.00 1.22 -0.00 0.00 0.50 0.00 0.00 46.19 47.91 2hfn s LEU 43 CO 0.00 -0.15 -0.24 -0.22 -1.32 0.00 0.00 176.35 174.42 2hfn s LEU 44 N 0.73 2.05 -0.06 -0.68 2.96 -0.37 -1.35 118.68 121.96 2hfn s LEU 44 Ca -0.04 -0.52 0.05 0.00 -0.22 0.00 0.00 54.13 53.39 2hfn s LEU 44 Cb -0.05 -1.35 -0.00 0.00 0.50 0.00 0.00 46.19 45.28 2hfn s LEU 44 CO -0.05 0.19 -0.21 0.00 -1.32 0.00 0.00 176.35 174.96 2hfn s TYR 46 N 0.07 3.07 -0.50 0.00 5.04 -0.27 -1.14 117.35 123.62 2hfn s TYR 46 Ca -0.08 -1.65 0.04 0.00 -2.44 0.00 0.00 57.07 52.95 2hfn s TYR 46 Cb -0.14 -2.04 0.13 0.00 0.35 0.00 0.00 41.96 40.26 2hfn s TYR 46 CO 0.04 -0.75 0.23 0.45 -1.34 0.00 0.00 175.55 174.18 2hfn s SER 47 N 1.30 4.37 -0.26 4.32 0.15 0.40 -1.30 113.70 122.69 2hfn s SER 47 Ca -0.00 -2.91 -0.33 0.00 0.70 0.00 0.00 55.95 53.41 2hfn s SER 47 Cb -0.17 -1.64 -0.14 0.00 -1.71 0.00 0.00 66.02 62.36 2hfn s SER 47 CO -0.05 -0.25 1.05 0.29 1.20 0.00 0.00 173.24 175.48 2hfn n LYS 48 N 3.25 0.00 -0.08 5.44 5.02 -1.26 0.02 118.16 130.55 2hfn n LYS 48 Ca 0.05 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.45 2hfn n LYS 48 Cb 0.33 -1.09 0.35 0.00 -0.02 0.00 0.00 35.03 34.61 2hfn n LYS 48 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2hfn n PRO 49 N 2.37 1.88 -3.50 1.97 -0.04 -1.26 -5.05 135.00 131.37 2hfn n PRO 49 Ca 0.20 -1.32 -0.34 0.00 -0.04 0.00 0.00 63.50 62.00 2hfn n PRO 49 Cb -0.01 -1.43 -0.05 0.00 -0.04 0.00 0.00 33.50 31.96 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 -1.79 3.67 0.04 0.55 0.00 0.10 -0.79 121.76 123.54 2hfn s ALA 50 Ca 0.34 -0.30 0.01 0.00 0.00 0.00 0.00 51.96 52.00 2hfn s ALA 50 Cb 0.19 -2.36 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 2hfn s ALA 50 CO 0.28 0.53 0.12 -0.06 0.00 0.00 0.00 175.76 176.64 2hfn s PHE 51 N -1.48 3.33 -0.04 0.00 0.40 -0.15 -0.45 117.98 119.59 2hfn s PHE 51 Ca 0.37 0.19 -0.01 0.00 -0.60 0.00 0.00 56.93 56.87 2hfn s PHE 51 Cb -0.14 -1.71 0.03 0.00 0.51 0.00 0.00 43.02 41.71 2hfn s PHE 51 CO 0.19 0.56 0.03 -1.17 0.70 0.00 0.00 175.22 175.53 2hfn s LEU 52 N -2.18 0.66 0.02 -0.37 2.96 -0.30 -1.53 118.68 117.96 2hfn s LEU 52 Ca 0.28 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.23 2hfn s LEU 52 Cb -0.12 -0.20 -0.02 0.00 0.50 0.00 0.00 46.19 46.35 2hfn s LEU 52 CO 0.21 -0.18 -0.07 -1.58 -1.32 0.00 0.00 176.35 173.41 2hfn s GLN 53 N 1.63 0.49 -0.03 1.98 0.74 -0.65 -0.33 119.66 123.49 2hfn s GLN 53 Ca -0.02 -0.51 0.07 0.00 0.05 0.00 0.00 55.36 54.95 2hfn s GLN 53 Cb -0.13 -0.35 -0.02 0.00 1.10 0.00 0.00 33.01 33.62 2hfn s GLN 53 CO -0.03 0.08 -0.23 0.54 -0.55 0.00 0.00 175.29 175.10 2hfn s VAL 54 N -0.83 2.27 -0.04 1.34 0.11 -0.46 -2.02 120.40 120.77 2hfn s VAL 54 Ca -0.05 -1.02 0.03 0.00 -2.93 0.00 0.00 61.98 58.01 2hfn s VAL 54 Cb -0.07 -1.82 0.01 0.00 -1.53 0.00 0.00 36.38 32.97 2hfn s VAL 54 CO 0.00 0.58 -0.11 -0.76 -3.33 0.00 0.00 175.10 171.48 2hfn s LEU 55 N -0.54 1.75 0.06 2.54 1.43 0.59 -2.62 118.68 121.90 2hfn s LEU 55 Ca 0.07 -0.24 0.07 0.00 -1.03 0.00 0.00 54.13 53.00 2hfn s LEU 55 Cb -0.11 -0.69 -0.03 0.00 0.03 0.00 0.00 46.19 45.40 2hfn s LEU 55 CO 0.00 0.07 -0.18 -1.61 0.23 0.00 0.00 176.35 174.86 2hfn s GLU 56 N 0.30 1.15 0.00 1.70 2.02 0.55 -0.45 118.70 123.97 2hfn s GLU 56 Ca -0.06 -0.93 0.00 0.00 0.02 0.00 0.00 54.97 54.00 2hfn s GLU 56 Cb -0.11 -1.26 0.00 0.00 0.10 0.00 0.00 34.13 32.86 2hfn s GLU 56 CO 0.01 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.01 2hfn n GLY 57 N 1.67 -2.86 3.75 -1.39 0.00 -0.95 -1.22 105.19 104.18 2hfn n GLY 57 Ca -0.18 -1.32 -0.34 0.00 0.00 0.00 0.00 46.02 44.18 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 -2.00 2.55 0.19 1.61 -1.05 -1.26 -0.76 118.70 117.98 2hfn s GLU 58 Ca 0.00 1.56 -0.13 0.00 -0.15 0.00 0.00 54.97 56.24 2hfn s GLU 58 Cb 0.00 -1.90 0.20 0.00 -0.44 0.00 0.00 34.13 31.99 2hfn s GLU 58 CO 0.00 -1.48 1.69 0.00 0.95 0.00 0.00 175.26 176.42 2hfn h GLU 60 N 0.13 0.75 0.07 0.00 4.81 -1.92 -1.79 114.58 116.64 2hfn h GLU 60 Ca 0.26 -0.04 -0.27 0.00 -0.13 0.00 0.00 59.36 59.17 2hfn h GLU 60 Cb 0.39 -0.17 0.02 0.00 0.63 0.00 0.00 28.75 29.62 2hfn h GLU 60 CO -0.42 0.49 -1.14 1.96 -0.73 0.00 0.00 179.01 179.18 2hfn h GLN 61 N 0.77 0.56 -0.44 1.92 1.08 -1.72 -0.71 115.11 116.57 2hfn h GLN 61 Ca 0.28 -0.70 0.03 0.00 -1.45 0.00 0.00 58.65 56.81 2hfn h GLN 61 Cb 0.08 0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.70 2hfn h GLN 61 CO -0.13 1.29 0.24 0.28 -0.95 0.00 0.00 178.83 179.56 2hfn h VAL 62 N 0.27 1.01 -0.48 -0.54 2.07 -0.88 -0.16 116.25 117.55 2hfn h VAL 62 Ca -0.15 -0.16 -0.09 0.00 0.82 0.00 0.00 66.70 67.12 2hfn h VAL 62 Cb 1.81 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 2hfn h VAL 62 CO 0.21 0.09 -0.04 0.78 0.02 0.00 0.00 177.57 178.63 2hfn h ASN 63 N 0.48 0.86 0.01 0.57 2.35 -1.29 0.50 115.58 119.05 2hfn h ASN 63 Ca 0.18 -0.33 0.01 0.00 -0.55 0.00 0.00 56.30 55.62 2hfn h ASN 63 Cb 0.05 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 2hfn h ASN 63 CO -0.11 0.98 -0.09 -0.08 -1.65 0.00 0.00 177.43 176.49 2hfn h GLU 64 N 0.72 -0.15 -0.23 0.81 4.22 -0.93 -0.69 114.58 118.33 2hfn h GLU 64 Ca 0.13 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.57 2hfn h GLU 64 Cb 0.56 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2hfn h GLU 64 CO 0.03 -0.10 0.12 1.15 -2.18 0.00 0.00 179.01 178.03 2hfn h THR 65 N -0.15 1.13 0.32 0.32 2.02 -0.92 -1.85 112.91 113.78 2hfn h THR 65 Ca 0.03 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 2hfn h THR 65 Cb 0.19 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2hfn h THR 65 CO -0.08 0.13 -0.21 0.22 0.37 0.00 0.00 175.52 175.95 2hfn h TYR 66 N 0.25 -0.54 0.00 3.16 3.20 -0.81 0.46 116.97 122.69 2hfn h TYR 66 Ca 0.08 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2hfn h TYR 66 Cb 0.10 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 2hfn h TYR 66 CO -0.03 -0.32 -0.02 0.45 -1.64 0.00 0.00 178.16 176.60 2hfn h HIS 67 N -0.51 0.00 0.20 -3.82 3.86 -1.05 -1.56 115.15 112.27 2hfn h HIS 67 Ca -0.03 0.00 -0.32 0.00 -1.16 0.00 0.00 60.37 58.86 2hfn h HIS 67 Cb 0.43 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.92 2hfn h HIS 67 CO -0.10 0.02 -1.45 -0.09 0.86 0.00 0.00 177.93 177.18 2hfn h ARG 68 N 0.00 0.42 -0.77 2.45 2.43 -0.98 -3.32 114.38 114.61 2hfn h ARG 68 Ca -0.00 -0.72 0.01 0.00 -0.81 0.00 0.00 59.98 58.46 2hfn h ARG 68 Cb 0.28 0.27 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 2hfn h ARG 68 CO 0.00 1.34 0.50 0.82 -1.51 0.00 0.00 179.97 181.12 2hfn h ILE 69 N 0.12 1.18 0.00 1.20 2.04 -0.06 -2.87 117.51 119.11 2hfn h ILE 69 Ca -0.23 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 2hfn h ILE 69 Cb 2.10 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 38.24 2hfn h ILE 69 CO 0.24 0.19 -0.04 -0.37 0.00 0.00 0.00 178.15 178.16 2hfn h VAL 70 N 1.02 0.39 -0.00 1.67 -1.51 -1.42 -0.21 116.25 116.20 2hfn h VAL 70 Ca 0.29 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 65.56 2hfn h VAL 70 Cb -0.09 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 30.21 2hfn h VAL 70 CO -0.07 0.04 -0.02 0.00 -1.23 0.00 0.00 177.57 176.29 2hfn n GLN 71 N -3.57 0.98 -2.31 5.19 10.64 -1.08 -4.84 117.38 122.38 2hfn n GLN 71 Ca -0.02 -0.19 -0.42 0.00 -1.83 0.00 0.00 57.00 54.53 2hfn n GLN 71 Cb 0.14 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.00 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 -2.16 6.97 0.00 2.61 2.15 -0.09 -4.92 116.67 121.22 2hfn s ASP 72 Ca 0.41 2.14 0.22 0.00 0.43 0.00 0.00 52.55 55.75 2hfn s ASP 72 Cb 0.21 -2.58 1.03 0.00 -0.30 0.00 0.00 42.92 41.28 2hfn s ASP 72 CO 0.39 -0.56 1.69 -0.62 -0.17 0.00 0.00 175.17 175.91 2hfn n GLU 73 N 4.00 0.19 0.00 4.34 1.02 -1.26 -3.37 120.64 125.56 2hfn n GLU 73 Ca 0.10 0.10 0.15 0.00 -0.02 0.00 0.00 57.16 57.49 2hfn n GLU 73 Cb 0.45 -1.50 0.68 0.00 -0.02 0.00 0.00 31.44 31.04 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 -1.37 1.11 -3.87 3.49 1.74 -1.26 -4.82 116.66 111.68 2hfn n ARG 74 Ca 0.08 -0.42 -0.09 0.00 -0.77 0.00 0.00 57.85 56.66 2hfn n ARG 74 Cb 0.20 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.11 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 -2.17 0.11 0.32 -1.55 -3.43 -1.22 -1.05 115.29 106.30 2hfn s HIS 75 Ca 0.38 -0.48 -0.08 0.00 -0.80 0.00 0.00 55.06 54.08 2hfn s HIS 75 Cb 0.21 0.29 0.01 0.00 -1.43 0.00 0.00 32.58 31.66 2hfn s HIS 75 CO 0.40 -0.95 0.53 -3.38 -2.00 0.00 0.00 174.74 169.34 2hfn s HIS 76 N -3.94 0.69 -1.28 0.38 -3.43 0.43 -4.84 115.29 103.31 2hfn s HIS 76 Ca 0.15 -1.04 -0.00 0.00 -0.80 0.00 0.00 55.06 53.37 2hfn s HIS 76 Cb -0.01 0.15 0.00 0.00 -1.43 0.00 0.00 32.58 31.30 2hfn s HIS 76 CO 0.03 -1.17 0.79 0.43 -2.00 0.00 0.00 174.74 172.82 2hfn n SER 77 N -1.10 -1.46 -4.76 7.38 7.64 -1.26 -1.27 113.62 118.79 2hfn n SER 77 Ca -0.01 -0.76 -0.41 0.00 1.01 0.00 0.00 58.87 58.69 2hfn n SER 77 Cb 0.61 -4.36 -0.02 0.00 -1.01 0.00 0.00 64.21 59.43 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 -5.81 4.30 -0.26 1.43 0.04 -1.26 -4.51 135.00 128.93 2hfn s PRO 78 Ca 0.01 2.27 0.02 0.00 0.04 0.00 0.00 61.00 63.34 2hfn s PRO 78 Cb -0.01 -3.08 0.07 0.00 0.04 0.00 0.00 34.50 31.52 2hfn s PRO 78 CO 0.79 -0.31 -0.05 -0.65 0.04 0.00 0.00 177.00 176.81 2hfn s GLN 79 N -1.17 1.72 -0.08 4.56 -1.52 0.27 -5.00 119.66 118.45 2hfn s GLN 79 Ca 0.54 -1.18 -0.30 0.00 -1.95 0.00 0.00 55.36 52.47 2hfn s GLN 79 Cb -0.41 -2.70 -0.05 0.00 -0.22 0.00 0.00 33.01 29.63 2hfn s GLN 79 CO 0.49 -0.65 1.54 0.42 -0.25 0.00 0.00 175.29 176.84 2hfn s ILE 80 N 1.28 3.75 -0.17 1.08 1.01 -1.26 -1.02 121.20 125.87 2hfn s ILE 80 Ca -0.04 0.94 -0.12 0.00 0.00 0.00 0.00 60.65 61.42 2hfn s ILE 80 Cb -0.19 -3.60 -0.22 0.00 0.01 0.00 0.00 42.46 38.45 2hfn s ILE 80 CO -0.07 -0.08 0.25 -0.38 0.00 0.00 0.00 174.94 174.66 2hfn n ILE 81 N 5.38 1.67 -3.68 2.92 5.41 0.51 -4.97 119.36 126.60 2hfn n ILE 81 Ca 0.16 -0.40 -0.13 0.00 1.00 0.00 0.00 62.75 63.38 2hfn n ILE 81 Cb 0.43 -1.85 -0.08 0.00 -0.71 0.00 0.00 39.64 37.43 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 -2.48 0.67 -0.10 0.38 2.12 -0.92 -4.76 118.70 113.61 2hfn s GLU 82 Ca -0.26 0.83 -0.03 0.00 0.36 0.00 0.00 54.97 55.86 2hfn s GLU 82 Cb 0.07 0.31 0.05 0.00 0.26 0.00 0.00 34.13 34.82 2hfn s GLU 82 CO 0.68 -0.09 0.15 0.00 -0.54 0.00 0.00 175.26 175.47 2hfn s MET 84 N 2.28 1.24 0.50 0.00 0.23 -0.81 -5.01 119.30 117.72 2hfn s MET 84 Ca 0.04 -0.52 -0.23 0.00 -1.03 0.00 0.00 55.69 53.95 2hfn s MET 84 Cb -0.13 0.56 -0.06 0.00 -1.53 0.00 0.00 34.83 33.68 2hfn s MET 84 CO -0.06 -0.53 1.29 -2.14 -2.03 0.00 0.00 175.02 171.55 2hfn s PRO 85 N -3.76 3.44 0.15 3.16 0.02 -1.26 -1.18 135.00 135.57 2hfn s PRO 85 Ca 0.01 2.09 0.08 0.00 0.02 0.00 0.00 61.00 63.20 2hfn s PRO 85 Cb -0.00 -2.37 -0.04 0.00 0.02 0.00 0.00 34.50 32.10 2hfn s PRO 85 CO -0.13 -0.90 -0.18 0.96 -0.33 0.00 0.00 177.00 176.42 2hfn s ILE 86 N -1.37 1.77 0.19 2.83 -4.36 -0.31 -4.83 121.20 115.12 2hfn s ILE 86 Ca 0.67 -1.86 -0.01 0.00 -0.26 0.00 0.00 60.65 59.19 2hfn s ILE 86 Cb -0.36 -1.78 -0.07 0.00 1.25 0.00 0.00 42.46 41.49 2hfn s ILE 86 CO 0.44 -0.29 1.49 0.03 0.24 0.00 0.00 174.94 176.84 2hfn h ARG 87 N 3.37 0.44 -2.71 0.37 2.47 -1.97 -3.44 114.38 112.91 2hfn h ARG 87 Ca -0.42 -0.31 0.03 0.00 -1.26 0.00 0.00 59.98 58.02 2hfn h ARG 87 Cb 1.20 0.05 -0.13 0.00 -1.65 0.00 0.00 29.97 29.44 2hfn h ARG 87 CO 0.50 0.93 0.32 -0.98 0.56 0.00 0.00 179.97 181.30 2hfn s ARG 88 N -3.80 1.10 0.63 0.04 1.70 -1.26 -5.11 118.95 112.26 2hfn s ARG 88 Ca -0.06 -0.41 -0.11 0.00 -0.47 0.00 0.00 55.73 54.68 2hfn s ARG 88 Cb 0.11 0.51 -0.03 0.00 -0.57 0.00 0.00 34.95 34.96 2hfn s ARG 88 CO 0.83 -0.48 1.03 1.03 -1.08 0.00 0.00 175.30 176.63 2hfn s ARG 89 N -3.50 3.49 0.00 3.89 0.52 -1.26 -5.00 118.95 117.08 2hfn s ARG 89 Ca 0.03 0.79 0.00 0.00 -0.52 0.00 0.00 55.73 56.02 2hfn s ARG 89 Cb -0.01 -2.07 0.00 0.00 0.52 0.00 0.00 34.95 33.39 2hfn s ARG 89 CO -0.11 -0.66 0.00 0.09 0.02 0.00 0.00 175.30 174.64 2hfn n ASN 90 N -2.81 1.28 -0.46 0.23 4.13 -1.26 -4.78 115.26 111.60 2hfn n ASN 90 Ca 0.06 -0.35 0.07 0.00 1.68 0.00 0.00 54.58 56.04 2hfn n ASN 90 Cb 0.54 0.96 0.15 0.00 -1.54 0.00 0.00 39.78 39.90 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 -1.09 0.00 0.21 3.10 3.01 -1.26 -4.86 117.46 116.56 2hfn n PHE 91 Ca 0.00 -1.12 0.11 0.00 1.01 0.00 0.00 57.45 57.46 2hfn n PHE 91 Cb 0.00 -0.19 0.59 0.00 -0.01 0.00 0.00 39.48 39.87 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 -1.04 0.15 0.02 -1.08 0.00 -1.26 -1.65 120.64 115.78 2hfn n GLU 92 Ca 0.15 0.61 0.13 0.00 0.00 0.00 0.00 57.16 58.05 2hfn n GLU 92 Cb 0.71 -1.96 0.34 0.00 0.00 0.00 0.00 31.44 30.53 2hfn n GLU 92 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.13 178.46 2hfn n VAL 93 N -2.28 0.10 -4.69 3.84 0.24 -1.26 -4.82 118.33 109.46 2hfn n VAL 93 Ca -0.01 -0.07 -0.33 0.00 -2.04 0.00 0.00 64.34 61.90 2hfn n VAL 93 Cb 0.07 -0.07 -0.16 0.00 -1.47 0.00 0.00 33.84 32.21 2hfn n VAL 93 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2hfn s TRP 94 N -3.04 2.70 0.17 6.34 0.51 -0.66 -4.98 118.94 119.99 2hfn s TRP 94 Ca 0.11 -1.20 -0.14 0.00 -2.12 0.00 0.00 56.10 52.75 2hfn s TRP 94 Cb 0.17 -1.83 0.10 0.00 -0.81 0.00 0.00 33.47 31.10 2hfn s TRP 94 CO 0.65 -0.54 1.80 0.66 -0.51 0.00 0.00 176.95 179.02 2hfn h SER 95 N 7.23 0.45 -3.48 2.95 4.64 -1.85 -2.76 113.55 120.74 2hfn h SER 95 Ca -0.31 0.01 0.11 0.00 -0.47 0.00 0.00 61.79 61.14 2hfn h SER 95 Cb 1.20 -0.08 -0.26 0.00 -0.31 0.00 0.00 62.40 62.95 2hfn h SER 95 CO 0.55 0.32 0.63 -0.32 -0.87 0.00 0.00 176.83 177.13 2hfn s MET 96 N -6.14 0.42 0.05 4.77 -2.45 -1.26 -3.67 119.30 111.01 2hfn s MET 96 Ca -0.13 0.24 0.01 0.00 -1.25 0.00 0.00 55.69 54.56 2hfn s MET 96 Cb 0.13 0.20 -0.03 0.00 1.25 0.00 0.00 34.83 36.38 2hfn s MET 96 CO 0.73 -0.10 -0.05 1.14 1.05 0.00 0.00 175.02 177.79 2hfn s GLN 97 N -0.59 0.53 -0.09 4.11 -2.07 -1.24 -4.83 119.66 115.47 2hfn s GLN 97 Ca 0.02 -0.90 0.03 0.00 -1.82 0.00 0.00 55.36 52.69 2hfn s GLN 97 Cb -0.02 -0.06 0.01 0.00 -1.09 0.00 0.00 33.01 31.85 2hfn s GLN 97 CO -0.04 -0.02 -0.17 0.00 -1.32 0.00 0.00 175.29 173.73 2hfn s ALA 98 N -2.27 1.73 -0.09 2.60 0.00 -1.26 -1.24 121.76 121.23 2hfn s ALA 98 Ca -0.05 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.21 2hfn s ALA 98 Cb -0.04 -0.75 0.01 0.00 0.00 0.00 0.00 23.12 22.35 2hfn s ALA 98 CO -0.03 0.10 -0.13 0.42 0.00 0.00 0.00 175.76 176.12 2hfn s ILE 99 N 0.67 1.30 -0.09 0.00 -1.09 -0.45 -5.02 121.20 116.52 2hfn s ILE 99 Ca -0.13 -0.54 -0.15 0.00 -2.23 0.00 0.00 60.65 57.60 2hfn s ILE 99 Cb -0.16 -1.20 -0.05 0.00 -1.58 0.00 0.00 42.46 39.47 2hfn s ILE 99 CO 0.03 0.40 0.37 0.42 -1.23 0.00 0.00 174.94 174.93 2hfn s THR 100 N 0.93 5.19 -0.16 2.92 -4.23 -1.26 -1.11 115.64 117.92 2hfn s THR 100 Ca -0.09 0.73 -0.02 0.00 -1.18 0.00 0.00 61.69 61.13 2hfn s THR 100 Cb -0.15 -3.69 0.05 0.00 1.34 0.00 0.00 72.50 70.04 2hfn s THR 100 CO 0.00 0.45 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.84 2hfn s VAL 101 N -0.11 0.72 0.00 2.29 1.01 -0.42 -4.94 120.40 118.94 2hfn s VAL 101 Ca 0.21 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2hfn s VAL 101 Cb -0.15 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.20 2hfn s VAL 101 CO 0.09 0.01 0.00 -0.46 0.00 0.00 0.00 175.10 174.74 2hfn n ASN 102 N 5.00 0.00 0.15 3.32 2.04 -1.26 -3.99 115.26 120.52 2hfn n ASN 102 Ca -0.10 -0.32 0.13 0.00 -0.44 0.00 0.00 54.58 53.85 2hfn n ASN 102 Cb 0.48 0.00 0.48 0.00 -2.53 0.00 0.00 39.78 38.21 2hfn n ASN 102 CO 0.00 0.00 0.00 -0.78 -0.44 0.00 0.00 177.26 176.04 2hfn h ASP 103 N 0.00 0.00 0.19 0.53 -0.00 -1.98 -2.33 116.42 112.84 2hfn h ASP 103 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 2hfn h ASP 103 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 2hfn h ASP 103 CO 0.00 0.00 -0.31 0.18 -0.00 0.00 0.00 179.24 179.11 2hfn n LEU 104 N -2.43 1.19 -4.73 2.28 4.77 -1.26 -4.98 117.00 111.85 2hfn n LEU 104 Ca 0.03 -0.35 -0.33 0.00 -0.03 0.00 0.00 56.01 55.33 2hfn n LEU 104 Cb 0.31 -0.10 0.10 0.00 -2.33 0.00 0.00 43.42 41.40 2hfn n LEU 104 CO 0.24 0.23 0.74 -0.44 -1.33 0.00 0.00 177.39 176.83 2hfn s SER 105 N -2.51 4.13 0.98 -1.43 0.01 -0.88 -4.99 113.70 109.00 2hfn s SER 105 Ca 0.23 2.15 -0.11 0.00 1.31 0.00 0.00 55.95 59.53 2hfn s SER 105 Cb 0.19 -2.56 0.18 0.00 0.21 0.00 0.00 66.02 64.03 2hfn s SER 105 CO 0.54 -2.30 1.10 0.28 0.41 0.00 0.00 173.24 173.27 2hfn s THR 106 N -2.37 2.23 0.24 1.44 -1.32 -1.26 -4.71 115.64 109.89 2hfn s THR 106 Ca 0.69 0.08 -0.05 0.00 -1.21 0.00 0.00 61.69 61.19 2hfn s THR 106 Cb -0.24 -2.21 0.23 0.00 -1.51 0.00 0.00 72.50 68.77 2hfn s THR 106 CO 0.49 -0.10 1.88 -0.33 -2.21 0.00 0.00 174.62 174.35 2hfn h GLU 107 N -2.00 1.06 -1.00 7.08 4.39 -1.98 -1.12 114.58 121.02 2hfn h GLU 107 Ca -0.49 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 59.18 2hfn h GLU 107 Cb 1.29 -0.24 -0.06 0.00 -0.10 0.00 0.00 28.75 29.64 2hfn h GLU 107 CO 0.47 0.70 0.65 -0.56 -1.16 0.00 0.00 179.01 179.11 2hfn h GLN 108 N 1.09 1.21 -0.05 2.33 3.07 -1.99 0.76 115.11 121.53 2hfn h GLN 108 Ca 0.37 -0.07 -0.09 0.00 0.09 0.00 0.00 58.65 58.96 2hfn h GLN 108 Cb 0.08 -0.27 0.00 0.00 0.08 0.00 0.00 27.48 27.37 2hfn h GLN 108 CO -0.14 0.80 -0.30 0.28 0.09 0.00 0.00 178.83 179.56 2hfn h VAL 109 N 1.25 1.44 -0.86 1.86 2.07 -1.84 -2.81 116.25 117.36 2hfn h VAL 109 Ca 0.40 -1.74 0.13 0.00 0.82 0.00 0.00 66.70 66.31 2hfn h VAL 109 Cb 0.03 2.40 -0.06 0.00 -1.52 0.00 0.00 31.29 32.13 2hfn h VAL 109 CO -0.13 0.50 0.56 0.11 0.02 0.00 0.00 177.57 178.62 2hfn h LYS 110 N -0.22 0.69 -0.02 1.57 1.57 -1.01 -2.12 116.57 117.03 2hfn h LYS 110 Ca -0.02 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.58 2hfn h LYS 110 Cb 0.96 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 2hfn h LYS 110 CO 0.06 0.45 -0.60 1.15 -0.57 0.00 0.00 179.45 179.94 2hfn h THR 111 N 0.71 1.42 -0.33 -0.16 2.02 -0.80 -1.92 112.91 113.85 2hfn h THR 111 Ca 0.42 -2.03 -0.06 0.00 0.77 0.00 0.00 66.41 65.51 2hfn h THR 111 Cb 0.62 2.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.10 2hfn h THR 111 CO -0.18 0.59 -0.02 -0.07 0.37 0.00 0.00 175.52 176.21 2hfn h LEU 112 N 0.06 0.58 -0.40 2.58 3.38 -1.13 -0.43 115.31 119.95 2hfn h LEU 112 Ca -0.01 -0.32 0.01 0.00 0.09 0.00 0.00 57.88 57.66 2hfn h LEU 112 Cb 1.08 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 2hfn h LEU 112 CO 0.08 0.77 0.25 0.58 0.09 0.00 0.00 178.44 180.20 2hfn h VAL 113 N 0.39 1.06 -0.73 1.22 2.07 -1.33 -2.54 116.25 116.40 2hfn h VAL 113 Ca 0.09 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 2hfn h VAL 113 Cb 0.48 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2hfn h VAL 113 CO 0.02 0.09 0.36 0.25 0.02 0.00 0.00 177.57 178.31 2hfn h LEU 114 N 0.50 0.93 -1.67 2.57 5.85 -1.23 -2.32 115.31 119.94 2hfn h LEU 114 Ca 0.16 -0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2hfn h LEU 114 Cb -0.02 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 2hfn h LEU 114 CO -0.06 0.78 0.37 0.50 -0.34 0.00 0.00 178.44 179.69 2hfn h LYS 115 N 1.03 0.37 -0.22 1.25 3.64 -0.63 -2.77 116.57 119.24 2hfn h LYS 115 Ca 0.25 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 2hfn h LYS 115 Cb 0.08 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2hfn h LYS 115 CO -0.04 0.25 0.00 0.66 -2.27 0.00 0.00 179.45 178.05 2hfn n TYR 116 N -4.47 0.29 -3.86 1.91 4.02 -1.02 -5.06 117.16 108.96 2hfn n TYR 116 Ca 0.08 -0.33 -0.10 0.00 -0.01 0.00 0.00 57.90 57.55 2hfn n TYR 116 Cb 0.34 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.65 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 -0.96 0.19 0.33 7.72 1.04 -0.90 -4.87 113.70 116.24 2hfn s SER 117 Ca 0.19 -1.21 0.25 0.00 0.48 0.00 0.00 55.95 55.65 2hfn s SER 117 Cb 0.11 0.82 0.58 0.00 0.10 0.00 0.00 66.02 67.63 2hfn s SER 117 CO 0.14 -1.61 1.70 1.23 0.98 0.00 0.00 173.24 175.67 2hfn h GLY 118 N 2.02 0.00 -1.75 7.32 0.00 -1.85 -3.42 103.07 105.39 2hfn h GLY 118 Ca -0.31 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.55 2hfn h GLY 118 CO 0.40 0.00 -0.45 0.69 0.00 0.00 0.00 176.54 177.18 2hfn n PHE 119 N -2.68 -0.71 1.13 5.60 3.72 -1.26 -5.06 117.46 118.21 2hfn n PHE 119 Ca 0.05 -2.68 0.12 0.00 -0.05 0.00 0.00 57.45 54.89 2hfn n PHE 119 Cb 0.48 0.26 0.20 0.00 -0.94 0.00 0.00 39.48 39.48 2hfn n PHE 119 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2hfn n THR 120 N -0.63 0.00 -4.23 4.37 5.66 -1.26 -3.31 114.28 114.88 2hfn n THR 120 Ca 0.07 -0.21 -0.35 0.00 -3.05 0.00 0.00 64.05 60.51 2hfn n THR 120 Cb 0.58 0.84 -0.10 0.00 -1.55 0.00 0.00 70.33 70.11 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 -2.45 4.50 -0.11 1.09 -4.23 -1.26 -4.69 115.64 108.48 2hfn s THR 121 Ca 0.22 -0.16 -0.30 0.00 -1.18 0.00 0.00 61.69 60.28 2hfn s THR 121 Cb 0.19 -2.95 -0.02 0.00 1.34 0.00 0.00 72.50 71.06 2hfn s THR 121 CO 0.53 0.55 1.22 -0.22 -0.54 0.00 0.00 174.62 176.16 2hfn s LEU 122 N -0.39 4.23 -0.37 4.79 2.96 -1.26 -4.99 118.68 123.65 2hfn s LEU 122 Ca 0.08 1.74 0.01 0.00 -0.22 0.00 0.00 54.13 55.74 2hfn s LEU 122 Cb -0.12 -3.55 0.12 0.00 0.50 0.00 0.00 46.19 43.14 2hfn s LEU 122 CO 0.02 -0.67 0.17 -0.13 -1.32 0.00 0.00 176.35 174.42 2hfn s ARG 123 N 2.86 0.94 0.37 1.98 0.52 -1.26 -4.82 118.95 119.54 2hfn s ARG 123 Ca 0.55 -1.51 0.13 0.00 -0.52 0.00 0.00 55.73 54.37 2hfn s ARG 123 Cb -0.23 -2.04 0.93 0.00 0.52 0.00 0.00 34.95 34.13 2hfn s ARG 123 CO 0.18 -1.09 1.83 -1.35 0.02 0.00 0.00 175.30 174.89 2hfn h PRO 124 N 7.35 0.55 0.00 3.54 0.11 -1.94 0.79 132.00 142.41 2hfn h PRO 124 Ca -0.06 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.02 2hfn h PRO 124 Cb 0.97 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.96 2hfn h PRO 124 CO 0.45 0.37 0.00 -1.13 -0.21 0.00 0.00 178.00 177.47 2hfn n SER 125 N -4.59 0.16 -1.06 -2.05 3.41 -1.26 -1.40 113.62 106.84 2hfn n SER 125 Ca 0.20 0.58 0.09 0.00 -0.26 0.00 0.00 58.87 59.48 2hfn n SER 125 Cb 0.62 -0.60 0.24 0.00 -0.26 0.00 0.00 64.21 64.21 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 -1.58 2.32 -2.61 7.33 0.00 0.27 -4.96 120.51 121.27 2hfn n ALA 126 Ca -0.00 -1.18 -0.21 0.00 0.00 0.00 0.00 53.44 52.05 2hfn n ALA 126 Cb 0.02 -0.73 -0.15 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.06 0.99 0.87 0.00 -1.94 -0.49 -4.78 119.30 112.88 2hfn s MET 127 Ca 0.38 -0.51 -0.13 0.00 -1.71 0.00 0.00 55.69 53.71 2hfn s MET 127 Cb 0.20 -0.96 0.12 0.00 2.01 0.00 0.00 34.83 36.20 2hfn s MET 127 CO 0.27 0.26 1.22 0.16 -0.01 0.00 0.00 175.02 176.91 2hfn s ASP 128 N -0.49 3.97 0.33 3.03 3.84 -1.26 -4.81 116.67 121.29 2hfn s ASP 128 Ca 0.04 0.64 0.01 0.00 -0.00 0.00 0.00 52.55 53.24 2hfn s ASP 128 Cb -0.05 -1.01 0.58 0.00 -1.38 0.00 0.00 42.92 41.06 2hfn s ASP 128 CO -0.00 -2.23 1.99 -0.65 -0.00 0.00 0.00 175.17 174.28 2hfn h PRO 129 N -1.28 0.91 -0.63 2.11 0.11 -1.97 -0.85 132.00 130.40 2hfn h PRO 129 Ca -0.46 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 2hfn h PRO 129 Cb 1.30 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 2hfn h PRO 129 CO 0.57 0.61 0.21 1.49 -0.21 0.00 0.00 178.00 180.67 2hfn h GLU 130 N 0.94 0.97 -0.27 1.05 4.81 -1.98 -1.55 114.58 118.55 2hfn h GLU 130 Ca 0.27 -0.20 -0.16 0.00 -0.13 0.00 0.00 59.36 59.14 2hfn h GLU 130 Cb -0.08 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 2hfn h GLU 130 CO -0.06 0.84 -0.46 1.96 -0.73 0.00 0.00 179.01 180.56 2hfn h GLN 131 N 0.90 0.71 -0.16 1.92 4.20 -1.85 -1.80 115.11 119.02 2hfn h GLN 131 Ca 0.20 -0.40 0.01 0.00 0.06 0.00 0.00 58.65 58.53 2hfn h GLN 131 Cb 0.27 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 2hfn h GLN 131 CO -0.01 1.02 0.08 0.00 -0.67 0.00 0.00 178.83 179.25 2hfn h LEU 133 N 0.17 0.21 -0.86 0.00 5.85 -1.23 -2.40 115.31 117.05 2hfn h LEU 133 Ca 0.06 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 2hfn h LEU 133 Cb 0.01 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2hfn h LEU 133 CO -0.04 0.38 0.30 0.78 -0.34 0.00 0.00 178.44 179.52 2hfn h ASN 134 N 0.04 1.05 -0.54 1.25 2.35 -1.30 0.77 115.58 119.19 2hfn h ASN 134 Ca 0.04 -0.16 0.04 0.00 -0.55 0.00 0.00 56.30 55.67 2hfn h ASN 134 Cb 0.25 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.31 2hfn h ASN 134 CO -0.00 0.93 0.30 0.15 -1.65 0.00 0.00 177.43 177.16 2hfn h PHE 135 N 1.11 0.55 -0.53 1.19 3.04 -1.11 -1.65 116.94 119.54 2hfn h PHE 135 Ca 0.26 0.02 -0.11 0.00 3.98 0.00 0.00 57.97 62.11 2hfn h PHE 135 Cb 0.21 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 38.53 2hfn h PHE 135 CO 0.02 0.29 -0.10 -0.07 -2.02 0.00 0.00 178.31 176.42 2hfn h LEU 136 N 0.58 1.01 -0.71 0.59 3.38 -0.82 -0.41 115.31 118.93 2hfn h LEU 136 Ca 0.23 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2hfn h LEU 136 Cb 0.10 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 2hfn h LEU 136 CO -0.14 1.13 0.32 -0.07 0.09 0.00 0.00 178.44 179.77 2hfn h LEU 137 N 0.88 0.95 -0.12 1.67 3.38 -0.69 -2.03 115.31 119.35 2hfn h LEU 137 Ca 0.14 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2hfn h LEU 137 Cb 0.67 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.18 2hfn h LEU 137 CO 0.05 0.84 -0.48 0.44 0.09 0.00 0.00 178.44 179.38 2hfn h ASP 138 N 1.01 0.63 0.28 -0.43 5.19 -1.15 -3.07 116.42 118.88 2hfn h ASP 138 Ca 0.24 -0.62 -0.05 0.00 -0.62 0.00 0.00 57.03 55.98 2hfn h ASP 138 Cb 0.16 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 2hfn h ASP 138 CO -0.03 1.15 -0.22 -0.29 -3.12 0.00 0.00 179.24 176.73 2hfn h ILE 139 N 0.15 1.05 0.00 0.35 2.10 -1.06 -1.72 117.51 118.38 2hfn h ILE 139 Ca -0.03 -0.79 -0.01 0.00 1.08 0.00 0.00 64.86 65.12 2hfn h ILE 139 Cb 1.12 1.44 -0.00 0.00 -1.09 0.00 0.00 36.82 38.28 2hfn h ILE 139 CO 0.10 0.22 -0.03 0.00 -1.08 0.00 0.00 178.15 177.35 2hfn h ALA 140 N 1.78 1.40 0.00 0.18 0.00 -1.26 -2.71 119.26 118.64 2hfn h ALA 140 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2hfn h ALA 140 Cb 0.42 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2hfn h ALA 140 CO 0.03 0.04 -0.43 1.63 0.00 0.00 0.00 179.25 180.53 2hfn n LYS 141 N -3.70 0.24 0.04 0.00 5.02 -0.65 -4.42 118.16 114.68 2hfn n LYS 141 Ca -0.03 0.11 -0.20 0.00 -2.02 0.00 0.00 58.31 56.17 2hfn n LYS 141 Cb 0.13 -1.69 -0.10 0.00 -0.02 0.00 0.00 35.03 33.34 2hfn n LYS 141 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 2hfn h ILE 142 N 0.00 1.30 -0.03 -0.18 3.07 -1.55 -3.52 117.51 116.59 2hfn h ILE 142 Ca 0.00 -2.22 0.00 0.00 1.55 0.00 0.00 64.86 64.19 2hfn h ILE 142 Cb 0.71 2.40 0.00 0.00 -0.27 0.00 0.00 36.82 39.66 2hfn h ILE 142 CO 0.00 0.68 0.00 -1.22 -1.05 0.00 0.00 178.15 176.56