#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dxf h VAL 5 N 0.00 0.89 -3.60 5.18 2.07 -1.98 -3.46 116.25 115.35 1dxf h VAL 5 Ca 0.00 -2.69 -0.67 0.00 0.82 0.00 0.00 66.70 64.16 1dxf h VAL 5 Cb 0.00 2.49 -0.16 0.00 -1.52 0.00 0.00 31.29 32.10 1dxf h VAL 5 CO 0.00 0.62 -0.75 -0.36 0.02 0.00 0.00 177.57 177.10 1dxf s PHE 6 N -2.60 2.72 0.46 1.57 0.08 -1.26 -4.13 117.98 114.82 1dxf s PHE 6 Ca -0.08 -0.16 -0.20 0.00 0.12 0.00 0.00 56.93 56.61 1dxf s PHE 6 Cb 0.08 -1.44 -0.10 0.00 -0.57 0.00 0.00 43.02 40.99 1dxf s PHE 6 CO 0.82 0.41 0.97 -1.25 -0.10 0.00 0.00 175.22 176.07 1dxf s PRO 7 N -2.12 4.08 -0.59 0.24 0.04 -1.26 -5.06 135.00 130.34 1dxf s PRO 7 Ca 0.20 1.12 -0.26 0.00 0.04 0.00 0.00 61.00 62.10 1dxf s PRO 7 Cb -0.11 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 1dxf s PRO 7 CO 0.13 -0.16 2.14 1.21 0.04 0.00 0.00 177.00 180.36 1dxf s ASN 8 N -2.36 4.81 0.33 6.66 3.84 -1.26 -4.82 114.94 122.14 1dxf s ASN 8 Ca 0.62 0.59 0.02 0.00 0.21 0.00 0.00 52.86 54.30 1dxf s ASN 8 Cb -0.10 -2.52 0.59 0.00 -0.55 0.00 0.00 41.25 38.67 1dxf s ASN 8 CO 0.18 -2.72 1.93 0.11 -2.79 0.00 0.00 177.10 173.82 1dxf h LYS 9 N 16.67 0.71 -0.31 0.43 1.57 -1.96 -2.48 116.57 131.19 1dxf h LYS 9 Ca -0.21 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.45 1dxf h LYS 9 Cb 1.19 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1dxf h LYS 9 CO 1.18 0.58 0.14 0.35 -0.57 0.00 0.00 179.45 181.13 1dxf h PHE 10 N 0.71 0.47 -0.27 -1.35 3.57 -1.97 -0.47 116.94 117.63 1dxf h PHE 10 Ca 0.17 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.67 1dxf h PHE 10 Cb 0.13 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1dxf h PHE 10 CO 0.01 0.43 0.18 -0.22 -2.23 0.00 0.00 178.31 176.48 1dxf h LYS 11 N 0.36 0.24 -0.05 1.11 3.64 -1.86 -1.86 116.57 118.16 1dxf h LYS 11 Ca 0.11 -0.01 -0.25 0.00 -1.27 0.00 0.00 60.65 59.22 1dxf h LYS 11 Cb 0.15 -0.05 0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1dxf h LYS 11 CO -0.01 0.16 -0.94 0.00 -2.27 0.00 0.00 179.45 176.39 1dxf h ALA 12 N 1.85 0.18 -0.82 5.00 0.00 -0.96 -2.68 119.26 121.82 1dxf h ALA 12 Ca 0.11 -0.66 0.01 0.00 0.00 0.00 0.00 54.91 54.37 1dxf h ALA 12 Cb 0.14 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1dxf h ALA 12 CO -0.02 0.66 0.53 0.00 0.00 0.00 0.00 179.25 180.42 1dxf h ALA 13 N 0.44 1.04 -0.74 0.00 0.00 -0.33 -1.23 119.26 118.44 1dxf h ALA 13 Ca -0.10 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1dxf h ALA 13 Cb 1.59 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 1dxf h ALA 13 CO 0.19 0.47 0.38 -0.07 0.00 0.00 0.00 179.25 180.21 1dxf h LEU 14 N 1.12 0.96 -0.45 0.00 3.38 -1.39 -0.43 115.31 118.49 1dxf h LEU 14 Ca 0.30 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 1dxf h LEU 14 Cb -0.11 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.38 1dxf h LEU 14 CO -0.06 0.80 0.25 0.00 0.09 0.00 0.00 178.44 179.52 1dxf h ALA 15 N 1.19 0.58 0.00 1.53 0.00 -1.02 0.10 119.26 121.63 1dxf h ALA 15 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1dxf h ALA 15 Cb 0.09 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1dxf h ALA 15 CO -0.04 0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1dxf n ALA 16 N -2.27 2.48 -4.43 0.00 0.00 -0.53 -4.86 120.51 110.91 1dxf n ALA 16 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.07 1dxf n ALA 16 Cb 0.08 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.45 1dxf n ALA 16 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1dxf n LYS 17 N -0.22 -1.05 -2.12 0.00 5.02 0.02 -4.93 118.16 114.88 1dxf n LYS 17 Ca 0.00 0.15 -0.31 0.00 -2.02 0.00 0.00 58.31 56.13 1dxf n LYS 17 Cb 0.14 -4.35 -0.01 0.00 -0.02 0.00 0.00 35.03 30.79 1dxf n LYS 17 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1dxf s GLN 18 N -7.25 3.75 -0.21 1.97 -0.21 -0.22 -4.95 119.66 112.53 1dxf s GLN 18 Ca 0.52 0.82 -0.29 0.00 0.02 0.00 0.00 55.36 56.42 1dxf s GLN 18 Cb -0.30 -2.11 -0.01 0.00 1.00 0.00 0.00 33.01 31.59 1dxf s GLN 18 CO 1.01 -0.43 1.25 0.08 -2.12 0.00 0.00 175.29 175.08 1dxf s VAL 19 N -2.93 4.29 -0.31 1.09 1.01 -1.26 -4.64 120.40 117.65 1dxf s VAL 19 Ca 0.56 1.53 -0.05 0.00 0.00 0.00 0.00 61.98 64.02 1dxf s VAL 19 Cb -0.11 -4.08 0.03 0.00 0.00 0.00 0.00 36.38 32.23 1dxf s VAL 19 CO 0.44 -0.23 0.06 -1.10 0.00 0.00 0.00 175.10 174.27 1dxf s GLN 20 N 3.64 2.75 -0.38 2.72 -1.52 -0.17 -5.00 119.66 121.71 1dxf s GLN 20 Ca 0.54 -1.08 -0.20 0.00 -1.95 0.00 0.00 55.36 52.67 1dxf s GLN 20 Cb -0.20 -3.34 0.01 0.00 -0.22 0.00 0.00 33.01 29.26 1dxf s GLN 20 CO 0.16 -0.57 0.61 0.42 -0.25 0.00 0.00 175.29 175.66 1dxf s ILE 21 N 1.40 4.90 0.42 1.08 -1.09 -1.26 -1.41 121.20 125.24 1dxf s ILE 21 Ca -0.01 0.41 0.06 0.00 -2.23 0.00 0.00 60.65 58.89 1dxf s ILE 21 Cb -0.19 -4.08 -0.07 0.00 -1.58 0.00 0.00 42.46 36.54 1dxf s ILE 21 CO 0.01 -0.36 0.05 -0.83 -1.23 0.00 0.00 174.94 172.58 1dxf s GLY 22 N 1.84 2.52 0.02 6.18 0.00 -0.16 0.77 107.32 118.49 1dxf s GLY 22 Ca 0.23 -2.06 0.01 0.00 0.00 0.00 0.00 44.72 42.90 1dxf s GLY 22 CO 0.16 -2.07 -0.05 0.00 0.00 0.00 0.00 173.10 171.14 1dxf s TRP 24 N -0.76 3.41 -0.09 0.00 -0.11 0.11 -1.28 118.94 120.22 1dxf s TRP 24 Ca -0.05 1.18 0.01 0.00 1.22 0.00 0.00 56.10 58.46 1dxf s TRP 24 Cb -0.06 -2.50 0.02 0.00 -1.50 0.00 0.00 33.47 29.43 1dxf s TRP 24 CO -0.00 0.15 -0.11 0.45 -4.62 0.00 0.00 176.95 172.82 1dxf s SER 25 N -2.22 1.99 0.00 5.86 0.15 0.01 0.23 113.70 119.73 1dxf s SER 25 Ca 0.52 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.85 1dxf s SER 25 Cb -0.11 -0.87 0.00 0.00 -1.71 0.00 0.00 66.02 63.33 1dxf s SER 25 CO 0.18 -0.02 0.05 0.00 1.20 0.00 0.00 173.24 174.65 1dxf n ALA 26 N 4.25 0.54 0.24 5.45 0.00 -1.26 -2.20 120.51 127.52 1dxf n ALA 26 Ca -0.19 -0.05 0.03 0.00 0.00 0.00 0.00 53.44 53.24 1dxf n ALA 26 Cb 0.51 0.00 0.14 0.00 0.00 0.00 0.00 19.45 20.11 1dxf n ALA 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1dxf n LEU 27 N -0.15 0.00 -4.19 0.00 4.77 -1.26 -4.44 117.00 111.72 1dxf n LEU 27 Ca 0.00 0.47 -0.32 0.00 -0.03 0.00 0.00 56.01 56.13 1dxf n LEU 27 Cb 0.07 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.64 1dxf n LEU 27 CO 0.00 -0.37 -0.22 -1.20 -1.33 0.00 0.00 177.39 174.28 1dxf n SER 28 N -1.47 -1.14 -3.62 -1.43 7.64 -1.26 -4.97 113.62 107.36 1dxf n SER 28 Ca 0.02 -1.10 -0.15 0.00 1.01 0.00 0.00 58.87 58.65 1dxf n SER 28 Cb 0.07 -2.47 -0.07 0.00 -1.01 0.00 0.00 64.21 60.73 1dxf n SER 28 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1dxf s ASN 29 N -3.91 -0.54 0.46 6.43 4.22 -1.26 -4.97 114.94 115.37 1dxf s ASN 29 Ca 0.33 0.74 0.14 0.00 -2.14 0.00 0.00 52.86 51.92 1dxf s ASN 29 Cb -0.18 0.71 1.06 0.00 1.28 0.00 0.00 41.25 44.12 1dxf s ASN 29 CO 0.94 -0.44 2.04 1.55 -2.04 0.00 0.00 177.10 179.15 1dxf h PRO 30 N 3.93 0.05 0.51 3.55 0.13 -1.87 -2.52 132.00 135.77 1dxf h PRO 30 Ca -0.28 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 64.82 1dxf h PRO 30 Cb 1.16 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1dxf h PRO 30 CO 0.31 0.15 -0.24 0.82 -0.23 0.00 0.00 178.00 178.80 1dxf h ILE 31 N 0.05 0.38 -0.03 -3.56 1.08 -1.97 -1.63 117.51 111.83 1dxf h ILE 31 Ca 0.01 -0.40 -0.14 0.00 -0.39 0.00 0.00 64.86 63.94 1dxf h ILE 31 Cb 0.21 0.52 -0.02 0.00 -3.07 0.00 0.00 36.82 34.46 1dxf h ILE 31 CO 0.01 0.05 -0.64 0.77 -0.69 0.00 0.00 178.15 177.65 1dxf h SER 32 N -0.96 0.12 0.43 1.72 4.64 -1.97 -3.01 113.55 114.52 1dxf h SER 32 Ca -0.07 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.10 1dxf h SER 32 Cb 0.61 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.65 1dxf h SER 32 CO 0.11 0.73 -0.37 0.74 -0.87 0.00 0.00 176.83 177.17 1dxf h THR 33 N 0.08 1.20 -0.28 2.95 2.02 -1.47 -0.36 112.91 117.04 1dxf h THR 33 Ca -0.01 -1.31 -0.12 0.00 0.77 0.00 0.00 66.41 65.74 1dxf h THR 33 Cb 1.15 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 1dxf h THR 33 CO 0.09 0.37 -0.32 -0.08 0.37 0.00 0.00 175.52 175.94 1dxf h GLU 34 N 0.00 0.60 -0.37 6.66 4.81 -1.15 -2.02 114.58 123.10 1dxf h GLU 34 Ca -0.00 -0.27 -0.15 0.00 -0.13 0.00 0.00 59.36 58.81 1dxf h GLU 34 Cb 0.69 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1dxf h GLU 34 CO 0.05 0.84 -0.36 0.28 -0.73 0.00 0.00 179.01 179.09 1dxf h VAL 35 N 0.51 1.28 -0.69 0.32 2.07 -1.41 -2.88 116.25 115.44 1dxf h VAL 35 Ca 0.06 -1.53 0.02 0.00 0.82 0.00 0.00 66.70 66.07 1dxf h VAL 35 Cb 0.81 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 1dxf h VAL 35 CO 0.07 0.51 0.46 0.25 0.02 0.00 0.00 177.57 178.87 1dxf h LEU 36 N 0.71 0.75 -0.40 2.57 5.85 -0.80 -1.67 115.31 122.32 1dxf h LEU 36 Ca 0.06 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1dxf h LEU 36 Cb 0.94 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1dxf h LEU 36 CO 0.09 0.53 0.00 0.61 -0.34 0.00 0.00 178.44 179.33 1dxf n GLY 37 N -1.44 -1.03 0.15 3.75 0.00 -0.79 -2.20 105.19 103.64 1dxf n GLY 37 Ca 0.08 0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.21 1dxf n GLY 37 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dxf h LEU 38 N 0.00 0.00 -1.43 0.99 3.38 -1.36 -3.37 115.31 113.52 1dxf h LEU 38 Ca 0.00 0.00 0.19 0.00 0.09 0.00 0.00 57.88 58.16 1dxf h LEU 38 Cb 0.24 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 1dxf h LEU 38 CO 0.00 0.22 0.59 0.00 0.09 0.00 0.00 178.44 179.34 1dxf h ALA 39 N 1.78 2.09 0.00 1.53 0.00 -1.52 -3.46 119.26 119.67 1dxf h ALA 39 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1dxf h ALA 39 Cb 1.20 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1dxf h ALA 39 CO 0.02 -0.37 0.00 0.41 0.00 0.00 0.00 179.25 179.32 1dxf n GLY 40 N -1.49 0.93 3.71 0.00 0.00 -1.26 -5.09 105.19 102.00 1dxf n GLY 40 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1dxf n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dxf s PHE 41 N -2.00 1.90 -0.06 1.61 0.08 -1.26 -4.88 117.98 113.37 1dxf s PHE 41 Ca 0.00 1.61 0.14 0.00 0.12 0.00 0.00 56.93 58.80 1dxf s PHE 41 Cb 0.00 -3.54 0.09 0.00 -0.57 0.00 0.00 43.02 39.00 1dxf s PHE 41 CO 0.00 -2.85 1.45 -0.44 -0.10 0.00 0.00 175.22 173.28 1dxf h ASP 42 N -0.45 0.00 -4.31 1.36 3.32 0.01 -3.22 116.42 113.12 1dxf h ASP 42 Ca -0.48 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.49 1dxf h ASP 42 Cb 1.31 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.64 1dxf h ASP 42 CO 0.48 0.58 -0.03 -1.66 -1.72 0.00 0.00 179.24 176.89 1dxf s TRP 43 N -2.99 -0.57 -0.11 4.55 1.48 -1.20 -1.07 118.94 119.02 1dxf s TRP 43 Ca 0.03 1.26 0.02 0.00 -1.06 0.00 0.00 56.10 56.35 1dxf s TRP 43 Cb 0.08 0.24 0.01 0.00 -1.16 0.00 0.00 33.47 32.64 1dxf s TRP 43 CO 0.75 -0.38 -0.17 -0.51 -4.06 0.00 0.00 176.95 172.58 1dxf s LEU 44 N -0.25 1.82 -0.48 -4.66 1.43 -0.60 -1.42 118.68 114.52 1dxf s LEU 44 Ca -0.04 -0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 52.38 1dxf s LEU 44 Cb -0.03 -1.17 0.04 0.00 0.03 0.00 0.00 46.19 45.05 1dxf s LEU 44 CO 0.03 0.04 0.68 -0.69 0.23 0.00 0.00 176.35 176.64 1dxf s VAL 45 N 0.91 4.78 -0.82 -1.59 1.01 -0.41 -1.13 120.40 123.14 1dxf s VAL 45 Ca -0.08 -0.11 -0.25 0.00 0.00 0.00 0.00 61.98 61.55 1dxf s VAL 45 Cb -0.15 -4.30 0.05 0.00 0.00 0.00 0.00 36.38 31.98 1dxf s VAL 45 CO -0.01 -0.76 1.27 -0.76 0.00 0.00 0.00 175.10 174.83 1dxf s LEU 46 N 2.92 3.60 -0.21 3.92 1.43 0.24 -0.80 118.68 129.78 1dxf s LEU 46 Ca 0.21 -0.95 -0.29 0.00 -1.03 0.00 0.00 54.13 52.07 1dxf s LEU 46 Cb -0.16 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 1dxf s LEU 46 CO 0.16 -1.62 1.93 -0.62 0.23 0.00 0.00 176.35 176.42 1dxf s ASP 47 N 4.08 5.95 0.00 2.29 2.15 -0.93 -2.41 116.67 127.79 1dxf s ASP 47 Ca 0.36 1.80 0.20 0.00 0.43 0.00 0.00 52.55 55.34 1dxf s ASP 47 Cb -0.07 -2.52 0.39 0.00 -0.30 0.00 0.00 42.92 40.42 1dxf s ASP 47 CO 0.05 -1.58 1.33 0.61 -0.17 0.00 0.00 175.17 175.41 1dxf n GLY 48 N 5.21 1.77 0.38 2.66 0.00 0.24 -3.95 105.19 111.50 1dxf n GLY 48 Ca 0.24 -0.64 -0.16 0.00 0.00 0.00 0.00 46.02 45.46 1dxf n GLY 48 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1dxf n GLU 49 N 1.25 0.36 -0.09 1.61 2.13 -1.15 -3.74 120.64 121.00 1dxf n GLU 49 Ca 0.17 0.14 0.06 0.00 0.66 0.00 0.00 57.16 58.18 1dxf n GLU 49 Cb 0.54 -1.15 0.10 0.00 0.27 0.00 0.00 31.44 31.21 1dxf n GLU 49 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1dxf n HIS 50 N -3.52 0.25 -4.91 4.31 8.25 -1.26 -4.95 115.22 113.38 1dxf n HIS 50 Ca -0.31 -0.26 -0.28 0.00 -0.26 0.00 0.00 57.72 56.61 1dxf n HIS 50 Cb 0.75 -0.01 -0.15 0.00 1.12 0.00 0.00 29.99 31.69 1dxf n HIS 50 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1dxf s ALA 51 N -0.98 1.86 -0.21 -1.41 0.00 -1.25 -5.03 121.76 114.74 1dxf s ALA 51 Ca 0.19 -1.03 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 1dxf s ALA 51 Cb 0.11 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1dxf s ALA 51 CO 0.15 0.44 1.37 -0.35 0.00 0.00 0.00 175.76 177.37 1dxf n PRO 52 N 2.20 0.70 -4.23 0.00 -0.04 -1.26 -4.56 135.00 127.81 1dxf n PRO 52 Ca -0.16 -0.59 -0.32 0.00 -0.04 0.00 0.00 63.50 62.38 1dxf n PRO 52 Cb 0.53 -1.92 -0.08 0.00 -0.04 0.00 0.00 33.50 31.98 1dxf n PRO 52 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1dxf s ASN 53 N 3.59 5.25 0.28 3.54 0.01 -1.26 -4.86 114.94 121.48 1dxf s ASN 53 Ca 0.16 0.02 -0.02 0.00 -0.71 0.00 0.00 52.86 52.31 1dxf s ASN 53 Cb 0.06 -1.40 0.01 0.00 0.41 0.00 0.00 41.25 40.33 1dxf s ASN 53 CO -0.01 0.27 0.41 -0.90 -1.51 0.00 0.00 177.10 175.36 1dxf n ASP 54 N 1.28 -1.14 -0.20 -1.22 5.68 -1.26 -4.79 116.55 114.91 1dxf n ASP 54 Ca -0.14 -2.46 0.01 0.00 -0.50 0.00 0.00 54.79 51.70 1dxf n ASP 54 Cb 0.53 2.08 0.11 0.00 -1.14 0.00 0.00 41.12 42.70 1dxf n ASP 54 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 1dxf h ILE 55 N 1.79 0.68 -0.20 2.12 1.08 -1.99 0.36 117.51 121.35 1dxf h ILE 55 Ca -0.22 -0.11 0.06 0.00 -0.39 0.00 0.00 64.86 64.20 1dxf h ILE 55 Cb 0.93 0.34 -0.01 0.00 -3.07 0.00 0.00 36.82 35.01 1dxf h ILE 55 CO 0.29 0.06 0.16 0.77 -0.69 0.00 0.00 178.15 178.74 1dxf h SER 56 N 0.32 0.00 0.08 1.72 4.64 -2.01 -2.55 113.55 115.75 1dxf h SER 56 Ca 0.32 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 61.30 1dxf h SER 56 Cb 0.45 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.48 1dxf h SER 56 CO -0.37 0.00 -2.26 0.35 -0.87 0.00 0.00 176.83 173.68 1dxf n THR 57 N -4.27 1.35 -0.12 2.95 -2.24 -0.41 -4.47 114.28 107.07 1dxf n THR 57 Ca 0.02 -0.83 -0.07 0.00 -2.27 0.00 0.00 64.05 60.89 1dxf n THR 57 Cb 0.29 -0.52 0.01 0.00 -2.10 0.00 0.00 70.33 68.01 1dxf n THR 57 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1dxf h PHE 58 N 0.00 0.38 -0.18 4.78 0.04 0.05 -2.89 116.94 119.12 1dxf h PHE 58 Ca -0.48 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1dxf h PHE 58 Cb 2.15 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 40.17 1dxf h PHE 58 CO 0.00 0.21 0.12 0.82 -0.60 0.00 0.00 178.31 178.86 1dxf h ILE 59 N 0.42 1.07 -0.83 -0.55 2.04 -1.73 0.21 117.51 118.13 1dxf h ILE 59 Ca 0.16 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.89 1dxf h ILE 59 Cb 0.04 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 36.90 1dxf h ILE 59 CO -0.09 0.06 0.54 -0.65 0.00 0.00 0.00 178.15 178.01 1dxf h PRO 60 N 0.23 1.03 -0.34 2.37 0.11 -1.77 -2.34 132.00 131.29 1dxf h PRO 60 Ca 0.07 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.02 1dxf h PRO 60 Cb 0.00 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.86 1dxf h PRO 60 CO -0.01 0.68 -0.20 1.96 -0.21 0.00 0.00 178.00 180.22 1dxf h GLN 61 N 1.06 0.63 -1.45 1.05 4.20 -1.28 0.28 115.11 119.60 1dxf h GLN 61 Ca 0.32 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1dxf h GLN 61 Cb -0.03 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1dxf h GLN 61 CO -0.10 0.79 0.00 1.28 -0.67 0.00 0.00 178.83 180.13 1dxf n LEU 62 N -4.14 0.90 0.00 1.46 4.77 0.04 -1.06 117.00 118.98 1dxf n LEU 62 Ca 0.00 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 1dxf n LEU 62 Cb 0.39 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1dxf n LEU 62 CO 0.43 0.15 0.00 0.00 -1.33 0.00 0.00 177.39 176.64 1dxf n ALA 64 N 0.75 0.00 1.23 -1.18 0.00 0.09 -2.67 120.51 118.73 1dxf n ALA 64 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1dxf n ALA 64 Cb 0.15 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.25 1dxf n ALA 64 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1dxf n LEU 65 N 0.00 0.10 -4.72 0.00 4.77 -0.22 -4.65 117.00 112.29 1dxf n LEU 65 Ca 0.00 0.31 -0.43 0.00 -0.03 0.00 0.00 56.01 55.86 1dxf n LEU 65 Cb 0.00 -0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 40.72 1dxf n LEU 65 CO 0.00 0.02 1.13 0.29 -1.33 0.00 0.00 177.39 177.51 1dxf n LYS 66 N -1.34 2.44 -0.96 3.23 5.02 -1.09 -0.95 118.16 124.51 1dxf n LYS 66 Ca 0.11 0.87 0.00 0.00 -2.02 0.00 0.00 58.31 57.26 1dxf n LYS 66 Cb 0.29 -2.59 0.00 0.00 -0.02 0.00 0.00 35.03 32.71 1dxf n LYS 66 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dxf n GLY 67 N 1.94 0.51 3.81 0.72 0.00 -1.26 -5.03 105.19 105.88 1dxf n GLY 67 Ca 0.09 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1dxf n GLY 67 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1dxf s SER 68 N -2.07 5.81 0.26 1.61 0.15 -0.12 -5.00 113.70 114.34 1dxf s SER 68 Ca 0.00 0.17 0.06 0.00 0.70 0.00 0.00 55.95 56.88 1dxf s SER 68 Cb 0.00 -1.69 0.34 0.00 -1.71 0.00 0.00 66.02 62.96 1dxf s SER 68 CO 0.00 0.26 1.62 0.00 1.20 0.00 0.00 173.24 176.32 1dxf h ALA 69 N 3.92 0.97 -2.45 5.45 0.00 -1.87 -3.44 119.26 121.83 1dxf h ALA 69 Ca -0.49 -0.49 -0.56 0.00 0.00 0.00 0.00 54.91 53.37 1dxf h ALA 69 Cb 1.18 -0.09 0.07 0.00 0.00 0.00 0.00 17.79 18.96 1dxf h ALA 69 CO 0.64 0.67 0.77 0.43 0.00 0.00 0.00 179.25 181.76 1dxf n SER 70 N -3.93 3.24 -4.67 0.00 7.64 -1.22 -4.88 113.62 109.79 1dxf n SER 70 Ca -0.02 1.12 -0.41 0.00 1.01 0.00 0.00 58.87 60.57 1dxf n SER 70 Cb 0.56 -1.48 -0.04 0.00 -1.01 0.00 0.00 64.21 62.24 1dxf n SER 70 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1dxf s ALA 71 N 0.33 3.49 -0.07 -0.43 0.00 -0.24 -4.84 121.76 120.00 1dxf s ALA 71 Ca 0.71 0.08 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 1dxf s ALA 71 Cb -0.60 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.26 1dxf s ALA 71 CO 0.44 -0.61 1.13 -2.14 0.00 0.00 0.00 175.76 174.59 1dxf s PRO 72 N 2.04 4.38 -0.08 0.00 0.02 -1.26 -1.56 135.00 138.54 1dxf s PRO 72 Ca 0.39 1.58 0.04 0.00 0.02 0.00 0.00 61.00 63.02 1dxf s PRO 72 Cb -0.17 -3.54 0.00 0.00 0.02 0.00 0.00 34.50 30.81 1dxf s PRO 72 CO 0.13 -0.39 -0.20 0.08 -0.33 0.00 0.00 177.00 176.30 1dxf s VAL 73 N 2.10 1.70 -0.14 3.83 1.01 -0.29 -4.12 120.40 124.48 1dxf s VAL 73 Ca 0.53 -0.81 -0.07 0.00 0.00 0.00 0.00 61.98 61.63 1dxf s VAL 73 Cb -0.23 -1.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 1dxf s VAL 73 CO 0.21 0.48 0.08 0.54 0.00 0.00 0.00 175.10 176.41 1dxf s VAL 74 N 0.40 5.02 -0.55 2.92 0.11 -0.87 0.82 120.40 128.24 1dxf s VAL 74 Ca -0.16 0.03 -0.12 0.00 -2.93 0.00 0.00 61.98 58.81 1dxf s VAL 74 Cb -0.17 -3.21 0.14 0.00 -1.53 0.00 0.00 36.38 31.61 1dxf s VAL 74 CO 0.06 0.54 0.47 -0.60 -3.33 0.00 0.00 175.10 172.24 1dxf s ARG 75 N -0.34 2.82 0.69 1.54 3.00 -1.01 -0.98 118.95 124.66 1dxf s ARG 75 Ca 0.10 -1.89 -0.17 0.00 -1.00 0.00 0.00 55.73 52.77 1dxf s ARG 75 Cb -0.12 -4.12 -0.02 0.00 0.00 0.00 0.00 34.95 30.70 1dxf s ARG 75 CO 0.01 -1.26 0.87 1.33 0.00 0.00 0.00 175.30 176.26 1dxf n VAL 76 N 4.81 2.87 0.28 7.11 0.24 -1.03 -0.59 118.33 132.02 1dxf n VAL 76 Ca -0.06 -0.41 0.15 0.00 -2.04 0.00 0.00 64.34 61.98 1dxf n VAL 76 Cb 0.41 -1.03 0.77 0.00 -1.47 0.00 0.00 33.84 32.52 1dxf n VAL 76 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1dxf h PRO 77 N -0.08 0.00 -1.74 7.34 0.13 -1.92 -3.39 132.00 132.34 1dxf h PRO 77 Ca -0.47 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 64.92 1dxf h PRO 77 Cb 1.35 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.35 1dxf h PRO 77 CO 0.47 0.08 0.71 -0.08 -0.23 0.00 0.00 178.00 178.95 1dxf s THR 78 N -3.96 0.00 -0.95 1.56 -1.32 -1.26 -4.84 115.64 104.87 1dxf s THR 78 Ca -0.02 -0.29 -0.17 0.00 -1.21 0.00 0.00 61.69 60.01 1dxf s THR 78 Cb 0.11 -1.77 0.16 0.00 -1.51 0.00 0.00 72.50 69.49 1dxf s THR 78 CO 0.55 0.00 1.10 0.21 -2.21 0.00 0.00 174.62 174.27 1dxf s ASN 79 N -2.81 6.73 -0.09 8.08 2.47 -1.26 -4.86 114.94 123.19 1dxf s ASN 79 Ca 0.12 -2.33 -0.08 0.00 0.42 0.00 0.00 52.86 50.99 1dxf s ASN 79 Cb 0.02 -2.36 0.03 0.00 -1.45 0.00 0.00 41.25 37.49 1dxf s ASN 79 CO -0.03 -0.91 0.25 -1.83 -3.72 0.00 0.00 177.10 170.86 1dxf s GLU 80 N 1.96 0.27 0.31 0.43 4.04 -1.26 -4.99 118.70 119.46 1dxf s GLU 80 Ca 0.31 0.37 0.05 0.00 0.04 0.00 0.00 54.97 55.75 1dxf s GLU 80 Cb -0.06 0.09 0.71 0.00 0.02 0.00 0.00 34.13 34.90 1dxf s GLU 80 CO -0.08 -0.06 1.80 -1.00 -1.84 0.00 0.00 175.26 174.08 1dxf h PRO 81 N 6.01 0.79 0.34 -4.83 0.13 -1.93 -3.18 132.00 129.34 1dxf h PRO 81 Ca -0.28 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 1dxf h PRO 81 Cb 1.19 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.13 1dxf h PRO 81 CO 0.36 0.52 -0.22 0.28 -0.23 0.00 0.00 178.00 178.71 1dxf h VAL 82 N 0.81 0.55 -0.43 1.56 2.07 -1.98 -0.69 116.25 118.14 1dxf h VAL 82 Ca 0.54 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.99 1dxf h VAL 82 Cb 0.79 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 1dxf h VAL 82 CO -0.33 0.00 -0.03 -0.29 0.02 0.00 0.00 177.57 176.94 1dxf h ILE 83 N -0.54 1.24 -0.63 4.57 6.09 -1.95 -1.68 117.51 124.60 1dxf h ILE 83 Ca -0.04 -1.00 -0.01 0.00 -1.37 0.00 0.00 64.86 62.44 1dxf h ILE 83 Cb 0.45 0.95 -0.03 0.00 0.47 0.00 0.00 36.82 38.66 1dxf h ILE 83 CO 0.03 0.35 0.34 0.40 -3.07 0.00 0.00 178.15 176.20 1dxf h ILE 84 N 0.66 1.21 0.23 2.19 2.04 -1.50 -0.05 117.51 122.28 1dxf h ILE 84 Ca 0.13 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.46 1dxf h ILE 84 Cb 0.46 0.40 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1dxf h ILE 84 CO 0.02 0.23 -0.19 0.50 0.00 0.00 0.00 178.15 178.71 1dxf h LYS 85 N 0.86 -0.41 -0.65 2.37 3.64 -0.59 -0.27 116.57 121.51 1dxf h LYS 85 Ca 0.22 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.64 1dxf h LYS 85 Cb 0.06 0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.94 1dxf h LYS 85 CO -0.03 -0.27 0.43 0.00 -2.27 0.00 0.00 179.45 177.31 1dxf h ARG 86 N -0.43 0.86 0.00 1.90 3.08 -1.09 -2.22 114.38 116.48 1dxf h ARG 86 Ca -0.01 -0.05 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 1dxf h ARG 86 Cb 0.38 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1dxf h ARG 86 CO -0.02 0.57 -0.50 -0.07 -1.07 0.00 0.00 179.97 178.88 1dxf h LEU 87 N 0.88 0.00 -0.20 3.04 3.38 -0.61 -2.89 115.31 118.91 1dxf h LEU 87 Ca 0.24 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.00 1dxf h LEU 87 Cb -0.10 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.66 1dxf h LEU 87 CO -0.05 0.50 -0.73 -0.07 0.09 0.00 0.00 178.44 178.18 1dxf h LEU 88 N 0.00 0.93 -0.79 1.67 3.38 -0.46 -2.87 115.31 117.17 1dxf h LEU 88 Ca -0.01 -0.59 -0.13 0.00 0.09 0.00 0.00 57.88 57.25 1dxf h LEU 88 Cb 1.07 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 1dxf h LEU 88 CO 0.07 1.39 -0.47 0.44 0.09 0.00 0.00 178.44 179.96 1dxf h ASP 89 N 0.56 0.35 0.86 -0.43 3.32 -1.43 -3.06 116.42 116.59 1dxf h ASP 89 Ca -0.04 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.85 1dxf h ASP 89 Cb 1.36 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1dxf h ASP 89 CO 0.15 0.77 0.00 2.30 -1.72 0.00 0.00 179.24 180.74 1dxf n ILE 90 N -3.98 0.56 0.00 0.35 -5.35 -1.10 -1.74 119.36 108.09 1dxf n ILE 90 Ca -0.02 0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 1dxf n ILE 90 Cb 0.53 -0.78 0.00 0.00 -1.74 0.00 0.00 39.64 37.64 1dxf n ILE 90 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dxf n GLY 91 N 0.73 1.36 3.73 3.28 0.00 -1.16 -4.58 105.19 108.55 1dxf n GLY 91 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 1dxf n GLY 91 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1dxf s PHE 92 N -1.36 3.43 -0.60 1.61 0.08 -1.09 -4.95 117.98 115.11 1dxf s PHE 92 Ca 0.00 0.44 0.07 0.00 0.12 0.00 0.00 56.93 57.55 1dxf s PHE 92 Cb 0.00 -2.24 -0.00 0.00 -0.57 0.00 0.00 43.02 40.20 1dxf s PHE 92 CO 0.00 0.26 0.50 0.66 -0.10 0.00 0.00 175.22 176.54 1dxf n TYR 93 N 3.58 0.00 -4.38 0.36 4.01 -1.26 -4.56 117.16 114.90 1dxf n TYR 93 Ca -0.14 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.38 1dxf n TYR 93 Cb 0.52 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.39 1dxf n TYR 93 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1dxf s ASN 94 N -1.06 1.29 0.03 7.72 0.01 -1.26 -0.72 114.94 120.94 1dxf s ASN 94 Ca 0.05 -0.20 0.06 0.00 -0.71 0.00 0.00 52.86 52.07 1dxf s ASN 94 Cb 0.05 -0.50 -0.02 0.00 0.41 0.00 0.00 41.25 41.19 1dxf s ASN 94 CO 0.17 0.02 -0.19 -0.36 -1.51 0.00 0.00 177.10 175.23 1dxf s PHE 95 N 0.53 1.64 -0.24 2.20 0.40 0.90 -2.05 117.98 121.37 1dxf s PHE 95 Ca -0.09 -0.35 -0.01 0.00 -0.60 0.00 0.00 56.93 55.88 1dxf s PHE 95 Cb -0.12 -1.00 0.02 0.00 0.51 0.00 0.00 43.02 42.44 1dxf s PHE 95 CO 0.01 0.05 -0.07 -1.17 0.70 0.00 0.00 175.22 174.74 1dxf s LEU 96 N -0.98 3.11 -0.43 -0.37 0.20 -0.16 0.17 118.68 120.22 1dxf s LEU 96 Ca 0.06 -0.85 -0.14 0.00 0.69 0.00 0.00 54.13 53.89 1dxf s LEU 96 Cb -0.08 -1.65 0.05 0.00 -0.43 0.00 0.00 46.19 44.08 1dxf s LEU 96 CO 0.01 -0.11 0.31 -0.63 -0.29 0.00 0.00 176.35 175.64 1dxf s ILE 97 N 1.32 5.00 0.62 6.68 -1.09 0.14 -2.45 121.20 131.42 1dxf s ILE 97 Ca 0.00 -0.94 -0.18 0.00 -2.23 0.00 0.00 60.65 57.31 1dxf s ILE 97 Cb -0.16 -3.90 -0.02 0.00 -1.58 0.00 0.00 42.46 36.80 1dxf s ILE 97 CO -0.05 -0.42 1.19 -2.16 -1.23 0.00 0.00 174.94 172.27 1dxf s PRO 98 N 1.61 2.82 -0.72 2.79 0.05 -1.26 -1.60 135.00 138.69 1dxf s PRO 98 Ca 0.04 1.76 -0.10 0.00 0.05 0.00 0.00 61.00 62.74 1dxf s PRO 98 Cb -0.22 -1.92 0.02 0.00 0.05 0.00 0.00 34.50 32.43 1dxf s PRO 98 CO 0.07 -1.31 0.62 1.19 0.05 0.00 0.00 177.00 177.63 1dxf n PHE 99 N -1.87 -2.28 -3.27 0.56 3.72 -1.25 -4.27 117.46 108.80 1dxf n PHE 99 Ca 0.13 0.94 -0.45 0.00 -0.05 0.00 0.00 57.45 58.01 1dxf n PHE 99 Cb 0.50 -2.60 -0.05 0.00 -0.94 0.00 0.00 39.48 36.38 1dxf n PHE 99 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1dxf s VAL 100 N -2.60 5.12 -0.08 -4.37 1.01 -0.45 -4.90 120.40 114.13 1dxf s VAL 100 Ca 0.10 -1.28 0.21 0.00 0.00 0.00 0.00 61.98 61.02 1dxf s VAL 100 Cb -0.01 -4.33 -0.28 0.00 0.00 0.00 0.00 36.38 31.75 1dxf s VAL 100 CO 0.88 -0.87 0.50 -0.62 0.00 0.00 0.00 175.10 174.99 1dxf n GLU 101 N 5.51 0.66 -4.21 2.72 1.02 -1.26 -4.54 120.64 120.53 1dxf n GLU 101 Ca -0.12 -0.12 -0.12 0.00 -0.02 0.00 0.00 57.16 56.77 1dxf n GLU 101 Cb 0.41 -1.56 -0.10 0.00 -0.02 0.00 0.00 31.44 30.17 1dxf n GLU 101 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1dxf s THR 102 N -3.34 0.65 0.43 2.62 -4.23 -1.26 -3.47 115.64 107.04 1dxf s THR 102 Ca -0.07 -1.96 0.20 0.00 -1.18 0.00 0.00 61.69 58.67 1dxf s THR 102 Cb 0.12 -1.97 0.22 0.00 1.34 0.00 0.00 72.50 72.21 1dxf s THR 102 CO 0.88 -0.61 2.02 0.50 -0.54 0.00 0.00 174.62 176.88 1dxf h LYS 103 N 2.79 0.00 0.72 3.99 3.64 -1.90 -1.30 116.57 124.52 1dxf h LYS 103 Ca -0.36 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 58.98 1dxf h LYS 103 Cb 1.19 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1dxf h LYS 103 CO 0.63 0.17 -0.34 0.93 -2.27 0.00 0.00 179.45 178.56 1dxf h GLU 104 N 0.00 -0.93 -0.73 1.90 4.39 -1.98 -1.96 114.58 115.28 1dxf h GLU 104 Ca -0.00 0.06 0.15 0.00 0.34 0.00 0.00 59.36 59.91 1dxf h GLU 104 Cb 0.34 0.21 -0.10 0.00 -0.10 0.00 0.00 28.75 29.10 1dxf h GLU 104 CO 0.02 -0.62 0.24 0.93 -1.16 0.00 0.00 179.01 178.42 1dxf h GLU 105 N -0.99 0.34 -0.89 2.33 5.08 -1.89 0.20 114.58 118.76 1dxf h GLU 105 Ca -0.10 -0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.36 1dxf h GLU 105 Cb 0.74 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.84 1dxf h GLU 105 CO 0.16 0.23 0.57 0.00 -1.00 0.00 0.00 179.01 178.97 1dxf h ALA 106 N 1.57 1.71 -0.10 3.43 0.00 -1.09 -0.90 119.26 123.88 1dxf h ALA 106 Ca 0.41 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 1dxf h ALA 106 Cb 0.65 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1dxf h ALA 106 CO -0.45 0.08 -0.34 0.93 0.00 0.00 0.00 179.25 179.47 1dxf h GLU 107 N 0.80 0.41 -0.10 0.00 5.08 -0.20 -2.71 114.58 117.87 1dxf h GLU 107 Ca 0.43 -0.30 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1dxf h GLU 107 Cb 0.53 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 1dxf h GLU 107 CO -0.19 0.93 -0.29 1.25 -1.00 0.00 0.00 179.01 179.71 1dxf h LEU 108 N -0.04 -0.89 -0.63 1.33 6.46 -0.57 0.31 115.31 121.29 1dxf h LEU 108 Ca -0.01 0.13 0.13 0.00 -0.12 0.00 0.00 57.88 58.01 1dxf h LEU 108 Cb 0.97 0.38 -0.10 0.00 -0.73 0.00 0.00 40.66 41.17 1dxf h LEU 108 CO 0.07 -0.34 0.03 0.00 -0.62 0.00 0.00 178.44 177.58 1dxf h ALA 109 N 0.47 0.65 -0.45 1.25 0.00 -1.22 0.16 119.26 120.12 1dxf h ALA 109 Ca 0.09 0.18 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 1dxf h ALA 109 Cb 0.51 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1dxf h ALA 109 CO -0.31 -0.38 0.03 0.28 0.00 0.00 0.00 179.25 178.87 1dxf h VAL 110 N 0.14 1.25 0.00 0.00 2.07 -1.00 -2.88 116.25 115.83 1dxf h VAL 110 Ca 0.33 -0.98 -0.03 0.00 0.82 0.00 0.00 66.70 66.84 1dxf h VAL 110 Cb 0.54 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.31 1dxf h VAL 110 CO -0.52 0.34 -0.14 0.00 0.02 0.00 0.00 177.57 177.28 1dxf h ALA 111 N 0.93 1.53 0.00 1.67 0.00 0.11 -2.12 119.26 121.38 1dxf h ALA 111 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1dxf h ALA 111 Cb 0.44 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1dxf h ALA 111 CO 0.02 0.17 0.00 0.77 0.00 0.00 0.00 179.25 180.21 1dxf h SER 112 N 0.00 0.00 -0.63 0.00 0.02 -0.53 0.52 113.55 112.93 1dxf h SER 112 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1dxf h SER 112 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1dxf h SER 112 CO 0.02 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.06 1dxf n THR 113 N -2.81 1.10 -4.40 -2.27 -2.24 -0.80 -4.32 114.28 98.54 1dxf n THR 113 Ca 0.03 -1.03 -0.21 0.00 -2.27 0.00 0.00 64.05 60.56 1dxf n THR 113 Cb 0.37 0.46 -0.16 0.00 -2.10 0.00 0.00 70.33 68.90 1dxf n THR 113 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1dxf s ARG 114 N -1.10 1.13 0.32 -0.78 0.52 -1.11 -4.76 118.95 113.16 1dxf s ARG 114 Ca 0.43 -0.29 -0.29 0.00 -0.52 0.00 0.00 55.73 55.06 1dxf s ARG 114 Cb 0.23 -1.02 -0.10 0.00 0.52 0.00 0.00 34.95 34.58 1dxf s ARG 114 CO 0.28 0.05 1.21 0.71 0.02 0.00 0.00 175.30 177.58 1dxf s TYR 115 N 0.46 3.25 0.89 -0.53 2.02 -1.26 0.00 117.35 122.18 1dxf s TYR 115 Ca -0.08 1.54 -0.12 0.00 -0.37 0.00 0.00 57.07 58.05 1dxf s TYR 115 Cb -0.12 -3.50 0.10 0.00 -0.40 0.00 0.00 41.96 38.05 1dxf s TYR 115 CO 0.01 -1.30 1.00 -0.35 -1.57 0.00 0.00 175.55 173.34 1dxf n PRO 116 N 0.87 -0.24 0.14 -1.71 -0.04 -1.11 -2.50 135.00 130.41 1dxf n PRO 116 Ca 0.00 -0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.59 1dxf n PRO 116 Cb 0.43 -2.28 0.40 0.00 -0.04 0.00 0.00 33.50 32.02 1dxf n PRO 116 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1dxf h PRO 117 N -1.53 0.00 -0.45 0.54 0.13 -2.01 -3.44 132.00 125.26 1dxf h PRO 117 Ca -0.44 0.00 0.13 0.00 -0.87 0.00 0.00 66.00 64.82 1dxf h PRO 117 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1dxf h PRO 117 CO 0.41 0.00 0.38 1.49 -0.23 0.00 0.00 178.00 180.05 1dxf h GLU 118 N 0.00 0.00 0.00 0.86 4.81 -1.85 -3.45 114.58 114.95 1dxf h GLU 118 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1dxf h GLU 118 Cb 0.69 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1dxf h GLU 118 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.69 1dxf n GLY 119 N -1.55 3.71 0.06 1.92 0.00 -1.04 -4.84 105.19 103.46 1dxf n GLY 119 Ca 0.08 -0.91 0.03 0.00 0.00 0.00 0.00 46.02 45.22 1dxf n GLY 119 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1dxf n ILE 120 N 0.00 1.26 -1.74 -0.61 -5.35 0.18 -2.75 119.36 110.35 1dxf n ILE 120 Ca 0.00 -1.35 -0.42 0.00 -0.27 0.00 0.00 62.75 60.71 1dxf n ILE 120 Cb 0.00 0.29 -0.01 0.00 -1.74 0.00 0.00 39.64 38.18 1dxf n ILE 120 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 1dxf n ARG 121 N -0.70 2.60 -2.58 6.28 0.63 0.10 -4.87 116.66 118.12 1dxf n ARG 121 Ca 0.05 0.92 -0.38 0.00 -0.92 0.00 0.00 57.85 57.52 1dxf n ARG 121 Cb 0.37 -2.68 -0.05 0.00 0.45 0.00 0.00 32.46 30.55 1dxf n ARG 121 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1dxf s GLY 122 N 0.37 2.93 -0.24 5.14 0.00 -1.26 -4.35 107.32 109.91 1dxf s GLY 122 Ca 0.63 0.74 -0.10 0.00 0.00 0.00 0.00 44.72 45.98 1dxf s GLY 122 CO 0.51 1.25 0.16 0.14 0.00 0.00 0.00 173.10 175.16 1dxf s VAL 123 N -1.40 5.32 0.11 1.40 1.01 -1.26 -5.03 120.40 120.54 1dxf s VAL 123 Ca 0.49 0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.73 1dxf s VAL 123 Cb -0.26 -3.48 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 1dxf s VAL 123 CO 0.33 0.35 -0.24 -0.55 0.00 0.00 0.00 175.10 174.98 1dxf s SER 124 N 1.07 2.91 0.07 3.32 0.15 -1.26 -5.07 113.70 114.88 1dxf s SER 124 Ca 0.07 -0.70 0.22 0.00 0.70 0.00 0.00 55.95 56.25 1dxf s SER 124 Cb -0.14 -0.19 -0.17 0.00 -1.71 0.00 0.00 66.02 63.82 1dxf s SER 124 CO 0.05 0.13 0.75 1.33 1.20 0.00 0.00 173.24 176.70 1dxf n VAL 125 N 1.10 0.26 -3.70 4.45 0.24 -1.26 -4.89 118.33 114.53 1dxf n VAL 125 Ca -0.19 -0.49 -0.16 0.00 -2.04 0.00 0.00 64.34 61.46 1dxf n VAL 125 Cb 0.53 -0.10 -0.16 0.00 -1.47 0.00 0.00 33.84 32.65 1dxf n VAL 125 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1dxf s SER 126 N -4.78 0.53 0.12 -1.34 0.15 -1.26 -4.41 113.70 102.72 1dxf s SER 126 Ca -0.04 0.27 -0.24 0.00 0.70 0.00 0.00 55.95 56.64 1dxf s SER 126 Cb 0.12 0.17 0.08 0.00 -1.71 0.00 0.00 66.02 64.69 1dxf s SER 126 CO 0.85 -0.21 1.12 -1.38 1.20 0.00 0.00 173.24 174.82 1dxf s HIS 127 N 1.90 0.06 0.39 3.44 -0.00 -1.26 -4.89 115.29 114.93 1dxf s HIS 127 Ca -0.01 -0.37 0.18 0.00 -0.00 0.00 0.00 55.06 54.86 1dxf s HIS 127 Cb -0.12 0.66 1.03 0.00 -0.00 0.00 0.00 32.58 34.15 1dxf s HIS 127 CO -0.05 -0.72 1.94 0.00 -0.00 0.00 0.00 174.74 175.91 1dxf h ARG 128 N 2.00 0.00 -0.02 -0.38 3.08 -1.70 0.62 114.38 117.98 1dxf h ARG 128 Ca -0.26 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.79 1dxf h ARG 128 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 1dxf h ARG 128 CO 0.35 0.24 0.01 0.00 -1.07 0.00 0.00 179.97 179.50 1dxf h ALA 129 N 1.76 0.03 0.00 0.04 0.00 -1.55 -3.43 119.26 116.11 1dxf h ALA 129 Ca -0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1dxf h ALA 129 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1dxf h ALA 129 CO 0.03 -0.43 -1.30 0.27 0.00 0.00 0.00 179.25 177.82 1dxf n ASN 130 N -5.03 1.93 -2.20 0.00 2.04 -1.20 -4.97 115.26 105.83 1dxf n ASN 130 Ca -0.07 0.37 0.00 0.00 -0.44 0.00 0.00 54.58 54.44 1dxf n ASN 130 Cb 0.07 -0.78 0.00 0.00 -2.53 0.00 0.00 39.78 36.54 1dxf n ASN 130 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 1dxf n PHE 132 N -4.43 0.00 -0.79 -2.53 3.72 0.22 -1.99 117.46 111.66 1dxf n PHE 132 Ca -0.23 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.17 1dxf n PHE 132 Cb 0.58 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 1dxf n PHE 132 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1dxf n GLY 133 N 0.99 0.62 0.33 1.37 0.00 -1.26 -4.88 105.19 102.36 1dxf n GLY 133 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1dxf n GLY 133 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1dxf n THR 134 N -2.75 0.00 -2.92 2.61 -2.24 -0.84 -4.87 114.28 103.27 1dxf n THR 134 Ca 0.00 -0.17 -0.41 0.00 -2.27 0.00 0.00 64.05 61.20 1dxf n THR 134 Cb 0.00 0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 69.10 1dxf n THR 134 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1dxf s VAL 135 N -2.58 4.91 0.24 2.28 1.01 -1.13 -5.01 120.40 120.11 1dxf s VAL 135 Ca 0.18 1.58 -0.30 0.00 0.00 0.00 0.00 61.98 63.44 1dxf s VAL 135 Cb 0.18 -4.11 -0.09 0.00 0.00 0.00 0.00 36.38 32.36 1dxf s VAL 135 CO 0.60 0.06 1.32 0.00 0.00 0.00 0.00 175.10 177.09 1dxf s ALA 136 N 1.96 3.53 -1.48 5.51 0.00 -1.26 -3.45 121.76 126.57 1dxf s ALA 136 Ca 0.38 1.17 -0.03 0.00 0.00 0.00 0.00 51.96 53.47 1dxf s ALA 136 Cb -0.17 -3.49 0.03 0.00 0.00 0.00 0.00 23.12 19.49 1dxf s ALA 136 CO 0.13 -0.58 0.39 -3.47 0.00 0.00 0.00 175.76 172.23 1dxf n ASP 137 N 2.19 -0.49 0.00 0.00 2.03 -1.26 -4.89 116.55 114.13 1dxf n ASP 137 Ca 0.05 -1.06 0.00 0.00 0.52 0.00 0.00 54.79 54.29 1dxf n ASP 137 Cb 0.42 -2.70 0.00 0.00 -0.72 0.00 0.00 41.12 38.12 1dxf n ASP 137 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dxf n TYR 138 N -4.43 0.00 -0.32 -0.67 9.36 -1.22 -1.66 117.16 118.21 1dxf n TYR 138 Ca -0.26 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.09 1dxf n TYR 138 Cb 0.66 -0.50 0.26 0.00 -0.63 0.00 0.00 39.34 39.13 1dxf n TYR 138 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 1dxf h PHE 139 N 0.00 -0.02 -0.07 2.98 0.04 -1.92 0.35 116.94 118.31 1dxf h PHE 139 Ca 0.00 0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 1dxf h PHE 139 Cb 0.00 0.16 -0.00 0.00 2.20 0.00 0.00 35.95 38.31 1dxf h PHE 139 CO -0.03 -0.37 -0.01 0.00 -0.60 0.00 0.00 178.31 177.29 1dxf h ALA 140 N 1.91 0.09 0.20 2.45 0.00 -1.95 -3.33 119.26 118.62 1dxf h ALA 140 Ca 0.56 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1dxf h ALA 140 Cb 1.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1dxf h ALA 140 CO -0.85 -0.22 -0.09 1.96 0.00 0.00 0.00 179.25 180.05 1dxf h GLN 141 N -0.19 -0.26 -0.77 0.00 1.08 -0.15 -3.33 115.11 111.49 1dxf h GLN 141 Ca 0.02 0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.34 1dxf h GLN 141 Cb 0.37 0.06 -0.11 0.00 -0.05 0.00 0.00 27.48 27.74 1dxf h GLN 141 CO 0.00 0.01 -0.35 0.45 -0.95 0.00 0.00 178.83 178.00 1dxf n SER 142 N -5.10 -0.60 0.00 1.46 2.88 0.11 -0.03 113.62 112.34 1dxf n SER 142 Ca -0.09 1.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.80 1dxf n SER 142 Cb 0.21 -0.27 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 1dxf n SER 142 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1dxf n ASN 143 N -5.08 0.00 -0.00 -3.46 4.13 -1.25 -1.27 115.26 108.33 1dxf n ASN 143 Ca 0.06 0.41 0.03 0.00 1.68 0.00 0.00 54.58 56.77 1dxf n ASN 143 Cb 0.27 -0.41 -0.05 0.00 -1.54 0.00 0.00 39.78 38.05 1dxf n ASN 143 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1dxf n LYS 144 N -1.41 2.30 -1.02 3.52 5.02 0.96 -4.70 118.16 122.82 1dxf n LYS 144 Ca -0.00 -0.03 -0.13 0.00 -2.02 0.00 0.00 58.31 56.13 1dxf n LYS 144 Cb 0.09 -1.01 0.22 0.00 -0.02 0.00 0.00 35.03 34.31 1dxf n LYS 144 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1dxf n ASN 145 N -1.48 3.58 -4.34 4.39 3.02 -0.40 -4.93 115.26 115.11 1dxf n ASN 145 Ca -0.00 -3.55 -0.35 0.00 -0.03 0.00 0.00 54.58 50.65 1dxf n ASN 145 Cb 0.15 -0.74 -0.14 0.00 -0.61 0.00 0.00 39.78 38.43 1dxf n ASN 145 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1dxf s ILE 146 N -3.20 3.38 -0.11 2.41 -1.09 -1.23 -4.66 121.20 116.70 1dxf s ILE 146 Ca 0.52 -0.50 -0.23 0.00 -2.23 0.00 0.00 60.65 58.21 1dxf s ILE 146 Cb 0.44 -2.52 -0.03 0.00 -1.58 0.00 0.00 42.46 38.78 1dxf s ILE 146 CO 0.08 0.45 0.71 -0.89 -1.23 0.00 0.00 174.94 174.06 1dxf s THR 147 N 1.19 5.01 -0.25 2.92 2.01 0.10 -4.99 115.64 121.63 1dxf s THR 147 Ca 0.02 1.44 -0.03 0.00 0.31 0.00 0.00 61.69 63.43 1dxf s THR 147 Cb -0.14 -4.04 0.01 0.00 0.01 0.00 0.00 72.50 68.34 1dxf s THR 147 CO -0.01 0.18 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.43 1dxf s ILE 148 N 1.27 3.15 -0.28 1.82 -1.09 -1.26 -0.07 121.20 124.74 1dxf s ILE 148 Ca 0.36 -0.82 0.01 0.00 -2.23 0.00 0.00 60.65 57.96 1dxf s ILE 148 Cb -0.17 -2.55 0.05 0.00 -1.58 0.00 0.00 42.46 38.21 1dxf s ILE 148 CO 0.16 0.25 -0.06 -0.76 -1.23 0.00 0.00 174.94 173.30 1dxf s LEU 149 N 1.39 3.61 -0.06 2.97 1.43 0.13 -0.77 118.68 127.38 1dxf s LEU 149 Ca 0.02 -1.29 -0.14 0.00 -1.03 0.00 0.00 54.13 51.69 1dxf s LEU 149 Cb -0.16 -1.63 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 1dxf s LEU 149 CO -0.03 -0.21 0.35 0.68 0.23 0.00 0.00 176.35 177.36 1dxf s VAL 150 N 1.19 5.17 -0.21 -1.59 -7.23 -0.94 0.25 120.40 117.05 1dxf s VAL 150 Ca -0.06 0.69 -0.15 0.00 -1.81 0.00 0.00 61.98 60.65 1dxf s VAL 150 Cb -0.20 -3.66 -0.04 0.00 0.56 0.00 0.00 36.38 33.05 1dxf s VAL 150 CO -0.03 0.53 0.36 -1.10 -0.31 0.00 0.00 175.10 174.54 1dxf s GLN 151 N -0.62 4.16 -0.45 4.82 -0.21 -0.63 -0.37 119.66 126.37 1dxf s GLN 151 Ca 0.21 0.13 -0.13 0.00 0.02 0.00 0.00 55.36 55.59 1dxf s GLN 151 Cb -0.15 -3.53 0.08 0.00 1.00 0.00 0.00 33.01 30.40 1dxf s GLN 151 CO 0.10 -0.01 0.34 0.42 -2.12 0.00 0.00 175.29 174.01 1dxf s ILE 152 N 1.24 4.81 -0.14 1.08 -1.09 0.41 -1.34 121.20 126.18 1dxf s ILE 152 Ca 0.17 -1.22 0.20 0.00 -2.23 0.00 0.00 60.65 57.58 1dxf s ILE 152 Cb -0.14 -3.91 0.40 0.00 -1.58 0.00 0.00 42.46 37.23 1dxf s ILE 152 CO 0.07 -0.56 1.17 -1.84 -1.23 0.00 0.00 174.94 172.56 1dxf n GLU 153 N 5.08 0.80 -3.98 2.79 0.28 -1.26 -3.23 120.64 121.12 1dxf n GLU 153 Ca -0.11 -2.33 -0.09 0.00 -0.16 0.00 0.00 57.16 54.46 1dxf n GLU 153 Cb 0.43 -0.47 -0.08 0.00 1.43 0.00 0.00 31.44 32.75 1dxf n GLU 153 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1dxf s SER 154 N -2.43 0.10 0.13 -1.84 1.04 -1.26 -3.28 113.70 106.15 1dxf s SER 154 Ca 0.24 -0.89 -0.14 0.00 0.48 0.00 0.00 55.95 55.64 1dxf s SER 154 Cb 0.32 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.80 1dxf s SER 154 CO -0.10 -0.84 1.52 -0.61 0.98 0.00 0.00 173.24 174.20 1dxf h GLN 155 N 2.64 0.78 -0.40 4.02 5.75 -1.92 -1.99 115.11 123.99 1dxf h GLN 155 Ca -0.33 -0.31 0.01 0.00 -0.15 0.00 0.00 58.65 57.87 1dxf h GLN 155 Cb 1.22 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.71 1dxf h GLN 155 CO 0.52 0.93 0.26 0.37 -2.65 0.00 0.00 178.83 178.25 1dxf h GLN 156 N 0.59 0.52 -0.78 1.69 4.15 -1.97 0.38 115.11 119.69 1dxf h GLN 156 Ca 0.10 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.54 1dxf h GLN 156 Cb 0.65 -0.12 -0.05 0.00 0.21 0.00 0.00 27.48 28.18 1dxf h GLN 156 CO 0.04 0.34 0.51 0.78 -1.93 0.00 0.00 178.83 178.58 1dxf h GLY 157 N 0.53 1.07 0.67 2.39 0.00 -1.56 -2.07 103.07 104.10 1dxf h GLY 157 Ca 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1dxf h GLY 157 CO -0.04 0.27 -0.19 -2.08 0.00 0.00 0.00 176.54 174.51 1dxf h VAL 158 N 0.87 0.54 -1.16 4.60 2.07 -0.51 -1.54 116.25 121.12 1dxf h VAL 158 Ca 0.33 -0.53 0.33 0.00 0.82 0.00 0.00 66.70 67.64 1dxf h VAL 158 Cb 0.18 0.78 -0.09 0.00 -1.52 0.00 0.00 31.29 30.63 1dxf h VAL 158 CO -0.11 0.09 0.76 0.44 0.02 0.00 0.00 177.57 178.77 1dxf h ASP 159 N -0.86 0.31 -0.58 0.57 3.32 -0.57 0.24 116.42 118.85 1dxf h ASP 159 Ca -0.05 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1dxf h ASP 159 Cb 0.54 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1dxf h ASP 159 CO 0.09 -0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.20 1dxf n ASN 160 N -4.56 3.90 -0.31 6.45 3.02 -0.81 -4.64 115.26 118.30 1dxf n ASN 160 Ca 0.29 -2.18 0.16 0.00 -0.03 0.00 0.00 54.58 52.81 1dxf n ASN 160 Cb 1.11 -0.45 0.34 0.00 -0.61 0.00 0.00 39.78 40.17 1dxf n ASN 160 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1dxf h VAL 161 N 3.46 0.34 0.24 2.41 3.04 0.55 -1.42 116.25 124.88 1dxf h VAL 161 Ca 0.00 -0.10 -0.01 0.00 -1.01 0.00 0.00 66.70 65.58 1dxf h VAL 161 Cb 1.07 0.04 0.00 0.00 -2.01 0.00 0.00 31.29 30.40 1dxf h VAL 161 CO 0.08 0.05 -0.12 0.44 -1.01 0.00 0.00 177.57 177.01 1dxf h ASP 162 N 0.28 -0.27 -0.40 3.17 3.32 -1.82 -0.52 116.42 120.17 1dxf h ASP 162 Ca 0.60 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.65 1dxf h ASP 162 Cb 1.25 0.07 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 1dxf h ASP 162 CO -0.62 -0.19 0.23 0.00 -1.72 0.00 0.00 179.24 176.94 1dxf h ALA 163 N 0.44 0.51 -0.12 3.45 0.00 -1.67 -2.09 119.26 119.78 1dxf h ALA 163 Ca -0.03 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1dxf h ALA 163 Cb 0.25 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1dxf h ALA 163 CO 0.05 0.01 -0.02 0.82 0.00 0.00 0.00 179.25 180.12 1dxf h ILE 164 N 0.52 0.90 0.00 0.00 2.04 -1.23 -2.15 117.51 117.59 1dxf h ILE 164 Ca 0.14 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 1dxf h ILE 164 Cb 0.02 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 1dxf h ILE 164 CO -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 178.15 178.02 1dxf h ALA 165 N 1.11 1.45 0.00 1.87 0.00 -0.95 -1.96 119.26 120.78 1dxf h ALA 165 Ca 0.06 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1dxf h ALA 165 Cb 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1dxf h ALA 165 CO -0.11 0.13 -0.11 0.00 0.00 0.00 0.00 179.25 179.16 1dxf h ALA 166 N 1.90 0.93 -2.64 0.00 0.00 -0.75 -3.45 119.26 115.25 1dxf h ALA 166 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1dxf h ALA 166 Cb 0.25 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.12 1dxf h ALA 166 CO 0.01 0.00 0.82 2.41 0.00 0.00 0.00 179.25 182.50 1dxf n THR 167 N -2.45 0.89 -2.07 0.00 -1.04 -0.74 -4.93 114.28 103.94 1dxf n THR 167 Ca 0.05 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.05 61.41 1dxf n THR 167 Cb 0.46 -1.83 -0.03 0.00 -1.82 0.00 0.00 70.33 67.10 1dxf n THR 167 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1dxf s GLU 168 N -0.30 4.26 0.00 -2.82 2.56 -1.26 -2.63 118.70 118.50 1dxf s GLU 168 Ca 0.66 2.18 0.00 0.00 0.00 0.00 0.00 54.97 57.82 1dxf s GLU 168 Cb -0.54 -3.36 0.00 0.00 2.00 0.00 0.00 34.13 32.24 1dxf s GLU 168 CO 0.47 -0.57 0.00 0.41 -0.56 0.00 0.00 175.26 175.01 1dxf n GLY 169 N 3.69 3.11 3.59 -1.50 0.00 -1.26 -4.95 105.19 107.87 1dxf n GLY 169 Ca 0.13 -1.00 -0.43 0.00 0.00 0.00 0.00 46.02 44.72 1dxf n GLY 169 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1dxf n VAL 170 N 0.00 0.32 0.37 1.61 0.31 -1.08 -4.27 118.33 115.59 1dxf n VAL 170 Ca 0.00 -0.46 0.12 0.00 -0.01 0.00 0.00 64.34 63.98 1dxf n VAL 170 Cb 0.00 -2.52 0.04 0.00 -0.91 0.00 0.00 33.84 30.45 1dxf n VAL 170 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1dxf n ASP 171 N 11.73 0.68 -3.54 4.52 8.00 0.05 -4.95 116.55 133.04 1dxf n ASP 171 Ca 0.31 0.08 -0.15 0.00 0.71 0.00 0.00 54.79 55.74 1dxf n ASP 171 Cb 0.44 0.58 -0.06 0.00 -0.02 0.00 0.00 41.12 42.06 1dxf n ASP 171 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1dxf s GLY 172 N -3.96 -0.45 -0.29 0.44 0.00 -1.05 -4.19 107.32 97.82 1dxf s GLY 172 Ca 0.02 1.60 -0.07 0.00 0.00 0.00 0.00 44.72 46.26 1dxf s GLY 172 CO 0.78 0.97 0.09 -0.42 0.00 0.00 0.00 173.10 174.52 1dxf s ILE 173 N -1.21 4.17 -0.09 0.90 -1.09 -0.24 -2.20 121.20 121.43 1dxf s ILE 173 Ca -0.07 -0.52 -0.01 0.00 -2.23 0.00 0.00 60.65 57.83 1dxf s ILE 173 Cb -0.00 -3.10 -0.03 0.00 -1.58 0.00 0.00 42.46 37.75 1dxf s ILE 173 CO 0.06 0.14 -0.05 0.12 -1.23 0.00 0.00 174.94 173.98 1dxf s PHE 174 N 1.55 2.99 -0.24 3.97 5.36 0.51 0.57 117.98 132.68 1dxf s PHE 174 Ca 0.04 -0.04 -0.08 0.00 -0.96 0.00 0.00 56.93 55.89 1dxf s PHE 174 Cb -0.17 -1.79 -0.04 0.00 -0.34 0.00 0.00 43.02 40.69 1dxf s PHE 174 CO 0.03 0.26 0.10 0.08 -1.46 0.00 0.00 175.22 174.23 1dxf s VAL 175 N -0.52 4.73 -0.74 3.12 1.01 0.65 -0.45 120.40 128.21 1dxf s VAL 175 Ca 0.08 -0.03 -0.18 0.00 0.00 0.00 0.00 61.98 61.85 1dxf s VAL 175 Cb -0.12 -3.21 0.14 0.00 0.00 0.00 0.00 36.38 33.19 1dxf s VAL 175 CO 0.02 0.34 0.85 -0.83 0.00 0.00 0.00 175.10 175.48 1dxf s GLY 176 N 1.34 2.01 0.10 4.51 0.00 -1.20 -3.81 107.32 110.27 1dxf s GLY 176 Ca 0.06 -2.62 -0.34 0.00 0.00 0.00 0.00 44.72 41.82 1dxf s GLY 176 CO 0.05 1.64 1.56 -0.56 0.00 0.00 0.00 173.10 175.80 1dxf h PRO 177 N 8.78 -0.74 -0.35 2.90 0.13 -1.89 -0.98 132.00 139.85 1dxf h PRO 177 Ca -0.08 0.05 0.08 0.00 -0.87 0.00 0.00 66.00 65.18 1dxf h PRO 177 Cb 1.06 0.17 -0.08 0.00 0.13 0.00 0.00 31.00 32.28 1dxf h PRO 177 CO 1.03 -0.49 -0.16 0.77 -0.23 0.00 0.00 178.00 178.91 1dxf h SER 178 N -0.77 -0.55 -0.56 1.44 0.02 -1.93 0.35 113.55 111.54 1dxf h SER 178 Ca -0.01 0.13 -0.10 0.00 -0.84 0.00 0.00 61.79 60.98 1dxf h SER 178 Cb 0.76 0.31 -0.02 0.00 0.14 0.00 0.00 62.40 63.59 1dxf h SER 178 CO -0.25 -0.20 -0.03 0.44 -1.14 0.00 0.00 176.83 175.65 1dxf h ASP 179 N -0.10 1.01 -0.49 3.07 3.32 -1.85 -1.68 116.42 119.70 1dxf h ASP 179 Ca 0.18 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1dxf h ASP 179 Cb 0.37 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1dxf h ASP 179 CO -0.42 1.08 0.22 0.25 -1.72 0.00 0.00 179.24 178.65 1dxf h LEU 180 N 0.93 0.66 -0.47 1.55 7.12 -0.52 0.79 115.31 125.37 1dxf h LEU 180 Ca 0.16 -0.14 -0.01 0.00 0.13 0.00 0.00 57.88 58.02 1dxf h LEU 180 Cb 0.58 -0.17 -0.02 0.00 -0.53 0.00 0.00 40.66 40.52 1dxf h LEU 180 CO 0.03 0.62 0.28 0.00 -0.13 0.00 0.00 178.44 179.24 1dxf h ALA 181 N 1.07 0.61 -0.77 1.25 0.00 -0.13 0.49 119.26 121.77 1dxf h ALA 181 Ca 0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1dxf h ALA 181 Cb 0.15 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1dxf h ALA 181 CO -0.02 0.11 0.33 0.00 0.00 0.00 0.00 179.25 179.67 1dxf h ALA 182 N 1.12 1.13 0.00 0.00 0.00 -1.05 0.36 119.26 120.82 1dxf h ALA 182 Ca 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1dxf h ALA 182 Cb 0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 1dxf h ALA 182 CO -0.03 0.64 -0.15 0.00 0.00 0.00 0.00 179.25 179.70 1dxf h ALA 183 N 1.25 1.65 -0.74 0.00 0.00 0.05 -2.21 119.26 119.25 1dxf h ALA 183 Ca 0.26 -0.14 -0.26 0.00 0.00 0.00 0.00 54.91 54.77 1dxf h ALA 183 Cb 0.17 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.79 1dxf h ALA 183 CO -0.03 0.19 0.33 1.28 0.00 0.00 0.00 179.25 181.02 1dxf n LEU 184 N -4.22 5.98 -1.16 0.00 4.77 0.08 -4.75 117.00 117.71 1dxf n LEU 184 Ca -0.02 -3.13 -0.14 0.00 -0.03 0.00 0.00 56.01 52.69 1dxf n LEU 184 Cb 0.23 -0.75 -0.05 0.00 -2.33 0.00 0.00 43.42 40.52 1dxf n LEU 184 CO 0.35 0.82 -0.14 0.61 -1.33 0.00 0.00 177.39 177.70 1dxf n GLY 185 N -0.28 1.06 2.54 -0.72 0.00 -0.83 -4.92 105.19 102.05 1dxf n GLY 185 Ca 0.42 -0.37 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 1dxf n GLY 185 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1dxf n HIS 186 N -2.92 1.96 -1.68 1.61 8.25 0.12 -5.00 115.22 117.56 1dxf n HIS 186 Ca -0.14 -3.44 -0.47 0.00 -0.26 0.00 0.00 57.72 53.41 1dxf n HIS 186 Cb 0.49 -0.36 -0.04 0.00 1.12 0.00 0.00 29.99 31.20 1dxf n HIS 186 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1dxf n LEU 187 N -0.08 3.34 -0.01 2.41 7.94 -1.23 -0.94 117.00 128.43 1dxf n LEU 187 Ca 0.25 1.02 -0.00 0.00 -1.11 0.00 0.00 56.01 56.16 1dxf n LEU 187 Cb 0.64 -1.40 -0.00 0.00 0.53 0.00 0.00 43.42 43.19 1dxf n LEU 187 CO 0.28 -0.14 -0.00 0.61 -1.11 0.00 0.00 177.39 177.03 1dxf n GLY 188 N 4.00 0.47 2.20 -3.96 0.00 -1.26 -4.94 105.19 101.69 1dxf n GLY 188 Ca 0.20 -0.10 -0.22 0.00 0.00 0.00 0.00 46.02 45.91 1dxf n GLY 188 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1dxf n ASN 189 N 0.11 0.49 0.25 1.61 5.15 -0.11 -4.93 115.26 117.83 1dxf n ASN 189 Ca -0.00 -2.83 0.14 0.00 -0.60 0.00 0.00 54.58 51.28 1dxf n ASN 189 Cb 0.04 -0.63 0.61 0.00 -0.53 0.00 0.00 39.78 39.26 1dxf n ASN 189 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1dxf h ALA 190 N 3.58 1.05 0.00 5.20 0.00 -1.89 -2.74 119.26 124.45 1dxf h ALA 190 Ca 0.08 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1dxf h ALA 190 Cb 0.91 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1dxf h ALA 190 CO 0.48 0.15 0.00 0.43 0.00 0.00 0.00 179.25 180.31 1dxf n SER 191 N -3.30 0.39 -4.67 0.00 7.64 -1.26 -3.94 113.62 108.48 1dxf n SER 191 Ca -0.00 0.59 -0.46 0.00 1.01 0.00 0.00 58.87 60.02 1dxf n SER 191 Cb 0.35 -0.68 -0.04 0.00 -1.01 0.00 0.00 64.21 62.83 1dxf n SER 191 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1dxf n HIS 192 N -1.92 2.25 -0.16 1.43 -0.00 -1.04 -4.70 115.22 111.08 1dxf n HIS 192 Ca 0.03 0.31 0.29 0.00 0.46 0.00 0.00 57.72 58.80 1dxf n HIS 192 Cb 0.21 -2.52 0.66 0.00 -0.12 0.00 0.00 29.99 28.21 1dxf n HIS 192 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1dxf h PRO 193 N 5.57 0.00 -0.18 1.57 0.13 -1.92 0.32 132.00 137.49 1dxf h PRO 193 Ca -0.45 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1dxf h PRO 193 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 1dxf h PRO 193 CO 0.86 0.00 -0.02 -0.44 -0.23 0.00 0.00 178.00 178.17 1dxf h ASP 194 N 0.00 0.34 -0.27 1.44 5.19 -1.92 -1.42 116.42 119.77 1dxf h ASP 194 Ca 0.43 -0.34 -0.10 0.00 -0.62 0.00 0.00 57.03 56.40 1dxf h ASP 194 Cb 2.15 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 41.57 1dxf h ASP 194 CO -0.00 0.60 -0.21 0.58 -3.12 0.00 0.00 179.24 177.08 1dxf h VAL 195 N 0.07 1.31 -0.95 -1.35 2.07 -0.66 -2.72 116.25 114.00 1dxf h VAL 195 Ca 0.05 -1.35 0.07 0.00 0.82 0.00 0.00 66.70 66.28 1dxf h VAL 195 Cb 0.44 1.59 -0.07 0.00 -1.52 0.00 0.00 31.29 31.73 1dxf h VAL 195 CO 0.01 0.43 0.61 1.56 0.02 0.00 0.00 177.57 180.20 1dxf h GLN 196 N 0.35 1.07 -0.26 1.57 1.08 -1.16 0.76 115.11 118.52 1dxf h GLN 196 Ca 0.05 -0.06 -0.11 0.00 -1.45 0.00 0.00 58.65 57.08 1dxf h GLN 196 Cb 0.76 -0.24 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 1dxf h GLN 196 CO 0.06 0.71 -0.29 0.87 -0.95 0.00 0.00 178.83 179.23 1dxf h LYS 197 N 1.10 0.53 -0.13 1.46 1.57 -1.18 -1.93 116.57 117.99 1dxf h LYS 197 Ca 0.41 -0.22 -0.16 0.00 -1.87 0.00 0.00 60.65 58.82 1dxf h LYS 197 Cb 0.18 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1dxf h LYS 197 CO -0.18 0.77 -0.59 0.00 -0.57 0.00 0.00 179.45 178.88 1dxf h ALA 198 N 1.23 0.74 0.03 3.86 0.00 -0.99 -2.40 119.26 121.72 1dxf h ALA 198 Ca 0.06 -0.53 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1dxf h ALA 198 Cb 0.74 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1dxf h ALA 198 CO 0.06 0.71 -0.01 0.82 0.00 0.00 0.00 179.25 180.82 1dxf h ILE 199 N 0.33 1.17 -0.28 0.00 2.04 -0.61 -2.47 117.51 117.69 1dxf h ILE 199 Ca -0.00 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.20 1dxf h ILE 199 Cb 1.12 1.58 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 1dxf h ILE 199 CO 0.10 0.16 -0.02 -0.61 0.00 0.00 0.00 178.15 177.78 1dxf h GLN 200 N -0.30 0.43 -0.03 2.37 4.15 -1.38 -2.09 115.11 118.26 1dxf h GLN 200 Ca -0.00 -0.09 0.01 0.00 0.77 0.00 0.00 58.65 59.34 1dxf h GLN 200 Cb 0.28 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1dxf h GLN 200 CO 0.01 0.48 -0.04 1.25 -1.93 0.00 0.00 178.83 178.60 1dxf h HIS 201 N 0.41 -0.09 -0.59 3.99 2.76 -1.29 0.30 115.15 120.64 1dxf h HIS 201 Ca 0.09 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.31 1dxf h HIS 201 Cb 0.31 0.04 -0.05 0.00 1.55 0.00 0.00 27.41 29.27 1dxf h HIS 201 CO 0.01 -0.06 0.32 0.82 -1.30 0.00 0.00 177.93 177.72 1dxf h ILE 202 N -0.05 0.98 0.57 6.26 2.04 -1.06 -0.14 117.51 126.11 1dxf h ILE 202 Ca 0.03 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.65 1dxf h ILE 202 Cb 0.09 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1dxf h ILE 202 CO -0.06 0.11 -0.36 -0.26 0.00 0.00 0.00 178.15 177.58 1dxf h PHE 203 N 0.62 -0.96 -0.75 1.37 -1.00 -0.88 0.21 116.94 115.54 1dxf h PHE 203 Ca 0.26 -0.01 0.14 0.00 2.81 0.00 0.00 57.97 61.17 1dxf h PHE 203 Cb 0.14 0.35 -0.14 0.00 3.61 0.00 0.00 35.95 39.91 1dxf h PHE 203 CO -0.08 -0.55 -0.29 -0.91 -1.61 0.00 0.00 178.31 174.87 1dxf h ASN 204 N -0.89 -1.05 -0.01 2.17 -0.26 0.15 0.29 115.58 116.00 1dxf h ASN 204 Ca -0.07 0.25 -0.10 0.00 -0.56 0.00 0.00 56.30 55.82 1dxf h ASN 204 Cb 0.73 0.58 -0.01 0.00 -1.06 0.00 0.00 38.32 38.55 1dxf h ASN 204 CO 0.06 -0.29 -0.28 0.03 -1.06 0.00 0.00 177.43 175.89 1dxf h ARG 205 N -0.07 0.44 0.43 0.81 2.47 -0.82 -0.32 114.38 117.32 1dxf h ARG 205 Ca 0.31 -0.17 -0.01 0.00 -1.26 0.00 0.00 59.98 58.85 1dxf h ARG 205 Cb 0.57 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.86 1dxf h ARG 205 CO -0.79 0.68 -0.28 0.00 0.56 0.00 0.00 179.97 180.14 1dxf h ALA 206 N 1.32 -0.69 -0.97 0.04 0.00 0.10 -1.90 119.26 117.17 1dxf h ALA 206 Ca 0.05 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.92 1dxf h ALA 206 Cb 0.69 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.77 1dxf h ALA 206 CO 0.05 -0.90 0.62 1.03 0.00 0.00 0.00 179.25 180.05 1dxf h SER 207 N -0.69 0.94 -0.94 0.00 0.87 -1.04 -1.43 113.55 111.27 1dxf h SER 207 Ca -0.05 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 60.70 1dxf h SER 207 Cb 0.57 -0.17 -0.08 0.00 -0.44 0.00 0.00 62.40 62.28 1dxf h SER 207 CO 0.04 0.56 0.60 0.00 -0.53 0.00 0.00 176.83 177.50 1dxf h ALA 208 N 1.51 1.82 -0.81 6.23 0.00 -0.28 -0.99 119.26 126.74 1dxf h ALA 208 Ca 0.45 0.03 -0.37 0.00 0.00 0.00 0.00 54.91 55.02 1dxf h ALA 208 Cb 0.32 -0.11 -0.22 0.00 0.00 0.00 0.00 17.79 17.79 1dxf h ALA 208 CO -0.20 -0.10 0.42 0.72 0.00 0.00 0.00 179.25 180.09 1dxf n HIS 209 N -4.61 2.56 -0.35 0.00 8.25 -0.60 -4.92 115.22 115.56 1dxf n HIS 209 Ca 0.19 -1.59 0.00 0.00 -0.26 0.00 0.00 57.72 56.06 1dxf n HIS 209 Cb 0.52 -0.79 0.00 0.00 1.12 0.00 0.00 29.99 30.84 1dxf n HIS 209 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1dxf n GLY 210 N -0.82 0.57 3.79 -1.41 0.00 -0.37 -4.88 105.19 102.07 1dxf n GLY 210 Ca 0.49 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.13 1dxf n GLY 210 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dxf s LYS 211 N -0.38 4.34 0.55 1.61 -0.14 -0.85 -4.95 119.74 119.93 1dxf s LYS 211 Ca 0.00 0.89 -0.18 0.00 -1.36 0.00 0.00 55.97 55.32 1dxf s LYS 211 Cb 0.00 -3.25 -0.05 0.00 -1.68 0.00 0.00 37.83 32.84 1dxf s LYS 211 CO 0.00 0.59 1.07 -1.25 -0.76 0.00 0.00 175.35 175.00 1dxf s PRO 212 N -1.05 3.45 0.20 -1.68 0.04 -1.26 -3.09 135.00 131.61 1dxf s PRO 212 Ca 0.32 1.36 0.07 0.00 0.04 0.00 0.00 61.00 62.79 1dxf s PRO 212 Cb -0.21 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 1dxf s PRO 212 CO 0.22 -0.72 0.06 -1.54 0.04 0.00 0.00 177.00 175.05 1dxf s SER 213 N -2.28 5.01 0.19 6.66 1.04 -1.26 -1.08 113.70 121.99 1dxf s SER 213 Ca 0.67 -0.36 -0.10 0.00 0.48 0.00 0.00 55.95 56.64 1dxf s SER 213 Cb -0.18 -1.14 -0.01 0.00 0.10 0.00 0.00 66.02 64.79 1dxf s SER 213 CO 0.29 0.05 0.33 -0.83 0.98 0.00 0.00 173.24 174.06 1dxf s GLY 214 N -3.26 0.52 0.07 7.32 0.00 0.19 -0.69 107.32 111.47 1dxf s GLY 214 Ca 0.30 -0.90 -0.26 0.00 0.00 0.00 0.00 44.72 43.86 1dxf s GLY 214 CO 0.21 -0.79 0.75 -1.50 0.00 0.00 0.00 173.10 171.77 1dxf s ILE 215 N -3.99 0.00 -0.17 0.90 2.07 -0.90 -0.26 121.20 118.86 1dxf s ILE 215 Ca 0.19 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.38 1dxf s ILE 215 Cb 0.02 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.58 1dxf s ILE 215 CO 0.03 0.00 0.02 -0.22 -1.91 0.00 0.00 174.94 172.85 1dxf s LEU 216 N -2.61 3.55 -0.37 8.50 2.96 -1.25 -0.53 118.68 128.93 1dxf s LEU 216 Ca 0.03 -0.02 0.06 0.00 -0.22 0.00 0.00 54.13 53.99 1dxf s LEU 216 Cb -0.01 -1.88 0.18 0.00 0.50 0.00 0.00 46.19 44.98 1dxf s LEU 216 CO -0.11 0.17 0.57 0.00 -1.32 0.00 0.00 176.35 175.66 1dxf s ALA 217 N 0.38 -2.01 0.05 5.97 0.00 -0.30 -4.72 121.76 121.14 1dxf s ALA 217 Ca -0.00 0.19 0.32 0.00 0.00 0.00 0.00 51.96 52.46 1dxf s ALA 217 Cb -0.13 -2.56 1.53 0.00 0.00 0.00 0.00 23.12 21.96 1dxf s ALA 217 CO 0.01 -2.11 1.95 -1.00 0.00 0.00 0.00 175.76 174.62 1dxf h PRO 218 N 7.27 0.00 -5.80 0.00 0.13 -1.77 -3.40 132.00 128.43 1dxf h PRO 218 Ca 0.03 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.57 1dxf h PRO 218 Cb 1.16 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.21 1dxf h PRO 218 CO 0.14 0.00 0.36 0.08 -0.23 0.00 0.00 178.00 178.34 1dxf s VAL 219 N -3.69 4.90 0.22 1.56 1.01 -1.26 -4.79 120.40 118.35 1dxf s VAL 219 Ca -0.01 1.49 -0.08 0.00 0.00 0.00 0.00 61.98 63.38 1dxf s VAL 219 Cb 0.09 -4.08 0.16 0.00 0.00 0.00 0.00 36.38 32.56 1dxf s VAL 219 CO 0.39 0.00 1.75 -0.08 0.00 0.00 0.00 175.10 177.16 1dxf h GLU 220 N 7.53 0.45 -0.08 2.72 4.81 -1.90 -1.00 114.58 127.11 1dxf h GLU 220 Ca -0.27 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 58.97 1dxf h GLU 220 Cb 1.12 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.35 1dxf h GLU 220 CO 0.83 0.30 -0.16 0.00 -0.73 0.00 0.00 179.01 179.26 1dxf h ALA 221 N 1.44 -0.12 -0.52 2.92 0.00 -1.94 0.24 119.26 121.27 1dxf h ALA 221 Ca 0.33 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.29 1dxf h ALA 221 Cb 0.41 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1dxf h ALA 221 CO -0.31 -0.62 0.32 -0.44 0.00 0.00 0.00 179.25 178.20 1dxf h ASP 222 N -0.22 0.54 -0.27 0.00 3.32 -1.82 0.12 116.42 118.10 1dxf h ASP 222 Ca 0.08 -0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.18 1dxf h ASP 222 Cb 0.33 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 1dxf h ASP 222 CO -0.21 0.39 -0.04 0.00 -1.72 0.00 0.00 179.24 177.66 1dxf h ALA 223 N 1.22 0.20 -0.03 3.45 0.00 -0.49 0.18 119.26 123.78 1dxf h ALA 223 Ca 0.20 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 1dxf h ALA 223 Cb -0.02 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1dxf h ALA 223 CO -0.07 -0.45 -0.27 0.00 0.00 0.00 0.00 179.25 178.46 1dxf h ARG 224 N 0.03 0.05 -0.14 0.00 3.08 0.00 -1.79 114.38 115.62 1dxf h ARG 224 Ca 0.13 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.05 1dxf h ARG 224 Cb 0.18 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1dxf h ARG 224 CO -0.25 0.33 -0.34 -0.09 -1.07 0.00 0.00 179.97 178.55 1dxf h ARG 225 N 0.05 0.47 -0.51 0.04 2.43 0.48 -2.80 114.38 114.54 1dxf h ARG 225 Ca 0.01 -0.32 -0.05 0.00 -0.81 0.00 0.00 59.98 58.80 1dxf h ARG 225 Cb 0.51 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1dxf h ARG 225 CO 0.04 0.94 0.10 1.88 -1.51 0.00 0.00 179.97 181.41 1dxf h TYR 226 N 0.08 0.81 -0.73 2.20 0.05 -0.49 -0.55 116.97 118.34 1dxf h TYR 226 Ca -0.00 -0.08 -0.05 0.00 0.05 0.00 0.00 58.73 58.65 1dxf h TYR 226 Cb 0.94 -0.24 -0.03 0.00 1.01 0.00 0.00 36.73 38.41 1dxf h TYR 226 CO 0.10 0.70 0.27 -0.07 -1.05 0.00 0.00 178.16 178.11 1dxf h LEU 227 N 0.75 1.02 -0.82 3.88 3.38 -1.34 -1.86 115.31 120.32 1dxf h LEU 227 Ca 0.16 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1dxf h LEU 227 Cb 0.31 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1dxf h LEU 227 CO 0.00 0.92 -0.53 1.05 0.09 0.00 0.00 178.44 179.97 1dxf h GLU 228 N 1.07 0.00 0.00 1.13 4.11 -1.13 -1.59 114.58 118.16 1dxf h GLU 228 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.67 1dxf h GLU 228 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1dxf h GLU 228 CO -0.02 0.53 0.00 0.91 0.07 0.00 0.00 179.01 180.50 1dxf n TRP 229 N -3.70 0.00 0.00 2.06 7.02 -0.27 -4.87 117.44 117.69 1dxf n TRP 229 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 1dxf n TRP 229 Cb 0.58 -0.25 0.00 0.00 -2.42 0.00 0.00 31.31 29.22 1dxf n TRP 229 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1dxf n GLY 230 N 0.24 2.48 3.57 6.99 0.00 -0.60 -4.90 105.19 112.97 1dxf n GLY 230 Ca 0.09 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.60 1dxf n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dxf n ALA 231 N -0.65 -1.18 -0.13 4.61 0.00 -0.85 -4.82 120.51 117.50 1dxf n ALA 231 Ca 0.00 0.50 -0.24 0.00 0.00 0.00 0.00 53.44 53.70 1dxf n ALA 231 Cb 0.00 -2.01 -0.08 0.00 0.00 0.00 0.00 19.45 17.36 1dxf n ALA 231 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1dxf n THR 232 N 1.92 1.52 -3.05 0.00 -2.24 0.13 -4.49 114.28 108.07 1dxf n THR 232 Ca 0.17 -0.23 -0.44 0.00 -2.27 0.00 0.00 64.05 61.27 1dxf n THR 232 Cb 0.21 -2.02 -0.04 0.00 -2.10 0.00 0.00 70.33 66.38 1dxf n THR 232 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1dxf s PHE 233 N -2.62 2.94 -0.13 4.78 -0.71 -1.10 -1.00 117.98 120.14 1dxf s PHE 233 Ca -0.36 -0.91 0.02 0.00 -1.04 0.00 0.00 56.93 54.64 1dxf s PHE 233 Cb 0.12 -4.09 -0.00 0.00 -1.21 0.00 0.00 43.02 37.83 1dxf s PHE 233 CO 0.47 -1.38 -0.19 0.08 -1.34 0.00 0.00 175.22 172.86 1dxf s VAL 234 N 2.96 2.45 -0.31 -2.49 1.01 -0.50 -2.11 120.40 121.41 1dxf s VAL 234 Ca 0.15 -0.86 -0.19 0.00 0.00 0.00 0.00 61.98 61.08 1dxf s VAL 234 Cb -0.21 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 1dxf s VAL 234 CO 0.06 0.54 0.56 0.00 0.00 0.00 0.00 175.10 176.26 1dxf s ALA 235 N 0.60 3.53 -2.23 5.51 0.00 0.31 -0.99 121.76 128.49 1dxf s ALA 235 Ca -0.10 -0.74 0.19 0.00 0.00 0.00 0.00 51.96 51.31 1dxf s ALA 235 Cb -0.16 -3.01 0.64 0.00 0.00 0.00 0.00 23.12 20.59 1dxf s ALA 235 CO 0.03 -1.02 1.48 1.33 0.00 0.00 0.00 175.76 177.59 1dxf n VAL 236 N 5.34 0.29 -3.65 0.00 0.24 -0.01 -1.14 118.33 119.40 1dxf n VAL 236 Ca -0.03 -0.41 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1dxf n VAL 236 Cb 0.49 0.39 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 1dxf n VAL 236 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1dxf n GLY 237 N 1.15 -1.30 3.07 7.63 0.00 -1.26 -4.27 105.19 110.21 1dxf n GLY 237 Ca 0.16 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 45.01 1dxf n GLY 237 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1dxf s SER 238 N -4.00 0.26 0.19 1.61 1.04 -1.26 0.10 113.70 111.63 1dxf s SER 238 Ca 0.00 -0.61 -0.12 0.00 0.48 0.00 0.00 55.95 55.69 1dxf s SER 238 Cb 0.00 0.19 0.18 0.00 0.10 0.00 0.00 66.02 66.49 1dxf s SER 238 CO 0.00 -0.47 1.75 -2.24 0.98 0.00 0.00 173.24 173.26 1dxf h ASP 239 N 3.83 0.20 -0.15 7.02 3.04 -0.58 -1.11 116.42 128.67 1dxf h ASP 239 Ca -0.33 0.06 0.04 0.00 -3.24 0.00 0.00 57.03 53.57 1dxf h ASP 239 Cb 1.18 0.04 -0.04 0.00 -1.04 0.00 0.00 39.33 39.47 1dxf h ASP 239 CO 0.51 0.14 -0.12 0.25 -2.04 0.00 0.00 179.24 177.98 1dxf h LEU 240 N 0.37 -0.38 -0.07 0.15 5.85 -1.95 -0.34 115.31 118.93 1dxf h LEU 240 Ca 0.25 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1dxf h LEU 240 Cb 0.26 0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 1dxf h LEU 240 CO -0.25 -0.16 0.02 1.23 -0.34 0.00 0.00 178.44 178.95 1dxf h GLY 241 N -0.13 0.12 1.55 3.75 0.00 -1.83 0.12 103.07 106.64 1dxf h GLY 241 Ca 0.10 -0.07 -0.10 0.00 0.00 0.00 0.00 47.33 47.26 1dxf h GLY 241 CO -0.23 0.06 -0.25 -0.39 0.00 0.00 0.00 176.54 175.73 1dxf h VAL 242 N -0.07 1.27 -0.29 4.60 -1.51 -1.16 -0.46 116.25 118.62 1dxf h VAL 242 Ca 0.02 -1.28 -0.03 0.00 -1.23 0.00 0.00 66.70 64.18 1dxf h VAL 242 Cb 0.20 1.33 -0.01 0.00 -2.13 0.00 0.00 31.29 30.68 1dxf h VAL 242 CO -0.00 0.41 0.06 0.15 -1.23 0.00 0.00 177.57 176.96 1dxf h PHE 243 N 0.46 0.50 -0.04 5.19 3.57 -0.94 0.10 116.94 125.78 1dxf h PHE 243 Ca 0.07 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1dxf h PHE 243 Cb 0.68 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.27 1dxf h PHE 243 CO 0.02 0.55 0.02 -0.09 -2.23 0.00 0.00 178.31 176.58 1dxf h ARG 244 N 0.31 0.04 -0.18 1.11 9.65 -0.39 -1.49 114.38 123.42 1dxf h ARG 244 Ca 0.09 -0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.93 1dxf h ARG 244 Cb 0.31 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 1dxf h ARG 244 CO 0.00 0.03 -0.05 0.77 2.80 0.00 0.00 179.97 183.52 1dxf h SER 245 N 0.04 0.36 -0.17 -3.80 0.02 -1.03 -2.08 113.55 106.88 1dxf h SER 245 Ca 0.02 -0.37 0.01 0.00 -0.84 0.00 0.00 61.79 60.61 1dxf h SER 245 Cb 0.01 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 1dxf h SER 245 CO -0.02 0.64 0.08 0.00 -1.14 0.00 0.00 176.83 176.40 1dxf h ALA 246 N 0.73 0.20 -0.17 3.77 0.00 -0.78 0.22 119.26 123.23 1dxf h ALA 246 Ca 0.05 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1dxf h ALA 246 Cb 0.49 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1dxf h ALA 246 CO 0.02 -0.35 0.04 1.79 0.00 0.00 0.00 179.25 180.75 1dxf h THR 247 N 0.18 1.21 -0.23 0.00 1.35 -1.31 -0.40 112.91 113.71 1dxf h THR 247 Ca 0.07 -0.67 0.02 0.00 -0.55 0.00 0.00 66.41 65.28 1dxf h THR 247 Cb 0.02 1.33 -0.02 0.00 -1.73 0.00 0.00 68.15 67.75 1dxf h THR 247 CO -0.05 0.20 0.10 -0.61 -0.25 0.00 0.00 175.52 174.91 1dxf h GLN 248 N 0.08 0.21 -0.46 4.72 5.75 -1.27 -1.76 115.11 122.37 1dxf h GLN 248 Ca 0.05 -0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.58 1dxf h GLN 248 Cb 0.28 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.74 1dxf h GLN 248 CO 0.00 0.14 0.24 -0.22 -2.65 0.00 0.00 178.83 176.34 1dxf h LYS 249 N 0.21 0.46 -0.86 1.69 3.64 -0.47 -1.42 116.57 119.82 1dxf h LYS 249 Ca 0.09 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.52 1dxf h LYS 249 Cb 0.04 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.69 1dxf h LYS 249 CO -0.08 0.30 0.53 1.25 -2.27 0.00 0.00 179.45 179.18 1dxf h LEU 250 N 0.47 0.82 -0.65 5.20 5.85 -0.60 -1.24 115.31 125.17 1dxf h LEU 250 Ca 0.20 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.86 1dxf h LEU 250 Cb 0.10 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1dxf h LEU 250 CO -0.14 0.52 0.08 0.00 -0.34 0.00 0.00 178.44 178.56 1dxf h ALA 251 N 1.42 0.87 -0.31 1.25 0.00 -0.73 -3.13 119.26 118.62 1dxf h ALA 251 Ca 0.38 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1dxf h ALA 251 Cb 0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1dxf h ALA 251 CO -0.19 0.65 -0.19 -0.44 0.00 0.00 0.00 179.25 179.08 1dxf h ASP 252 N 1.01 0.58 0.21 0.00 3.32 -0.42 -0.80 116.42 120.32 1dxf h ASP 252 Ca 0.19 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1dxf h ASP 252 Cb 0.47 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1dxf h ASP 252 CO 0.02 0.78 0.00 0.35 -1.72 0.00 0.00 179.24 178.67 1dxf n THR 253 N -4.14 0.40 0.00 0.35 -2.24 -0.55 0.76 114.28 108.86 1dxf n THR 253 Ca 0.00 0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1dxf n THR 253 Cb 0.38 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 67.77 1dxf n THR 253 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1dxf n PHE 254 N -1.21 0.00 0.00 4.78 3.72 -1.03 -4.76 117.46 118.97 1dxf n PHE 254 Ca 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 1dxf n PHE 254 Cb 0.11 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.64 1dxf n PHE 254 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1dxf n LYS 255 N -1.16 3.82 -0.99 -1.08 5.02 -0.33 -5.13 118.16 118.31 1dxf n LYS 255 Ca 0.00 -0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1dxf n LYS 255 Cb 0.00 -0.73 0.00 0.00 -0.02 0.00 0.00 35.03 34.28 1dxf n LYS 255 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51