#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dby h TYR 6 N 0.00 0.82 -0.26 -2.53 3.20 -1.96 -2.77 116.97 113.47 3dby h TYR 6 Ca 0.00 0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.78 3dby h TYR 6 Cb 0.00 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 3dby h TYR 6 CO 0.00 0.53 -0.23 1.49 -1.64 0.00 0.00 178.16 178.31 3dby h GLU 7 N 0.88 0.62 -0.02 1.82 4.57 -1.98 -0.38 114.58 120.08 3dby h GLU 7 Ca 0.24 -0.32 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3dby h GLU 7 Cb -0.08 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.52 3dby h GLU 7 CO -0.05 0.91 0.00 0.93 -1.18 0.00 0.00 179.01 179.63 3dby h GLU 8 N 0.34 0.04 0.38 1.92 5.08 -1.97 -1.73 114.58 118.65 3dby h GLU 8 Ca 0.05 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3dby h GLU 8 Cb 0.78 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.01 3dby h GLU 8 CO 0.06 0.29 -0.38 1.03 -1.00 0.00 0.00 179.01 179.01 3dby h SER 9 N -0.22 -1.02 -0.53 1.42 0.87 -1.53 -1.57 113.55 110.98 3dby h SER 9 Ca 0.01 0.09 0.07 0.00 -1.23 0.00 0.00 61.79 60.73 3dby h SER 9 Cb 0.27 0.34 -0.10 0.00 -0.44 0.00 0.00 62.40 62.48 3dby h SER 9 CO 0.00 -0.52 -0.49 0.00 -0.53 0.00 0.00 176.83 175.29 3dby h ALA 10 N -0.36 -0.51 -0.29 6.23 0.00 -1.07 0.53 119.26 123.78 3dby h ALA 10 Ca -0.03 0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.98 3dby h ALA 10 Cb 0.70 1.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.50 3dby h ALA 10 CO -0.06 -0.92 0.08 -0.07 0.00 0.00 0.00 179.25 178.28 3dby h LEU 11 N -0.28 0.06 0.23 0.00 3.38 -1.23 -1.24 115.31 116.24 3dby h LEU 11 Ca 0.14 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3dby h LEU 11 Cb 0.57 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3dby h LEU 11 CO -0.66 0.07 -0.22 0.15 0.09 0.00 0.00 178.44 177.86 3dby h PHE 12 N 0.20 -0.59 -0.46 1.13 3.57 -0.73 -0.56 116.94 119.50 3dby h PHE 12 Ca 0.13 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.66 3dby h PHE 12 Cb 0.12 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 3dby h PHE 12 CO -0.15 -0.33 0.26 0.93 -2.23 0.00 0.00 178.31 176.79 3dby h GLU 13 N -0.49 0.51 -0.48 1.11 4.39 -0.73 -1.62 114.58 117.27 3dby h GLU 13 Ca -0.01 -0.03 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 3dby h GLU 13 Cb 0.45 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 3dby h GLU 13 CO -0.04 0.34 -0.10 0.45 -1.16 0.00 0.00 179.01 178.49 3dby h HIS 14 N 0.52 1.03 -0.34 4.33 3.86 -1.11 -0.39 115.15 123.06 3dby h HIS 14 Ca 0.19 -0.22 -0.09 0.00 -1.16 0.00 0.00 60.37 59.10 3dby h HIS 14 Cb 0.04 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 28.25 3dby h HIS 14 CO -0.08 1.00 -0.12 1.96 0.86 0.00 0.00 177.93 181.55 3dby h GLN 15 N 0.78 0.69 0.23 2.45 4.20 -0.89 -0.83 115.11 121.74 3dby h GLN 15 Ca 0.12 -0.28 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 3dby h GLN 15 Cb 0.65 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.38 3dby h GLN 15 CO 0.04 0.87 -0.34 0.35 -0.67 0.00 0.00 178.83 179.08 3dby h PHE 16 N 0.47 -0.96 -0.32 2.96 3.57 -1.16 -3.05 116.94 118.45 3dby h PHE 16 Ca 0.08 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 3dby h PHE 16 Cb 0.64 0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 3dby h PHE 16 CO 0.05 -0.43 -0.22 -1.49 -2.23 0.00 0.00 178.31 174.00 3dby h TRP 17 N -0.60 0.84 -0.20 0.41 -0.00 -1.08 -1.71 115.95 113.61 3dby h TRP 17 Ca -0.03 -0.23 -0.04 0.00 -0.00 0.00 0.00 58.89 58.59 3dby h TRP 17 Cb 0.55 -0.19 -0.01 0.00 -0.00 0.00 0.00 29.16 29.51 3dby h TRP 17 CO -0.27 0.96 -0.06 -0.07 -0.00 0.00 0.00 178.44 178.99 3dby h LEU 18 N 0.48 0.28 -0.12 -4.49 3.38 -1.28 -0.44 115.31 113.12 3dby h LEU 18 Ca 0.06 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 3dby h LEU 18 Cb 0.77 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.46 3dby h LEU 18 CO 0.06 0.39 -0.53 0.50 0.09 0.00 0.00 178.44 178.94 3dby h LYS 19 N 0.29 0.58 -0.65 1.13 1.63 -1.40 -1.52 116.57 116.63 3dby h LYS 19 Ca 0.06 -0.46 0.11 0.00 -0.85 0.00 0.00 60.65 59.52 3dby h LYS 19 Cb 0.30 0.09 -0.08 0.00 -0.60 0.00 0.00 32.23 31.94 3dby h LYS 19 CO 0.01 1.08 0.21 0.28 -3.45 0.00 0.00 179.45 177.59 3dby h VAL 20 N 0.21 0.69 0.00 2.00 2.07 -1.12 -1.09 116.25 119.01 3dby h VAL 20 Ca -0.03 -0.13 -0.14 0.00 0.82 0.00 0.00 66.70 67.22 3dby h VAL 20 Cb 1.17 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 3dby h VAL 20 CO 0.11 0.07 -0.68 -0.07 0.02 0.00 0.00 177.57 177.02 3dby h LEU 21 N 0.37 0.00 -0.49 2.57 3.38 -1.08 -1.35 115.31 118.70 3dby h LEU 21 Ca 0.34 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.25 3dby h LEU 21 Cb 0.48 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3dby h LEU 21 CO -0.37 0.68 0.08 0.74 0.09 0.00 0.00 178.44 179.66 3dby h THR 22 N 0.00 1.25 0.19 0.22 2.02 -0.80 -2.12 112.91 113.66 3dby h THR 22 Ca -0.01 -0.92 0.01 0.00 0.77 0.00 0.00 66.41 66.27 3dby h THR 22 Cb 1.27 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 68.53 3dby h THR 22 CO 0.09 0.33 -0.42 0.44 0.37 0.00 0.00 175.52 176.33 3dby h ASP 23 N 0.69 -1.21 -0.55 4.18 3.45 -1.07 -2.12 116.42 119.79 3dby h ASP 23 Ca 0.15 0.13 0.11 0.00 0.43 0.00 0.00 57.03 57.84 3dby h ASP 23 Cb 0.39 0.44 -0.11 0.00 -0.56 0.00 0.00 39.33 39.49 3dby h ASP 23 CO 0.01 -0.51 -0.25 0.45 -1.57 0.00 0.00 179.24 177.37 3dby h HIS 24 N -0.70 -0.64 -0.95 4.55 3.86 -1.12 0.17 115.15 120.33 3dby h HIS 24 Ca 0.01 0.06 0.07 0.00 -1.16 0.00 0.00 60.37 59.35 3dby h HIS 24 Cb 0.70 0.36 -0.06 0.00 1.06 0.00 0.00 27.41 29.47 3dby h HIS 24 CO -0.33 -0.33 0.61 0.00 0.86 0.00 0.00 177.93 178.74 3dby h ALA 25 N 1.22 1.49 -0.18 2.45 0.00 -1.27 0.20 119.26 123.16 3dby h ALA 25 Ca 0.25 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 3dby h ALA 25 Cb 0.50 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3dby h ALA 25 CO -0.62 0.36 -0.27 0.37 0.00 0.00 0.00 179.25 179.09 3dby h GLN 26 N 1.07 0.51 0.06 0.00 5.75 -0.54 -0.38 115.11 121.58 3dby h GLN 26 Ca 0.41 -0.30 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 3dby h GLN 26 Cb 0.23 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 3dby h GLN 26 CO -0.17 0.90 -0.05 0.74 -2.65 0.00 0.00 178.83 177.60 3dby h PHE 27 N 0.16 -0.14 0.29 3.99 0.04 -0.18 -1.30 116.94 119.80 3dby h PHE 27 Ca 0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.79 3dby h PHE 27 Cb 0.85 0.05 -0.03 0.00 2.20 0.00 0.00 35.95 39.03 3dby h PHE 27 CO 0.09 -0.09 -0.33 -0.07 -0.60 0.00 0.00 178.31 177.31 3dby h LEU 28 N -0.12 -0.91 -0.89 1.54 3.38 -0.99 0.13 115.31 117.45 3dby h LEU 28 Ca 0.00 0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.14 3dby h LEU 28 Cb 0.12 0.32 -0.11 0.00 0.09 0.00 0.00 40.66 41.08 3dby h LEU 28 CO -0.01 -0.46 -0.51 -0.11 0.09 0.00 0.00 178.44 177.44 3dby n LEU 29 N -5.44 -0.92 0.19 1.67 7.94 -0.15 -0.87 117.00 119.42 3dby n LEU 29 Ca -0.09 1.58 0.14 0.00 -1.11 0.00 0.00 56.01 56.53 3dby n LEU 29 Cb 0.34 -0.21 0.52 0.00 0.53 0.00 0.00 43.42 44.59 3dby n LEU 29 CO 0.27 -1.30 0.91 0.44 -1.11 0.00 0.00 177.39 176.60 3dby h ASP 30 N 0.00 0.00 1.26 1.96 3.45 -0.94 -3.12 116.42 119.03 3dby h ASP 30 Ca 0.15 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.58 3dby h ASP 30 Cb 0.38 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.14 3dby h ASP 30 CO -0.84 0.00 -0.76 0.00 -1.57 0.00 0.00 179.24 176.07 3dby h ALA 31 N 2.17 0.67 -2.80 3.45 0.00 0.10 -3.47 119.26 119.37 3dby h ALA 31 Ca 0.00 -0.16 -0.51 0.00 0.00 0.00 0.00 54.91 54.24 3dby h ALA 31 Cb 0.55 0.03 0.05 0.00 0.00 0.00 0.00 17.79 18.42 3dby h ALA 31 CO 0.00 0.19 0.54 -0.51 0.00 0.00 0.00 179.25 179.47 3dby s LEU 32 N -5.74 4.37 0.51 0.00 1.43 -0.53 -1.14 118.68 117.58 3dby s LEU 32 Ca 0.01 2.45 -0.23 0.00 -1.03 0.00 0.00 54.13 55.33 3dby s LEU 32 Cb 0.08 -3.79 -0.06 0.00 0.03 0.00 0.00 46.19 42.44 3dby s LEU 32 CO 0.76 -0.49 1.33 0.00 0.23 0.00 0.00 176.35 178.17 3dby n ALA 33 N 0.61 1.52 -0.20 4.21 0.00 -0.58 -4.91 120.51 121.16 3dby n ALA 33 Ca 0.01 0.17 0.24 0.00 0.00 0.00 0.00 53.44 53.86 3dby n ALA 33 Cb 0.44 -2.33 0.63 0.00 0.00 0.00 0.00 19.45 18.19 3dby n ALA 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3dby h PRO 34 N 1.65 0.18 0.00 0.00 0.11 -1.94 -0.16 132.00 131.84 3dby h PRO 34 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3dby h PRO 34 Cb 1.30 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3dby h PRO 34 CO 0.58 0.12 0.00 0.36 -0.21 0.00 0.00 178.00 178.85 3dby n LYS 35 N -4.39 0.08 -2.09 1.05 2.85 -1.26 -4.08 118.16 110.32 3dby n LYS 35 Ca 0.19 0.25 -0.41 0.00 -1.05 0.00 0.00 58.31 57.28 3dby n LYS 35 Cb 0.83 -1.50 -0.00 0.00 -0.65 0.00 0.00 35.03 33.71 3dby n LYS 35 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3dby n GLU 36 N -1.40 4.35 -0.04 -1.58 -0.58 -0.07 -4.76 120.64 116.56 3dby n GLU 36 Ca 0.04 -3.49 -0.09 0.00 -0.42 0.00 0.00 57.16 53.21 3dby n GLU 36 Cb 0.12 -2.70 -0.03 0.00 -0.57 0.00 0.00 31.44 28.25 3dby n GLU 36 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3dby h LYS 37 N 4.90 0.06 0.00 3.49 1.79 -1.85 -1.32 116.57 123.65 3dby h LYS 37 Ca 0.62 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 59.07 3dby h LYS 37 Cb 0.39 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.02 3dby h LYS 37 CO 1.52 0.04 -0.07 1.49 -1.08 0.00 0.00 179.45 181.34 3dby h GLU 38 N 0.06 0.00 0.06 3.15 4.57 -1.96 -2.02 114.58 118.44 3dby h GLU 38 Ca 0.09 0.00 -0.27 0.00 -1.18 0.00 0.00 59.36 58.00 3dby h GLU 38 Cb 0.11 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 3dby h GLU 38 CO -0.15 0.07 -1.40 -0.44 -1.18 0.00 0.00 179.01 175.91 3dby h ASP 39 N 0.00 0.20 0.07 1.04 3.32 -1.92 -3.15 116.42 115.98 3dby h ASP 39 Ca -0.00 -0.27 -0.13 0.00 0.02 0.00 0.00 57.03 56.65 3dby h ASP 39 Cb 0.81 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 3dby h ASP 39 CO 0.01 1.22 -0.43 0.40 -1.72 0.00 0.00 179.24 178.72 3dby h ILE 40 N 0.03 1.31 -0.26 0.35 2.04 -0.94 -0.94 117.51 119.09 3dby h ILE 40 Ca -0.18 -1.61 -0.02 0.00 1.00 0.00 0.00 64.86 64.06 3dby h ILE 40 Cb 1.94 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 39.65 3dby h ILE 40 CO 0.14 0.50 0.10 0.50 0.00 0.00 0.00 178.15 179.39 3dby h LYS 41 N 0.37 0.40 -0.34 2.37 3.64 -1.50 -0.78 116.57 120.73 3dby h LYS 41 Ca 0.03 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3dby h LYS 41 Cb 0.91 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.65 3dby h LYS 41 CO 0.08 0.43 0.22 0.87 -2.27 0.00 0.00 179.45 178.78 3dby h LYS 42 N 0.28 0.45 -0.17 1.90 1.57 -1.44 -0.55 116.57 118.61 3dby h LYS 42 Ca 0.09 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.74 3dby h LYS 42 Cb 0.18 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 3dby h LYS 42 CO -0.01 0.31 -0.33 0.00 -0.57 0.00 0.00 179.45 178.85 3dby h ALA 43 N 1.11 1.11 -0.46 3.86 0.00 -1.12 -1.54 119.26 122.23 3dby h ALA 43 Ca 0.12 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3dby h ALA 43 Cb -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3dby h ALA 43 CO -0.03 0.56 0.11 1.15 0.00 0.00 0.00 179.25 181.05 3dby h THR 44 N 0.30 1.23 -0.65 0.00 2.02 -0.89 -1.34 112.91 113.58 3dby h THR 44 Ca 0.04 -0.82 0.10 0.00 0.77 0.00 0.00 66.41 66.50 3dby h THR 44 Cb 0.74 0.89 -0.04 0.00 -1.74 0.00 0.00 68.15 68.00 3dby h THR 44 CO 0.06 0.29 0.43 0.22 0.37 0.00 0.00 175.52 176.89 3dby h TYR 45 N 0.62 0.51 0.13 3.16 3.20 -0.41 -2.22 116.97 121.95 3dby h TYR 45 Ca 0.14 0.01 -0.28 0.00 3.14 0.00 0.00 58.73 61.75 3dby h TYR 45 Cb 0.32 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.43 3dby h TYR 45 CO 0.02 0.24 -1.28 0.74 -1.64 0.00 0.00 178.16 176.23 3dby h PHE 46 N 0.47 0.50 0.33 -3.82 0.04 -0.94 -1.39 116.94 112.13 3dby h PHE 46 Ca 0.30 -0.36 -0.00 0.00 2.80 0.00 0.00 57.97 60.71 3dby h PHE 46 Cb 0.55 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.66 3dby h PHE 46 CO -0.00 1.30 -0.30 0.28 -0.60 0.00 0.00 178.31 178.99 3dby h VAL 47 N 0.07 0.37 -0.22 -0.55 2.07 -0.88 -1.17 116.25 115.95 3dby h VAL 47 Ca -0.15 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.42 3dby h VAL 47 Cb 1.98 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 32.07 3dby h VAL 47 CO 0.20 0.00 -0.15 -0.33 0.02 0.00 0.00 177.57 177.31 3dby h GLU 48 N -0.65 -0.13 0.50 1.57 5.08 -1.44 -1.40 114.58 118.11 3dby h GLU 48 Ca -0.02 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3dby h GLU 48 Cb 0.58 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3dby h GLU 48 CO -0.04 -0.09 -0.39 1.15 -1.00 0.00 0.00 179.01 178.64 3dby h THR 49 N -0.14 0.21 -0.22 1.13 2.02 -1.07 -1.31 112.91 113.54 3dby h THR 49 Ca 0.13 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.21 3dby h THR 49 Cb 0.33 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 3dby h THR 49 CO -0.31 0.00 -0.28 -0.26 0.37 0.00 0.00 175.52 175.05 3dby h PHE 50 N -0.88 0.47 -0.11 3.16 0.04 -1.21 -0.67 116.94 117.74 3dby h PHE 50 Ca -0.05 -0.10 0.02 0.00 2.80 0.00 0.00 57.97 60.63 3dby h PHE 50 Cb 0.74 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 38.76 3dby h PHE 50 CO -0.16 0.66 -0.00 1.15 -0.60 0.00 0.00 178.31 179.36 3dby h THR 51 N 0.37 0.93 -0.52 -1.55 2.02 -1.12 0.33 112.91 113.36 3dby h THR 51 Ca 0.05 -0.01 -0.06 0.00 0.77 0.00 0.00 66.41 67.17 3dby h THR 51 Cb 0.68 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 3dby h THR 51 CO 0.05 0.01 0.11 0.78 0.37 0.00 0.00 175.52 176.84 3dby h ASN 52 N 0.03 0.81 -0.75 4.18 2.35 -1.03 -0.11 115.58 121.06 3dby h ASN 52 Ca 0.05 -0.24 0.12 0.00 -0.55 0.00 0.00 56.30 55.68 3dby h ASN 52 Cb 0.06 -0.21 -0.09 0.00 0.05 0.00 0.00 38.32 38.13 3dby h ASN 52 CO -0.08 0.84 0.35 -0.07 -1.65 0.00 0.00 177.43 176.81 3dby h LEU 53 N 0.73 0.40 -0.68 1.61 3.38 -1.01 -2.81 115.31 116.93 3dby h LEU 53 Ca 0.16 0.09 -0.13 0.00 0.09 0.00 0.00 57.88 58.08 3dby h LEU 53 Cb 0.36 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3dby h LEU 53 CO 0.01 0.19 -0.41 0.25 0.09 0.00 0.00 178.44 178.56 3dby h LEU 54 N 0.54 0.58 -0.95 1.67 5.85 -0.34 -3.10 115.31 119.56 3dby h LEU 54 Ca 0.40 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.78 3dby h LEU 54 Cb 0.53 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3dby h LEU 54 CO -0.34 0.92 -0.11 0.78 -0.34 0.00 0.00 178.44 179.36 3dby h ASN 55 N 0.45 0.63 -0.63 1.25 -0.26 -0.79 -2.99 115.58 113.24 3dby h ASN 55 Ca 0.04 -0.18 0.00 0.00 -0.56 0.00 0.00 56.30 55.60 3dby h ASN 55 Cb 0.91 -0.17 0.00 0.00 -1.06 0.00 0.00 38.32 38.00 3dby h ASN 55 CO 0.08 0.77 0.00 2.29 -1.06 0.00 0.00 177.43 179.51 3dby n LYS 56 N -4.18 3.40 0.28 0.81 2.85 -1.11 -4.58 118.16 115.63 3dby n LYS 56 Ca 0.01 -2.77 0.14 0.00 -1.05 0.00 0.00 58.31 54.63 3dby n LYS 56 Cb 0.34 -1.77 0.85 0.00 -0.65 0.00 0.00 35.03 33.81 3dby n LYS 56 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 177.40 177.11 3dby h VAL 57 N 3.90 0.63 0.00 0.58 3.04 -1.44 -2.09 116.25 120.87 3dby h VAL 57 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3dby h VAL 57 Cb 1.29 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 3dby h VAL 57 CO 0.16 0.00 -0.75 0.54 -1.01 0.00 0.00 177.57 176.51 3dby n ARG 58 N -4.01 0.07 -0.87 4.17 1.74 -1.26 -4.31 116.66 112.20 3dby n ARG 58 Ca -0.03 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.98 3dby n ARG 58 Cb 0.10 -1.53 0.20 0.00 -1.02 0.00 0.00 32.46 30.21 3dby n ARG 58 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3dby n ASN 59 N -1.62 2.85 -4.08 0.55 5.03 -0.78 -5.02 115.26 112.19 3dby n ASN 59 Ca 0.04 -3.69 -0.09 0.00 0.87 0.00 0.00 54.58 51.71 3dby n ASN 59 Cb 0.36 -0.67 -0.09 0.00 -1.02 0.00 0.00 39.78 38.36 3dby n ASN 59 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 3dby s VAL 60 N -3.23 0.12 -0.33 2.41 -7.23 -1.25 -5.11 120.40 105.78 3dby s VAL 60 Ca 0.47 -1.73 -0.29 0.00 -1.81 0.00 0.00 61.98 58.62 3dby s VAL 60 Cb 0.42 -1.84 0.00 0.00 0.56 0.00 0.00 36.38 35.52 3dby s VAL 60 CO 0.03 -0.55 1.36 0.21 -0.31 0.00 0.00 175.10 175.84 3dby s ASN 61 N -2.99 6.53 0.17 4.85 3.04 -1.26 -4.94 114.94 120.33 3dby s ASN 61 Ca 0.18 1.10 -0.15 0.00 0.04 0.00 0.00 52.86 54.03 3dby s ASN 61 Cb 0.07 -2.54 0.06 0.00 -1.54 0.00 0.00 41.25 37.29 3dby s ASN 61 CO -0.02 -1.22 1.82 -0.07 -3.04 0.00 0.00 177.10 174.57 3dby h LEU 62 N 11.41 0.51 -1.00 3.21 3.38 -1.98 0.14 115.31 130.98 3dby h LEU 62 Ca -0.27 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.63 3dby h LEU 62 Cb 1.10 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3dby h LEU 62 CO 1.05 0.36 0.05 0.24 0.09 0.00 0.00 178.44 180.23 3dby h MET 63 N 0.61 0.77 0.08 1.13 2.86 -1.91 0.76 114.93 119.24 3dby h MET 63 Ca 0.18 -0.18 -0.28 0.00 -2.06 0.00 0.00 59.70 57.36 3dby h MET 63 Cb -0.04 -0.10 0.02 0.00 0.06 0.00 0.00 31.60 31.54 3dby h MET 63 CO -0.06 0.75 -1.16 0.00 1.06 0.00 0.00 176.91 177.50 3dby h ALA 64 N 1.32 0.08 -0.68 6.32 0.00 -1.80 -3.17 119.26 121.34 3dby h ALA 64 Ca 0.15 -0.76 0.11 0.00 0.00 0.00 0.00 54.91 54.41 3dby h ALA 64 Cb 0.38 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.16 3dby h ALA 64 CO 0.01 0.73 0.28 0.35 0.00 0.00 0.00 179.25 180.62 3dby h PHE 65 N 0.28 0.49 -0.55 0.00 3.57 -0.45 -2.17 116.94 118.12 3dby h PHE 65 Ca -0.16 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.52 3dby h PHE 65 Cb 1.83 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 40.43 3dby h PHE 65 CO 0.10 0.12 0.39 0.77 -2.23 0.00 0.00 178.31 177.46 3dby h SER 66 N 0.47 0.05 0.40 0.41 0.02 -0.82 0.62 113.55 114.69 3dby h SER 66 Ca 0.35 0.00 -0.22 0.00 -0.84 0.00 0.00 61.79 61.09 3dby h SER 66 Cb 0.45 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.98 3dby h SER 66 CO -0.33 0.03 -0.92 0.11 -1.14 0.00 0.00 176.83 174.58 3dby h LYS 67 N 0.05 0.36 -0.07 3.45 1.57 -1.42 -1.25 116.57 119.26 3dby h LYS 67 Ca 0.26 -0.38 -0.23 0.00 -1.87 0.00 0.00 60.65 58.43 3dby h LYS 67 Cb 0.97 0.11 0.01 0.00 0.08 0.00 0.00 32.23 33.39 3dby h LYS 67 CO -0.02 1.06 -0.88 1.49 -0.57 0.00 0.00 179.45 180.53 3dby h GLU 68 N 0.20 0.63 -0.34 3.15 4.81 -0.95 -2.65 114.58 119.44 3dby h GLU 68 Ca -0.07 -0.59 0.01 0.00 -0.13 0.00 0.00 59.36 58.58 3dby h GLU 68 Cb 1.55 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 31.06 3dby h GLU 68 CO 0.15 1.20 0.21 0.00 -0.73 0.00 0.00 179.01 179.85 3dby h ALA 69 N 0.61 0.42 -0.32 2.92 0.00 -0.95 -2.67 119.26 119.27 3dby h ALA 69 Ca -0.08 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.86 3dby h ALA 69 Cb 1.51 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 3dby h ALA 69 CO 0.17 -0.13 0.06 1.49 0.00 0.00 0.00 179.25 180.83 3dby h GLU 70 N 0.43 0.17 -0.52 0.00 4.81 -1.18 0.15 114.58 118.44 3dby h GLU 70 Ca 0.13 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.40 3dby h GLU 70 Cb -0.03 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.27 3dby h GLU 70 CO -0.04 0.11 0.24 0.37 -0.73 0.00 0.00 179.01 178.96 3dby h GLN 71 N 0.17 0.46 -0.64 1.92 5.75 -1.34 -0.23 115.11 121.19 3dby h GLN 71 Ca 0.15 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.55 3dby h GLN 71 Cb 0.16 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.58 3dby h GLN 71 CO -0.20 0.30 0.13 0.00 -2.65 0.00 0.00 178.83 176.42 3dby h ALA 72 N 1.30 0.85 -0.45 3.38 0.00 -1.07 -2.53 119.26 120.74 3dby h ALA 72 Ca 0.24 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.92 3dby h ALA 72 Cb 0.19 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 3dby h ALA 72 CO -0.19 0.59 0.26 0.00 0.00 0.00 0.00 179.25 179.91 3dby h ALA 73 N 1.05 0.57 -0.12 0.00 0.00 -0.24 -1.40 119.26 119.11 3dby h ALA 73 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 3dby h ALA 73 Cb 0.40 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3dby h ALA 73 CO 0.01 -0.05 -0.08 0.87 0.00 0.00 0.00 179.25 179.99 3dby h LYS 74 N 0.53 0.17 -0.12 0.00 1.57 -1.00 -0.70 116.57 117.02 3dby h LYS 74 Ca 0.18 -0.03 -0.18 0.00 -1.87 0.00 0.00 60.65 58.75 3dby h LYS 74 Cb 0.02 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.31 3dby h LYS 74 CO -0.08 0.27 -0.61 0.93 -0.57 0.00 0.00 179.45 179.38 3dby h GLU 75 N 0.17 0.63 0.00 3.15 5.08 -1.02 -2.31 114.58 120.27 3dby h GLU 75 Ca 0.04 -0.52 -0.09 0.00 -1.00 0.00 0.00 59.36 57.79 3dby h GLU 75 Cb 0.26 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 3dby h GLU 75 CO 0.01 1.13 -0.42 0.97 -1.00 0.00 0.00 179.01 179.71 3dby h ILE 76 N 0.29 0.91 0.33 3.13 2.10 -0.87 -2.17 117.51 121.22 3dby h ILE 76 Ca -0.04 -1.72 -0.01 0.00 1.08 0.00 0.00 64.86 64.17 3dby h ILE 76 Cb 1.25 2.05 -0.00 0.00 -1.09 0.00 0.00 36.82 39.03 3dby h ILE 76 CO 0.13 0.41 -0.19 -0.09 -1.08 0.00 0.00 178.15 177.33 3dby h ARG 77 N 0.00 -0.48 -0.99 2.19 2.43 -1.06 -1.78 114.38 114.69 3dby h ARG 77 Ca -0.00 0.03 0.14 0.00 -0.81 0.00 0.00 59.98 59.34 3dby h ARG 77 Cb 1.02 0.11 -0.09 0.00 -0.42 0.00 0.00 29.97 30.59 3dby h ARG 77 CO 0.05 -0.32 0.61 0.00 -1.51 0.00 0.00 179.97 178.80 3dby h ALA 78 N 0.15 1.53 0.26 2.80 0.00 -1.14 -1.04 119.26 121.82 3dby h ALA 78 Ca -0.04 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3dby h ALA 78 Cb 0.41 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3dby h ALA 78 CO 0.05 0.12 -0.13 0.35 0.00 0.00 0.00 179.25 179.64 3dby h PHE 79 N 0.90 -0.33 -0.52 0.00 3.57 -1.28 0.60 116.94 119.89 3dby h PHE 79 Ca 0.52 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 62.08 3dby h PHE 79 Cb 0.61 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.41 3dby h PHE 79 CO -0.01 -0.05 0.19 0.87 -2.23 0.00 0.00 178.31 177.08 3dby h LYS 80 N -0.59 0.36 -0.22 1.11 1.57 -1.03 0.19 116.57 117.96 3dby h LYS 80 Ca -0.04 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.66 3dby h LYS 80 Cb 0.43 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3dby h LYS 80 CO 0.06 0.24 -0.13 -0.07 -0.57 0.00 0.00 179.45 178.98 3dby h LEU 81 N 0.37 0.35 -0.53 2.94 3.38 -1.12 -1.27 115.31 119.42 3dby h LEU 81 Ca 0.25 -0.08 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 3dby h LEU 81 Cb 0.26 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3dby h LEU 81 CO -0.25 0.51 -0.23 -1.13 0.09 0.00 0.00 178.44 177.44 3dby h ASN 82 N 0.34 0.97 -0.49 -0.43 -1.24 -0.07 -1.84 115.58 112.82 3dby h ASN 82 Ca 0.07 -0.37 -0.01 0.00 0.71 0.00 0.00 56.30 56.70 3dby h ASN 82 Cb 0.44 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 3dby h ASN 82 CO 0.03 1.15 0.28 0.40 -1.29 0.00 0.00 177.43 178.00 3dby h ILE 83 N 0.82 1.16 -0.48 2.57 2.04 -0.34 -1.86 117.51 121.42 3dby h ILE 83 Ca 0.10 -0.39 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 3dby h ILE 83 Cb 0.79 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 3dby h ILE 83 CO 0.07 0.17 0.26 0.40 0.00 0.00 0.00 178.15 179.04 3dby h ILE 84 N 0.66 1.17 -0.07 -0.67 2.04 -1.24 0.18 117.51 119.59 3dby h ILE 84 Ca 0.18 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.59 3dby h ILE 84 Cb 0.02 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 3dby h ILE 84 CO -0.03 0.19 0.03 -0.61 0.00 0.00 0.00 178.15 177.72 3dby h GLN 85 N 0.64 0.06 -0.75 2.37 4.15 -1.13 -1.35 115.11 119.11 3dby h GLN 85 Ca 0.17 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.59 3dby h GLN 85 Cb 0.06 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.70 3dby h GLN 85 CO -0.03 0.04 0.47 0.87 -1.93 0.00 0.00 178.83 178.25 3dby h LYS 86 N 0.07 1.00 -0.70 1.69 1.57 -0.91 -1.96 116.57 117.32 3dby h LYS 86 Ca 0.03 -0.08 0.10 0.00 -1.87 0.00 0.00 60.65 58.83 3dby h LYS 86 Cb 0.01 -0.22 -0.07 0.00 0.08 0.00 0.00 32.23 32.03 3dby h LYS 86 CO -0.02 0.69 0.33 1.96 -0.57 0.00 0.00 179.45 181.84 3dby h GLN 87 N 1.02 0.54 0.00 3.15 4.20 0.26 0.45 115.11 124.73 3dby h GLN 87 Ca 0.27 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.95 3dby h GLN 87 Cb -0.07 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.59 3dby h GLN 87 CO -0.05 0.36 0.00 -0.07 -0.67 0.00 0.00 178.83 178.40 3dby h LEU 88 N 0.56 0.00 -3.00 1.46 3.38 -0.52 -1.81 115.31 115.39 3dby h LEU 88 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 3dby h LEU 88 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dby h LEU 88 CO -0.28 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.63 3dby n GLU 89 N -2.43 2.86 -2.45 1.13 1.02 -0.90 -4.98 120.64 114.89 3dby n GLU 89 Ca 0.03 -2.24 -0.17 0.00 -0.02 0.00 0.00 57.16 54.76 3dby n GLU 89 Cb 0.31 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.32 3dby n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dby n GLY 90 N 0.12 -0.30 1.03 0.62 0.00 -0.31 -4.93 105.19 101.43 3dby n GLY 90 Ca 0.13 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 46.07 3dby n GLY 90 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dby n LYS 91 N -2.77 3.24 -3.72 1.61 5.02 0.14 -4.95 118.16 116.73 3dby n LYS 91 Ca -0.17 -2.78 -0.14 0.00 -2.02 0.00 0.00 58.31 53.20 3dby n LYS 91 Cb 0.64 -1.83 -0.08 0.00 -0.02 0.00 0.00 35.03 33.74 3dby n LYS 91 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 3dby s ILE 92 N -2.51 0.04 -0.29 -0.18 2.07 -1.26 -4.94 121.20 114.13 3dby s ILE 92 Ca 0.42 -0.37 -0.07 0.00 -1.41 0.00 0.00 60.65 59.22 3dby s ILE 92 Cb 0.32 -0.68 0.00 0.00 0.13 0.00 0.00 42.46 42.24 3dby s ILE 92 CO 0.12 -0.20 0.09 -0.89 -1.91 0.00 0.00 174.94 172.14 3dby s THR 93 N -1.22 4.07 -0.10 4.00 2.01 -1.26 -4.83 115.64 118.31 3dby s THR 93 Ca -0.12 -0.63 -0.14 0.00 0.31 0.00 0.00 61.69 61.11 3dby s THR 93 Cb -0.04 -3.08 0.03 0.00 0.01 0.00 0.00 72.50 69.42 3dby s THR 93 CO 0.05 0.09 0.36 -0.51 -0.69 0.00 0.00 174.62 173.92 3dby s ILE 94 N 1.52 0.02 -0.35 1.82 2.07 -1.26 -1.53 121.20 123.50 3dby s ILE 94 Ca 0.03 -0.14 0.02 0.00 -1.41 0.00 0.00 60.65 59.14 3dby s ILE 94 Cb -0.17 -0.56 0.41 0.00 0.13 0.00 0.00 42.46 42.27 3dby s ILE 94 CO 0.03 -0.08 1.74 1.41 -1.91 0.00 0.00 174.94 176.13 3dby n HIS 95 N 2.35 2.10 -5.23 3.50 8.25 -0.29 -4.76 115.22 121.14 3dby n HIS 95 Ca -0.16 -1.69 -0.31 0.00 -0.26 0.00 0.00 57.72 55.30 3dby n HIS 95 Cb 0.57 -0.85 -0.15 0.00 1.12 0.00 0.00 29.99 30.68 3dby n HIS 95 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3dby s PHE 96 N -2.33 2.39 0.63 4.41 2.99 -1.26 -5.03 117.98 119.78 3dby s PHE 96 Ca 0.40 -0.39 -0.14 0.00 0.00 0.00 0.00 56.93 56.79 3dby s PHE 96 Cb 0.33 -1.52 -0.02 0.00 0.00 0.00 0.00 43.02 41.81 3dby s PHE 96 CO 0.05 0.00 1.07 0.95 -0.00 0.00 0.00 175.22 177.29 3dby s THR 97 N -0.63 3.75 0.46 0.64 -4.23 -1.26 -4.92 115.64 109.44 3dby s THR 97 Ca 0.10 0.76 0.16 0.00 -1.18 0.00 0.00 61.69 61.53 3dby s THR 97 Cb -0.10 -3.32 0.33 0.00 1.34 0.00 0.00 72.50 70.75 3dby s THR 97 CO -0.01 -0.55 2.00 -0.65 -0.54 0.00 0.00 174.62 174.87 3dby h PRO 98 N 0.08 0.30 -0.29 3.99 0.11 -1.98 -2.32 132.00 131.89 3dby h PRO 98 Ca -0.46 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 3dby h PRO 98 Cb 1.22 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 3dby h PRO 98 CO 0.56 0.20 -0.36 1.15 -0.21 0.00 0.00 178.00 179.35 3dby h THR 99 N 0.31 1.29 -0.75 -1.15 2.02 -1.98 0.15 112.91 112.79 3dby h THR 99 Ca 0.24 -1.50 -0.03 0.00 0.77 0.00 0.00 66.41 65.89 3dby h THR 99 Cb 0.54 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 3dby h THR 99 CO -0.06 0.48 0.34 0.15 0.37 0.00 0.00 175.52 176.81 3dby h PHE 100 N 0.55 1.11 -0.05 3.16 3.57 -1.80 -0.79 116.94 122.68 3dby h PHE 100 Ca 0.06 -0.06 -0.15 0.00 3.53 0.00 0.00 57.97 61.34 3dby h PHE 100 Cb 0.87 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 3dby h PHE 100 CO 0.04 0.82 -0.64 0.82 -2.23 0.00 0.00 178.31 177.13 3dby h ILE 101 N 1.07 1.41 -0.91 1.41 2.04 -1.35 -2.54 117.51 118.64 3dby h ILE 101 Ca 0.26 -2.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.03 3dby h ILE 101 Cb 0.15 2.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.26 3dby h ILE 101 CO -0.03 0.61 0.53 -1.13 0.00 0.00 0.00 178.15 178.13 3dby h ASN 102 N 0.14 1.12 -0.47 1.72 -1.24 -0.21 -1.19 115.58 115.45 3dby h ASN 102 Ca -0.01 -0.08 -0.06 0.00 0.71 0.00 0.00 56.30 56.86 3dby h ASN 102 Cb 1.15 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.90 3dby h ASN 102 CO 0.10 0.87 0.06 0.45 -1.29 0.00 0.00 177.43 177.61 3dby h HIS 103 N 1.27 0.84 -0.69 0.67 3.86 -0.95 -1.33 115.15 118.82 3dby h HIS 103 Ca 0.33 -0.13 0.14 0.00 -1.16 0.00 0.00 60.37 59.55 3dby h HIS 103 Cb -0.02 -0.23 -0.13 0.00 1.06 0.00 0.00 27.41 28.09 3dby h HIS 103 CO 0.01 0.79 -0.20 0.52 0.86 0.00 0.00 177.93 179.91 3dby h MET 104 N 0.65 -0.02 -0.82 2.45 2.86 -1.03 0.13 114.93 119.16 3dby h MET 104 Ca 0.14 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.80 3dby h MET 104 Cb 0.42 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.04 3dby h MET 104 CO 0.01 -0.01 0.53 0.28 1.06 0.00 0.00 176.91 178.78 3dby h VAL 105 N -0.02 1.16 -0.54 -2.22 2.07 -0.69 -0.45 116.25 115.57 3dby h VAL 105 Ca 0.33 -0.36 0.05 0.00 0.82 0.00 0.00 66.70 67.54 3dby h VAL 105 Cb 0.52 0.01 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 3dby h VAL 105 CO -0.73 0.19 0.26 0.78 0.02 0.00 0.00 177.57 178.10 3dby h ASN 106 N 1.06 0.36 0.48 0.57 2.35 -0.57 -1.33 115.58 118.49 3dby h ASN 106 Ca 0.31 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 56.08 3dby h ASN 106 Cb -0.05 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 3dby h ASN 106 CO -0.09 0.24 -0.35 -0.33 -1.65 0.00 0.00 177.43 175.25 3dby h GLU 107 N 0.50 -0.76 -0.96 0.81 5.08 -0.40 -2.48 114.58 116.36 3dby h GLU 107 Ca 0.24 0.05 0.25 0.00 -1.00 0.00 0.00 59.36 58.91 3dby h GLU 107 Cb 0.18 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 3dby h GLU 107 CO -0.19 -0.51 0.66 -0.24 -1.00 0.00 0.00 179.01 177.73 3dby h VAL 108 N -0.79 0.57 0.00 3.13 3.04 -0.99 0.18 116.25 121.39 3dby h VAL 108 Ca -0.06 -0.08 -0.07 0.00 -1.01 0.00 0.00 66.70 65.48 3dby h VAL 108 Cb 0.65 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 30.26 3dby h VAL 108 CO 0.03 0.04 -0.34 -0.33 -1.01 0.00 0.00 177.57 175.96 3dby h GLU 109 N 0.22 0.00 -0.20 4.17 5.08 -1.05 -1.71 114.58 121.09 3dby h GLU 109 Ca 0.49 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.73 3dby h GLU 109 Cb 1.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.80 3dby h GLU 109 CO -0.13 0.34 -0.34 0.93 -1.00 0.00 0.00 179.01 178.82 3dby h GLU 110 N 0.00 0.58 0.26 2.33 4.39 -0.20 -2.14 114.58 119.80 3dby h GLU 110 Ca -0.00 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.34 3dby h GLU 110 Cb 0.89 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.56 3dby h GLU 110 CO 0.04 0.97 -0.25 -0.92 -1.16 0.00 0.00 179.01 177.69 3dby h TYR 111 N 0.25 -0.66 -0.77 4.33 3.20 -1.24 -2.46 116.97 119.62 3dby h TYR 111 Ca 0.01 0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.06 3dby h TYR 111 Cb 0.93 0.26 -0.05 0.00 1.54 0.00 0.00 36.73 39.40 3dby h TYR 111 CO 0.09 -0.37 0.52 0.82 -1.64 0.00 0.00 178.16 177.58 3dby h ILE 112 N -0.54 0.75 -0.27 1.81 2.04 -1.31 0.00 117.51 119.99 3dby h ILE 112 Ca -0.01 -0.12 -0.13 0.00 1.00 0.00 0.00 64.86 65.60 3dby h ILE 112 Cb 0.50 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 3dby h ILE 112 CO -0.05 0.06 -0.37 0.00 0.00 0.00 0.00 178.15 177.79 3dby h ALA 113 N 1.64 0.85 -0.24 1.87 0.00 -0.96 -2.54 119.26 119.88 3dby h ALA 113 Ca 0.38 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3dby h ALA 113 Cb 1.00 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 3dby h ALA 113 CO -0.11 0.64 0.05 0.28 0.00 0.00 0.00 179.25 180.11 3dby h VAL 114 N 0.51 1.22 -0.14 0.00 2.07 -0.73 -3.08 116.25 116.09 3dby h VAL 114 Ca 0.05 -0.72 0.04 0.00 0.82 0.00 0.00 66.70 66.89 3dby h VAL 114 Cb 0.88 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3dby h VAL 114 CO 0.08 0.23 0.15 -0.07 0.02 0.00 0.00 177.57 177.98 3dby h LEU 115 N 0.21 0.00 -1.15 2.57 3.38 -0.83 0.81 115.31 120.30 3dby h LEU 115 Ca 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3dby h LEU 115 Cb 0.30 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 3dby h LEU 115 CO 0.00 0.00 0.43 -0.08 0.09 0.00 0.00 178.44 178.88 3dby h GLU 116 N 0.00 1.01 0.00 1.13 4.81 -1.36 -0.30 114.58 119.87 3dby h GLU 116 Ca 0.07 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3dby h GLU 116 Cb 0.37 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 3dby h GLU 116 CO -0.00 0.73 -0.05 0.74 -0.73 0.00 0.00 179.01 179.69 3dby h PHE 117 N 1.03 0.00 -0.83 0.92 0.04 -1.03 -3.31 116.94 113.76 3dby h PHE 117 Ca 0.26 0.00 0.16 0.00 2.80 0.00 0.00 57.97 61.19 3dby h PHE 117 Cb -0.01 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 38.04 3dby h PHE 117 CO 0.01 0.89 0.38 -0.07 -0.60 0.00 0.00 178.31 178.92 3dby h LEU 118 N -1.00 0.41 -1.21 1.54 3.38 -1.10 0.11 115.31 117.44 3dby h LEU 118 Ca -0.01 0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.15 3dby h LEU 118 Cb 0.89 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.63 3dby h LEU 118 CO -0.01 0.14 0.57 0.11 0.09 0.00 0.00 178.44 179.34 3dby h LYS 119 N 0.52 0.87 -0.61 1.13 1.57 -1.19 -2.61 116.57 116.25 3dby h LYS 119 Ca 0.46 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 3dby h LYS 119 Cb 0.72 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3dby h LYS 119 CO -0.41 0.58 0.00 0.36 -0.57 0.00 0.00 179.45 179.41 3dby n LYS 120 N -4.52 2.91 -0.19 3.15 2.85 -0.03 -4.87 118.16 117.46 3dby n LYS 120 Ca 0.14 -2.23 0.00 0.00 -1.05 0.00 0.00 58.31 55.18 3dby n LYS 120 Cb 0.28 -1.66 0.00 0.00 -0.65 0.00 0.00 35.03 33.00 3dby n LYS 120 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3dby n GLY 121 N 1.13 1.06 3.87 2.58 0.00 -0.98 -5.03 105.19 107.82 3dby n GLY 121 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 3dby n GLY 121 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dby s GLU 122 N -0.56 3.82 0.25 1.61 2.02 -0.82 -4.84 118.70 120.18 3dby s GLU 122 Ca 0.00 0.29 -0.30 0.00 0.02 0.00 0.00 54.97 54.99 3dby s GLU 122 Cb 0.00 -2.70 -0.10 0.00 0.10 0.00 0.00 34.13 31.43 3dby s GLU 122 CO 0.00 0.35 1.34 0.08 0.02 0.00 0.00 175.26 177.05 3dby s VAL 123 N -1.75 2.95 0.22 2.63 1.01 -1.26 -3.22 120.40 120.98 3dby s VAL 123 Ca 0.45 0.83 -0.30 0.00 0.00 0.00 0.00 61.98 62.96 3dby s VAL 123 Cb -0.12 -3.53 -0.09 0.00 0.00 0.00 0.00 36.38 32.64 3dby s VAL 123 CO 0.21 0.15 1.33 -2.84 0.00 0.00 0.00 175.10 173.95 3dby s PRO 124 N -0.64 4.37 0.93 2.72 0.02 -1.26 -4.92 135.00 136.21 3dby s PRO 124 Ca 0.55 2.11 -0.12 0.00 0.02 0.00 0.00 61.00 63.56 3dby s PRO 124 Cb -0.39 -3.17 0.15 0.00 0.02 0.00 0.00 34.50 31.11 3dby s PRO 124 CO 0.43 -0.27 1.09 -1.25 -0.33 0.00 0.00 177.00 176.67 3dby s PRO 125 N -0.28 0.98 -0.27 5.54 0.04 -1.26 -4.98 135.00 134.76 3dby s PRO 125 Ca 0.56 0.88 -0.24 0.00 0.04 0.00 0.00 61.00 62.24 3dby s PRO 125 Cb -0.38 -1.77 -0.00 0.00 0.04 0.00 0.00 34.50 32.39 3dby s PRO 125 CO 0.40 -2.45 0.80 0.08 0.04 0.00 0.00 177.00 175.87 3dby s VAL 126 N -2.86 4.82 0.62 -0.36 1.01 -1.26 -5.03 120.40 117.34 3dby s VAL 126 Ca 0.64 1.38 -0.13 0.00 0.00 0.00 0.00 61.98 63.87 3dby s VAL 126 Cb -0.19 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 3dby s VAL 126 CO 0.58 -0.15 1.04 -0.36 0.00 0.00 0.00 175.10 176.21 3dby s PHE 127 N 2.88 3.24 0.36 5.22 0.08 -1.26 -4.98 117.98 123.51 3dby s PHE 127 Ca 0.33 1.43 -0.27 0.00 0.12 0.00 0.00 56.93 58.54 3dby s PHE 127 Cb -0.15 -2.87 -0.12 0.00 -0.57 0.00 0.00 43.02 39.31 3dby s PHE 127 CO 0.10 -0.95 1.12 1.58 -0.10 0.00 0.00 175.22 176.97 3dby n HIS 128 N -2.49 1.64 0.04 0.36 -0.00 -1.26 -4.67 115.22 108.83 3dby n HIS 128 Ca 0.07 0.60 0.13 0.00 -0.00 0.00 0.00 57.72 58.52 3dby n HIS 128 Cb 0.53 -2.31 0.59 0.00 -0.00 0.00 0.00 29.99 28.81 3dby n HIS 128 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 3dby h GLU 129 N 2.05 0.19 0.00 1.57 4.11 -1.92 0.22 114.58 120.79 3dby h GLU 129 Ca -0.44 -0.01 -0.02 0.00 0.07 0.00 0.00 59.36 58.96 3dby h GLU 129 Cb 1.32 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 3dby h GLU 129 CO 0.60 0.12 -0.11 -0.07 0.07 0.00 0.00 179.01 179.63 3dby h LEU 130 N 0.19 0.00 0.02 3.06 3.38 -1.98 -1.48 115.31 118.51 3dby h LEU 130 Ca 0.19 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.18 3dby h LEU 130 Cb 0.50 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 3dby h LEU 130 CO -0.03 0.11 -0.18 -0.74 0.09 0.00 0.00 178.44 177.68 3dby h HIS 131 N 0.00 -0.48 -0.45 1.13 2.76 -1.28 -1.52 115.15 115.30 3dby h HIS 131 Ca -0.00 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.11 3dby h HIS 131 Cb 0.32 0.21 -0.02 0.00 1.55 0.00 0.00 27.41 29.47 3dby h HIS 131 CO 0.00 -0.27 -0.01 1.88 -1.30 0.00 0.00 177.93 178.23 3dby h TYR 132 N -0.31 0.80 0.08 5.26 0.05 -1.47 -2.39 116.97 118.99 3dby h TYR 132 Ca 0.05 -0.11 -0.00 0.00 0.05 0.00 0.00 58.73 58.71 3dby h TYR 132 Cb 0.37 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 37.89 3dby h TYR 132 CO -0.22 0.76 -0.04 0.45 -1.05 0.00 0.00 178.16 178.05 3dby h HIS 133 N 0.70 -0.10 0.00 4.88 3.86 -1.16 0.55 115.15 123.89 3dby h HIS 133 Ca 0.14 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.32 3dby h HIS 133 Cb 0.45 0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.95 3dby h HIS 133 CO 0.02 0.00 -0.10 -0.07 0.86 0.00 0.00 177.93 178.64 3dby h LEU 134 N -0.18 0.00 0.14 2.43 3.38 -1.11 -1.14 115.31 118.83 3dby h LEU 134 Ca -0.01 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.66 3dby h LEU 134 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3dby h LEU 134 CO 0.02 0.10 -1.52 0.58 0.09 0.00 0.00 178.44 177.71 3dby h VAL 135 N 0.00 1.00 -0.00 1.22 2.07 -1.19 -3.41 116.25 115.94 3dby h VAL 135 Ca -0.00 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.08 3dby h VAL 135 Cb 0.26 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 3dby h VAL 135 CO 0.01 0.76 -0.79 0.79 0.02 0.00 0.00 177.57 178.36 3dby n TRP 136 N -3.81 0.00 0.12 1.57 7.02 0.16 -3.94 117.44 118.56 3dby n TRP 136 Ca -0.25 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.00 3dby n TRP 136 Cb 0.96 -0.04 -0.14 0.00 -2.42 0.00 0.00 31.31 29.67 3dby n TRP 136 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 3dby h LEU 137 N 0.60 0.86 -0.63 -0.99 3.38 -1.40 -1.45 115.31 115.68 3dby h LEU 137 Ca 0.00 -0.85 -0.13 0.00 0.09 0.00 0.00 57.88 57.00 3dby h LEU 137 Cb 0.56 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3dby h LEU 137 CO 0.00 1.65 -0.28 0.71 0.09 0.00 0.00 178.44 180.61 3dby h THR 138 N 0.22 1.28 -0.26 0.22 1.35 -1.80 -1.57 112.91 112.35 3dby h THR 138 Ca -0.22 -1.42 0.06 0.00 -0.55 0.00 0.00 66.41 64.29 3dby h THR 138 Cb 2.03 1.29 -0.06 0.00 -1.73 0.00 0.00 68.15 69.68 3dby h THR 138 CO 0.26 0.47 -0.12 -0.78 -0.25 0.00 0.00 175.52 175.09 3dby h ASP 139 N 0.66 -0.40 -0.61 5.36 3.58 -1.67 0.34 116.42 123.69 3dby h ASP 139 Ca 0.08 0.10 -0.05 0.00 0.42 0.00 0.00 57.03 57.58 3dby h ASP 139 Cb 0.81 0.23 -0.03 0.00 1.72 0.00 0.00 39.33 42.06 3dby h ASP 139 CO 0.07 -0.15 0.19 0.00 -2.88 0.00 0.00 179.24 176.47 3dby h ALA 140 N 1.13 0.79 -0.68 -0.78 0.00 -1.00 0.30 119.26 119.03 3dby h ALA 140 Ca 0.14 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3dby h ALA 140 Cb 0.29 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3dby h ALA 140 CO -0.31 0.46 0.25 0.00 0.00 0.00 0.00 179.25 179.64 3dby h ALA 141 N 1.06 1.16 -0.89 0.00 0.00 -0.98 -0.86 119.26 118.76 3dby h ALA 141 Ca 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3dby h ALA 141 Cb 0.28 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3dby h ALA 141 CO -0.01 0.59 0.49 0.78 0.00 0.00 0.00 179.25 181.10 3dby h GLY 142 N 1.06 1.33 0.97 0.00 0.00 0.63 0.17 103.07 107.23 3dby h GLY 142 Ca 0.23 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 3dby h GLY 142 CO -0.02 0.58 -0.15 0.45 0.00 0.00 0.00 176.54 177.41 3dby h HIS 143 N 1.25 -0.39 -0.45 5.60 3.86 0.30 0.95 115.15 126.27 3dby h HIS 143 Ca 0.31 -0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.53 3dby h HIS 143 Cb 0.03 0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.60 3dby h HIS 143 CO 0.01 -0.22 0.27 0.00 0.86 0.00 0.00 177.93 178.85 3dby h ALA 144 N 0.21 0.56 -0.88 2.45 0.00 -1.02 -1.95 119.26 118.64 3dby h ALA 144 Ca -0.04 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.93 3dby h ALA 144 Cb 0.35 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 3dby h ALA 144 CO 0.07 -0.04 0.57 0.78 0.00 0.00 0.00 179.25 180.63 3dby h GLY 145 N 0.54 1.26 1.66 0.00 0.00 -0.86 -1.39 103.07 104.28 3dby h GLY 145 Ca 0.18 -0.38 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 3dby h GLY 145 CO -0.07 0.25 -0.48 1.76 0.00 0.00 0.00 176.54 178.00 3dby h SER 146 N 0.93 0.39 0.00 0.19 0.02 -0.32 -1.39 113.55 113.38 3dby h SER 146 Ca 0.39 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 61.15 3dby h SER 146 Cb 0.29 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.72 3dby h SER 146 CO -0.15 0.81 -0.00 0.40 -1.14 0.00 0.00 176.83 176.75 3dby h ILE 147 N 0.29 1.13 -0.32 3.27 2.04 -0.77 0.28 117.51 123.43 3dby h ILE 147 Ca 0.02 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 3dby h ILE 147 Cb 0.95 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 3dby h ILE 147 CO 0.08 0.10 0.07 -1.28 0.00 0.00 0.00 178.15 177.13 3dby h SER 148 N -0.18 0.42 1.01 1.72 0.87 -1.13 -1.59 113.55 114.67 3dby h SER 148 Ca -0.00 -0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.37 3dby h SER 148 Cb 0.17 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 3dby h SER 148 CO 0.00 0.44 -0.66 1.23 -0.53 0.00 0.00 176.83 177.31 3dby h GLY 149 N 0.69 0.00 1.84 5.77 0.00 -1.11 -3.25 103.07 107.02 3dby h GLY 149 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3dby h GLY 149 CO -0.00 0.00 -0.09 0.61 0.00 0.00 0.00 176.54 177.05 3dby n GLY 150 N 0.84 -1.54 3.81 4.60 0.00 0.97 -4.91 105.19 108.96 3dby n GLY 150 Ca 0.00 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 3dby n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dby s LEU 151 N -3.61 4.00 0.68 0.99 1.43 -0.90 -0.73 118.68 120.56 3dby s LEU 151 Ca 0.12 1.78 -0.17 0.00 -1.03 0.00 0.00 54.13 54.83 3dby s LEU 151 Cb 0.16 -4.43 -0.03 0.00 0.03 0.00 0.00 46.19 41.91 3dby s LEU 151 CO 0.58 -0.39 0.71 -0.67 0.23 0.00 0.00 176.35 176.82 3dby n ASP 152 N -0.46 -0.43 -0.16 2.29 2.03 -0.31 -4.90 116.55 114.61 3dby n ASP 152 Ca 0.06 0.66 0.09 0.00 0.52 0.00 0.00 54.79 56.12 3dby n ASP 152 Cb 0.53 -1.29 0.40 0.00 -0.72 0.00 0.00 41.12 40.04 3dby n ASP 152 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3dby h LEU 153 N -0.13 0.57 -0.01 -2.67 5.85 -1.96 -2.23 115.31 114.72 3dby h LEU 153 Ca -0.46 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.26 3dby h LEU 153 Cb 1.35 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.27 3dby h LEU 153 CO 0.46 0.35 0.00 1.33 -0.34 0.00 0.00 178.44 180.24 3dby n VAL 154 N -4.49 0.25 -1.37 1.05 0.24 -1.26 -4.26 118.33 108.49 3dby n VAL 154 Ca 0.11 -0.08 -0.34 0.00 -2.04 0.00 0.00 64.34 61.99 3dby n VAL 154 Cb 0.30 -0.56 -0.05 0.00 -1.47 0.00 0.00 33.84 32.06 3dby n VAL 154 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3dby n GLU 155 N -1.77 3.49 -0.32 7.34 -0.58 -0.84 -4.70 120.64 123.26 3dby n GLU 155 Ca 0.06 -2.19 -0.04 0.00 -0.42 0.00 0.00 57.16 54.57 3dby n GLU 155 Cb 0.36 -2.61 0.08 0.00 -0.57 0.00 0.00 31.44 28.71 3dby n GLU 155 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3dby h LYS 156 N 4.50 1.23 -0.07 3.49 6.56 -1.83 -0.90 116.57 129.56 3dby h LYS 156 Ca 0.71 -0.15 -0.01 0.00 -1.06 0.00 0.00 60.65 60.14 3dby h LYS 156 Cb 0.52 -0.24 -0.00 0.00 -0.57 0.00 0.00 32.23 31.94 3dby h LYS 156 CO 1.43 0.91 0.01 0.00 -2.06 0.00 0.00 179.45 179.74 3dby h ARG 157 N 1.23 0.12 -0.78 3.15 2.47 -1.97 0.33 114.38 118.93 3dby h ARG 157 Ca 0.31 -0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.97 3dby h ARG 157 Cb 0.04 -0.01 -0.04 0.00 -1.65 0.00 0.00 29.97 28.31 3dby h ARG 157 CO -0.05 0.35 0.39 -0.07 0.56 0.00 0.00 179.97 181.15 3dby h LEU 158 N -0.13 1.00 -0.77 3.04 3.38 -1.95 -2.11 115.31 117.78 3dby h LEU 158 Ca 0.02 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.90 3dby h LEU 158 Cb 0.28 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 3dby h LEU 158 CO 0.00 0.84 0.50 0.50 0.09 0.00 0.00 178.44 180.37 3dby h LYS 159 N 1.09 0.95 -0.82 1.13 3.64 -0.89 -0.55 116.57 121.12 3dby h LYS 159 Ca 0.27 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 3dby h LYS 159 Cb 0.09 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 31.66 3dby h LYS 159 CO -0.04 0.63 0.40 0.93 -2.27 0.00 0.00 179.45 179.10 3dby h GLU 160 N 0.98 1.17 -0.06 1.90 5.08 0.00 -0.72 114.58 122.92 3dby h GLU 160 Ca 0.31 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 3dby h GLU 160 Cb -0.01 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.02 3dby h GLU 160 CO -0.10 0.90 0.01 -0.22 -1.00 0.00 0.00 179.01 178.59 3dby h LYS 161 N 1.15 0.11 -0.60 2.33 1.63 -1.11 -1.81 116.57 118.27 3dby h LYS 161 Ca 0.28 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 60.01 3dby h LYS 161 Cb 0.11 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.70 3dby h LYS 161 CO -0.04 0.36 0.22 0.66 -3.45 0.00 0.00 179.45 177.20 3dby h SER 162 N -0.15 0.82 -0.48 4.20 4.64 -0.99 -1.71 113.55 119.87 3dby h SER 162 Ca 0.02 -0.12 0.04 0.00 -0.47 0.00 0.00 61.79 61.26 3dby h SER 162 Cb 0.30 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 3dby h SER 162 CO 0.00 0.75 0.32 -0.33 -0.87 0.00 0.00 176.83 176.71 3dby h GLU 163 N 0.87 0.50 -0.14 4.77 4.39 -1.02 -0.57 114.58 123.40 3dby h GLU 163 Ca 0.20 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.83 3dby h GLU 163 Cb 0.21 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 3dby h GLU 163 CO -0.01 0.33 -0.08 1.49 -1.16 0.00 0.00 179.01 179.58 3dby h GLU 164 N 0.52 0.30 -0.57 2.33 4.81 -0.46 -1.45 114.58 120.05 3dby h GLU 164 Ca 0.20 -0.14 0.07 0.00 -0.13 0.00 0.00 59.36 59.37 3dby h GLU 164 Cb 0.14 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.46 3dby h GLU 164 CO -0.05 0.64 0.24 0.74 -0.73 0.00 0.00 179.01 179.85 3dby h PHE 165 N -0.05 0.43 -0.64 0.92 0.04 -1.06 -1.59 116.94 114.99 3dby h PHE 165 Ca 0.03 0.03 0.09 0.00 2.80 0.00 0.00 57.97 60.91 3dby h PHE 165 Cb 0.56 -0.11 -0.07 0.00 2.20 0.00 0.00 35.95 38.54 3dby h PHE 165 CO 0.07 0.15 0.28 1.15 -0.60 0.00 0.00 178.31 179.37 3dby h THR 166 N 0.45 0.83 -0.18 -1.55 2.02 -0.86 -1.01 112.91 112.60 3dby h THR 166 Ca 0.27 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 3dby h THR 166 Cb 0.28 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3dby h THR 166 CO -0.25 0.09 0.08 0.50 0.37 0.00 0.00 175.52 176.32 3dby h LYS 167 N 0.50 0.26 -0.28 6.66 3.64 -1.08 -1.41 116.57 124.86 3dby h LYS 167 Ca 0.31 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.71 3dby h LYS 167 Cb 0.34 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 3dby h LYS 167 CO -0.27 0.30 -0.05 0.45 -2.27 0.00 0.00 179.45 177.60 3dby h HIS 168 N 0.16 -0.12 -0.62 1.91 3.86 -0.80 -0.15 115.15 119.39 3dby h HIS 168 Ca 0.06 0.02 -0.09 0.00 -1.16 0.00 0.00 60.37 59.20 3dby h HIS 168 Cb 0.13 0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 3dby h HIS 168 CO -0.02 -0.10 0.03 0.74 0.86 0.00 0.00 177.93 179.43 3dby h PHE 169 N 0.02 1.16 -0.12 2.45 0.04 -1.16 0.06 116.94 119.39 3dby h PHE 169 Ca 0.13 -0.19 0.04 0.00 2.80 0.00 0.00 57.97 60.75 3dby h PHE 169 Cb 0.20 -0.31 -0.04 0.00 2.20 0.00 0.00 35.95 38.00 3dby h PHE 169 CO -0.26 1.01 -0.12 0.93 -0.60 0.00 0.00 178.31 179.28 3dby h GLU 170 N 0.98 -0.14 -0.77 1.51 5.08 -1.09 0.80 114.58 120.95 3dby h GLU 170 Ca 0.18 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3dby h GLU 170 Cb 0.53 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.78 3dby h GLU 170 CO 0.03 -0.09 0.49 1.96 -1.00 0.00 0.00 179.01 180.39 3dby h GLN 171 N -0.14 1.02 -0.87 2.33 4.20 -0.81 -1.26 115.11 119.57 3dby h GLN 171 Ca 0.08 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3dby h GLN 171 Cb 0.27 -0.22 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 3dby h GLN 171 CO -0.21 0.70 0.56 0.74 -0.67 0.00 0.00 178.83 179.95 3dby h PHE 172 N 1.04 1.11 -0.76 2.96 0.04 -0.76 -2.34 116.94 118.22 3dby h PHE 172 Ca 0.28 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 61.01 3dby h PHE 172 Cb -0.09 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 37.66 3dby h PHE 172 CO -0.01 0.72 0.28 -0.92 -0.60 0.00 0.00 178.31 177.77 3dby h TYR 173 N 1.19 1.20 -0.66 -0.55 3.20 0.27 0.13 116.97 121.74 3dby h TYR 173 Ca 0.32 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 62.03 3dby h TYR 173 Cb -0.11 -0.35 -0.03 0.00 1.54 0.00 0.00 36.73 37.78 3dby h TYR 173 CO 0.00 0.92 0.20 -0.07 -1.64 0.00 0.00 178.16 177.57 3dby h LEU 174 N 1.12 0.97 -0.12 2.82 3.38 -0.97 -1.10 115.31 121.41 3dby h LEU 174 Ca 0.25 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 58.02 3dby h LEU 174 Cb 0.26 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 3dby h LEU 174 CO -0.01 0.92 0.05 0.50 0.09 0.00 0.00 178.44 179.98 3dby h LYS 175 N 0.96 0.11 -0.90 1.13 3.64 -1.03 -2.58 116.57 117.90 3dby h LYS 175 Ca 0.21 -0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.77 3dby h LYS 175 Cb 0.31 -0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 31.99 3dby h LYS 175 CO -0.01 0.07 0.45 0.00 -2.27 0.00 0.00 179.45 177.70 3dby h ALA 176 N 1.07 1.42 -0.25 5.00 0.00 -0.25 -1.65 119.26 124.60 3dby h ALA 176 Ca 0.05 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3dby h ALA 176 Cb 0.02 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3dby h ALA 176 CO -0.05 -0.20 0.06 0.28 0.00 0.00 0.00 179.25 179.35 3dby h VAL 177 N 0.55 1.21 -0.74 0.00 2.07 -1.01 -1.08 116.25 117.25 3dby h VAL 177 Ca 0.53 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 3dby h VAL 177 Cb 0.88 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 3dby h VAL 177 CO -0.44 0.22 0.24 -0.33 0.02 0.00 0.00 177.57 177.29 3dby h GLU 178 N 0.23 1.15 -0.64 1.57 4.39 -1.15 -2.96 114.58 117.17 3dby h GLU 178 Ca 0.08 -0.24 -0.08 0.00 0.34 0.00 0.00 59.36 59.45 3dby h GLU 178 Cb 0.28 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.74 3dby h GLU 178 CO 0.00 0.97 0.08 0.52 -1.16 0.00 0.00 179.01 179.42 3dby h MET 179 N 1.11 1.08 -0.64 2.33 2.86 -1.12 -1.89 114.93 118.65 3dby h MET 179 Ca 0.24 -0.31 0.09 0.00 -2.06 0.00 0.00 59.70 57.66 3dby h MET 179 Cb 0.30 -0.12 -0.07 0.00 0.06 0.00 0.00 31.60 31.77 3dby h MET 179 CO -0.01 1.01 0.29 1.15 1.06 0.00 0.00 176.91 180.41 3dby h THR 180 N 0.99 0.82 -0.57 2.22 2.02 -1.13 -2.04 112.91 115.23 3dby h THR 180 Ca 0.19 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 3dby h THR 180 Cb 0.47 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 3dby h THR 180 CO 0.02 0.09 0.28 1.23 0.37 0.00 0.00 175.52 177.51 3dby h GLY 181 N 0.50 0.86 1.81 2.16 0.00 -1.21 -1.83 103.07 105.36 3dby h GLY 181 Ca 0.32 -0.40 0.02 0.00 0.00 0.00 0.00 47.33 47.27 3dby h GLY 181 CO -0.27 0.38 0.07 -0.97 0.00 0.00 0.00 176.54 175.75 3dby h TYR 182 N 0.81 0.00 -0.25 5.60 0.05 -0.66 -1.88 116.97 120.64 3dby h TYR 182 Ca 0.20 0.00 0.07 0.00 0.05 0.00 0.00 58.73 59.05 3dby h TYR 182 Cb 0.08 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 3dby h TYR 182 CO 0.01 0.00 0.27 -0.07 -1.05 0.00 0.00 178.16 177.31 3dby h LEU 183 N 0.00 0.00 -1.84 3.88 3.38 -0.95 -0.55 115.31 119.23 3dby h LEU 183 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3dby h LEU 183 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3dby h LEU 183 CO -0.00 0.00 0.00 0.03 0.09 0.00 0.00 178.44 178.56 3dby h ARG 184 N 0.00 0.00 0.00 1.13 3.08 -1.48 0.40 114.38 117.51 3dby h ARG 184 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 3dby h ARG 184 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.70 3dby h ARG 184 CO -0.00 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.15 3dby n THR 185 N -2.50 1.03 -0.76 2.04 -2.24 -0.21 -4.87 114.28 106.78 3dby n THR 185 Ca -0.02 0.33 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 3dby n THR 185 Cb 0.06 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.07 3dby n THR 185 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dby n GLU 186 N -1.91 0.00 -2.91 -0.78 1.02 0.14 -4.98 120.64 111.21 3dby n GLU 186 Ca 0.02 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.73 3dby n GLU 186 Cb 0.16 -2.81 -0.05 0.00 -0.02 0.00 0.00 31.44 28.72 3dby n GLU 186 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3dby s LEU 187 N 0.00 4.20 0.00 -4.62 2.96 -1.26 -4.96 118.68 115.01 3dby s LEU 187 Ca 0.00 -0.18 0.23 0.00 -0.22 0.00 0.00 54.13 53.96 3dby s LEU 187 Cb 0.00 -2.94 0.07 0.00 0.50 0.00 0.00 46.19 43.82 3dby s LEU 187 CO 0.00 -1.03 1.12 1.41 -1.32 0.00 0.00 176.35 176.54 3dby n HIS 188 N 6.98 0.00 -3.76 5.38 8.25 -1.26 -4.55 115.22 126.25 3dby n HIS 188 Ca 0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.35 3dby n HIS 188 Cb 0.48 -0.04 -0.14 0.00 1.12 0.00 0.00 29.99 31.41 3dby n HIS 188 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3dby s HIS 189 N -2.71 -0.19 0.14 4.41 3.76 -1.26 -5.05 115.29 114.39 3dby s HIS 189 Ca 0.15 0.51 -0.16 0.00 -0.15 0.00 0.00 55.06 55.41 3dby s HIS 189 Cb 0.17 -0.03 0.03 0.00 1.11 0.00 0.00 32.58 33.87 3dby s HIS 189 CO 0.68 -0.16 0.42 -0.59 -0.85 0.00 0.00 174.74 174.24 3dby s PHE 190 N 0.92 -0.16 0.29 1.40 -0.12 -1.26 -5.08 117.98 113.97 3dby s PHE 190 Ca -0.07 -0.16 -0.02 0.00 -0.05 0.00 0.00 56.93 56.63 3dby s PHE 190 Cb -0.09 0.27 0.43 0.00 -0.63 0.00 0.00 43.02 43.00 3dby s PHE 190 CO -0.05 -0.74 1.94 -1.35 -0.05 0.00 0.00 175.22 174.97 3dby h PRO 191 N 2.34 1.12 -0.84 1.99 0.11 -2.01 -2.34 132.00 132.37 3dby h PRO 191 Ca -0.33 -0.07 0.04 0.00 0.11 0.00 0.00 66.00 65.76 3dby h PRO 191 Cb 1.26 -0.25 -0.05 0.00 0.11 0.00 0.00 31.00 32.06 3dby h PRO 191 CO 0.45 0.74 0.55 0.00 -0.21 0.00 0.00 178.00 179.53 3dby h ALA 192 N 1.47 1.51 -0.12 -0.75 0.00 -1.99 -1.06 119.26 118.31 3dby h ALA 192 Ca 0.34 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.17 3dby h ALA 192 Cb -0.04 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 3dby h ALA 192 CO -0.09 0.39 -0.12 1.25 0.00 0.00 0.00 179.25 180.68 3dby h LEU 193 N 1.01 0.32 -0.77 0.00 5.85 -1.85 -1.13 115.31 118.74 3dby h LEU 193 Ca 0.34 -0.48 0.03 0.00 0.84 0.00 0.00 57.88 58.61 3dby h LEU 193 Cb 0.08 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 3dby h LEU 193 CO -0.11 0.74 0.49 0.11 -0.34 0.00 0.00 178.44 179.33 3dby h LYS 194 N -0.09 0.94 -0.80 1.25 1.79 -1.27 -0.82 116.57 117.57 3dby h LYS 194 Ca 0.02 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 58.41 3dby h LYS 194 Cb 0.64 -0.21 -0.04 0.00 -1.58 0.00 0.00 32.23 31.05 3dby h LYS 194 CO 0.03 0.62 0.41 -0.22 -1.08 0.00 0.00 179.45 179.21 3dby h LYS 195 N 0.97 1.13 -0.69 3.15 1.63 -1.17 -2.49 116.57 119.11 3dby h LYS 195 Ca 0.30 -0.15 0.02 0.00 -0.85 0.00 0.00 60.65 59.97 3dby h LYS 195 Cb -0.01 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.37 3dby h LYS 195 CO -0.10 0.86 0.44 0.35 -3.45 0.00 0.00 179.45 177.55 3dby h PHE 196 N 1.12 0.83 -0.02 1.91 3.57 -0.45 -1.09 116.94 122.81 3dby h PHE 196 Ca 0.28 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.72 3dby h PHE 196 Cb 0.08 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 3dby h PHE 196 CO 0.01 0.50 -0.38 1.15 -2.23 0.00 0.00 178.31 177.35 3dby h THR 197 N 0.88 1.28 -0.12 4.41 2.02 -0.79 -0.63 112.91 119.97 3dby h THR 197 Ca 0.27 -1.34 -0.05 0.00 0.77 0.00 0.00 66.41 66.05 3dby h THR 197 Cb -0.04 1.69 -0.00 0.00 -1.74 0.00 0.00 68.15 68.06 3dby h THR 197 CO -0.08 0.39 -0.13 0.11 0.37 0.00 0.00 175.52 176.17 3dby h LYS 198 N 0.04 0.30 -0.37 6.66 1.57 -1.02 -1.03 116.57 122.72 3dby h LYS 198 Ca 0.00 -0.16 0.06 0.00 -1.87 0.00 0.00 60.65 58.68 3dby h LYS 198 Cb 0.70 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.96 3dby h LYS 198 CO 0.05 0.71 0.06 -0.44 -0.57 0.00 0.00 179.45 179.27 3dby h ASP 199 N -0.10 -0.01 -0.53 0.86 3.32 -0.97 0.38 116.42 119.36 3dby h ASP 199 Ca 0.02 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 3dby h ASP 199 Cb 0.67 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.28 3dby h ASP 199 CO 0.03 0.03 0.27 0.58 -1.72 0.00 0.00 179.24 178.43 3dby h VAL 200 N 0.18 1.19 -0.44 -1.35 2.07 -1.11 -1.71 116.25 115.08 3dby h VAL 200 Ca 0.18 -0.53 0.03 0.00 0.82 0.00 0.00 66.70 67.20 3dby h VAL 200 Cb 0.21 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 3dby h VAL 200 CO -0.24 0.21 0.23 0.28 0.02 0.00 0.00 177.57 178.07 3dby h SER 201 N 0.71 0.34 -0.18 0.57 0.02 -0.56 0.12 113.55 114.56 3dby h SER 201 Ca 0.18 0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.21 3dby h SER 201 Cb 0.10 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.53 3dby h SER 201 CO -0.02 0.24 -0.27 -0.07 -1.14 0.00 0.00 176.83 175.57 3dby h LEU 202 N 0.46 -0.84 -0.60 5.07 -0.00 -0.76 -1.91 115.31 116.72 3dby h LEU 202 Ca 0.19 0.14 0.07 0.00 -0.00 0.00 0.00 57.88 58.28 3dby h LEU 202 Cb 0.08 0.38 -0.06 0.00 -0.00 0.00 0.00 40.66 41.06 3dby h LEU 202 CO -0.12 -0.31 0.28 -0.08 -0.00 0.00 0.00 178.44 178.21 3dby h GLU 203 N -0.31 0.50 -0.73 1.13 4.57 -0.46 -2.04 114.58 117.25 3dby h GLU 203 Ca 0.12 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 3dby h GLU 203 Cb 0.49 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.93 3dby h GLU 203 CO -0.36 0.33 0.47 -0.07 -1.18 0.00 0.00 179.01 178.20 3dby h LEU 204 N 0.52 0.84 -0.25 1.64 3.38 -0.39 0.79 115.31 121.84 3dby h LEU 204 Ca 0.28 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 3dby h LEU 204 Cb 0.26 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3dby h LEU 204 CO -0.23 0.62 0.05 0.11 0.09 0.00 0.00 178.44 179.08 3dby h LYS 205 N 0.99 0.42 -0.82 1.13 1.57 -0.98 -0.95 116.57 117.92 3dby h LYS 205 Ca 0.26 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3dby h LYS 205 Cb -0.09 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.13 3dby h LYS 205 CO -0.05 0.54 0.49 -0.07 -0.57 0.00 0.00 179.45 179.78 3dby h LEU 206 N 0.23 0.99 -0.24 2.94 3.38 -0.63 -1.56 115.31 120.41 3dby h LEU 206 Ca 0.08 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 3dby h LEU 206 Cb 0.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3dby h LEU 206 CO 0.00 0.76 -0.10 0.15 0.09 0.00 0.00 178.44 179.35 3dby h PHE 207 N 1.14 0.57 -0.59 1.13 3.57 -0.77 -1.05 116.94 120.93 3dby h PHE 207 Ca 0.30 -0.14 0.11 0.00 3.53 0.00 0.00 57.97 61.77 3dby h PHE 207 Cb -0.04 -0.13 -0.09 0.00 2.79 0.00 0.00 35.95 38.48 3dby h PHE 207 CO 0.00 0.75 0.11 0.77 -2.23 0.00 0.00 178.31 177.72 3dby h SER 208 N 0.23 -0.02 -0.20 0.41 0.02 -0.97 0.86 113.55 113.87 3dby h SER 208 Ca 0.06 0.11 0.05 0.00 -0.84 0.00 0.00 61.79 61.17 3dby h SER 208 Cb 0.59 0.16 -0.06 0.00 0.14 0.00 0.00 62.40 63.24 3dby h SER 208 CO 0.03 -0.00 -0.16 0.45 -1.14 0.00 0.00 176.83 176.01 3dby h HIS 209 N 0.24 -0.41 -0.24 3.45 3.86 -1.05 -1.10 115.15 119.90 3dby h HIS 209 Ca 0.31 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.58 3dby h HIS 209 Cb 0.46 0.21 -0.03 0.00 1.06 0.00 0.00 27.41 29.12 3dby h HIS 209 CO -0.26 -0.24 0.08 0.35 0.86 0.00 0.00 177.93 178.73 3dby h PHE 210 N -0.17 0.14 -0.87 2.45 3.57 0.16 -0.11 116.94 122.11 3dby h PHE 210 Ca 0.12 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.72 3dby h PHE 210 Cb 0.35 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.00 3dby h PHE 210 CO -0.31 0.06 0.56 -0.07 -2.23 0.00 0.00 178.31 176.32 3dby h LEU 211 N 0.19 0.79 -0.45 0.59 3.38 0.98 -0.56 115.31 120.22 3dby h LEU 211 Ca 0.11 0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.92 3dby h LEU 211 Cb 0.08 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 3dby h LEU 211 CO -0.12 0.47 -0.63 0.45 0.09 0.00 0.00 178.44 178.71 3dby h HIS 212 N 0.87 0.68 -0.55 1.13 3.86 -0.47 0.12 115.15 120.79 3dby h HIS 212 Ca 0.40 -0.26 -0.01 0.00 -1.16 0.00 0.00 60.37 59.33 3dby h HIS 212 Cb 0.38 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.71 3dby h HIS 212 CO -0.00 1.01 0.30 0.93 0.86 0.00 0.00 177.93 181.03 3dby h GLU 213 N 0.39 0.76 -0.55 2.45 5.08 -0.28 -1.75 114.58 120.68 3dby h GLU 213 Ca -0.01 -0.09 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 3dby h GLU 213 Cb 1.18 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 3dby h GLU 213 CO 0.11 0.58 -0.06 0.28 -1.00 0.00 0.00 179.01 178.93 3dby h VAL 214 N 0.73 1.26 -0.93 3.13 2.07 -0.78 -2.21 116.25 119.53 3dby h VAL 214 Ca 0.19 -1.19 0.03 0.00 0.82 0.00 0.00 66.70 66.55 3dby h VAL 214 Cb 0.04 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 3dby h VAL 214 CO -0.03 0.43 0.60 -0.08 0.02 0.00 0.00 177.57 178.51 3dby h GLU 215 N 0.90 1.14 -0.28 1.57 4.81 -0.51 -1.27 114.58 120.94 3dby h GLU 215 Ca 0.15 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.19 3dby h GLU 215 Cb 0.60 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 3dby h GLU 215 CO 0.04 0.75 -0.31 0.93 -0.73 0.00 0.00 179.01 179.69 3dby h GLU 216 N 1.17 0.70 -0.97 1.92 4.39 -1.06 -0.74 114.58 119.99 3dby h GLU 216 Ca 0.37 -0.38 0.02 0.00 0.34 0.00 0.00 59.36 59.70 3dby h GLU 216 Cb -0.01 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.61 3dby h GLU 216 CO -0.12 1.00 0.64 -0.07 -1.16 0.00 0.00 179.01 179.30 3dby h LEU 217 N 0.44 1.10 -0.22 1.33 3.38 -1.32 0.13 115.31 120.14 3dby h LEU 217 Ca 0.04 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3dby h LEU 217 Cb 0.89 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 3dby h LEU 217 CO 0.08 0.78 0.01 -0.33 0.09 0.00 0.00 178.44 179.07 3dby h GLU 218 N 1.29 0.39 -0.39 1.13 4.39 -0.98 0.16 114.58 120.57 3dby h GLU 218 Ca 0.37 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.93 3dby h GLU 218 Cb -0.10 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 3dby h GLU 218 CO -0.09 0.56 0.17 -0.07 -1.16 0.00 0.00 179.01 178.42 3dby h LEU 219 N 0.17 0.48 -1.04 1.33 3.38 -0.78 -1.69 115.31 117.16 3dby h LEU 219 Ca 0.07 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3dby h LEU 219 Cb 0.37 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3dby h LEU 219 CO 0.01 0.43 -0.12 -1.54 0.09 0.00 0.00 178.44 177.31 3dby n SER 220 N -4.40 1.74 -1.49 -0.43 3.41 0.00 -4.92 113.62 107.53 3dby n SER 220 Ca 0.03 -1.45 -0.16 0.00 -0.26 0.00 0.00 58.87 57.03 3dby n SER 220 Cb 0.13 0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.12 3dby n SER 220 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3dby n ASN 221 N 0.18 -4.87 -0.01 4.04 3.02 0.37 -4.89 115.26 113.11 3dby n ASN 221 Ca 0.15 0.22 0.13 0.00 -0.03 0.00 0.00 54.58 55.05 3dby n ASN 221 Cb 0.41 -3.87 0.45 0.00 -0.61 0.00 0.00 39.78 36.17 3dby n ASN 221 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dby n GLU 222 N -2.54 0.04 -4.48 3.52 1.02 -0.03 -4.85 120.64 113.32 3dby n GLU 222 Ca -0.17 -0.01 -0.31 0.00 -0.02 0.00 0.00 57.16 56.64 3dby n GLU 222 Cb 0.58 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.39 3dby n GLU 222 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3dby s VAL 223 N -2.97 3.24 -0.25 2.62 0.11 -1.23 -5.05 120.40 116.88 3dby s VAL 223 Ca 0.14 -1.05 -0.15 0.00 -2.93 0.00 0.00 61.98 57.98 3dby s VAL 223 Cb 0.18 -2.42 -0.04 0.00 -1.53 0.00 0.00 36.38 32.58 3dby s VAL 223 CO 0.60 0.31 0.38 -0.76 -3.33 0.00 0.00 175.10 172.30 3dby s LEU 224 N -1.61 4.07 0.04 2.54 1.43 -1.26 -4.91 118.68 118.98 3dby s LEU 224 Ca 0.17 0.36 -0.27 0.00 -1.03 0.00 0.00 54.13 53.36 3dby s LEU 224 Cb -0.11 -2.45 0.10 0.00 0.03 0.00 0.00 46.19 43.76 3dby s LEU 224 CO 0.08 -0.15 1.22 -0.94 0.23 0.00 0.00 176.35 176.79 3dby s SER 225 N 1.44 -0.02 -0.07 2.29 1.04 -1.26 -1.17 113.70 115.94 3dby s SER 225 Ca 0.16 -0.29 0.12 0.00 0.48 0.00 0.00 55.95 56.42 3dby s SER 225 Cb -0.15 0.24 0.36 0.00 0.10 0.00 0.00 66.02 66.57 3dby s SER 225 CO 0.09 -0.48 1.29 1.33 0.98 0.00 0.00 173.24 176.45 3dby n VAL 226 N -0.71 1.51 -2.56 5.02 0.24 0.09 -4.91 118.33 117.01 3dby n VAL 226 Ca -0.02 -1.39 -0.24 0.00 -2.04 0.00 0.00 64.34 60.66 3dby n VAL 226 Cb 0.60 0.19 0.13 0.00 -1.47 0.00 0.00 33.84 33.29 3dby n VAL 226 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3dby n LEU 227 N -0.06 0.00 -4.06 1.34 4.77 -1.26 -5.04 117.00 112.70 3dby n LEU 227 Ca 0.14 -2.07 -0.08 0.00 -0.03 0.00 0.00 56.01 53.97 3dby n LEU 227 Cb 0.59 -0.68 -0.10 0.00 -2.33 0.00 0.00 43.42 40.90 3dby n LEU 227 CO 0.09 -1.03 -0.37 -0.94 -1.33 0.00 0.00 177.39 173.82 3dby s SER 228 N -5.15 0.49 0.33 -1.43 1.04 -1.26 -5.03 113.70 102.69 3dby s SER 228 Ca 0.67 -0.79 0.07 0.00 0.48 0.00 0.00 55.95 56.38 3dby s SER 228 Cb -0.04 0.14 0.75 0.00 0.10 0.00 0.00 66.02 66.98 3dby s SER 228 CO 0.45 -0.45 1.84 0.00 0.98 0.00 0.00 173.24 176.05 3dby h ALA 229 N 3.77 1.74 -0.71 5.32 0.00 -1.87 -2.32 119.26 125.18 3dby h ALA 229 Ca -0.34 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 3dby h ALA 229 Cb 1.17 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 3dby h ALA 229 CO 0.55 -0.02 0.19 -0.09 0.00 0.00 0.00 179.25 179.88 3dby h ARG 230 N 0.77 1.13 -0.33 0.00 2.43 -1.96 -1.21 114.38 115.21 3dby h ARG 230 Ca 0.49 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 3dby h ARG 230 Cb 0.73 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 3dby h ARG 230 CO -0.26 0.98 0.22 1.98 -1.51 0.00 0.00 179.97 181.38 3dby h MET 231 N 1.08 0.44 -0.45 0.20 4.05 -1.84 -0.41 114.93 117.99 3dby h MET 231 Ca 0.23 -0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.59 3dby h MET 231 Cb 0.35 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.03 3dby h MET 231 CO -0.00 0.31 0.17 0.00 0.23 0.00 0.00 176.91 177.61 3dby h ALA 232 N 1.11 0.59 -0.16 0.39 0.00 -1.19 -0.48 119.26 119.53 3dby h ALA 232 Ca 0.12 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.92 3dby h ALA 232 Cb -0.03 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.53 3dby h ALA 232 CO -0.03 0.21 -0.14 0.22 0.00 0.00 0.00 179.25 179.52 3dby h ASP 233 N 0.59 -0.45 -0.37 0.00 3.58 -1.24 -0.78 116.42 117.76 3dby h ASP 233 Ca 0.15 0.09 0.08 0.00 0.42 0.00 0.00 57.03 57.77 3dby h ASP 233 Cb 0.22 0.22 -0.08 0.00 1.72 0.00 0.00 39.33 41.41 3dby h ASP 233 CO -0.01 -0.18 -0.12 -0.74 -2.88 0.00 0.00 179.24 175.30 3dby h HIS 234 N -0.16 -0.28 -0.59 0.28 2.76 -0.73 -0.37 115.15 116.05 3dby h HIS 234 Ca 0.10 0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 3dby h HIS 234 Cb 0.31 0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.42 3dby h HIS 234 CO -0.27 -0.20 0.33 0.52 -1.30 0.00 0.00 177.93 177.01 3dby h MET 235 N -0.04 0.82 -0.81 5.26 2.86 -0.89 -2.01 114.93 120.12 3dby h MET 235 Ca 0.18 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 3dby h MET 235 Cb 0.32 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 3dby h MET 235 CO -0.41 0.63 0.39 0.00 1.06 0.00 0.00 176.91 178.58 3dby h ALA 236 N 1.15 1.04 -0.61 6.32 0.00 -0.67 -1.38 119.26 125.11 3dby h ALA 236 Ca 0.21 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3dby h ALA 236 Cb 0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 3dby h ALA 236 CO -0.03 0.61 0.27 0.00 0.00 0.00 0.00 179.25 180.09 3dby h ARG 237 N 1.15 0.90 -0.80 0.00 3.08 -0.77 -0.91 114.38 117.03 3dby h ARG 237 Ca 0.28 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.16 3dby h ARG 237 Cb 0.12 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.98 3dby h ARG 237 CO -0.03 0.75 0.42 0.93 -1.07 0.00 0.00 179.97 180.96 3dby h GLU 238 N 0.85 1.11 -0.22 0.04 5.08 -1.17 -0.27 114.58 119.99 3dby h GLU 238 Ca 0.21 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 3dby h GLU 238 Cb 0.16 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 3dby h GLU 238 CO -0.02 0.83 -0.20 0.93 -1.00 0.00 0.00 179.01 179.54 3dby h GLU 239 N 1.12 0.39 -0.47 2.33 4.39 -1.07 -1.31 114.58 119.96 3dby h GLU 239 Ca 0.28 -0.13 -0.06 0.00 0.34 0.00 0.00 59.36 59.80 3dby h GLU 239 Cb 0.05 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 3dby h GLU 239 CO -0.04 0.58 0.07 0.00 -1.16 0.00 0.00 179.01 178.46 3dby h TYR 241 N 0.65 1.04 0.21 0.00 3.20 -0.67 -0.57 116.97 120.83 3dby h TYR 241 Ca 0.14 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 3dby h TYR 241 Cb 0.40 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.32 3dby h TYR 241 CO 0.03 0.69 -0.10 -0.92 -1.64 0.00 0.00 178.16 176.21 3dby h TYR 242 N 1.09 -0.27 -0.93 -3.82 3.20 -1.06 -1.80 116.97 113.38 3dby h TYR 242 Ca 0.29 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.31 3dby h TYR 242 Cb -0.06 0.09 -0.10 0.00 1.54 0.00 0.00 36.73 38.20 3dby h TYR 242 CO -0.01 -0.12 0.54 -0.07 -1.64 0.00 0.00 178.16 176.86 3dby h LEU 243 N -0.35 0.70 -0.28 2.82 3.38 -0.49 -1.43 115.31 119.66 3dby h LEU 243 Ca -0.03 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3dby h LEU 243 Cb 0.27 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3dby h LEU 243 CO 0.05 0.29 0.13 0.25 0.09 0.00 0.00 178.44 179.25 3dby h LEU 244 N 0.75 0.38 -0.63 1.67 5.85 -0.89 -0.35 115.31 122.09 3dby h LEU 244 Ca 0.51 -0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.98 3dby h LEU 244 Cb 0.71 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 3dby h LEU 244 CO -0.35 0.41 -0.15 0.11 -0.34 0.00 0.00 178.44 178.12 3dby h LYS 245 N 0.32 0.93 -0.49 1.25 1.79 -0.92 -1.94 116.57 117.51 3dby h LYS 245 Ca 0.10 -0.35 -0.00 0.00 -2.18 0.00 0.00 60.65 58.21 3dby h LYS 245 Cb 0.14 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.71 3dby h LYS 245 CO -0.01 1.01 0.29 -0.07 -1.08 0.00 0.00 179.45 179.59 3dby h LEU 246 N 0.82 0.58 -0.71 2.94 3.38 -1.02 0.61 115.31 121.92 3dby h LEU 246 Ca 0.12 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 3dby h LEU 246 Cb 0.69 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3dby h LEU 246 CO 0.05 0.46 0.06 0.00 0.09 0.00 0.00 178.44 179.10 3dby h ALA 247 N 1.14 0.92 0.01 1.53 0.00 -0.95 0.14 119.26 122.05 3dby h ALA 247 Ca 0.17 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3dby h ALA 247 Cb -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3dby h ALA 247 CO -0.03 0.66 -0.00 1.96 0.00 0.00 0.00 179.25 181.83 3dby h GLN 248 N 0.98 -0.01 -0.07 0.00 4.20 -1.15 0.53 115.11 119.59 3dby h GLN 248 Ca 0.19 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.84 3dby h GLN 248 Cb 0.48 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 3dby h GLN 248 CO 0.02 0.52 -0.23 0.66 -0.67 0.00 0.00 178.83 179.13 3dby h SER 249 N -0.54 0.12 0.00 1.46 4.64 -0.89 -3.32 113.55 115.02 3dby h SER 249 Ca -0.00 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.24 3dby h SER 249 Cb 0.53 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3dby h SER 249 CO 0.00 0.36 -1.90 -0.24 -0.87 0.00 0.00 176.83 174.18 3dby n SER 250 N -4.22 0.73 -0.66 4.97 2.88 0.49 -4.63 113.62 113.18 3dby n SER 250 Ca -0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 3dby n SER 250 Cb 0.32 1.72 0.00 0.00 -0.75 0.00 0.00 64.21 65.49 3dby n SER 250 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dby n GLY 251 N 1.51 0.58 3.68 0.46 0.00 0.02 -5.03 105.19 106.42 3dby n GLY 251 Ca -0.07 -0.34 -0.24 0.00 0.00 0.00 0.00 46.02 45.37 3dby n GLY 251 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dby s LEU 252 N -1.33 3.08 0.35 0.99 1.43 -0.28 -5.05 118.68 117.88 3dby s LEU 252 Ca 0.00 -0.99 -0.28 0.00 -1.03 0.00 0.00 54.13 51.84 3dby s LEU 252 Cb 0.00 -1.44 -0.10 0.00 0.03 0.00 0.00 46.19 44.68 3dby s LEU 252 CO 0.00 -0.35 1.27 -1.61 0.23 0.00 0.00 176.35 175.89 3dby s GLU 253 N -3.80 4.25 0.25 1.70 2.02 -1.26 -4.59 118.70 117.27 3dby s GLU 253 Ca 0.37 2.11 -0.30 0.00 0.02 0.00 0.00 54.97 57.17 3dby s GLU 253 Cb 0.01 -2.96 -0.11 0.00 0.10 0.00 0.00 34.13 31.18 3dby s GLU 253 CO 0.21 -0.24 1.53 -1.64 0.02 0.00 0.00 175.26 175.15 3dby s MET 254 N -1.93 4.20 0.57 1.61 -1.94 -1.26 -4.88 119.30 115.66 3dby s MET 254 Ca 0.51 2.43 -0.20 0.00 -1.71 0.00 0.00 55.69 56.73 3dby s MET 254 Cb -0.37 -3.08 -0.06 0.00 2.01 0.00 0.00 34.83 33.33 3dby s MET 254 CO 0.49 -0.55 1.02 -0.35 -0.01 0.00 0.00 175.02 175.62 3dby n PRO 255 N 2.61 1.07 -2.27 2.03 -0.04 -1.26 -4.94 135.00 132.20 3dby n PRO 255 Ca 0.09 0.40 -0.42 0.00 -0.04 0.00 0.00 63.50 63.53 3dby n PRO 255 Cb 0.39 -2.20 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 3dby n PRO 255 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 3dby n LYS 256 N -0.83 3.84 -3.61 0.54 4.81 -1.26 -4.92 118.16 116.73 3dby n LYS 256 Ca 0.13 -3.53 -0.13 0.00 -0.87 0.00 0.00 58.31 53.90 3dby n LYS 256 Cb 0.46 -2.85 -0.06 0.00 0.02 0.00 0.00 35.03 32.60 3dby n LYS 256 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3dby s ASN 258 N -2.02 4.59 0.00 0.00 2.47 -1.26 -4.95 114.94 113.76 3dby s ASN 258 Ca -0.05 -0.45 0.29 0.00 0.42 0.00 0.00 52.86 53.07 3dby s ASN 258 Cb -0.01 -1.79 1.27 0.00 -1.45 0.00 0.00 41.25 39.27 3dby s ASN 258 CO -0.02 -0.06 1.93 -0.81 -3.72 0.00 0.00 177.10 174.42 3dby n PRO 259 N 4.82 0.11 0.01 0.43 -0.04 -1.26 -3.50 135.00 135.57 3dby n PRO 259 Ca -0.17 -0.01 -0.04 0.00 -0.04 0.00 0.00 63.50 63.24 3dby n PRO 259 Cb 0.50 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.35 3dby n PRO 259 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3dby h LEU 260 N 0.01 0.00 0.00 1.53 3.38 -1.92 -3.45 115.31 114.86 3dby h LEU 260 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dby h LEU 260 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3dby h LEU 260 CO 0.00 0.78 0.00 1.21 0.09 0.00 0.00 178.44 180.52