#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dby s GLU 3 N 0.00 4.15 0.03 3.23 2.12 -1.26 -4.94 118.70 122.03 3dby s GLU 3 Ca 0.00 2.52 -0.29 0.00 0.36 0.00 0.00 54.97 57.56 3dby s GLU 3 Cb 0.00 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 31.33 3dby s GLU 3 CO 0.00 -0.55 0.95 1.03 -0.54 0.00 0.00 175.26 176.15 3dby s ARG 4 N -1.02 4.59 0.31 4.30 0.52 -1.26 -5.07 118.95 121.32 3dby s ARG 4 Ca 0.59 1.38 0.09 0.00 -0.52 0.00 0.00 55.73 57.27 3dby s ARG 4 Cb -0.46 -3.43 -0.05 0.00 0.52 0.00 0.00 34.95 31.53 3dby s ARG 4 CO 0.52 0.04 -0.00 0.54 0.02 0.00 0.00 175.30 176.42 3dby s ASN 5 N 0.69 4.29 0.17 0.23 2.20 -1.26 -5.00 114.94 116.27 3dby s ASN 5 Ca 0.49 -0.85 -0.14 0.00 -0.94 0.00 0.00 52.86 51.42 3dby s ASN 5 Cb -0.21 -0.63 0.09 0.00 -2.00 0.00 0.00 41.25 38.50 3dby s ASN 5 CO 0.28 -0.13 1.80 0.22 -2.94 0.00 0.00 177.10 176.33 3dby h TYR 6 N 1.86 0.52 0.15 1.54 3.20 -1.94 -1.94 116.97 120.36 3dby h TYR 6 Ca -0.43 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.45 3dby h TYR 6 Cb 1.25 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.36 3dby h TYR 6 CO 0.70 0.29 -0.07 0.93 -1.64 0.00 0.00 178.16 178.37 3dby h GLU 7 N 0.56 -0.20 -0.18 1.82 4.39 -1.99 0.17 114.58 119.16 3dby h GLU 7 Ca 0.20 0.01 -0.19 0.00 0.34 0.00 0.00 59.36 59.72 3dby h GLU 7 Cb 0.04 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 3dby h GLU 7 CO -0.10 0.01 -0.65 0.93 -1.16 0.00 0.00 179.01 178.03 3dby h GLU 8 N -0.37 0.66 0.29 2.33 5.08 -1.99 -2.32 114.58 118.26 3dby h GLU 8 Ca -0.02 -0.48 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 3dby h GLU 8 Cb 0.29 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3dby h GLU 8 CO 0.03 1.10 -0.14 1.03 -1.00 0.00 0.00 179.01 180.04 3dby h SER 9 N 0.48 -0.33 -0.52 1.42 0.87 -1.22 -1.02 113.55 113.24 3dby h SER 9 Ca -0.02 -0.18 0.10 0.00 -1.23 0.00 0.00 61.79 60.47 3dby h SER 9 Cb 1.24 0.08 -0.10 0.00 -0.44 0.00 0.00 62.40 63.19 3dby h SER 9 CO 0.13 0.03 -0.17 0.00 -0.53 0.00 0.00 176.83 176.28 3dby h ALA 10 N -0.14 0.26 -0.53 6.23 0.00 -0.74 -0.46 119.26 123.87 3dby h ALA 10 Ca -0.04 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3dby h ALA 10 Cb 0.49 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3dby h ALA 10 CO 0.06 -0.49 0.11 -0.07 0.00 0.00 0.00 179.25 178.86 3dby h LEU 11 N -0.05 0.82 -0.23 0.00 4.07 -1.40 -1.18 115.31 117.34 3dby h LEU 11 Ca 0.25 -0.25 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 3dby h LEU 11 Cb 0.43 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.94 3dby h LEU 11 CO -0.56 0.86 0.09 0.15 -1.08 0.00 0.00 178.44 177.90 3dby h PHE 12 N 0.75 0.34 -0.23 1.13 3.57 -0.90 -1.40 116.94 120.20 3dby h PHE 12 Ca 0.16 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 3dby h PHE 12 Cb 0.37 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 3dby h PHE 12 CO 0.03 0.37 -0.01 0.93 -2.23 0.00 0.00 178.31 177.40 3dby h GLU 13 N 0.21 0.41 -0.20 1.11 4.39 -0.93 -0.67 114.58 118.90 3dby h GLU 13 Ca 0.08 -0.14 0.01 0.00 0.34 0.00 0.00 59.36 59.65 3dby h GLU 13 Cb 0.17 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.77 3dby h GLU 13 CO -0.01 0.60 0.10 0.45 -1.16 0.00 0.00 179.01 179.00 3dby h HIS 14 N 0.17 0.19 -0.63 4.33 3.86 -1.24 -0.34 115.15 121.50 3dby h HIS 14 Ca 0.06 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.19 3dby h HIS 14 Cb 0.42 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.82 3dby h HIS 14 CO 0.04 0.11 0.04 1.96 0.86 0.00 0.00 177.93 180.94 3dby h GLN 15 N 0.22 1.07 0.71 2.45 4.20 -1.14 0.22 115.11 122.83 3dby h GLN 15 Ca 0.08 -0.32 -0.03 0.00 0.06 0.00 0.00 58.65 58.44 3dby h GLN 15 Cb 0.02 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 27.69 3dby h GLN 15 CO -0.06 1.02 -0.34 0.35 -0.67 0.00 0.00 178.83 179.13 3dby h PHE 16 N 0.99 -0.88 -0.12 2.96 3.57 -0.89 -2.96 116.94 119.60 3dby h PHE 16 Ca 0.18 -0.02 -0.17 0.00 3.53 0.00 0.00 57.97 61.50 3dby h PHE 16 Cb 0.51 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 3dby h PHE 16 CO 0.04 -0.54 -0.63 -1.49 -2.23 0.00 0.00 178.31 173.46 3dby h TRP 17 N -0.99 0.56 -0.03 0.41 4.06 -0.97 -2.06 115.95 116.94 3dby h TRP 17 Ca -0.10 -0.22 -0.14 0.00 2.06 0.00 0.00 58.89 60.49 3dby h TRP 17 Cb 0.74 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.79 3dby h TRP 17 CO -0.02 0.94 -0.63 -0.07 -3.56 0.00 0.00 178.44 175.10 3dby h LEU 18 N 0.32 0.12 -0.32 -4.49 3.38 -0.67 -0.96 115.31 112.69 3dby h LEU 18 Ca -0.01 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 3dby h LEU 18 Cb 1.17 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 3dby h LEU 18 CO 0.11 0.72 -0.19 0.50 0.09 0.00 0.00 178.44 179.67 3dby h LYS 19 N 0.08 0.70 -0.66 1.13 1.63 -1.48 -0.90 116.57 117.07 3dby h LYS 19 Ca -0.01 -0.32 0.09 0.00 -0.85 0.00 0.00 60.65 59.56 3dby h LYS 19 Cb 1.13 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 32.68 3dby h LYS 19 CO 0.09 0.92 0.29 0.28 -3.45 0.00 0.00 179.45 177.59 3dby h VAL 20 N 0.47 0.82 0.00 2.00 2.07 -1.25 -0.15 116.25 120.20 3dby h VAL 20 Ca 0.07 -0.18 -0.18 0.00 0.82 0.00 0.00 66.70 67.24 3dby h VAL 20 Cb 0.73 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3dby h VAL 20 CO 0.05 0.09 -0.84 -0.07 0.02 0.00 0.00 177.57 176.83 3dby h LEU 21 N 0.51 0.00 -0.08 2.57 3.38 -1.16 -1.50 115.31 119.03 3dby h LEU 21 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3dby h LEU 21 Cb 0.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3dby h LEU 21 CO -0.28 0.84 0.05 0.74 0.09 0.00 0.00 178.44 179.89 3dby h THR 22 N 0.00 1.03 -0.32 0.22 2.02 -0.81 -1.77 112.91 113.28 3dby h THR 22 Ca -0.01 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 67.18 3dby h THR 22 Cb 1.49 0.92 -0.07 0.00 -1.74 0.00 0.00 68.15 68.75 3dby h THR 22 CO 0.11 0.03 -0.11 0.44 0.37 0.00 0.00 175.52 176.36 3dby h ASP 23 N 0.11 -0.38 -0.54 4.18 3.45 -0.80 -0.97 116.42 121.47 3dby h ASP 23 Ca 0.03 0.11 0.03 0.00 0.43 0.00 0.00 57.03 57.63 3dby h ASP 23 Cb -0.00 0.23 -0.04 0.00 -0.56 0.00 0.00 39.33 38.96 3dby h ASP 23 CO -0.01 -0.14 0.31 0.45 -1.57 0.00 0.00 179.24 178.28 3dby h HIS 24 N -0.04 0.57 -0.51 4.55 3.86 -1.13 0.10 115.15 122.54 3dby h HIS 24 Ca 0.16 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.38 3dby h HIS 24 Cb 0.28 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.55 3dby h HIS 24 CO -0.32 0.31 0.27 0.00 0.86 0.00 0.00 177.93 179.04 3dby h ALA 25 N 1.26 0.66 -0.72 2.45 0.00 -1.05 -0.68 119.26 121.18 3dby h ALA 25 Ca 0.23 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3dby h ALA 25 Cb 0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3dby h ALA 25 CO -0.12 0.20 0.21 0.37 0.00 0.00 0.00 179.25 179.91 3dby h GLN 26 N 0.68 1.11 -0.42 0.00 5.75 -0.59 -1.62 115.11 120.02 3dby h GLN 26 Ca 0.18 -0.24 -0.12 0.00 -0.15 0.00 0.00 58.65 58.32 3dby h GLN 26 Cb 0.07 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 3dby h GLN 26 CO -0.03 0.95 -0.19 0.74 -2.65 0.00 0.00 178.83 177.65 3dby h PHE 27 N 1.07 1.01 -0.10 3.99 0.04 -0.48 -2.06 116.94 120.41 3dby h PHE 27 Ca 0.23 -0.25 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 3dby h PHE 27 Cb 0.31 -0.23 -0.00 0.00 2.20 0.00 0.00 35.95 38.22 3dby h PHE 27 CO 0.02 1.03 0.02 -0.07 -0.60 0.00 0.00 178.31 178.72 3dby h LEU 28 N 0.70 0.15 -0.36 1.54 3.38 -1.09 -1.61 115.31 118.02 3dby h LEU 28 Ca 0.10 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.90 3dby h LEU 28 Cb 0.76 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.38 3dby h LEU 28 CO 0.06 0.35 -0.35 0.25 0.09 0.00 0.00 178.44 178.84 3dby h LEU 29 N -0.05 -1.14 -1.84 1.67 5.85 -1.27 -1.84 115.31 116.69 3dby h LEU 29 Ca 0.03 0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 3dby h LEU 29 Cb 0.26 0.52 -0.00 0.00 0.37 0.00 0.00 40.66 41.81 3dby h LEU 29 CO 0.00 -0.34 -0.03 0.44 -0.34 0.00 0.00 178.44 178.18 3dby h ASP 30 N -0.29 0.00 0.86 1.25 3.45 -1.23 -2.90 116.42 117.55 3dby h ASP 30 Ca 0.16 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.62 3dby h ASP 30 Cb 0.55 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.32 3dby h ASP 30 CO -0.52 0.03 -0.81 0.00 -1.57 0.00 0.00 179.24 176.37 3dby h ALA 31 N 1.97 0.51 -2.72 3.45 0.00 -0.52 -3.47 119.26 118.49 3dby h ALA 31 Ca -0.00 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.41 3dby h ALA 31 Cb 0.39 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.21 3dby h ALA 31 CO 0.00 0.00 0.48 -0.51 0.00 0.00 0.00 179.25 179.22 3dby s LEU 32 N -4.59 4.35 0.57 0.00 1.43 -0.77 -0.05 118.68 119.61 3dby s LEU 32 Ca 0.04 2.26 -0.18 0.00 -1.03 0.00 0.00 54.13 55.21 3dby s LEU 32 Cb 0.12 -3.87 -0.05 0.00 0.03 0.00 0.00 46.19 42.42 3dby s LEU 32 CO 0.76 -0.40 1.10 0.00 0.23 0.00 0.00 176.35 178.04 3dby s ALA 33 N -1.35 2.68 0.65 4.21 0.00 -0.77 -4.89 121.76 122.30 3dby s ALA 33 Ca 0.51 0.65 0.43 0.00 0.00 0.00 0.00 51.96 53.55 3dby s ALA 33 Cb -0.30 -3.31 2.35 0.00 0.00 0.00 0.00 23.12 21.87 3dby s ALA 33 CO 0.38 -0.82 2.36 -1.35 0.00 0.00 0.00 175.76 176.33 3dby h PRO 34 N 0.86 0.00 0.00 0.00 0.11 -1.95 -0.88 132.00 130.13 3dby h PRO 34 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3dby h PRO 34 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3dby h PRO 34 CO 0.57 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 178.72 3dby n LYS 35 N -3.18 0.08 -1.45 1.05 -0.00 -1.26 -4.13 118.16 109.26 3dby n LYS 35 Ca -0.03 0.17 -0.30 0.00 -0.00 0.00 0.00 58.31 58.15 3dby n LYS 35 Cb 0.07 -1.61 -0.07 0.00 -0.00 0.00 0.00 35.03 33.43 3dby n LYS 35 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 3dby n GLU 36 N -1.74 3.20 -0.35 -1.58 -0.58 -0.34 -4.75 120.64 114.51 3dby n GLU 36 Ca 0.05 -2.25 0.15 0.00 -0.42 0.00 0.00 57.16 54.69 3dby n GLU 36 Cb 0.29 -2.40 0.35 0.00 -0.57 0.00 0.00 31.44 29.11 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 3.93 0.68 -0.04 3.49 1.79 -1.84 -0.96 116.57 123.62 3dby h LYS 37 Ca 0.55 -0.04 -0.19 0.00 -2.18 0.00 0.00 60.65 58.78 3dby h LYS 37 Cb 0.70 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.19 3dby h LYS 37 CO 1.10 0.45 -0.81 0.93 -1.08 0.00 0.00 179.45 180.04 3dby h GLU 38 N 0.70 0.33 0.11 3.15 4.39 -1.96 -1.72 114.58 119.59 3dby h GLU 38 Ca 0.59 -0.31 -0.27 0.00 0.34 0.00 0.00 59.36 59.72 3dby h GLU 38 Cb 1.00 0.08 0.01 0.00 -0.10 0.00 0.00 28.75 29.73 3dby h GLU 38 CO -0.39 0.97 -1.20 -0.44 -1.16 0.00 0.00 179.01 176.79 3dby h ASP 39 N 0.21 0.46 -0.98 1.42 3.32 -1.77 -2.38 116.42 116.70 3dby h ASP 39 Ca -0.04 -0.47 0.05 0.00 0.02 0.00 0.00 57.03 56.58 3dby h ASP 39 Cb 1.40 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 40.74 3dby h ASP 39 CO 0.13 1.35 0.64 0.40 -1.72 0.00 0.00 179.24 180.04 3dby h ILE 40 N 0.10 1.13 -0.45 0.35 2.04 -1.17 0.11 117.51 119.62 3dby h ILE 40 Ca -0.13 -0.41 -0.09 0.00 1.00 0.00 0.00 64.86 65.23 3dby h ILE 40 Cb 1.91 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 3dby h ILE 40 CO 0.20 0.22 -0.07 0.50 0.00 0.00 0.00 178.15 179.00 3dby h LYS 41 N 1.20 0.85 -0.23 2.37 3.64 -1.29 -0.60 116.57 122.51 3dby h LYS 41 Ca 0.41 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 3dby h LYS 41 Cb 0.07 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3dby h LYS 41 CO -0.15 0.94 0.06 0.87 -2.27 0.00 0.00 179.45 178.90 3dby h LYS 42 N 0.69 0.37 -0.39 1.90 1.57 -1.10 -2.39 116.57 117.23 3dby h LYS 42 Ca 0.12 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 3dby h LYS 42 Cb 0.60 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 3dby h LYS 42 CO 0.04 0.48 0.11 0.00 -0.57 0.00 0.00 179.45 179.51 3dby h ALA 43 N 0.88 1.46 -0.31 3.86 0.00 -0.62 -0.63 119.26 123.90 3dby h ALA 43 Ca 0.07 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 3dby h ALA 43 Cb 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3dby h ALA 43 CO 0.00 0.40 -0.41 1.15 0.00 0.00 0.00 179.25 180.39 3dby h THR 44 N 0.56 1.29 -0.62 0.00 2.02 -1.04 0.50 112.91 115.61 3dby h THR 44 Ca 0.13 -1.58 0.00 0.00 0.77 0.00 0.00 66.41 65.73 3dby h THR 44 Cb 0.20 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 3dby h THR 44 CO -0.01 0.51 0.39 0.22 0.37 0.00 0.00 175.52 177.01 3dby h TYR 45 N 0.61 0.80 -0.53 3.16 3.20 -0.94 -1.34 116.97 121.93 3dby h TYR 45 Ca 0.05 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.84 3dby h TYR 45 Cb 0.96 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.94 3dby h TYR 45 CO 0.05 0.53 0.01 0.74 -1.64 0.00 0.00 178.16 177.85 3dby h PHE 46 N 0.84 0.97 -0.37 -3.82 0.04 -0.79 0.21 116.94 114.02 3dby h PHE 46 Ca 0.23 -0.14 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 3dby h PHE 46 Cb -0.05 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.82 3dby h PHE 46 CO -0.02 0.87 0.21 0.28 -0.60 0.00 0.00 178.31 179.05 3dby h VAL 47 N 0.84 1.13 -0.27 -0.55 2.07 -0.59 -1.69 116.25 117.18 3dby h VAL 47 Ca 0.16 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 3dby h VAL 47 Cb 0.48 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3dby h VAL 47 CO 0.02 0.13 0.06 -0.33 0.02 0.00 0.00 177.57 177.47 3dby h GLU 48 N 0.47 0.44 0.43 1.57 5.08 -1.09 -1.77 114.58 119.71 3dby h GLU 48 Ca 0.13 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3dby h GLU 48 Cb 0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3dby h GLU 48 CO -0.02 0.54 -0.27 1.15 -1.00 0.00 0.00 179.01 179.40 3dby h THR 49 N 0.27 0.44 -0.03 1.13 2.02 -0.48 -1.02 112.91 115.23 3dby h THR 49 Ca 0.08 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.13 3dby h THR 49 Cb 0.30 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 3dby h THR 49 CO 0.00 0.00 -0.59 -0.26 0.37 0.00 0.00 175.52 175.05 3dby h PHE 50 N -0.67 0.15 -0.76 3.16 0.04 -1.36 -0.76 116.94 116.73 3dby h PHE 50 Ca -0.05 -0.05 -0.03 0.00 2.80 0.00 0.00 57.97 60.64 3dby h PHE 50 Cb 0.56 -0.03 -0.04 0.00 2.20 0.00 0.00 35.95 38.65 3dby h PHE 50 CO -0.10 0.67 0.35 1.15 -0.60 0.00 0.00 178.31 179.78 3dby h THR 51 N 0.09 1.24 0.24 -1.55 2.02 -1.26 0.23 112.91 113.91 3dby h THR 51 Ca -0.00 -0.71 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 3dby h THR 51 Cb 1.06 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 3dby h THR 51 CO 0.08 0.30 -0.11 -1.13 0.37 0.00 0.00 175.52 175.03 3dby h ASN 52 N 1.08 -0.27 -0.61 4.18 -0.00 -0.74 -2.84 115.58 116.39 3dby h ASN 52 Ca 0.26 -0.15 -0.02 0.00 -0.00 0.00 0.00 56.30 56.39 3dby h ASN 52 Cb 0.14 0.07 -0.03 0.00 -0.00 0.00 0.00 38.32 38.50 3dby h ASN 52 CO -0.03 -0.00 0.31 -0.07 -0.00 0.00 0.00 177.43 177.64 3dby h LEU 53 N -0.54 0.79 -0.64 0.34 3.38 -0.97 0.10 115.31 117.77 3dby h LEU 53 Ca -0.03 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.90 3dby h LEU 53 Cb 0.40 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 3dby h LEU 53 CO 0.05 0.67 0.38 0.25 0.09 0.00 0.00 178.44 179.88 3dby h LEU 54 N 0.89 0.60 0.00 1.67 5.85 -0.56 -2.54 115.31 121.22 3dby h LEU 54 Ca 0.22 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.95 3dby h LEU 54 Cb 0.07 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.99 3dby h LEU 54 CO -0.03 0.40 -0.52 0.78 -0.34 0.00 0.00 178.44 178.74 3dby h ASN 55 N 0.73 0.00 0.98 1.25 2.35 -1.19 -3.33 115.58 116.36 3dby h ASN 55 Ca 0.27 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3dby h ASN 55 Cb 0.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.45 3dby h ASN 55 CO -0.13 0.05 -0.99 2.29 -1.65 0.00 0.00 177.43 177.00 3dby n LYS 56 N -2.38 0.58 -1.88 0.81 2.85 -0.02 -4.90 118.16 113.23 3dby n LYS 56 Ca 0.03 0.12 -0.42 0.00 -1.05 0.00 0.00 58.31 56.99 3dby n LYS 56 Cb 0.47 -1.82 -0.03 0.00 -0.65 0.00 0.00 35.03 33.01 3dby n LYS 56 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 3dby s VAL 57 N -3.35 2.41 0.39 0.58 0.11 -0.98 -4.95 120.40 114.59 3dby s VAL 57 Ca -0.00 0.31 -0.15 0.00 -2.93 0.00 0.00 61.98 59.21 3dby s VAL 57 Cb 0.10 -3.20 0.05 0.00 -1.53 0.00 0.00 36.38 31.80 3dby s VAL 57 CO 0.79 0.04 0.78 0.00 -3.33 0.00 0.00 175.10 173.37 3dby s ARG 58 N 0.45 2.24 0.00 1.54 1.70 -1.26 -5.04 118.95 118.58 3dby s ARG 58 Ca 0.67 -1.47 0.00 0.00 -0.47 0.00 0.00 55.73 54.46 3dby s ARG 58 Cb -0.45 0.62 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 3dby s ARG 58 CO 0.38 -1.04 0.48 0.27 -1.08 0.00 0.00 175.30 174.30 3dby n ASN 59 N -1.45 1.17 -4.35 -2.89 0.23 -1.26 -4.55 115.26 102.17 3dby n ASN 59 Ca -0.08 -1.47 -0.33 0.00 -0.53 0.00 0.00 54.58 52.17 3dby n ASN 59 Cb 0.60 -0.37 -0.14 0.00 -2.08 0.00 0.00 39.78 37.79 3dby n ASN 59 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 3dby s VAL 60 N -0.62 3.04 -1.37 3.53 1.01 -1.26 -4.75 120.40 119.97 3dby s VAL 60 Ca 0.00 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.29 3dby s VAL 60 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 34.09 3dby s VAL 60 CO 0.00 0.51 0.45 0.59 0.00 0.00 0.00 175.10 176.65 3dby n ASN 61 N 3.79 -0.93 -0.06 3.32 3.02 -1.26 -4.87 115.26 118.26 3dby n ASN 61 Ca -0.18 -1.03 -0.03 0.00 -0.03 0.00 0.00 54.58 53.32 3dby n ASN 61 Cb 0.52 -3.01 0.21 0.00 -0.61 0.00 0.00 39.78 36.90 3dby n ASN 61 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3dby h LEU 62 N -1.87 0.65 -0.24 3.41 3.38 -1.85 -0.69 115.31 118.10 3dby h LEU 62 Ca -0.64 -0.14 -0.10 0.00 0.09 0.00 0.00 57.88 57.09 3dby h LEU 62 Cb 1.38 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.95 3dby h LEU 62 CO 0.61 0.72 -0.22 0.24 0.09 0.00 0.00 178.44 179.88 3dby h MET 63 N 0.64 0.58 -0.89 1.13 2.86 -1.91 -1.46 114.93 115.89 3dby h MET 63 Ca 0.13 -0.30 -0.02 0.00 -2.06 0.00 0.00 59.70 57.46 3dby h MET 63 Cb 0.41 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.03 3dby h MET 63 CO 0.02 0.89 0.49 0.00 1.06 0.00 0.00 176.91 179.37 3dby h ALA 64 N 0.68 1.13 -0.81 6.32 0.00 -1.89 -2.34 119.26 122.35 3dby h ALA 64 Ca 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3dby h ALA 64 Cb 0.77 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3dby h ALA 64 CO 0.06 0.63 0.47 0.35 0.00 0.00 0.00 179.25 180.76 3dby h PHE 65 N 1.23 1.09 -0.87 0.00 3.57 -0.90 -2.26 116.94 118.79 3dby h PHE 65 Ca 0.31 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.93 3dby h PHE 65 Cb 0.01 -0.35 -0.09 0.00 2.79 0.00 0.00 35.95 38.31 3dby h PHE 65 CO 0.01 0.74 0.48 0.77 -2.23 0.00 0.00 178.31 178.08 3dby h SER 66 N 1.13 0.64 0.00 0.41 0.02 -0.71 0.47 113.55 115.51 3dby h SER 66 Ca 0.29 0.07 -0.12 0.00 -0.84 0.00 0.00 61.79 61.19 3dby h SER 66 Cb -0.01 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 3dby h SER 66 CO -0.05 0.31 -0.36 0.11 -1.14 0.00 0.00 176.83 175.69 3dby h LYS 67 N 0.73 0.49 -0.39 3.45 1.57 -1.28 0.22 116.57 121.36 3dby h LYS 67 Ca 0.46 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.94 3dby h LYS 67 Cb 0.56 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 3dby h LYS 67 CO -0.32 0.78 -0.04 1.49 -0.57 0.00 0.00 179.45 180.80 3dby h GLU 68 N 0.41 0.71 -0.22 3.15 4.81 -1.16 -1.90 114.58 120.38 3dby h GLU 68 Ca 0.04 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 3dby h GLU 68 Cb 0.83 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 3dby h GLU 68 CO 0.07 0.82 0.13 0.00 -0.73 0.00 0.00 179.01 179.30 3dby h ALA 69 N 0.86 0.28 -0.51 2.92 0.00 -0.77 -2.53 119.26 119.50 3dby h ALA 69 Ca 0.10 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3dby h ALA 69 Cb 0.53 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 3dby h ALA 69 CO 0.03 -0.22 0.30 1.49 0.00 0.00 0.00 179.25 180.85 3dby h GLU 70 N 0.27 0.57 -0.69 0.00 4.81 -0.49 -1.30 114.58 117.75 3dby h GLU 70 Ca 0.08 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.33 3dby h GLU 70 Cb 0.02 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 29.22 3dby h GLU 70 CO -0.01 0.38 0.39 0.37 -0.73 0.00 0.00 179.01 179.40 3dby h GLN 71 N 0.59 0.70 -0.54 1.92 5.75 -1.19 -0.74 115.11 121.59 3dby h GLN 71 Ca 0.21 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.59 3dby h GLN 71 Cb 0.05 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.42 3dby h GLN 71 CO -0.11 0.46 0.03 0.00 -2.65 0.00 0.00 178.83 176.56 3dby h ALA 72 N 1.35 0.72 -0.58 3.38 0.00 -0.99 -2.14 119.26 121.00 3dby h ALA 72 Ca 0.31 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3dby h ALA 72 Cb 0.18 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3dby h ALA 72 CO -0.18 0.52 0.15 0.00 0.00 0.00 0.00 179.25 179.74 3dby h ALA 73 N 0.96 0.76 -0.39 0.00 0.00 -0.87 -0.65 119.26 119.07 3dby h ALA 73 Ca 0.16 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3dby h ALA 73 Cb 0.50 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3dby h ALA 73 CO 0.02 0.46 0.09 0.87 0.00 0.00 0.00 179.25 180.70 3dby h LYS 74 N 0.83 0.58 -0.09 0.00 1.57 -1.01 -0.61 116.57 117.84 3dby h LYS 74 Ca 0.18 -0.10 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 3dby h LYS 74 Cb 0.34 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.55 3dby h LYS 74 CO 0.00 0.54 -0.18 0.93 -0.57 0.00 0.00 179.45 180.16 3dby h GLU 75 N 0.57 0.29 -0.17 3.15 5.08 -0.80 -2.34 114.58 120.36 3dby h GLU 75 Ca 0.13 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 3dby h GLU 75 Cb 0.22 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3dby h GLU 75 CO -0.00 0.78 -0.06 0.97 -1.00 0.00 0.00 179.01 179.69 3dby h ILE 76 N -0.17 1.15 -0.10 3.13 2.10 -1.06 -1.84 117.51 120.72 3dby h ILE 76 Ca 0.00 -0.62 0.00 0.00 1.08 0.00 0.00 64.86 65.32 3dby h ILE 76 Cb 0.77 1.09 -0.01 0.00 -1.09 0.00 0.00 36.82 37.58 3dby h ILE 76 CO 0.04 0.20 0.06 -0.09 -1.08 0.00 0.00 178.15 177.28 3dby h ARG 77 N 0.25 0.12 -0.95 2.19 2.43 -1.03 -0.59 114.38 116.80 3dby h ARG 77 Ca 0.06 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 3dby h ARG 77 Cb 0.28 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 3dby h ARG 77 CO 0.01 0.08 0.63 0.00 -1.51 0.00 0.00 179.97 179.18 3dby h ALA 78 N 1.04 1.32 0.00 2.80 0.00 -1.06 -0.82 119.26 122.54 3dby h ALA 78 Ca 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3dby h ALA 78 Cb -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.39 3dby h ALA 78 CO -0.01 0.63 -0.00 0.35 0.00 0.00 0.00 179.25 180.22 3dby h PHE 79 N 1.29 -0.00 -0.73 0.00 3.57 -1.03 0.49 116.94 120.53 3dby h PHE 79 Ca 0.35 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.90 3dby h PHE 79 Cb -0.15 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 38.54 3dby h PHE 79 CO 0.00 0.14 0.44 0.87 -2.23 0.00 0.00 178.31 177.53 3dby h LYS 80 N -0.15 0.81 -0.15 1.11 1.57 -0.87 0.13 116.57 119.02 3dby h LYS 80 Ca -0.00 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.63 3dby h LYS 80 Cb 0.15 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 3dby h LYS 80 CO 0.00 0.54 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.00 3dby h LEU 81 N 0.84 0.32 -0.68 2.94 3.38 -0.88 -1.04 115.31 120.20 3dby h LEU 81 Ca 0.31 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 3dby h LEU 81 Cb 0.11 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3dby h LEU 81 CO -0.15 0.65 -0.32 -1.13 0.09 0.00 0.00 178.44 177.59 3dby h ASN 82 N 0.27 0.70 -0.15 -0.43 -1.24 -0.14 -0.40 115.58 114.19 3dby h ASN 82 Ca 0.03 -0.28 -0.01 0.00 0.71 0.00 0.00 56.30 56.75 3dby h ASN 82 Cb 0.74 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 39.60 3dby h ASN 82 CO 0.06 0.97 0.05 0.40 -1.29 0.00 0.00 177.43 177.61 3dby h ILE 83 N 0.57 1.19 -0.66 2.57 2.04 -0.24 -2.32 117.51 120.65 3dby h ILE 83 Ca 0.06 -0.58 0.06 0.00 1.00 0.00 0.00 64.86 65.41 3dby h ILE 83 Cb 0.83 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 38.13 3dby h ILE 83 CO 0.07 0.17 0.35 0.40 0.00 0.00 0.00 178.15 179.15 3dby h ILE 84 N 0.06 0.94 -0.25 -0.67 2.04 -1.13 -1.60 117.51 116.91 3dby h ILE 84 Ca 0.05 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.74 3dby h ILE 84 Cb 0.23 0.24 -0.06 0.00 -0.74 0.00 0.00 36.82 36.49 3dby h ILE 84 CO -0.00 0.12 -0.12 -0.61 0.00 0.00 0.00 178.15 177.53 3dby h GLN 85 N 0.65 -0.09 0.00 2.37 4.15 -0.89 -1.22 115.11 120.08 3dby h GLN 85 Ca 0.30 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.69 3dby h GLN 85 Cb 0.22 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.92 3dby h GLN 85 CO -0.20 -0.06 -0.16 0.87 -1.93 0.00 0.00 178.83 177.35 3dby h LYS 86 N -0.09 0.00 -0.10 1.69 1.57 -0.98 -2.15 116.57 116.51 3dby h LYS 86 Ca 0.13 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 3dby h LYS 86 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 3dby h LYS 86 CO -0.31 0.16 -0.24 1.96 -0.57 0.00 0.00 179.45 180.46 3dby h GLN 87 N 0.00 0.33 0.00 3.15 4.20 -0.38 1.02 115.11 123.44 3dby h GLN 87 Ca -0.00 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.48 3dby h GLN 87 Cb 0.41 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.23 3dby h GLN 87 CO 0.02 0.84 0.00 -0.07 -0.67 0.00 0.00 178.83 178.95 3dby h LEU 88 N -0.12 0.00 -2.66 1.46 3.38 -0.86 -1.51 115.31 114.99 3dby h LEU 88 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dby h LEU 88 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 3dby h LEU 88 CO 0.05 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.96 3dby n GLU 89 N -3.05 2.55 -2.78 1.13 1.02 -0.85 -4.98 120.64 113.69 3dby n GLU 89 Ca -0.03 -2.04 -0.17 0.00 -0.02 0.00 0.00 57.16 54.90 3dby n GLU 89 Cb 0.08 -1.32 0.02 0.00 -0.02 0.00 0.00 31.44 30.20 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 0.73 -0.27 0.72 0.62 0.00 -0.15 -4.92 105.19 101.93 3dby n GLY 90 Ca 0.13 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.22 2.74 -3.64 1.61 5.02 0.34 -5.00 118.16 116.00 3dby n LYS 91 Ca -0.11 -2.62 -0.15 0.00 -2.02 0.00 0.00 58.31 53.41 3dby n LYS 91 Cb 0.60 -1.67 -0.08 0.00 -0.02 0.00 0.00 35.03 33.86 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 -2.43 0.01 -0.35 -0.18 2.07 -1.24 -4.94 121.20 114.14 3dby s ILE 92 Ca 0.36 -0.09 -0.09 0.00 -1.41 0.00 0.00 60.65 59.42 3dby s ILE 92 Cb 0.28 -0.83 0.03 0.00 0.13 0.00 0.00 42.46 42.07 3dby s ILE 92 CO 0.09 -0.05 0.16 -0.89 -1.91 0.00 0.00 174.94 172.34 3dby s THR 93 N -0.48 4.26 -0.02 4.00 2.01 -1.26 -4.85 115.64 119.31 3dby s THR 93 Ca -0.06 -0.91 -0.03 0.00 0.31 0.00 0.00 61.69 61.00 3dby s THR 93 Cb -0.03 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.12 3dby s THR 93 CO 0.04 -0.17 0.08 -0.51 -0.69 0.00 0.00 174.62 173.37 3dby s ILE 94 N 1.50 0.02 -0.22 1.82 2.07 -1.26 -1.84 121.20 123.30 3dby s ILE 94 Ca 0.01 -0.20 0.01 0.00 -1.41 0.00 0.00 60.65 59.07 3dby s ILE 94 Cb -0.19 -0.18 0.29 0.00 0.13 0.00 0.00 42.46 42.51 3dby s ILE 94 CO 0.05 -0.11 1.50 1.41 -1.91 0.00 0.00 174.94 175.89 3dby n HIS 95 N 2.67 1.40 -5.02 3.50 8.25 0.93 -4.77 115.22 122.18 3dby n HIS 95 Ca -0.15 -1.23 -0.31 0.00 -0.26 0.00 0.00 57.72 55.78 3dby n HIS 95 Cb 0.58 -0.62 -0.15 0.00 1.12 0.00 0.00 29.99 30.93 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 -1.53 2.37 0.57 4.41 2.99 -1.26 -5.03 117.98 120.50 3dby s PHE 96 Ca 0.26 -0.39 -0.15 0.00 0.00 0.00 0.00 56.93 56.65 3dby s PHE 96 Cb 0.22 -1.45 -0.05 0.00 0.00 0.00 0.00 43.02 41.74 3dby s PHE 96 CO 0.04 0.09 1.02 0.95 -0.00 0.00 0.00 175.22 177.31 3dby s THR 97 N -0.75 4.41 0.33 0.64 -4.23 -1.26 -4.93 115.64 109.85 3dby s THR 97 Ca 0.11 1.02 0.08 0.00 -1.18 0.00 0.00 61.69 61.73 3dby s THR 97 Cb -0.10 -3.67 0.32 0.00 1.34 0.00 0.00 72.50 70.38 3dby s THR 97 CO 0.01 -0.79 1.79 -0.65 -0.54 0.00 0.00 174.62 174.45 3dby h PRO 98 N 0.38 0.68 -0.60 3.99 0.11 -1.98 -2.31 132.00 132.28 3dby h PRO 98 Ca -0.46 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 3dby h PRO 98 Cb 1.19 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3dby h PRO 98 CO 0.60 0.45 0.14 1.15 -0.21 0.00 0.00 178.00 180.14 3dby h THR 99 N 0.70 1.25 -0.56 -1.15 2.02 -1.98 0.27 112.91 113.45 3dby h THR 99 Ca 0.56 -0.91 0.01 0.00 0.77 0.00 0.00 66.41 66.85 3dby h THR 99 Cb 0.96 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 3dby h THR 99 CO -0.34 0.34 0.36 0.15 0.37 0.00 0.00 175.52 176.40 3dby h PHE 100 N 0.87 0.68 -0.03 3.16 3.57 -1.80 0.13 116.94 123.52 3dby h PHE 100 Ca 0.19 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.56 3dby h PHE 100 Cb 0.35 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.85 3dby h PHE 100 CO 0.03 0.41 -0.64 0.82 -2.23 0.00 0.00 178.31 176.69 3dby h ILE 101 N 0.72 1.44 -1.00 1.41 2.04 -1.30 -2.19 117.51 118.62 3dby h ILE 101 Ca 0.22 -2.15 0.07 0.00 1.00 0.00 0.00 64.86 63.99 3dby h ILE 101 Cb -0.04 2.14 -0.07 0.00 -0.74 0.00 0.00 36.82 38.11 3dby h ILE 101 CO -0.07 0.62 0.65 -1.13 0.00 0.00 0.00 178.15 178.22 3dby h ASN 102 N 0.07 1.04 -0.53 1.72 -1.24 0.56 -1.41 115.58 115.78 3dby h ASN 102 Ca -0.01 0.01 -0.09 0.00 0.71 0.00 0.00 56.30 56.92 3dby h ASN 102 Cb 1.15 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.97 3dby h ASN 102 CO 0.09 0.66 -0.00 0.45 -1.29 0.00 0.00 177.43 177.34 3dby h HIS 103 N 1.17 1.05 -0.98 0.67 3.86 -0.26 -1.23 115.15 119.44 3dby h HIS 103 Ca 0.43 -0.17 0.07 0.00 -1.16 0.00 0.00 60.37 59.54 3dby h HIS 103 Cb 0.17 -0.28 -0.07 0.00 1.06 0.00 0.00 27.41 28.29 3dby h HIS 103 CO -0.00 0.94 0.63 0.52 0.86 0.00 0.00 177.93 180.88 3dby h MET 104 N 0.90 1.11 -0.16 2.45 2.86 -0.84 -1.39 114.93 119.86 3dby h MET 104 Ca 0.16 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 3dby h MET 104 Cb 0.52 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3dby h MET 104 CO 0.03 0.73 0.07 0.28 1.06 0.00 0.00 176.91 179.08 3dby h VAL 105 N 1.14 1.13 -0.78 -2.22 2.07 -0.78 -1.58 116.25 115.23 3dby h VAL 105 Ca 0.42 -0.39 0.18 0.00 0.82 0.00 0.00 66.70 67.74 3dby h VAL 105 Cb 0.17 1.10 -0.13 0.00 -1.52 0.00 0.00 31.29 30.91 3dby h VAL 105 CO -0.17 0.12 0.07 0.78 0.02 0.00 0.00 177.57 178.39 3dby h ASN 106 N 0.12 -0.24 0.21 0.57 2.35 -0.82 -0.66 115.58 117.11 3dby h ASN 106 Ca 0.05 0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.98 3dby h ASN 106 Cb 0.13 0.31 0.00 0.00 0.05 0.00 0.00 38.32 38.81 3dby h ASN 106 CO -0.01 -0.16 -0.10 -0.33 -1.65 0.00 0.00 177.43 175.19 3dby h GLU 107 N 0.14 -0.27 0.00 0.81 5.08 -1.01 -2.30 114.58 117.04 3dby h GLU 107 Ca 0.44 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 3dby h GLU 107 Cb 0.80 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 3dby h GLU 107 CO -0.64 -0.01 -0.00 -0.24 -1.00 0.00 0.00 179.01 177.12 3dby h VAL 108 N -0.51 0.89 0.00 3.13 3.04 -1.00 -0.10 116.25 121.70 3dby h VAL 108 Ca -0.03 -0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.55 3dby h VAL 108 Cb 0.39 1.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.65 3dby h VAL 108 CO 0.05 0.00 -0.50 -0.33 -1.01 0.00 0.00 177.57 175.78 3dby h GLU 109 N 0.00 0.00 -0.38 4.17 5.08 -0.92 -1.98 114.58 120.56 3dby h GLU 109 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3dby h GLU 109 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3dby h GLU 109 CO 0.00 0.50 0.07 0.93 -1.00 0.00 0.00 179.01 179.51 3dby h GLU 110 N 0.00 0.62 -0.44 2.33 4.39 -0.46 -1.42 114.58 119.60 3dby h GLU 110 Ca -0.00 -0.16 0.03 0.00 0.34 0.00 0.00 59.36 59.56 3dby h GLU 110 Cb 0.89 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.43 3dby h GLU 110 CO 0.06 0.68 0.24 -0.92 -1.16 0.00 0.00 179.01 177.91 3dby h TYR 111 N 0.47 0.45 -0.40 4.33 3.20 -1.28 -2.11 116.97 121.63 3dby h TYR 111 Ca 0.12 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.95 3dby h TYR 111 Cb 0.35 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 3dby h TYR 111 CO 0.02 0.24 0.03 0.82 -1.64 0.00 0.00 178.16 177.64 3dby h ILE 112 N 0.48 1.21 -0.66 1.81 2.04 -1.28 0.26 117.51 121.37 3dby h ILE 112 Ca 0.19 -0.80 -0.09 0.00 1.00 0.00 0.00 64.86 65.16 3dby h ILE 112 Cb 0.06 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3dby h ILE 112 CO -0.11 0.28 0.08 0.00 0.00 0.00 0.00 178.15 178.40 3dby h ALA 113 N 1.45 0.89 -0.06 1.87 0.00 -1.05 -2.54 119.26 119.82 3dby h ALA 113 Ca 0.13 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 3dby h ALA 113 Cb 0.33 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3dby h ALA 113 CO 0.01 0.67 -0.65 -0.39 0.00 0.00 0.00 179.25 178.89 3dby h VAL 114 N 1.03 1.40 -0.02 0.00 -1.51 -0.51 -2.87 116.25 113.77 3dby h VAL 114 Ca 0.20 -2.08 0.01 0.00 -1.23 0.00 0.00 66.70 63.59 3dby h VAL 114 Cb 0.48 2.08 -0.00 0.00 -2.13 0.00 0.00 31.29 31.71 3dby h VAL 114 CO 0.02 0.61 0.03 -0.07 -1.23 0.00 0.00 177.57 176.93 3dby h LEU 115 N 0.17 0.00 -0.10 4.19 3.38 -0.31 -0.65 115.31 121.98 3dby h LEU 115 Ca -0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dby h LEU 115 Cb 1.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 3dby h LEU 115 CO 0.10 0.00 0.06 -0.08 0.09 0.00 0.00 178.44 178.61 3dby h GLU 116 N 0.00 0.14 0.47 1.13 4.81 -1.22 -1.87 114.58 118.05 3dby h GLU 116 Ca 0.01 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3dby h GLU 116 Cb 0.07 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.42 3dby h GLU 116 CO -0.00 0.17 -0.23 0.74 -0.73 0.00 0.00 179.01 178.96 3dby h PHE 117 N 0.07 -0.59 -1.01 0.92 0.04 -1.53 -3.31 116.94 111.53 3dby h PHE 117 Ca 0.04 -0.01 0.24 0.00 2.80 0.00 0.00 57.97 61.03 3dby h PHE 117 Cb 0.07 0.20 -0.11 0.00 2.20 0.00 0.00 35.95 38.30 3dby h PHE 117 CO -0.05 -0.27 0.62 -0.07 -0.60 0.00 0.00 178.31 177.94 3dby h LEU 118 N -0.89 0.62 -0.05 1.54 3.38 -1.06 -0.82 115.31 118.04 3dby h LEU 118 Ca -0.07 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3dby h LEU 118 Cb 0.58 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.35 3dby h LEU 118 CO 0.11 0.13 -0.05 2.29 0.09 0.00 0.00 178.44 181.00 3dby n LYS 119 N -4.79 0.34 -0.19 1.13 2.85 -0.71 -1.95 118.16 114.84 3dby n LYS 119 Ca 0.26 -0.05 0.12 0.00 -1.05 0.00 0.00 58.31 57.59 3dby n LYS 119 Cb 0.76 -1.50 0.23 0.00 -0.65 0.00 0.00 35.03 33.87 3dby n LYS 119 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 3dby n LYS 120 N -1.29 2.46 -2.09 -1.58 5.02 -0.37 -4.92 118.16 115.39 3dby n LYS 120 Ca 0.12 -2.21 -0.09 0.00 -2.02 0.00 0.00 58.31 54.10 3dby n LYS 120 Cb 0.28 -1.51 -0.01 0.00 -0.02 0.00 0.00 35.03 33.77 3dby n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dby n GLY 121 N 1.49 0.09 3.61 0.72 0.00 -0.82 -5.03 105.19 105.24 3dby n GLY 121 Ca 0.19 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 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 -4.31 2.61 -0.12 1.61 2.02 -0.84 -4.97 118.70 114.71 3dby s GLU 122 Ca 0.00 -0.68 -0.29 0.00 0.02 0.00 0.00 54.97 54.02 3dby s GLU 122 Cb 0.00 -2.54 -0.06 0.00 0.10 0.00 0.00 34.13 31.63 3dby s GLU 122 CO 0.00 0.61 2.02 0.08 0.02 0.00 0.00 175.26 178.00 3dby s VAL 123 N -0.99 3.12 0.33 2.63 1.01 -1.26 -3.43 120.40 121.81 3dby s VAL 123 Ca 0.17 0.14 -0.29 0.00 0.00 0.00 0.00 61.98 61.99 3dby s VAL 123 Cb -0.11 -3.12 -0.11 0.00 0.00 0.00 0.00 36.38 33.03 3dby s VAL 123 CO 0.07 -0.05 1.52 -2.16 0.00 0.00 0.00 175.10 174.48 3dby s PRO 124 N 5.34 4.13 1.00 2.72 0.04 -1.26 -4.97 135.00 142.00 3dby s PRO 124 Ca 0.91 2.55 -0.12 0.00 0.04 0.00 0.00 61.00 64.38 3dby s PRO 124 Cb -0.36 -3.00 0.19 0.00 0.04 0.00 0.00 34.50 31.37 3dby s PRO 124 CO 0.37 -0.56 1.08 -1.25 0.04 0.00 0.00 177.00 176.68 3dby s PRO 125 N -1.36 0.42 -0.24 0.56 0.04 -1.26 -5.00 135.00 128.16 3dby s PRO 125 Ca 0.57 0.82 -0.17 0.00 0.04 0.00 0.00 61.00 62.27 3dby s PRO 125 Cb -0.47 -1.71 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 3dby s PRO 125 CO 0.56 -2.82 0.46 0.08 0.04 0.00 0.00 177.00 175.32 3dby s VAL 126 N -2.78 5.12 0.76 -0.36 1.01 -1.26 -5.07 120.40 117.82 3dby s VAL 126 Ca 0.66 0.79 -0.11 0.00 0.00 0.00 0.00 61.98 63.31 3dby s VAL 126 Cb -0.20 -3.78 0.05 0.00 0.00 0.00 0.00 36.38 32.44 3dby s VAL 126 CO 0.59 0.15 1.10 -0.36 0.00 0.00 0.00 175.10 176.58 3dby s PHE 127 N 1.97 3.04 0.27 5.22 0.08 -1.26 -4.97 117.98 122.33 3dby s PHE 127 Ca 0.20 1.11 -0.29 0.00 0.12 0.00 0.00 56.93 58.06 3dby s PHE 127 Cb -0.15 -3.10 -0.14 0.00 -0.57 0.00 0.00 43.02 39.05 3dby s PHE 127 CO 0.09 -1.52 1.09 1.58 -0.10 0.00 0.00 175.22 176.36 3dby n HIS 128 N -3.25 1.43 -0.23 0.36 -0.00 -1.26 -4.75 115.22 107.51 3dby n HIS 128 Ca 0.07 0.67 0.22 0.00 -0.00 0.00 0.00 57.72 58.67 3dby n HIS 128 Cb 0.57 -2.28 0.56 0.00 -0.00 0.00 0.00 29.99 28.83 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 2.42 0.30 -0.15 1.57 4.11 -1.92 -0.11 114.58 120.80 3dby h GLU 129 Ca -0.41 -0.02 -0.03 0.00 0.07 0.00 0.00 59.36 58.97 3dby h GLU 129 Cb 1.33 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3dby h GLU 129 CO 0.63 0.20 -0.04 -0.07 0.07 0.00 0.00 179.01 179.80 3dby h LEU 130 N 0.31 0.20 -0.34 3.06 3.38 -1.97 -1.88 115.31 118.08 3dby h LEU 130 Ca 0.47 -0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.49 3dby h LEU 130 Cb 1.32 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.94 3dby h LEU 130 CO -0.15 0.28 -0.14 -0.74 0.09 0.00 0.00 178.44 177.78 3dby h HIS 131 N 0.22 -0.34 -0.53 1.13 2.76 -1.35 -0.87 115.15 116.16 3dby h HIS 131 Ca 0.05 0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.18 3dby h HIS 131 Cb 0.22 0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.36 3dby h HIS 131 CO 0.00 -0.22 0.05 1.88 -1.30 0.00 0.00 177.93 178.35 3dby h TYR 132 N -0.08 0.98 -0.18 5.26 0.05 -1.46 -2.40 116.97 119.14 3dby h TYR 132 Ca 0.17 -0.15 0.03 0.00 0.05 0.00 0.00 58.73 58.83 3dby h TYR 132 Cb 0.34 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 37.79 3dby h TYR 132 CO -0.36 0.89 -0.03 0.45 -1.05 0.00 0.00 178.16 178.06 3dby h HIS 133 N 0.79 -0.06 0.00 4.88 3.86 -1.17 0.16 115.15 123.61 3dby h HIS 133 Ca 0.16 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 3dby h HIS 133 Cb 0.46 0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.99 3dby h HIS 133 CO 0.03 -0.06 -0.09 -0.07 0.86 0.00 0.00 177.93 178.61 3dby h LEU 134 N 0.02 0.00 0.07 2.43 3.38 -1.01 -2.02 115.31 118.18 3dby h LEU 134 Ca 0.09 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.83 3dby h LEU 134 Cb 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3dby h LEU 134 CO -0.17 0.09 -1.20 0.58 0.09 0.00 0.00 178.44 177.83 3dby h VAL 135 N 0.00 1.10 -0.00 1.22 2.07 -0.99 -3.43 116.25 116.22 3dby h VAL 135 Ca -0.00 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.18 3dby h VAL 135 Cb 0.38 2.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 3dby h VAL 135 CO 0.01 0.60 -0.79 0.79 0.02 0.00 0.00 177.57 178.21 3dby n TRP 136 N -4.13 0.00 -0.03 1.57 7.02 0.53 -3.66 117.44 118.74 3dby n TRP 136 Ca -0.25 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.09 3dby n TRP 136 Cb 0.80 -0.02 -0.12 0.00 -2.42 0.00 0.00 31.31 29.55 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 0.77 0.14 -1.30 -0.99 3.38 -1.56 0.28 115.31 116.03 3dby h LEU 137 Ca 0.00 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.19 3dby h LEU 137 Cb 0.58 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 3dby h LEU 137 CO 0.00 0.91 0.41 0.71 0.09 0.00 0.00 178.44 180.56 3dby h THR 138 N -0.60 1.18 -0.25 0.22 1.35 -1.79 -0.95 112.91 112.07 3dby h THR 138 Ca -0.02 -0.37 0.04 0.00 -0.55 0.00 0.00 66.41 65.51 3dby h THR 138 Cb 0.93 0.24 -0.04 0.00 -1.73 0.00 0.00 68.15 67.55 3dby h THR 138 CO 0.03 0.18 -0.01 -0.78 -0.25 0.00 0.00 175.52 174.69 3dby h ASP 139 N 0.90 -0.12 -0.41 5.36 1.82 -1.61 0.69 116.42 123.06 3dby h ASP 139 Ca 0.24 0.06 -0.03 0.00 -0.39 0.00 0.00 57.03 56.91 3dby h ASP 139 Cb -0.06 0.11 -0.02 0.00 0.68 0.00 0.00 39.33 40.04 3dby h ASP 139 CO -0.05 -0.03 0.15 0.00 -1.61 0.00 0.00 179.24 177.70 3dby h ALA 140 N 1.22 0.53 -0.94 -0.78 0.00 -0.48 0.01 119.26 118.81 3dby h ALA 140 Ca 0.12 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.00 3dby h ALA 140 Cb 0.16 -0.16 -0.09 0.00 0.00 0.00 0.00 17.79 17.70 3dby h ALA 140 CO -0.21 0.16 0.57 0.00 0.00 0.00 0.00 179.25 179.77 3dby h ALA 141 N 0.99 1.42 -0.17 0.00 0.00 -0.98 -0.67 119.26 119.85 3dby h ALA 141 Ca 0.13 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 3dby h ALA 141 Cb 0.22 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3dby h ALA 141 CO -0.01 0.13 -0.54 0.78 0.00 0.00 0.00 179.25 179.61 3dby h GLY 142 N 0.88 0.55 0.84 0.00 0.00 -0.31 -0.59 103.07 104.44 3dby h GLY 142 Ca 0.48 -0.63 0.01 0.00 0.00 0.00 0.00 47.33 47.18 3dby h GLY 142 CO -0.29 0.57 -0.11 0.45 0.00 0.00 0.00 176.54 177.16 3dby h HIS 143 N 0.39 -0.28 -0.17 5.60 3.86 -0.44 0.46 115.15 124.57 3dby h HIS 143 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3dby h HIS 143 Cb 1.07 0.11 -0.01 0.00 1.06 0.00 0.00 27.41 29.65 3dby h HIS 143 CO 0.04 -0.17 0.10 0.00 0.86 0.00 0.00 177.93 178.76 3dby h ALA 144 N 0.65 0.21 -0.67 2.45 0.00 -1.05 -2.31 119.26 118.54 3dby h ALA 144 Ca 0.01 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3dby h ALA 144 Cb 0.23 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3dby h ALA 144 CO -0.04 -0.32 0.44 0.78 0.00 0.00 0.00 179.25 180.11 3dby h GLY 145 N 0.21 0.94 1.30 0.00 0.00 -0.99 -1.88 103.07 102.65 3dby h GLY 145 Ca 0.06 -0.35 -0.11 0.00 0.00 0.00 0.00 47.33 46.93 3dby h GLY 145 CO -0.02 0.34 -0.19 0.23 0.00 0.00 0.00 176.54 176.89 3dby h SER 146 N 0.90 0.82 -0.17 0.19 0.87 0.23 -1.73 113.55 114.66 3dby h SER 146 Ca 0.25 -0.28 -0.00 0.00 -1.23 0.00 0.00 61.79 60.52 3dby h SER 146 Cb -0.10 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 61.63 3dby h SER 146 CO -0.05 1.00 0.10 0.40 -0.53 0.00 0.00 176.83 177.74 3dby h ILE 147 N 0.71 1.09 -0.51 2.23 2.04 -1.12 0.13 117.51 122.09 3dby h ILE 147 Ca 0.10 -0.24 0.10 0.00 1.00 0.00 0.00 64.86 65.83 3dby h ILE 147 Cb 0.71 0.94 -0.10 0.00 -0.74 0.00 0.00 36.82 37.63 3dby h ILE 147 CO 0.05 0.09 -0.14 0.28 0.00 0.00 0.00 178.15 178.43 3dby h SER 148 N 0.19 -0.52 1.00 1.72 0.02 -1.21 -1.63 113.55 113.12 3dby h SER 148 Ca 0.06 0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 61.08 3dby h SER 148 Cb 0.05 0.34 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 3dby h SER 148 CO -0.01 -0.18 -0.42 1.23 -1.14 0.00 0.00 176.83 176.31 3dby h GLY 149 N -0.02 0.00 2.00 -3.77 0.00 -1.26 -3.17 103.07 96.86 3dby h GLY 149 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3dby h GLY 149 CO -0.54 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.61 3dby n GLY 150 N 0.50 -1.62 3.79 4.60 0.00 0.46 -4.88 105.19 108.04 3dby n GLY 150 Ca 0.00 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 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 -4.04 4.33 0.63 0.99 1.43 -0.76 -1.19 118.68 120.08 3dby s LEU 151 Ca 0.11 1.76 -0.17 0.00 -1.03 0.00 0.00 54.13 54.80 3dby s LEU 151 Cb 0.14 -3.95 -0.07 0.00 0.03 0.00 0.00 46.19 42.34 3dby s LEU 151 CO 0.56 -0.06 0.51 -0.67 0.23 0.00 0.00 176.35 176.92 3dby n ASP 152 N 0.55 -1.16 -0.34 2.29 2.03 0.16 -4.88 116.55 115.19 3dby n ASP 152 Ca 0.01 0.67 0.21 0.00 0.52 0.00 0.00 54.79 56.21 3dby n ASP 152 Cb 0.50 -1.18 0.45 0.00 -0.72 0.00 0.00 41.12 40.17 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 -0.01 0.56 -0.05 -2.67 5.85 -1.95 -2.31 115.31 114.72 3dby h LEU 153 Ca -0.46 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.39 3dby h LEU 153 Cb 1.38 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.45 3dby h LEU 153 CO 0.45 0.05 -0.09 1.33 -0.34 0.00 0.00 178.44 179.84 3dby n VAL 154 N -4.81 0.00 -1.25 1.05 0.24 -1.26 -4.30 118.33 107.99 3dby n VAL 154 Ca 0.28 -0.01 -0.28 0.00 -2.04 0.00 0.00 64.34 62.28 3dby n VAL 154 Cb 0.86 -0.31 -0.08 0.00 -1.47 0.00 0.00 33.84 32.84 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 -1.32 3.05 -0.15 7.34 -0.58 -0.87 -4.68 120.64 123.43 3dby n GLU 155 Ca 0.10 -1.84 -0.08 0.00 -0.42 0.00 0.00 57.16 54.93 3dby n GLU 155 Cb 0.30 -2.45 0.01 0.00 -0.57 0.00 0.00 31.44 28.73 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 4.11 0.63 -0.62 3.49 1.79 -1.83 -0.88 116.57 123.25 3dby h LYS 156 Ca 0.58 -0.07 -0.05 0.00 -2.18 0.00 0.00 60.65 58.94 3dby h LYS 156 Cb 0.78 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.27 3dby h LYS 156 CO 1.13 0.48 0.20 0.00 -1.08 0.00 0.00 179.45 180.18 3dby h ARG 157 N 0.60 0.96 -0.54 3.15 2.47 -1.97 0.63 114.38 119.68 3dby h ARG 157 Ca 0.16 -0.20 -0.07 0.00 -1.26 0.00 0.00 59.98 58.61 3dby h ARG 157 Cb 0.03 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.18 3dby h ARG 157 CO -0.03 0.84 0.06 -0.07 0.56 0.00 0.00 179.97 181.33 3dby h LEU 158 N 0.89 0.88 -0.63 3.04 3.38 -1.91 -2.36 115.31 118.59 3dby h LEU 158 Ca 0.20 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 3dby h LEU 158 Cb 0.28 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3dby h LEU 158 CO -0.01 0.94 0.29 0.50 0.09 0.00 0.00 178.44 180.25 3dby h LYS 159 N 0.80 0.92 -0.81 1.13 3.64 -1.00 -1.12 116.57 120.13 3dby h LYS 159 Ca 0.16 -0.14 0.05 0.00 -1.27 0.00 0.00 60.65 59.45 3dby h LYS 159 Cb 0.45 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.05 3dby h LYS 159 CO 0.02 0.74 0.50 0.93 -2.27 0.00 0.00 179.45 179.37 3dby h GLU 160 N 0.87 0.90 -0.54 1.90 5.08 -0.69 -1.12 114.58 120.98 3dby h GLU 160 Ca 0.22 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 3dby h GLU 160 Cb 0.14 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3dby h GLU 160 CO -0.03 0.59 -0.04 -0.22 -1.00 0.00 0.00 179.01 178.32 3dby h LYS 161 N 0.92 0.98 0.00 2.33 1.63 -0.95 -1.53 116.57 119.96 3dby h LYS 161 Ca 0.35 -0.33 -0.15 0.00 -0.85 0.00 0.00 60.65 59.67 3dby h LYS 161 Cb 0.14 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.67 3dby h LYS 161 CO -0.16 1.01 -0.70 0.66 -3.45 0.00 0.00 179.45 176.81 3dby h SER 162 N 0.85 0.00 -0.80 4.20 4.64 -0.98 -2.11 113.55 119.36 3dby h SER 162 Ca 0.15 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.45 3dby h SER 162 Cb 0.59 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.64 3dby h SER 162 CO 0.04 0.70 0.44 -0.33 -0.87 0.00 0.00 176.83 176.80 3dby h GLU 163 N 0.00 1.11 -0.25 4.77 4.39 -1.11 0.81 114.58 124.29 3dby h GLU 163 Ca -0.01 -0.13 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 3dby h GLU 163 Cb 1.33 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 3dby h GLU 163 CO 0.09 0.82 0.12 1.49 -1.16 0.00 0.00 179.01 180.37 3dby h GLU 164 N 1.11 0.36 -0.61 2.33 4.81 -0.94 -1.41 114.58 120.23 3dby h GLU 164 Ca 0.28 -0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.56 3dby h GLU 164 Cb 0.03 -0.06 -0.08 0.00 0.63 0.00 0.00 28.75 29.27 3dby h GLU 164 CO -0.05 0.36 0.20 0.74 -0.73 0.00 0.00 179.01 179.53 3dby h PHE 165 N 0.27 0.34 -0.16 0.92 0.04 -1.32 -1.55 116.94 115.48 3dby h PHE 165 Ca 0.09 0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.94 3dby h PHE 165 Cb 0.12 -0.06 -0.06 0.00 2.20 0.00 0.00 35.95 38.15 3dby h PHE 165 CO -0.02 0.06 -0.25 1.15 -0.60 0.00 0.00 178.31 178.64 3dby h THR 166 N 0.36 0.40 -0.20 -1.55 2.02 -0.58 -1.25 112.91 112.10 3dby h THR 166 Ca 0.31 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.55 3dby h THR 166 Cb 0.41 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 67.16 3dby h THR 166 CO -0.34 0.00 -0.25 0.50 0.37 0.00 0.00 175.52 175.81 3dby h LYS 167 N -0.30 -0.27 -0.22 6.66 3.64 -1.04 -1.20 116.57 123.85 3dby h LYS 167 Ca 0.11 0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 3dby h LYS 167 Cb 0.47 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 3dby h LYS 167 CO -0.34 -0.18 0.13 0.45 -2.27 0.00 0.00 179.45 177.25 3dby h HIS 168 N -0.28 0.25 -0.77 1.91 3.86 -1.06 0.08 115.15 119.15 3dby h HIS 168 Ca 0.12 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.29 3dby h HIS 168 Cb 0.46 -0.08 -0.03 0.00 1.06 0.00 0.00 27.41 28.82 3dby h HIS 168 CO -0.38 0.16 0.29 0.74 0.86 0.00 0.00 177.93 179.60 3dby h PHE 169 N 0.28 1.20 -0.80 2.45 0.04 -1.10 0.13 116.94 119.14 3dby h PHE 169 Ca 0.09 -0.10 0.00 0.00 2.80 0.00 0.00 57.97 60.76 3dby h PHE 169 Cb -0.01 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 37.74 3dby h PHE 169 CO -0.07 0.92 0.51 0.93 -0.60 0.00 0.00 178.31 180.00 3dby h GLU 170 N 1.13 1.06 -0.46 1.51 5.08 -0.89 -0.28 114.58 121.73 3dby h GLU 170 Ca 0.26 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.42 3dby h GLU 170 Cb 0.24 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3dby h GLU 170 CO -0.02 0.71 -0.20 1.96 -1.00 0.00 0.00 179.01 180.46 3dby h GLN 171 N 1.08 0.96 -0.84 2.33 4.20 -0.57 -1.90 115.11 120.36 3dby h GLN 171 Ca 0.29 -0.41 0.01 0.00 0.06 0.00 0.00 58.65 58.60 3dby h GLN 171 Cb -0.10 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.60 3dby h GLN 171 CO -0.06 1.07 0.56 0.74 -0.67 0.00 0.00 178.83 180.47 3dby h PHE 172 N 0.80 1.05 -0.66 2.96 0.04 -0.56 -2.70 116.94 117.87 3dby h PHE 172 Ca 0.11 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.92 3dby h PHE 172 Cb 0.77 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 38.53 3dby h PHE 172 CO 0.05 0.66 0.42 -0.92 -0.60 0.00 0.00 178.31 177.92 3dby h TYR 173 N 1.13 0.79 -0.91 -0.55 3.20 -0.53 0.14 116.97 120.23 3dby h TYR 173 Ca 0.31 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.21 3dby h TYR 173 Cb -0.12 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 37.85 3dby h TYR 173 CO -0.01 0.46 0.60 -0.07 -1.64 0.00 0.00 178.16 177.50 3dby h LEU 174 N 0.83 1.04 -0.20 2.82 3.38 -1.12 0.14 115.31 122.20 3dby h LEU 174 Ca 0.26 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 3dby h LEU 174 Cb -0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 3dby h LEU 174 CO -0.09 0.75 -0.06 0.50 0.09 0.00 0.00 178.44 179.63 3dby h LYS 175 N 1.23 0.38 -0.86 1.13 3.64 -1.10 -2.08 116.57 118.91 3dby h LYS 175 Ca 0.34 -0.15 0.15 0.00 -1.27 0.00 0.00 60.65 59.72 3dby h LYS 175 Cb -0.13 -0.02 -0.10 0.00 -0.41 0.00 0.00 32.23 31.58 3dby h LYS 175 CO -0.08 0.65 0.44 0.00 -2.27 0.00 0.00 179.45 178.19 3dby h ALA 176 N 0.73 1.31 0.19 5.00 0.00 -0.21 -0.30 119.26 125.96 3dby h ALA 176 Ca 0.05 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3dby h ALA 176 Cb 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3dby h ALA 176 CO 0.02 -0.10 -0.09 0.28 0.00 0.00 0.00 179.25 179.36 3dby h VAL 177 N 0.62 0.84 -0.02 0.00 2.07 -0.82 -0.57 116.25 118.37 3dby h VAL 177 Ca 0.47 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.88 3dby h VAL 177 Cb 0.69 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3dby h VAL 177 CO -0.37 0.03 -0.01 -0.33 0.02 0.00 0.00 177.57 176.91 3dby h GLU 178 N -0.30 -0.01 -0.09 1.57 4.39 -1.13 -2.55 114.58 116.46 3dby h GLU 178 Ca -0.03 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.70 3dby h GLU 178 Cb 0.24 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.88 3dby h GLU 178 CO 0.04 -0.00 0.08 0.52 -1.16 0.00 0.00 179.01 178.49 3dby h MET 179 N -0.01 0.00 -0.50 2.33 2.86 -1.01 -0.28 114.93 118.32 3dby h MET 179 Ca 0.01 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.57 3dby h MET 179 Cb 0.02 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 3dby h MET 179 CO -0.02 0.00 -0.00 1.15 1.06 0.00 0.00 176.91 179.10 3dby h THR 180 N 0.00 1.25 -0.39 2.22 2.02 -0.67 -2.26 112.91 115.09 3dby h THR 180 Ca 0.04 -1.04 -0.10 0.00 0.77 0.00 0.00 66.41 66.09 3dby h THR 180 Cb 0.20 0.86 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3dby h THR 180 CO -0.00 0.37 -0.16 1.23 0.37 0.00 0.00 175.52 177.33 3dby h GLY 181 N 0.98 0.78 1.81 2.16 0.00 -0.95 -2.50 103.07 105.34 3dby h GLY 181 Ca 0.15 -0.61 0.03 0.00 0.00 0.00 0.00 47.33 46.90 3dby h GLY 181 CO 0.02 0.56 0.07 -0.97 0.00 0.00 0.00 176.54 176.22 3dby h TYR 182 N 0.64 0.00 0.00 5.60 0.05 -0.81 -1.45 116.97 121.00 3dby h TYR 182 Ca 0.10 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.88 3dby h TYR 182 Cb 0.63 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.37 3dby h TYR 182 CO 0.03 0.00 0.21 -0.07 -1.05 0.00 0.00 178.16 177.28 3dby h LEU 183 N 0.00 0.00 -1.74 3.88 3.38 -1.10 -0.04 115.31 119.70 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 -1.42 -0.19 114.38 116.98 3dby h ARG 184 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dby h ARG 184 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.48 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 -2.77 0.97 -1.15 2.04 -2.24 -0.03 -4.86 114.28 106.25 3dby n THR 185 Ca -0.00 0.26 -0.05 0.00 -2.27 0.00 0.00 64.05 61.99 3dby n THR 185 Cb 0.18 -1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 67.29 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 -1.79 -0.65 -3.53 -0.78 1.02 -0.08 -5.00 120.64 109.83 3dby n GLU 186 Ca 0.03 0.57 -0.42 0.00 -0.02 0.00 0.00 57.16 57.32 3dby n GLU 186 Cb 0.18 -4.33 -0.10 0.00 -0.02 0.00 0.00 31.44 27.17 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 -1.19 4.95 0.00 -4.62 2.96 -1.26 -4.97 118.68 114.55 3dby s LEU 187 Ca 0.00 -0.98 0.23 0.00 -0.22 0.00 0.00 54.13 53.15 3dby s LEU 187 Cb 0.00 -2.09 0.10 0.00 0.50 0.00 0.00 46.19 44.70 3dby s LEU 187 CO 0.00 -0.43 1.13 1.41 -1.32 0.00 0.00 176.35 177.14 3dby n HIS 188 N 5.08 0.00 -3.74 5.38 8.25 -1.26 -4.48 115.22 124.45 3dby n HIS 188 Ca -0.11 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.20 3dby n HIS 188 Cb 0.46 -0.09 -0.15 0.00 1.12 0.00 0.00 29.99 31.33 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 -2.92 -0.12 0.07 4.41 3.76 -1.26 -5.05 115.29 114.19 3dby s HIS 189 Ca 0.11 0.42 -0.19 0.00 -0.15 0.00 0.00 55.06 55.25 3dby s HIS 189 Cb 0.17 -0.14 0.04 0.00 1.11 0.00 0.00 32.58 33.76 3dby s HIS 189 CO 0.76 -0.16 0.45 -0.59 -0.85 0.00 0.00 174.74 174.35 3dby s PHE 190 N 1.27 -0.31 0.38 1.40 -0.12 -1.26 -5.06 117.98 114.27 3dby s PHE 190 Ca -0.08 0.21 0.08 0.00 -0.05 0.00 0.00 56.93 57.09 3dby s PHE 190 Cb -0.12 0.28 0.82 0.00 -0.63 0.00 0.00 43.02 43.38 3dby s PHE 190 CO -0.05 -0.64 1.95 -1.35 -0.05 0.00 0.00 175.22 175.07 3dby h PRO 191 N 2.71 0.65 -0.57 1.99 0.11 -2.01 -1.05 132.00 133.83 3dby h PRO 191 Ca -0.32 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 3dby h PRO 191 Cb 1.23 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 3dby h PRO 191 CO 0.43 0.43 0.21 0.00 -0.21 0.00 0.00 178.00 178.86 3dby h ALA 192 N 1.62 1.30 -0.14 -0.75 0.00 -1.99 -0.55 119.26 118.76 3dby h ALA 192 Ca 0.33 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 3dby h ALA 192 Cb 0.41 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 3dby h ALA 192 CO -0.11 0.51 -0.07 1.25 0.00 0.00 0.00 179.25 180.83 3dby h LEU 193 N 0.82 0.30 -0.64 0.00 5.85 -1.62 -1.57 115.31 118.46 3dby h LEU 193 Ca 0.19 -0.41 0.06 0.00 0.84 0.00 0.00 57.88 58.56 3dby h LEU 193 Cb 0.18 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 3dby h LEU 193 CO -0.02 0.65 0.34 0.11 -0.34 0.00 0.00 178.44 179.19 3dby h LYS 194 N -0.04 0.62 -0.16 1.25 1.79 -1.18 -1.62 116.57 117.23 3dby h LYS 194 Ca 0.03 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3dby h LYS 194 Cb 0.53 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.03 3dby h LYS 194 CO 0.02 0.41 0.10 -0.22 -1.08 0.00 0.00 179.45 178.68 3dby h LYS 195 N 0.64 0.22 -0.48 3.15 1.63 -1.15 -2.16 116.57 118.41 3dby h LYS 195 Ca 0.28 -0.02 0.09 0.00 -0.85 0.00 0.00 60.65 60.16 3dby h LYS 195 Cb 0.18 -0.05 -0.10 0.00 -0.60 0.00 0.00 32.23 31.66 3dby h LYS 195 CO -0.18 0.19 -0.28 0.35 -3.45 0.00 0.00 179.45 176.07 3dby h PHE 196 N 0.19 -0.76 -0.09 1.91 3.57 -0.98 -0.90 116.94 119.87 3dby h PHE 196 Ca 0.06 0.06 -0.07 0.00 3.53 0.00 0.00 57.97 61.55 3dby h PHE 196 Cb 0.03 0.41 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 3dby h PHE 196 CO -0.05 -0.35 -0.24 1.15 -2.23 0.00 0.00 178.31 176.58 3dby h THR 197 N -0.17 1.22 -0.32 4.41 2.02 -1.13 0.84 112.91 119.78 3dby h THR 197 Ca 0.21 -1.02 -0.06 0.00 0.77 0.00 0.00 66.41 66.32 3dby h THR 197 Cb 0.52 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 3dby h THR 197 CO -0.59 0.30 -0.03 0.11 0.37 0.00 0.00 175.52 175.69 3dby h LYS 198 N 0.14 0.58 -0.65 6.66 1.57 -0.75 -1.10 116.57 123.03 3dby h LYS 198 Ca 0.02 -0.20 0.04 0.00 -1.87 0.00 0.00 60.65 58.65 3dby h LYS 198 Cb 0.52 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.73 3dby h LYS 198 CO 0.04 0.74 0.38 -0.44 -0.57 0.00 0.00 179.45 179.59 3dby h ASP 199 N 0.37 0.59 -0.62 0.86 3.32 -0.42 -1.48 116.42 119.04 3dby h ASP 199 Ca 0.09 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.09 3dby h ASP 199 Cb 0.49 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 3dby h ASP 199 CO 0.02 0.40 0.12 0.58 -1.72 0.00 0.00 179.24 178.64 3dby h VAL 200 N 0.72 1.26 -0.29 -1.35 2.07 -0.79 -2.28 116.25 115.58 3dby h VAL 200 Ca 0.28 -0.96 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 3dby h VAL 200 Cb 0.10 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3dby h VAL 200 CO -0.14 0.36 -0.04 0.28 0.02 0.00 0.00 177.57 178.04 3dby h SER 201 N 0.91 0.43 0.26 0.57 0.02 -0.66 -0.75 113.55 114.34 3dby h SER 201 Ca 0.19 -0.09 -0.25 0.00 -0.84 0.00 0.00 61.79 60.80 3dby h SER 201 Cb 0.39 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 62.83 3dby h SER 201 CO 0.01 0.53 -1.05 0.17 -1.14 0.00 0.00 176.83 175.35 3dby h LEU 202 N 0.44 0.66 -1.08 5.07 8.10 -1.10 -2.31 115.31 125.09 3dby h LEU 202 Ca 0.09 -0.56 0.02 0.00 0.11 0.00 0.00 57.88 57.54 3dby h LEU 202 Cb 0.36 -0.20 -0.05 0.00 -0.44 0.00 0.00 40.66 40.32 3dby h LEU 202 CO 0.01 1.37 0.62 -0.08 -4.11 0.00 0.00 178.44 176.26 3dby h GLU 203 N 0.26 1.21 -0.07 0.17 4.57 -1.00 -1.09 114.58 118.61 3dby h GLU 203 Ca -0.11 -0.07 -0.10 0.00 -1.18 0.00 0.00 59.36 57.89 3dby h GLU 203 Cb 1.70 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 30.01 3dby h GLU 203 CO 0.19 0.80 -0.41 -0.07 -1.18 0.00 0.00 179.01 178.33 3dby h LEU 204 N 1.24 0.17 -0.21 1.64 3.38 -1.07 0.09 115.31 120.54 3dby h LEU 204 Ca 0.36 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.22 3dby h LEU 204 Cb -0.08 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3dby h LEU 204 CO -0.09 0.57 -0.02 0.50 0.09 0.00 0.00 178.44 179.48 3dby h LYS 205 N 0.13 0.39 -0.89 1.13 1.63 -1.05 -0.61 116.57 117.30 3dby h LYS 205 Ca 0.01 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 3dby h LYS 205 Cb 0.79 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.35 3dby h LYS 205 CO 0.06 0.61 0.56 -0.07 -3.45 0.00 0.00 179.45 177.16 3dby h LEU 206 N 0.13 1.04 -0.49 5.20 3.38 -0.93 -2.46 115.31 121.18 3dby h LEU 206 Ca 0.06 -0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 3dby h LEU 206 Cb 0.45 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3dby h LEU 206 CO 0.02 0.78 -0.24 0.15 0.09 0.00 0.00 178.44 179.24 3dby h PHE 207 N 1.21 1.13 -0.65 1.13 3.57 -0.85 -2.25 116.94 120.24 3dby h PHE 207 Ca 0.32 -0.28 0.01 0.00 3.53 0.00 0.00 57.97 61.55 3dby h PHE 207 Cb -0.10 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.35 3dby h PHE 207 CO -0.00 1.11 0.43 0.77 -2.23 0.00 0.00 178.31 178.38 3dby h SER 208 N 0.84 0.73 -0.49 0.41 0.02 -1.00 0.17 113.55 114.23 3dby h SER 208 Ca 0.10 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3dby h SER 208 Cb 0.82 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 3dby h SER 208 CO 0.07 0.52 0.32 -0.74 -1.14 0.00 0.00 176.83 175.87 3dby h HIS 209 N 0.87 0.62 -0.59 3.45 -0.00 -1.18 0.42 115.15 118.74 3dby h HIS 209 Ca 0.25 0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.65 3dby h HIS 209 Cb -0.07 -0.21 -0.04 0.00 -0.00 0.00 0.00 27.41 27.09 3dby h HIS 209 CO -0.03 0.40 0.36 0.35 -0.00 0.00 0.00 177.93 179.01 3dby h PHE 210 N 0.66 0.68 -0.34 5.26 3.57 -0.93 -0.45 116.94 125.40 3dby h PHE 210 Ca 0.18 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.61 3dby h PHE 210 Cb -0.07 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.44 3dby h PHE 210 CO -0.04 0.39 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.18 3dby h LEU 211 N 0.71 0.62 -0.45 0.59 3.38 -0.30 0.21 115.31 120.07 3dby h LEU 211 Ca 0.24 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3dby h LEU 211 Cb 0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3dby h LEU 211 CO -0.10 0.81 0.12 0.45 0.09 0.00 0.00 178.44 179.82 3dby h HIS 212 N 0.56 0.75 -0.61 1.13 3.86 -0.60 -0.69 115.15 119.55 3dby h HIS 212 Ca 0.09 -0.08 0.04 0.00 -1.16 0.00 0.00 60.37 59.26 3dby h HIS 212 Cb 0.62 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.84 3dby h HIS 212 CO 0.03 0.68 0.35 1.49 0.86 0.00 0.00 177.93 181.34 3dby h GLU 213 N 0.60 0.66 -0.49 2.45 4.81 -0.44 -1.30 114.58 120.87 3dby h GLU 213 Ca 0.14 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 3dby h GLU 213 Cb 0.30 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 3dby h GLU 213 CO -0.00 0.44 0.07 0.28 -0.73 0.00 0.00 179.01 179.07 3dby h VAL 214 N 0.68 1.25 -0.68 0.32 2.07 -0.46 -0.04 116.25 119.39 3dby h VAL 214 Ca 0.25 -0.93 0.02 0.00 0.82 0.00 0.00 66.70 66.87 3dby h VAL 214 Cb 0.08 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 3dby h VAL 214 CO -0.13 0.33 0.43 -0.08 0.02 0.00 0.00 177.57 178.14 3dby h GLU 215 N 0.68 0.84 -0.36 1.57 4.81 -0.89 0.14 114.58 121.37 3dby h GLU 215 Ca 0.15 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.21 3dby h GLU 215 Cb 0.40 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 3dby h GLU 215 CO 0.01 0.55 -0.27 0.93 -0.73 0.00 0.00 179.01 179.51 3dby h GLU 216 N 0.86 0.73 -0.80 1.92 5.08 -0.90 -1.37 114.58 120.10 3dby h GLU 216 Ca 0.27 -0.31 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3dby h GLU 216 Cb -0.02 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 3dby h GLU 216 CO -0.09 0.92 0.53 -0.07 -1.00 0.00 0.00 179.01 179.30 3dby h LEU 217 N 0.63 0.90 -0.38 1.33 3.38 -0.69 -2.34 115.31 118.15 3dby h LEU 217 Ca 0.08 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3dby h LEU 217 Cb 0.78 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3dby h LEU 217 CO 0.06 0.65 -0.06 -0.33 0.09 0.00 0.00 178.44 178.85 3dby h GLU 218 N 1.06 0.71 -0.20 1.13 4.39 -0.24 -0.73 114.58 120.70 3dby h GLU 218 Ca 0.30 -0.26 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 3dby h GLU 218 Cb -0.09 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 3dby h GLU 218 CO -0.07 0.85 -0.24 -0.07 -1.16 0.00 0.00 179.01 178.31 3dby h LEU 219 N 0.52 0.37 -2.12 1.33 3.38 -1.17 -2.46 115.31 115.16 3dby h LEU 219 Ca 0.10 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dby h LEU 219 Cb 0.57 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3dby h LEU 219 CO 0.03 0.62 0.00 -1.54 0.09 0.00 0.00 178.44 177.64 3dby n SER 220 N -4.14 3.10 -2.16 -0.43 3.41 -0.89 -4.94 113.62 107.58 3dby n SER 220 Ca -0.01 -1.98 -0.18 0.00 -0.26 0.00 0.00 58.87 56.45 3dby n SER 220 Cb 0.38 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 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 1.21 -4.98 -0.06 4.04 3.02 -0.91 -4.87 115.26 112.70 3dby n ASN 221 Ca 0.20 0.17 0.12 0.00 -0.03 0.00 0.00 54.58 55.04 3dby n ASN 221 Cb 0.50 -4.26 0.31 0.00 -0.61 0.00 0.00 39.78 35.72 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 -2.71 0.22 -4.86 3.52 1.02 -0.33 -4.82 120.64 112.68 3dby n GLU 222 Ca -0.20 -0.12 -0.32 0.00 -0.02 0.00 0.00 57.16 56.50 3dby n GLU 222 Cb 0.63 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.42 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 -2.86 2.89 -0.25 2.62 0.11 -1.21 -5.04 120.40 116.64 3dby s VAL 223 Ca 0.15 -0.90 -0.15 0.00 -2.93 0.00 0.00 61.98 58.15 3dby s VAL 223 Cb 0.18 -2.15 -0.04 0.00 -1.53 0.00 0.00 36.38 32.85 3dby s VAL 223 CO 0.64 0.51 0.39 -0.76 -3.33 0.00 0.00 175.10 172.56 3dby s LEU 224 N -0.94 4.07 0.09 2.54 1.43 -1.26 -4.92 118.68 119.69 3dby s LEU 224 Ca 0.12 0.36 -0.25 0.00 -1.03 0.00 0.00 54.13 53.33 3dby s LEU 224 Cb -0.11 -2.47 0.09 0.00 0.03 0.00 0.00 46.19 43.74 3dby s LEU 224 CO 0.02 -0.17 1.15 -0.94 0.23 0.00 0.00 176.35 176.64 3dby s SER 225 N 1.49 -0.01 -0.23 2.29 1.04 -1.26 -0.67 113.70 116.34 3dby s SER 225 Ca 0.16 -0.43 0.13 0.00 0.48 0.00 0.00 55.95 56.29 3dby s SER 225 Cb -0.15 0.33 0.49 0.00 0.10 0.00 0.00 66.02 66.79 3dby s SER 225 CO 0.09 -0.66 1.41 1.33 0.98 0.00 0.00 173.24 176.40 3dby n VAL 226 N -0.73 2.38 -2.26 5.02 0.24 -0.33 -4.88 118.33 117.76 3dby n VAL 226 Ca -0.01 -2.39 -0.10 0.00 -2.04 0.00 0.00 64.34 59.79 3dby n VAL 226 Cb 0.60 -0.29 0.06 0.00 -1.47 0.00 0.00 33.84 32.73 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 -0.93 0.00 -3.87 1.34 4.77 -1.26 -5.04 117.00 112.01 3dby n LEU 227 Ca 0.27 -0.87 -0.09 0.00 -0.03 0.00 0.00 56.01 55.28 3dby n LEU 227 Cb 0.94 -0.30 -0.08 0.00 -2.33 0.00 0.00 43.42 41.65 3dby n LEU 227 CO 0.15 -0.74 -0.12 -0.94 -1.33 0.00 0.00 177.39 174.42 3dby s SER 228 N -2.81 0.11 0.36 -1.43 1.04 -1.26 -5.03 113.70 104.69 3dby s SER 228 Ca 0.29 -0.55 0.05 0.00 0.48 0.00 0.00 55.95 56.22 3dby s SER 228 Cb -0.02 0.30 0.71 0.00 0.10 0.00 0.00 66.02 67.12 3dby s SER 228 CO 0.20 -0.64 1.98 0.00 0.98 0.00 0.00 173.24 175.75 3dby h ALA 229 N 3.12 1.66 -0.53 5.32 0.00 -1.87 -2.69 119.26 124.27 3dby h ALA 229 Ca -0.33 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 3dby h ALA 229 Cb 1.19 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 3dby h ALA 229 CO 0.53 0.25 -0.03 -0.09 0.00 0.00 0.00 179.25 179.92 3dby h ARG 230 N 0.78 0.92 -0.74 0.00 2.43 -1.95 -1.66 114.38 114.16 3dby h ARG 230 Ca 0.29 -0.28 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3dby h ARG 230 Cb 0.15 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 3dby h ARG 230 CO -0.09 0.93 0.41 1.98 -1.51 0.00 0.00 179.97 181.69 3dby h MET 231 N 0.85 1.03 -0.66 0.20 4.05 -1.90 -0.52 114.93 117.99 3dby h MET 231 Ca 0.15 -0.12 -0.02 0.00 -0.28 0.00 0.00 59.70 59.43 3dby h MET 231 Cb 0.54 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.11 3dby h MET 231 CO 0.03 0.77 0.32 0.00 0.23 0.00 0.00 176.91 178.26 3dby h ALA 232 N 1.21 0.85 -0.10 0.39 0.00 -1.15 -0.92 119.26 119.55 3dby h ALA 232 Ca 0.26 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 3dby h ALA 232 Cb 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3dby h ALA 232 CO -0.04 0.41 0.06 0.22 0.00 0.00 0.00 179.25 179.90 3dby h ASP 233 N 0.92 0.12 -0.57 0.00 3.58 -1.25 -0.31 116.42 118.90 3dby h ASP 233 Ca 0.23 -0.04 0.07 0.00 0.42 0.00 0.00 57.03 57.71 3dby h ASP 233 Cb 0.12 -0.03 -0.06 0.00 1.72 0.00 0.00 39.33 41.08 3dby h ASP 233 CO -0.03 0.12 0.26 -0.74 -2.88 0.00 0.00 179.24 175.97 3dby h HIS 234 N 0.10 0.47 -0.46 0.28 2.76 -0.86 -0.74 115.15 116.70 3dby h HIS 234 Ca 0.04 0.03 -0.14 0.00 -2.20 0.00 0.00 60.37 58.09 3dby h HIS 234 Cb 0.03 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 3dby h HIS 234 CO -0.06 0.18 -0.25 0.52 -1.30 0.00 0.00 177.93 177.02 3dby h MET 235 N 0.48 0.98 -0.73 5.26 2.86 -0.99 -2.19 114.93 120.59 3dby h MET 235 Ca 0.27 -0.44 -0.01 0.00 -2.06 0.00 0.00 59.70 57.46 3dby h MET 235 Cb 0.25 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.86 3dby h MET 235 CO -0.23 1.11 0.41 0.00 1.06 0.00 0.00 176.91 179.26 3dby h ALA 236 N 0.84 0.94 -0.60 6.32 0.00 -0.80 -1.69 119.26 124.26 3dby h ALA 236 Ca 0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3dby h ALA 236 Cb 0.83 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3dby h ALA 236 CO 0.07 0.44 0.23 0.00 0.00 0.00 0.00 179.25 180.00 3dby h ARG 237 N 1.01 0.88 -0.33 0.00 3.08 -1.03 -1.83 114.38 116.16 3dby h ARG 237 Ca 0.26 -0.14 -0.13 0.00 0.07 0.00 0.00 59.98 60.04 3dby h ARG 237 Cb 0.02 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3dby h ARG 237 CO -0.04 0.73 -0.33 0.93 -1.07 0.00 0.00 179.97 180.19 3dby h GLU 238 N 0.87 0.72 -0.35 0.04 5.08 -1.27 -2.10 114.58 117.57 3dby h GLU 238 Ca 0.20 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 58.15 3dby h GLU 238 Cb 0.18 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 3dby h GLU 238 CO -0.02 0.95 -0.12 0.93 -1.00 0.00 0.00 179.01 179.75 3dby h GLU 239 N 0.61 0.60 -0.39 2.33 4.39 -1.13 -2.10 114.58 118.89 3dby h GLU 239 Ca 0.07 -0.18 -0.04 0.00 0.34 0.00 0.00 59.36 59.54 3dby h GLU 239 Cb 0.85 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.42 3dby h GLU 239 CO 0.07 0.71 0.09 0.00 -1.16 0.00 0.00 179.01 178.72 3dby h TYR 241 N 0.49 0.75 -0.60 0.00 3.20 -1.20 0.32 116.97 119.93 3dby h TYR 241 Ca 0.12 -0.05 0.03 0.00 3.14 0.00 0.00 58.73 61.97 3dby h TYR 241 Cb 0.32 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 3dby h TYR 241 CO 0.02 0.61 0.37 -0.92 -1.64 0.00 0.00 178.16 176.60 3dby h TYR 242 N 0.68 0.69 -0.53 -3.82 3.20 -1.26 -0.91 116.97 115.02 3dby h TYR 242 Ca 0.17 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.06 3dby h TYR 242 Cb 0.16 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 3dby h TYR 242 CO 0.00 0.40 0.34 -0.07 -1.64 0.00 0.00 178.16 177.19 3dby h LEU 243 N 0.73 0.61 -0.05 2.82 3.38 -0.28 -0.85 115.31 121.68 3dby h LEU 243 Ca 0.24 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.20 3dby h LEU 243 Cb 0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3dby h LEU 243 CO -0.10 0.45 -0.03 0.25 0.09 0.00 0.00 178.44 179.10 3dby h LEU 244 N 0.71 -0.11 -0.71 1.67 5.85 -0.07 -1.11 115.31 121.54 3dby h LEU 244 Ca 0.19 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.89 3dby h LEU 244 Cb -0.07 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 3dby h LEU 244 CO -0.04 -0.05 0.25 0.11 -0.34 0.00 0.00 178.44 178.37 3dby h LYS 245 N -0.04 1.09 -0.85 1.25 1.79 -1.03 -1.04 116.57 117.74 3dby h LYS 245 Ca 0.03 -0.22 0.01 0.00 -2.18 0.00 0.00 60.65 58.29 3dby h LYS 245 Cb 0.09 -0.17 -0.04 0.00 -1.58 0.00 0.00 32.23 30.53 3dby h LYS 245 CO -0.07 0.92 0.55 -0.07 -1.08 0.00 0.00 179.45 179.70 3dby h LEU 246 N 1.04 0.99 -0.29 2.94 3.38 -1.00 -0.13 115.31 122.25 3dby h LEU 246 Ca 0.23 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 3dby h LEU 246 Cb 0.26 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3dby h LEU 246 CO -0.01 0.73 -0.26 0.00 0.09 0.00 0.00 178.44 178.98 3dby h ALA 247 N 1.45 0.42 -0.23 1.53 0.00 -0.37 0.98 119.26 123.05 3dby h ALA 247 Ca 0.31 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 3dby h ALA 247 Cb -0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3dby h ALA 247 CO -0.07 0.42 -0.34 1.96 0.00 0.00 0.00 179.25 181.22 3dby h GLN 248 N 0.44 0.63 0.04 0.00 4.20 -1.12 0.04 115.11 119.34 3dby h GLN 248 Ca 0.05 -0.38 -0.24 0.00 0.06 0.00 0.00 58.65 58.14 3dby h GLN 248 Cb 0.83 0.03 0.01 0.00 0.30 0.00 0.00 27.48 28.65 3dby h GLN 248 CO 0.07 0.99 -1.03 0.66 -0.67 0.00 0.00 178.83 178.84 3dby h SER 249 N 0.33 0.53 0.69 1.46 4.64 -0.96 -3.35 113.55 116.89 3dby h SER 249 Ca 0.02 -0.46 -0.11 0.00 -0.47 0.00 0.00 61.79 60.77 3dby h SER 249 Cb 0.93 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 62.83 3dby h SER 249 CO 0.08 1.28 -1.39 -0.24 -0.87 0.00 0.00 176.83 175.69 3dby n SER 250 N -3.70 0.73 -0.01 4.97 2.88 0.33 -4.68 113.62 114.14 3dby n SER 250 Ca -0.08 0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 3dby n SER 250 Cb 0.89 0.46 0.00 0.00 -0.75 0.00 0.00 64.21 64.81 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 1.33 0.96 3.69 0.46 0.00 -0.56 -5.05 105.19 106.02 3dby n GLY 251 Ca -0.07 -0.02 -0.24 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.03 3.15 0.39 0.99 1.43 -0.11 -5.06 118.68 119.45 3dby s LEU 252 Ca 0.00 -0.85 -0.28 0.00 -1.03 0.00 0.00 54.13 51.98 3dby s LEU 252 Cb 0.00 -1.59 -0.10 0.00 0.03 0.00 0.00 46.19 44.52 3dby s LEU 252 CO 0.00 -0.26 1.45 -0.70 0.23 0.00 0.00 176.35 177.08 3dby s GLU 253 N -3.79 4.05 0.47 1.70 2.12 -1.26 -4.59 118.70 117.41 3dby s GLU 253 Ca 0.36 2.50 -0.24 0.00 0.36 0.00 0.00 54.97 57.95 3dby s GLU 253 Cb -0.02 -2.92 -0.07 0.00 0.26 0.00 0.00 34.13 31.38 3dby s GLU 253 CO 0.21 -0.55 1.33 -1.64 -0.54 0.00 0.00 175.26 174.08 3dby s MET 254 N -2.13 3.61 0.49 4.30 -1.94 -1.26 -4.83 119.30 117.53 3dby s MET 254 Ca 0.54 2.19 -0.20 0.00 -1.71 0.00 0.00 55.69 56.51 3dby s MET 254 Cb -0.45 -2.52 -0.08 0.00 2.01 0.00 0.00 34.83 33.78 3dby s MET 254 CO 0.61 -0.80 1.02 -1.25 -0.01 0.00 0.00 175.02 174.59 3dby s PRO 255 N -2.57 3.82 -1.12 2.03 0.04 -1.26 -4.99 135.00 130.96 3dby s PRO 255 Ca 0.63 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.85 3dby s PRO 255 Cb -0.39 -2.10 0.23 0.00 0.04 0.00 0.00 34.50 32.28 3dby s PRO 255 CO 0.48 -0.40 1.20 0.15 0.04 0.00 0.00 177.00 178.47 3dby s LYS 256 N -3.35 4.11 0.10 4.56 1.02 -1.26 -4.94 119.74 119.98 3dby s LYS 256 Ca 0.66 -2.92 -0.25 0.00 0.02 0.00 0.00 55.97 53.48 3dby s LYS 256 Cb -0.15 -4.73 0.07 0.00 -0.52 0.00 0.00 37.83 32.51 3dby s LYS 256 CO 0.21 -1.43 0.63 0.00 -0.92 0.00 0.00 175.35 173.84 3dby s ASN 258 N -2.33 5.18 0.24 0.00 3.84 -1.26 -4.96 114.94 115.64 3dby s ASN 258 Ca -0.02 -0.86 0.20 0.00 0.21 0.00 0.00 52.86 52.39 3dby s ASN 258 Cb -0.01 -1.87 0.93 0.00 -0.55 0.00 0.00 41.25 39.75 3dby s ASN 258 CO -0.07 -0.24 1.61 -2.65 -2.79 0.00 0.00 177.10 172.96 3dby n PRO 259 N 4.85 0.14 -0.03 0.43 -0.02 -1.26 -3.53 135.00 135.58 3dby n PRO 259 Ca -0.14 0.49 -0.01 0.00 -2.02 0.00 0.00 63.50 61.82 3dby n PRO 259 Cb 0.47 -1.84 -0.13 0.00 -0.02 0.00 0.00 33.50 31.98 3dby n PRO 259 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dby n LEU 260 N -2.12 0.35 -3.64 2.45 4.77 -1.26 -4.78 117.00 112.77 3dby n LEU 260 Ca 0.01 0.16 -0.07 0.00 -0.03 0.00 0.00 56.01 56.08 3dby n LEU 260 Cb 0.13 0.21 -0.07 0.00 -2.33 0.00 0.00 43.42 41.37 3dby n LEU 260 CO 0.14 0.25 0.48 -0.70 -1.33 0.00 0.00 177.39 176.22 3dby s GLU 261 N -2.90 0.62 0.42 3.23 2.12 -1.23 -4.94 118.70 116.02 3dby s GLU 261 Ca -0.07 1.00 -0.06 0.00 0.36 0.00 0.00 54.97 56.21 3dby s GLU 261 Cb 0.09 0.16 0.09 0.00 0.26 0.00 0.00 34.13 34.74 3dby s GLU 261 CO 0.84 -0.12 0.57 0.41 -0.54 0.00 0.00 175.26 176.42 3dby n GLY 262 N 3.80 -0.76 0.14 -1.50 0.00 -1.26 -4.61 105.19 101.00 3dby n GLY 262 Ca -0.18 -1.77 0.12 0.00 0.00 0.00 0.00 46.02 44.19 3dby n GLY 262 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 3dby n HIS 263 N -2.63 0.00 -0.02 1.61 1.44 -1.26 -4.23 115.22 110.13 3dby n HIS 263 Ca 0.08 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.81 3dby n HIS 263 Cb 0.27 -0.15 -0.08 0.00 0.12 0.00 0.00 29.99 30.14 3dby n HIS 263 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3dby n HIS 264 N -1.05 0.00 -3.50 -1.40 8.25 -1.26 -4.83 115.22 111.43 3dby n HIS 264 Ca 0.08 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.14 3dby n HIS 264 Cb 0.35 -0.32 -0.04 0.00 1.12 0.00 0.00 29.99 31.10 3dby n HIS 264 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3dby s HIS 265 N -2.57 4.06 0.04 4.41 3.76 -1.26 -4.94 115.29 118.79 3dby s HIS 265 Ca -0.04 -2.86 -0.27 0.00 -0.15 0.00 0.00 55.06 51.74 3dby s HIS 265 Cb 0.06 -3.52 0.09 0.00 1.11 0.00 0.00 32.58 30.32 3dby s HIS 265 CO 0.43 -0.84 0.84 -3.38 -0.85 0.00 0.00 174.74 170.94 3dby s HIS 266 N -1.26 -0.36 -0.28 1.40 -0.00 -1.26 -4.62 115.29 108.90 3dby s HIS 266 Ca 0.29 0.20 0.08 0.00 -0.00 0.00 0.00 55.06 55.62 3dby s HIS 266 Cb -0.09 0.55 0.46 0.00 -0.00 0.00 0.00 32.58 33.51 3dby s HIS 266 CO -0.10 -0.63 1.19 0.72 -0.00 0.00 0.00 174.74 175.91 3dby n HIS 267 N -0.29 2.52 -0.11 0.38 8.25 -1.26 -5.17 115.22 119.54 3dby n HIS 267 Ca -0.10 -2.17 0.00 0.00 -0.26 0.00 0.00 57.72 55.19 3dby n HIS 267 Cb 0.62 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.40 3dby n HIS 267 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59