#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 4.34 0.14 3.23 2.12 -1.26 -4.98 118.70 122.28 3dby s GLU 3 Ca 0.00 2.06 -0.30 0.00 0.36 0.00 0.00 54.97 57.09 3dby s GLU 3 Cb 0.00 -3.24 -0.07 0.00 0.26 0.00 0.00 34.13 31.09 3dby s GLU 3 CO 0.00 -0.39 1.06 1.03 -0.54 0.00 0.00 175.26 176.42 3dby s ARG 4 N 0.83 4.61 0.32 4.30 0.52 -1.26 -5.05 118.95 123.23 3dby s ARG 4 Ca 0.63 1.63 0.06 0.00 -0.52 0.00 0.00 55.73 57.53 3dby s ARG 4 Cb -0.37 -3.32 -0.06 0.00 0.52 0.00 0.00 34.95 31.72 3dby s ARG 4 CO 0.32 0.09 -0.03 0.54 0.02 0.00 0.00 175.30 176.24 3dby s ASN 5 N 0.06 2.97 0.03 0.23 6.03 -1.26 -5.02 114.94 117.98 3dby s ASN 5 Ca 0.49 -1.26 -0.22 0.00 -1.03 0.00 0.00 52.86 50.84 3dby s ASN 5 Cb -0.27 -0.21 -0.15 0.00 -3.03 0.00 0.00 41.25 37.59 3dby s ASN 5 CO 0.32 -0.40 1.40 0.22 -2.03 0.00 0.00 177.10 176.62 3dby h TYR 6 N 2.13 0.24 -0.39 1.54 3.20 -1.94 -0.92 116.97 120.83 3dby h TYR 6 Ca -0.41 -0.06 -0.07 0.00 3.14 0.00 0.00 58.73 61.34 3dby h TYR 6 Cb 1.24 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.44 3dby h TYR 6 CO 0.68 0.54 -0.01 0.93 -1.64 0.00 0.00 178.16 178.65 3dby h GLU 7 N -0.13 0.70 -0.41 1.82 3.07 -1.97 -0.38 114.58 117.29 3dby h GLU 7 Ca 0.03 -0.23 -0.15 0.00 -0.50 0.00 0.00 59.36 58.51 3dby h GLU 7 Cb 0.47 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 3dby h GLU 7 CO 0.01 0.80 -0.32 0.93 -1.40 0.00 0.00 179.01 179.03 3dby h GLU 8 N 0.52 0.94 -0.03 2.33 5.08 -1.99 -1.83 114.58 119.61 3dby h GLU 8 Ca 0.11 -0.46 -0.00 0.00 -1.00 0.00 0.00 59.36 58.00 3dby h GLU 8 Cb 0.49 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 3dby h GLU 8 CO 0.02 1.12 -0.00 0.77 -1.00 0.00 0.00 179.01 179.92 3dby h SER 9 N 0.77 0.05 -0.37 1.42 0.02 -0.95 -1.67 113.55 112.82 3dby h SER 9 Ca 0.08 -0.33 0.08 0.00 -0.84 0.00 0.00 61.79 60.77 3dby h SER 9 Cb 0.91 -0.01 -0.07 0.00 0.14 0.00 0.00 62.40 63.36 3dby h SER 9 CO 0.08 0.37 -0.11 0.00 -1.14 0.00 0.00 176.83 176.03 3dby h ALA 10 N 0.68 0.22 -0.22 3.77 0.00 -1.12 0.17 119.26 122.75 3dby h ALA 10 Ca 0.01 0.14 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3dby h ALA 10 Cb 0.34 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3dby h ALA 10 CO 0.00 -0.48 0.13 1.25 0.00 0.00 0.00 179.25 180.16 3dby h LEU 11 N -0.03 0.22 -0.13 0.00 5.85 -1.29 -1.33 115.31 118.61 3dby h LEU 11 Ca 0.18 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 3dby h LEU 11 Cb 0.30 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 3dby h LEU 11 CO -0.40 0.16 0.07 0.15 -0.34 0.00 0.00 178.44 178.09 3dby h PHE 12 N 0.27 0.18 -0.27 1.25 3.57 -1.01 -1.37 116.94 119.55 3dby h PHE 12 Ca 0.08 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 3dby h PHE 12 Cb -0.01 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 3dby h PHE 12 CO -0.07 0.18 -0.04 0.93 -2.23 0.00 0.00 178.31 177.07 3dby h GLU 13 N 0.12 0.51 0.04 1.11 4.39 -0.57 -0.21 114.58 119.96 3dby h GLU 13 Ca 0.05 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.57 3dby h GLU 13 Cb 0.06 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.66 3dby h GLU 13 CO -0.01 0.70 -0.05 0.45 -1.16 0.00 0.00 179.01 178.94 3dby h HIS 14 N 0.27 -0.12 -0.85 4.33 3.86 -1.26 -0.98 115.15 120.40 3dby h HIS 14 Ca 0.07 0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.37 3dby h HIS 14 Cb 0.49 0.05 -0.07 0.00 1.06 0.00 0.00 27.41 28.94 3dby h HIS 14 CO 0.04 -0.07 0.51 1.96 0.86 0.00 0.00 177.93 181.23 3dby h GLN 15 N -0.10 0.83 0.20 2.45 4.20 -1.09 -0.10 115.11 121.51 3dby h GLN 15 Ca 0.01 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 3dby h GLN 15 Cb 0.10 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.70 3dby h GLN 15 CO -0.02 0.55 -0.10 0.35 -0.67 0.00 0.00 178.83 178.94 3dby h PHE 16 N 0.86 -0.25 0.09 2.96 3.57 -0.66 -2.92 116.94 120.58 3dby h PHE 16 Ca 0.40 -0.01 -0.26 0.00 3.53 0.00 0.00 57.97 61.64 3dby h PHE 16 Cb 0.33 0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.16 3dby h PHE 16 CO -0.05 -0.02 -1.15 -1.49 -2.23 0.00 0.00 178.31 173.37 3dby h TRP 17 N -0.45 0.49 -0.07 0.41 4.06 -1.11 -1.99 115.95 117.29 3dby h TRP 17 Ca -0.03 -0.33 -0.13 0.00 2.06 0.00 0.00 58.89 60.46 3dby h TRP 17 Cb 0.34 -0.03 -0.01 0.00 -1.00 0.00 0.00 29.16 28.46 3dby h TRP 17 CO -0.01 1.22 -0.54 -0.07 -3.56 0.00 0.00 178.44 175.48 3dby h LEU 18 N 0.11 0.21 -0.38 -4.49 3.38 -1.11 -0.85 115.31 112.17 3dby h LEU 18 Ca -0.11 -0.11 -0.17 0.00 0.09 0.00 0.00 57.88 57.57 3dby h LEU 18 Cb 1.85 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.54 3dby h LEU 18 CO 0.19 0.71 -0.51 0.50 0.09 0.00 0.00 178.44 179.42 3dby h LYS 19 N 0.15 0.80 -0.77 1.13 3.64 -1.46 -2.01 116.57 118.05 3dby h LYS 19 Ca 0.00 -0.49 0.08 0.00 -1.27 0.00 0.00 60.65 58.97 3dby h LYS 19 Cb 1.01 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.81 3dby h LYS 19 CO 0.08 1.12 0.44 0.28 -2.27 0.00 0.00 179.45 179.10 3dby h VAL 20 N 0.63 0.94 0.04 2.00 2.07 -0.98 -0.37 116.25 120.58 3dby h VAL 20 Ca 0.02 -0.26 -0.23 0.00 0.82 0.00 0.00 66.70 67.06 3dby h VAL 20 Cb 1.10 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 3dby h VAL 20 CO 0.11 0.14 -1.04 -0.07 0.02 0.00 0.00 177.57 176.73 3dby h LEU 21 N 0.76 0.17 -0.74 2.57 3.38 -1.14 0.64 115.31 120.95 3dby h LEU 21 Ca 0.36 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3dby h LEU 21 Cb 0.28 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 3dby h LEU 21 CO -0.22 1.10 0.44 0.74 0.09 0.00 0.00 178.44 180.59 3dby h THR 22 N 0.04 1.21 0.26 0.22 2.02 -1.20 -0.60 112.91 114.86 3dby h THR 22 Ca -0.05 -0.47 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 3dby h THR 22 Cb 1.77 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 3dby h THR 22 CO 0.15 0.22 -0.13 0.44 0.37 0.00 0.00 175.52 176.57 3dby h ASP 23 N 1.02 -0.32 -0.44 4.18 3.45 -0.56 -1.41 116.42 122.34 3dby h ASP 23 Ca 0.27 0.01 0.09 0.00 0.43 0.00 0.00 57.03 57.83 3dby h ASP 23 Cb -0.03 0.09 -0.08 0.00 -0.56 0.00 0.00 39.33 38.75 3dby h ASP 23 CO -0.05 -0.22 -0.10 0.45 -1.57 0.00 0.00 179.24 177.74 3dby h HIS 24 N -0.36 -0.22 -0.27 4.55 3.86 -0.72 0.98 115.15 122.96 3dby h HIS 24 Ca -0.03 0.04 0.03 0.00 -1.16 0.00 0.00 60.37 59.25 3dby h HIS 24 Cb 0.29 0.17 -0.03 0.00 1.06 0.00 0.00 27.41 28.89 3dby h HIS 24 CO -0.07 -0.18 0.07 0.00 0.86 0.00 0.00 177.93 178.61 3dby h ALA 25 N 1.43 0.29 -0.75 2.45 0.00 -1.01 0.26 119.26 121.93 3dby h ALA 25 Ca 0.21 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3dby h ALA 25 Cb 0.32 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3dby h ALA 25 CO -0.45 -0.34 0.44 0.37 0.00 0.00 0.00 179.25 179.28 3dby h GLN 26 N 0.18 1.03 -0.37 0.00 5.75 -0.78 -0.53 115.11 120.39 3dby h GLN 26 Ca 0.12 -0.10 -0.06 0.00 -0.15 0.00 0.00 58.65 58.47 3dby h GLN 26 Cb 0.11 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 3dby h GLN 26 CO -0.15 0.74 0.01 0.74 -2.65 0.00 0.00 178.83 177.52 3dby h PHE 27 N 1.03 0.70 -0.24 3.99 0.04 -0.52 -0.44 116.94 121.51 3dby h PHE 27 Ca 0.27 -0.12 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3dby h PHE 27 Cb -0.02 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 3dby h PHE 27 CO -0.01 0.73 0.15 -0.07 -0.60 0.00 0.00 178.31 178.52 3dby h LEU 28 N 0.47 0.28 -0.28 1.54 3.38 -0.83 -1.40 115.31 118.47 3dby h LEU 28 Ca 0.11 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.11 3dby h LEU 28 Cb 0.44 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.06 3dby h LEU 28 CO 0.02 0.23 -0.11 0.25 0.09 0.00 0.00 178.44 178.92 3dby h LEU 29 N 0.31 -0.37 -0.64 1.67 5.85 -0.83 -1.05 115.31 120.24 3dby h LEU 29 Ca 0.09 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3dby h LEU 29 Cb -0.01 0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.24 3dby h LEU 29 CO -0.02 -0.14 0.00 0.44 -0.34 0.00 0.00 178.44 178.38 3dby h ASP 30 N -0.06 0.00 0.81 1.25 3.45 -0.93 -3.11 116.42 117.83 3dby h ASP 30 Ca 0.14 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.60 3dby h ASP 30 Cb 0.27 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.04 3dby h ASP 30 CO -0.32 0.00 -0.59 0.00 -1.57 0.00 0.00 179.24 176.76 3dby n ALA 31 N -1.91 3.01 -1.76 3.45 0.00 -0.45 -4.92 120.51 117.93 3dby n ALA 31 Ca 0.03 -0.26 -0.39 0.00 0.00 0.00 0.00 53.44 52.81 3dby n ALA 31 Cb 0.34 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 3dby n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3dby s LEU 32 N -4.00 4.53 0.55 0.00 1.43 -0.91 -0.98 118.68 119.30 3dby s LEU 32 Ca 0.07 2.06 -0.21 0.00 -1.03 0.00 0.00 54.13 55.02 3dby s LEU 32 Cb 0.14 -3.72 -0.05 0.00 0.03 0.00 0.00 46.19 42.59 3dby s LEU 32 CO 0.71 -0.04 1.29 0.00 0.23 0.00 0.00 176.35 178.54 3dby s ALA 33 N -1.27 2.75 0.54 4.21 0.00 -0.68 -4.87 121.76 122.44 3dby s ALA 33 Ca 0.45 1.20 0.37 0.00 0.00 0.00 0.00 51.96 53.97 3dby s ALA 33 Cb -0.27 -3.51 1.55 0.00 0.00 0.00 0.00 23.12 20.89 3dby s ALA 33 CO 0.34 -1.24 1.79 -1.35 0.00 0.00 0.00 175.76 175.31 3dby h PRO 34 N 1.37 0.01 0.00 0.00 0.11 -1.95 0.12 132.00 131.66 3dby h PRO 34 Ca -0.51 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3dby h PRO 34 Cb 1.29 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3dby h PRO 34 CO 0.57 0.01 0.00 0.36 -0.21 0.00 0.00 178.00 178.73 3dby n LYS 35 N -4.18 0.13 -1.30 1.05 2.85 -1.26 -4.06 118.16 111.39 3dby n LYS 35 Ca 0.26 0.29 -0.30 0.00 -1.05 0.00 0.00 58.31 57.51 3dby n LYS 35 Cb 1.27 -1.71 -0.07 0.00 -0.65 0.00 0.00 35.03 33.87 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 -1.95 3.21 -0.18 -1.58 -0.58 0.42 -4.73 120.64 115.25 3dby n GLU 36 Ca 0.04 -1.98 -0.03 0.00 -0.42 0.00 0.00 57.16 54.77 3dby n GLU 36 Cb 0.26 -2.50 0.04 0.00 -0.57 0.00 0.00 31.44 28.67 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 4.23 -0.06 -0.13 3.49 1.79 -1.83 0.34 116.57 124.40 3dby h LYS 37 Ca 0.62 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 59.14 3dby h LYS 37 Cb 0.69 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.30 3dby h LYS 37 CO 1.23 -0.04 -0.13 1.49 -1.08 0.00 0.00 179.45 180.92 3dby h GLU 38 N -0.06 -0.16 -0.04 3.15 4.81 -1.96 -0.82 114.58 119.50 3dby h GLU 38 Ca 0.26 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.38 3dby h GLU 38 Cb 0.45 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 3dby h GLU 38 CO -0.59 -0.11 -0.52 -0.44 -0.73 0.00 0.00 179.01 176.63 3dby h ASP 39 N -0.16 0.13 -0.55 1.04 3.32 -1.82 -1.68 116.42 116.69 3dby h ASP 39 Ca 0.09 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 3dby h ASP 39 Cb 0.30 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 3dby h ASP 39 CO -0.23 0.63 0.23 0.40 -1.72 0.00 0.00 179.24 178.55 3dby h ILE 40 N 0.09 1.22 -0.69 0.35 2.04 -0.78 0.10 117.51 119.85 3dby h ILE 40 Ca 0.00 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 3dby h ILE 40 Cb 0.95 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 3dby h ILE 40 CO 0.07 0.25 0.35 0.50 0.00 0.00 0.00 178.15 179.33 3dby h LYS 41 N 0.75 0.98 -0.20 2.37 3.11 -0.89 -1.18 116.57 121.50 3dby h LYS 41 Ca 0.19 -0.13 -0.01 0.00 -2.81 0.00 0.00 60.65 57.88 3dby h LYS 41 Cb 0.18 -0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.22 3dby h LYS 41 CO -0.02 0.76 0.07 0.87 -2.81 0.00 0.00 179.45 178.32 3dby h LYS 42 N 0.95 0.30 -0.75 1.90 1.57 -1.10 -2.14 116.57 117.30 3dby h LYS 42 Ca 0.24 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.96 3dby h LYS 42 Cb 0.09 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.32 3dby h LYS 42 CO -0.03 0.40 0.49 0.00 -0.57 0.00 0.00 179.45 179.74 3dby h ALA 43 N 0.89 0.95 -0.42 3.86 0.00 -0.69 -0.62 119.26 123.23 3dby h ALA 43 Ca 0.06 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.95 3dby h ALA 43 Cb 0.22 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3dby h ALA 43 CO -0.00 0.37 0.23 1.15 0.00 0.00 0.00 179.25 181.00 3dby h THR 44 N 1.01 1.01 -0.69 0.00 2.02 -1.19 0.09 112.91 115.17 3dby h THR 44 Ca 0.27 -0.16 0.07 0.00 0.77 0.00 0.00 66.41 67.36 3dby h THR 44 Cb -0.12 0.50 -0.06 0.00 -1.74 0.00 0.00 68.15 66.74 3dby h THR 44 CO -0.06 0.09 0.37 0.22 0.37 0.00 0.00 175.52 176.51 3dby h TYR 45 N 0.47 0.67 -0.43 3.16 3.20 -0.76 -0.88 116.97 122.39 3dby h TYR 45 Ca 0.17 0.03 -0.10 0.00 3.14 0.00 0.00 58.73 61.97 3dby h TYR 45 Cb 0.05 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 3dby h TYR 45 CO -0.08 0.30 -0.15 0.74 -1.64 0.00 0.00 178.16 177.33 3dby h PHE 46 N 0.67 0.90 -0.22 -3.82 0.04 -0.59 0.98 116.94 114.90 3dby h PHE 46 Ca 0.32 -0.18 0.04 0.00 2.80 0.00 0.00 57.97 60.95 3dby h PHE 46 Cb 0.24 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.12 3dby h PHE 46 CO -0.09 0.90 -0.06 0.28 -0.60 0.00 0.00 178.31 178.75 3dby h VAL 47 N 0.72 0.78 -0.18 -0.55 2.07 -0.56 -0.29 116.25 118.25 3dby h VAL 47 Ca 0.11 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 3dby h VAL 47 Cb 0.65 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 3dby h VAL 47 CO 0.05 0.00 0.08 -0.33 0.02 0.00 0.00 177.57 177.39 3dby h GLU 48 N -0.00 0.26 -0.30 1.57 5.08 -0.96 -0.82 114.58 119.41 3dby h GLU 48 Ca 0.10 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3dby h GLU 48 Cb 0.16 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 3dby h GLU 48 CO -0.23 0.30 0.18 1.15 -1.00 0.00 0.00 179.01 179.42 3dby h THR 49 N 0.15 1.10 -0.04 1.13 2.02 -0.61 -1.17 112.91 115.49 3dby h THR 49 Ca 0.06 -0.22 -0.20 0.00 0.77 0.00 0.00 66.41 66.82 3dby h THR 49 Cb 0.13 0.71 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3dby h THR 49 CO -0.01 0.10 -0.81 -0.26 0.37 0.00 0.00 175.52 174.91 3dby h PHE 50 N 0.39 0.55 -0.56 3.16 0.04 -1.01 -0.53 116.94 118.97 3dby h PHE 50 Ca 0.11 -0.27 0.05 0.00 2.80 0.00 0.00 57.97 60.66 3dby h PHE 50 Cb -0.00 -0.07 -0.05 0.00 2.20 0.00 0.00 35.95 38.02 3dby h PHE 50 CO -0.05 1.05 0.29 1.15 -0.60 0.00 0.00 178.31 180.15 3dby h THR 51 N 0.25 0.95 -0.40 -1.55 2.02 -1.06 -0.40 112.91 112.72 3dby h THR 51 Ca -0.05 -0.19 -0.11 0.00 0.77 0.00 0.00 66.41 66.84 3dby h THR 51 Cb 1.41 0.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.16 3dby h THR 51 CO 0.14 0.10 -0.18 0.78 0.37 0.00 0.00 175.52 176.73 3dby h ASN 52 N 0.55 0.84 -0.29 4.18 2.35 -1.07 -1.37 115.58 120.77 3dby h ASN 52 Ca 0.25 -0.40 0.03 0.00 -0.55 0.00 0.00 56.30 55.63 3dby h ASN 52 Cb 0.16 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 3dby h ASN 52 CO -0.17 1.05 0.11 -0.07 -1.65 0.00 0.00 177.43 176.70 3dby h LEU 53 N 0.63 0.14 -0.82 1.61 3.38 -0.95 -2.39 115.31 116.92 3dby h LEU 53 Ca 0.09 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3dby h LEU 53 Cb 0.73 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.44 3dby h LEU 53 CO 0.05 0.12 0.47 0.25 0.09 0.00 0.00 178.44 179.42 3dby h LEU 54 N 0.25 1.00 -1.84 1.67 5.85 -0.93 -1.57 115.31 119.74 3dby h LEU 54 Ca 0.12 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 3dby h LEU 54 Cb 0.08 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.85 3dby h LEU 54 CO -0.11 0.80 -0.11 0.78 -0.34 0.00 0.00 178.44 179.46 3dby h ASN 55 N 1.13 0.00 -0.30 1.25 -0.26 -1.05 -3.01 115.58 113.34 3dby h ASN 55 Ca 0.29 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.03 3dby h ASN 55 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 3dby h ASN 55 CO -0.05 0.11 0.00 2.29 -1.06 0.00 0.00 177.43 178.72 3dby n LYS 56 N -3.48 2.95 -2.09 0.81 2.85 -0.63 -4.99 118.16 113.59 3dby n LYS 56 Ca -0.01 -2.55 -0.41 0.00 -1.05 0.00 0.00 58.31 54.29 3dby n LYS 56 Cb 0.26 -1.63 -0.02 0.00 -0.65 0.00 0.00 35.03 32.98 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 -2.12 2.83 0.12 0.58 0.11 -0.99 -5.00 120.40 115.94 3dby s VAL 57 Ca 0.35 0.71 -0.16 0.00 -2.93 0.00 0.00 61.98 59.95 3dby s VAL 57 Cb 0.26 -3.45 0.04 0.00 -1.53 0.00 0.00 36.38 31.69 3dby s VAL 57 CO 0.12 0.12 0.41 -0.13 -3.33 0.00 0.00 175.10 172.29 3dby s ARG 58 N -0.54 1.07 0.00 1.54 0.52 -1.26 -5.04 118.95 115.24 3dby s ARG 58 Ca 0.57 -0.68 0.22 0.00 -0.52 0.00 0.00 55.73 55.31 3dby s ARG 58 Cb -0.40 0.47 1.29 0.00 0.52 0.00 0.00 34.95 36.84 3dby s ARG 58 CO 0.43 -0.42 1.83 0.27 0.02 0.00 0.00 175.30 177.43 3dby n ASN 59 N -0.20 0.00 -4.77 0.23 0.23 -1.26 -4.44 115.26 105.06 3dby n ASN 59 Ca -0.16 -1.31 -0.35 0.00 -0.53 0.00 0.00 54.58 52.23 3dby n ASN 59 Cb 0.64 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.26 3dby n ASN 59 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 3dby s VAL 60 N -2.00 4.76 -1.49 3.53 -7.23 -1.26 -4.63 120.40 112.08 3dby s VAL 60 Ca 0.32 -0.19 -0.04 0.00 -1.81 0.00 0.00 61.98 60.27 3dby s VAL 60 Cb 0.15 -3.08 0.00 0.00 0.56 0.00 0.00 36.38 34.01 3dby s VAL 60 CO 0.25 0.52 0.47 0.59 -0.31 0.00 0.00 175.10 176.61 3dby n ASN 61 N 1.76 -5.78 0.14 4.85 5.03 -1.26 -4.89 115.26 115.11 3dby n ASN 61 Ca -0.17 -0.22 0.04 0.00 0.87 0.00 0.00 54.58 55.10 3dby n ASN 61 Cb 0.54 -4.64 0.45 0.00 -1.02 0.00 0.00 39.78 35.11 3dby n ASN 61 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 3dby h LEU 62 N -1.06 0.18 0.02 3.41 3.38 -1.82 -0.05 115.31 119.37 3dby h LEU 62 Ca -0.49 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.45 3dby h LEU 62 Cb 1.34 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3dby h LEU 62 CO 0.53 0.29 -0.01 0.24 0.09 0.00 0.00 178.44 179.58 3dby h MET 63 N 0.19 -0.03 -0.83 1.13 2.86 -1.90 0.15 114.93 116.50 3dby h MET 63 Ca 0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 3dby h MET 63 Cb 0.26 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.89 3dby h MET 63 CO 0.01 0.47 0.46 0.00 1.06 0.00 0.00 176.91 178.91 3dby h ALA 64 N 0.41 1.25 -0.94 6.32 0.00 -1.86 -2.14 119.26 122.30 3dby h ALA 64 Ca -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3dby h ALA 64 Cb 0.51 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3dby h ALA 64 CO 0.01 0.62 0.57 0.35 0.00 0.00 0.00 179.25 180.79 3dby h PHE 65 N 1.16 1.23 -0.19 0.00 3.57 -0.79 -2.58 116.94 119.36 3dby h PHE 65 Ca 0.29 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.75 3dby h PHE 65 Cb 0.02 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 38.34 3dby h PHE 65 CO 0.01 0.82 -0.08 0.77 -2.23 0.00 0.00 178.31 177.59 3dby h SER 66 N 1.29 0.27 -0.33 0.41 0.02 -0.04 0.09 113.55 115.25 3dby h SER 66 Ca 0.34 -0.05 -0.17 0.00 -0.84 0.00 0.00 61.79 61.07 3dby h SER 66 Cb -0.06 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 62.41 3dby h SER 66 CO -0.06 0.39 -0.45 0.11 -1.14 0.00 0.00 176.83 175.68 3dby h LYS 67 N 0.27 0.89 -0.34 3.45 1.57 -1.12 0.25 116.57 121.53 3dby h LYS 67 Ca 0.06 -0.51 -0.01 0.00 -1.87 0.00 0.00 60.65 58.32 3dby h LYS 67 Cb 0.32 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 3dby h LYS 67 CO 0.02 1.16 0.17 1.49 -0.57 0.00 0.00 179.45 181.72 3dby h GLU 68 N 0.69 0.49 -0.91 3.15 4.81 -0.97 -2.05 114.58 119.78 3dby h GLU 68 Ca 0.04 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.27 3dby h GLU 68 Cb 1.05 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 30.27 3dby h GLU 68 CO 0.11 0.43 0.57 0.00 -0.73 0.00 0.00 179.01 179.38 3dby h ALA 69 N 1.03 1.26 -0.27 2.92 0.00 -0.91 -2.27 119.26 121.01 3dby h ALA 69 Ca 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3dby h ALA 69 Cb 0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3dby h ALA 69 CO -0.02 0.32 0.12 1.49 0.00 0.00 0.00 179.25 181.16 3dby h GLU 70 N 1.03 0.40 -0.46 0.00 4.81 -0.69 0.56 114.58 120.22 3dby h GLU 70 Ca 0.40 -0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.61 3dby h GLU 70 Cb 0.19 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 3dby h GLU 70 CO -0.18 0.42 0.19 0.37 -0.73 0.00 0.00 179.01 179.08 3dby h GLN 71 N 0.29 0.38 -0.47 1.92 5.75 -1.05 -0.81 115.11 121.12 3dby h GLN 71 Ca 0.09 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.57 3dby h GLN 71 Cb 0.16 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 3dby h GLN 71 CO -0.01 0.25 0.31 0.00 -2.65 0.00 0.00 178.83 176.73 3dby h ALA 72 N 1.28 0.60 -0.49 3.38 0.00 -1.22 -2.05 119.26 120.75 3dby h ALA 72 Ca 0.21 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.13 3dby h ALA 72 Cb 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3dby h ALA 72 CO -0.19 0.04 0.25 0.00 0.00 0.00 0.00 179.25 179.36 3dby h ALA 73 N 1.17 0.63 -0.67 0.00 0.00 -0.49 -0.70 119.26 119.20 3dby h ALA 73 Ca 0.17 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3dby h ALA 73 Cb -0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3dby h ALA 73 CO -0.04 -0.09 0.39 0.87 0.00 0.00 0.00 179.25 180.38 3dby h LYS 74 N 0.50 0.91 -0.16 0.00 6.56 -1.08 -1.28 116.57 122.02 3dby h LYS 74 Ca 0.21 -0.08 -0.07 0.00 -1.06 0.00 0.00 60.65 59.65 3dby h LYS 74 Cb 0.11 -0.19 -0.00 0.00 -0.57 0.00 0.00 32.23 31.58 3dby h LYS 74 CO -0.15 0.65 -0.18 0.93 -2.06 0.00 0.00 179.45 178.64 3dby h GLU 75 N 0.93 0.41 -0.39 3.15 5.08 -0.58 -2.27 114.58 120.90 3dby h GLU 75 Ca 0.24 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 3dby h GLU 75 Cb -0.02 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3dby h GLU 75 CO -0.04 0.79 -0.03 0.97 -1.00 0.00 0.00 179.01 179.69 3dby h ILE 76 N 0.05 1.23 -0.53 3.13 2.10 -1.11 -0.64 117.51 121.74 3dby h ILE 76 Ca 0.02 -0.94 0.08 0.00 1.08 0.00 0.00 64.86 65.10 3dby h ILE 76 Cb 0.72 0.97 -0.06 0.00 -1.09 0.00 0.00 36.82 37.36 3dby h ILE 76 CO 0.04 0.32 0.17 -0.09 -1.08 0.00 0.00 178.15 177.52 3dby h ARG 77 N 0.59 0.33 -0.80 2.19 2.43 -1.18 0.95 114.38 118.90 3dby h ARG 77 Ca 0.12 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.23 3dby h ARG 77 Cb 0.43 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 3dby h ARG 77 CO 0.02 0.22 0.35 0.00 -1.51 0.00 0.00 179.97 179.05 3dby h ALA 78 N 1.37 1.03 -0.00 2.80 0.00 -0.76 -1.41 119.26 122.28 3dby h ALA 78 Ca 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3dby h ALA 78 Cb 0.31 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3dby h ALA 78 CO -0.28 0.63 -0.00 0.35 0.00 0.00 0.00 179.25 179.95 3dby h PHE 79 N 1.15 -0.00 -0.27 0.00 3.57 -0.63 0.59 116.94 121.35 3dby h PHE 79 Ca 0.27 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.77 3dby h PHE 79 Cb 0.18 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3dby h PHE 79 CO 0.02 -0.00 0.17 0.87 -2.23 0.00 0.00 178.31 177.14 3dby h LYS 80 N -0.00 0.35 -0.89 1.11 1.57 -0.64 -1.89 116.57 116.18 3dby h LYS 80 Ca 0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3dby h LYS 80 Cb 0.00 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3dby h LYS 80 CO -0.00 0.24 0.49 -0.07 -0.57 0.00 0.00 179.45 179.54 3dby h LEU 81 N 0.36 1.11 -1.01 2.94 3.38 -1.08 -1.52 115.31 119.49 3dby h LEU 81 Ca 0.10 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.05 3dby h LEU 81 Cb -0.03 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.36 3dby h LEU 81 CO -0.02 0.89 0.64 -1.13 0.09 0.00 0.00 178.44 178.91 3dby h ASN 82 N 1.24 1.01 -0.44 -0.43 -1.24 -0.60 0.39 115.58 115.51 3dby h ASN 82 Ca 0.31 0.02 -0.11 0.00 0.71 0.00 0.00 56.30 57.23 3dby h ASN 82 Cb 0.02 -0.19 -0.01 0.00 0.73 0.00 0.00 38.32 38.87 3dby h ASN 82 CO -0.05 0.61 -0.16 0.40 -1.29 0.00 0.00 177.43 176.94 3dby h ILE 83 N 1.12 1.27 -0.66 2.57 2.04 -0.78 -1.58 117.51 121.49 3dby h ILE 83 Ca 0.45 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 3dby h ILE 83 Cb 0.27 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3dby h ILE 83 CO -0.20 0.44 0.39 0.40 0.00 0.00 0.00 178.15 179.18 3dby h ILE 84 N 0.72 1.19 -0.50 -0.67 2.04 -0.90 -0.39 117.51 119.00 3dby h ILE 84 Ca 0.11 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.55 3dby h ILE 84 Cb 0.72 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 3dby h ILE 84 CO 0.05 0.20 0.28 -0.61 0.00 0.00 0.00 178.15 178.08 3dby h GLN 85 N 0.90 0.55 -0.21 2.37 4.15 -0.78 -0.88 115.11 121.20 3dby h GLN 85 Ca 0.24 -0.03 -0.08 0.00 0.77 0.00 0.00 58.65 59.54 3dby h GLN 85 Cb -0.01 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.54 3dby h GLN 85 CO -0.04 0.36 -0.23 0.87 -1.93 0.00 0.00 178.83 177.86 3dby h LYS 86 N 0.56 0.38 -0.44 1.69 1.57 -0.85 -2.53 116.57 116.96 3dby h LYS 86 Ca 0.21 -0.13 0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3dby h LYS 86 Cb 0.06 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3dby h LYS 86 CO -0.11 0.59 0.23 1.96 -0.57 0.00 0.00 179.45 181.56 3dby h GLN 87 N 0.35 0.45 0.00 3.15 4.20 0.14 0.48 115.11 123.88 3dby h GLN 87 Ca 0.06 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.74 3dby h GLN 87 Cb 0.59 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.27 3dby h GLN 87 CO 0.04 0.30 0.00 1.28 -0.67 0.00 0.00 178.83 179.78 3dby n LEU 88 N -4.89 0.66 -0.62 1.46 4.77 -0.46 -2.22 117.00 115.71 3dby n LEU 88 Ca 0.02 0.65 0.07 0.00 -0.03 0.00 0.00 56.01 56.73 3dby n LEU 88 Cb 0.09 -0.55 0.09 0.00 -2.33 0.00 0.00 43.42 40.72 3dby n LEU 88 CO 0.31 -0.52 0.52 -0.62 -1.33 0.00 0.00 177.39 175.75 3dby n GLU 89 N -2.22 1.38 -2.35 3.23 1.02 -0.91 -5.00 120.64 115.80 3dby n GLU 89 Ca 0.02 -1.53 -0.11 0.00 -0.02 0.00 0.00 57.16 55.52 3dby n GLU 89 Cb 0.25 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 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 0.78 -0.03 0.77 0.62 0.00 0.26 -4.94 105.19 102.64 3dby n GLY 90 Ca 0.10 -0.39 0.08 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.17 2.84 -3.61 1.61 5.02 0.14 -4.98 118.16 117.01 3dby n LYS 91 Ca -0.11 -2.60 -0.15 0.00 -2.02 0.00 0.00 58.31 53.44 3dby n LYS 91 Cb 0.59 -1.66 -0.07 0.00 -0.02 0.00 0.00 35.03 33.87 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 -2.32 0.00 -0.39 -0.18 2.07 -1.26 -4.93 121.20 114.20 3dby s ILE 92 Ca 0.36 -0.01 -0.12 0.00 -1.41 0.00 0.00 60.65 59.47 3dby s ILE 92 Cb 0.27 -0.97 0.03 0.00 0.13 0.00 0.00 42.46 41.93 3dby s ILE 92 CO 0.10 -0.01 0.24 -0.89 -1.91 0.00 0.00 174.94 172.47 3dby s THR 93 N -0.07 4.68 0.02 4.00 2.01 -1.26 -4.83 115.64 120.18 3dby s THR 93 Ca -0.03 -0.90 -0.01 0.00 0.31 0.00 0.00 61.69 61.07 3dby s THR 93 Cb -0.04 -3.65 -0.02 0.00 0.01 0.00 0.00 72.50 68.81 3dby s THR 93 CO 0.03 -0.29 -0.01 -0.51 -0.69 0.00 0.00 174.62 173.15 3dby s ILE 94 N 1.56 0.09 -0.35 1.82 2.07 -1.26 -1.68 121.20 123.46 3dby s ILE 94 Ca 0.03 -0.77 0.03 0.00 -1.41 0.00 0.00 60.65 58.53 3dby s ILE 94 Cb -0.20 -0.24 0.52 0.00 0.13 0.00 0.00 42.46 42.67 3dby s ILE 94 CO 0.07 -0.42 1.71 1.41 -1.91 0.00 0.00 174.94 175.79 3dby n HIS 95 N 1.79 2.36 -4.64 3.50 8.25 -0.15 -4.80 115.22 121.53 3dby n HIS 95 Ca -0.22 -1.53 -0.29 0.00 -0.26 0.00 0.00 57.72 55.41 3dby n HIS 95 Cb 0.56 -0.79 -0.14 0.00 1.12 0.00 0.00 29.99 30.74 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 -2.54 2.26 0.47 4.41 2.99 -1.26 -5.04 117.98 119.27 3dby s PHE 96 Ca 0.44 -0.40 -0.15 0.00 0.00 0.00 0.00 56.93 56.82 3dby s PHE 96 Cb 0.37 -1.29 -0.08 0.00 0.00 0.00 0.00 43.02 42.02 3dby s PHE 96 CO 0.08 0.22 0.91 0.95 -0.00 0.00 0.00 175.22 177.38 3dby s THR 97 N -0.93 4.61 0.41 0.64 -4.23 -1.26 -4.94 115.64 109.94 3dby s THR 97 Ca 0.12 1.04 0.16 0.00 -1.18 0.00 0.00 61.69 61.83 3dby s THR 97 Cb -0.10 -3.72 0.37 0.00 1.34 0.00 0.00 72.50 70.40 3dby s THR 97 CO 0.04 -0.61 1.85 -0.65 -0.54 0.00 0.00 174.62 174.71 3dby h PRO 98 N 1.10 0.43 -0.29 3.99 0.11 -1.98 -1.90 132.00 133.47 3dby h PRO 98 Ca -0.47 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 3dby h PRO 98 Cb 1.18 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3dby h PRO 98 CO 0.62 0.29 -0.32 1.15 -0.21 0.00 0.00 178.00 179.53 3dby h THR 99 N 0.45 1.28 -0.22 -1.15 2.02 -1.97 0.55 112.91 113.87 3dby h THR 99 Ca 0.48 -1.44 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 3dby h THR 99 Cb 1.14 1.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 3dby h THR 99 CO -0.20 0.46 0.13 0.15 0.37 0.00 0.00 175.52 176.43 3dby h PHE 100 N 0.52 0.29 -0.05 3.16 3.57 -1.73 0.22 116.94 122.92 3dby h PHE 100 Ca 0.06 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 3dby h PHE 100 Cb 0.81 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.44 3dby h PHE 100 CO 0.03 0.23 -0.53 0.82 -2.23 0.00 0.00 178.31 176.63 3dby h ILE 101 N 0.26 1.37 -0.78 1.41 2.04 -1.27 -2.12 117.51 118.42 3dby h ILE 101 Ca 0.08 -1.83 0.03 0.00 1.00 0.00 0.00 64.86 64.14 3dby h ILE 101 Cb 0.03 1.93 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 3dby h ILE 101 CO -0.01 0.53 0.51 -1.13 0.00 0.00 0.00 178.15 178.05 3dby h ASN 102 N 0.11 0.85 -0.65 1.72 -1.24 0.67 -1.54 115.58 115.49 3dby h ASN 102 Ca -0.00 -0.01 -0.09 0.00 0.71 0.00 0.00 56.30 56.91 3dby h ASN 102 Cb 0.98 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 39.80 3dby h ASN 102 CO 0.08 0.59 0.06 0.45 -1.29 0.00 0.00 177.43 177.31 3dby h HIS 103 N 0.99 1.19 -0.95 0.67 3.86 -0.00 -1.64 115.15 119.26 3dby h HIS 103 Ca 0.30 -0.19 0.09 0.00 -1.16 0.00 0.00 60.37 59.42 3dby h HIS 103 Cb -0.01 -0.32 -0.07 0.00 1.06 0.00 0.00 27.41 28.08 3dby h HIS 103 CO -0.00 1.02 0.61 0.52 0.86 0.00 0.00 177.93 180.94 3dby h MET 104 N 1.02 0.98 -0.22 2.45 2.86 -0.86 -1.96 114.93 119.20 3dby h MET 104 Ca 0.19 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.77 3dby h MET 104 Cb 0.50 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3dby h MET 104 CO 0.02 0.65 0.13 0.28 1.06 0.00 0.00 176.91 179.05 3dby h VAL 105 N 1.01 1.09 -0.91 -2.22 2.07 -0.92 -0.62 116.25 115.76 3dby h VAL 105 Ca 0.44 -0.24 0.10 0.00 0.82 0.00 0.00 66.70 67.82 3dby h VAL 105 Cb 0.34 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 30.90 3dby h VAL 105 CO -0.19 0.09 0.56 0.78 0.02 0.00 0.00 177.57 178.82 3dby h ASN 106 N 0.26 0.83 0.15 0.57 2.35 -0.89 0.11 115.58 118.95 3dby h ASN 106 Ca 0.08 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.86 3dby h ASN 106 Cb 0.04 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.28 3dby h ASN 106 CO -0.01 0.47 -0.07 -0.33 -1.65 0.00 0.00 177.43 175.84 3dby h GLU 107 N 0.93 -0.20 -0.46 0.81 5.08 -1.07 -2.04 114.58 117.64 3dby h GLU 107 Ca 0.43 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.90 3dby h GLU 107 Cb 0.36 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 3dby h GLU 107 CO -0.24 0.20 0.31 -0.24 -1.00 0.00 0.00 179.01 178.05 3dby h VAL 108 N -0.65 0.87 -0.25 3.13 3.04 -0.88 -1.15 116.25 120.35 3dby h VAL 108 Ca -0.02 -0.07 -0.07 0.00 -1.01 0.00 0.00 66.70 65.53 3dby h VAL 108 Cb 0.48 0.65 -0.01 0.00 -2.01 0.00 0.00 31.29 30.40 3dby h VAL 108 CO 0.03 0.04 -0.14 -0.33 -1.01 0.00 0.00 177.57 176.16 3dby h GLU 109 N 0.21 0.43 -0.56 4.17 5.08 -0.84 -0.44 114.58 122.63 3dby h GLU 109 Ca 0.21 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3dby h GLU 109 Cb 0.56 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 3dby h GLU 109 CO -0.04 0.57 0.22 0.93 -1.00 0.00 0.00 179.01 179.70 3dby h GLU 110 N 0.39 0.84 -0.53 2.33 4.39 -0.48 -1.99 114.58 119.54 3dby h GLU 110 Ca 0.07 -0.15 -0.01 0.00 0.34 0.00 0.00 59.36 59.61 3dby h GLU 110 Cb 0.49 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 3dby h GLU 110 CO 0.03 0.73 0.30 -0.92 -1.16 0.00 0.00 179.01 177.99 3dby h TYR 111 N 0.77 0.71 -0.50 4.33 3.20 -0.92 -1.55 116.97 123.01 3dby h TYR 111 Ca 0.19 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.11 3dby h TYR 111 Cb 0.20 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 3dby h TYR 111 CO 0.01 0.50 0.33 0.82 -1.64 0.00 0.00 178.16 178.19 3dby h ILE 112 N 0.71 0.98 0.01 1.81 2.04 -0.92 0.93 117.51 123.06 3dby h ILE 112 Ca 0.19 -0.15 -0.19 0.00 1.00 0.00 0.00 64.86 65.70 3dby h ILE 112 Cb 0.02 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.57 3dby h ILE 112 CO -0.03 0.08 -0.90 0.00 0.00 0.00 0.00 178.15 177.30 3dby h ALA 113 N 1.73 0.51 -0.16 1.87 0.00 -0.76 -1.91 119.26 120.54 3dby h ALA 113 Ca 0.21 -0.80 -0.12 0.00 0.00 0.00 0.00 54.91 54.20 3dby h ALA 113 Cb 0.29 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3dby h ALA 113 CO -0.06 1.08 -0.42 0.28 0.00 0.00 0.00 179.25 180.14 3dby h VAL 114 N 0.01 1.31 0.00 0.00 2.07 -0.27 -3.18 116.25 116.20 3dby h VAL 114 Ca -0.02 -1.56 -0.04 0.00 0.82 0.00 0.00 66.70 65.90 3dby h VAL 114 Cb 1.58 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 3dby h VAL 114 CO 0.12 0.48 -0.20 -0.07 0.02 0.00 0.00 177.57 177.92 3dby h LEU 115 N 0.30 0.00 -0.22 2.57 3.38 -0.11 -1.91 115.31 119.33 3dby h LEU 115 Ca 0.03 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.01 3dby h LEU 115 Cb 0.86 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 3dby h LEU 115 CO 0.07 0.20 0.10 -0.08 0.09 0.00 0.00 178.44 178.82 3dby h GLU 116 N 0.00 0.21 -0.29 1.13 4.81 -1.38 -0.40 114.58 118.65 3dby h GLU 116 Ca -0.00 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3dby h GLU 116 Cb 0.88 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 3dby h GLU 116 CO 0.03 0.14 0.12 0.74 -0.73 0.00 0.00 179.01 179.30 3dby h PHE 117 N 0.21 0.45 -0.21 0.92 0.04 -1.56 -3.30 116.94 113.49 3dby h PHE 117 Ca 0.09 -0.03 -0.11 0.00 2.80 0.00 0.00 57.97 60.72 3dby h PHE 117 Cb 0.04 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 3dby h PHE 117 CO -0.10 0.44 -0.35 -0.07 -0.60 0.00 0.00 178.31 177.62 3dby h LEU 118 N 0.33 0.46 -1.98 1.54 3.38 -0.97 -1.63 115.31 116.44 3dby h LEU 118 Ca 0.10 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3dby h LEU 118 Cb 0.18 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3dby h LEU 118 CO -0.01 0.78 -0.10 0.11 0.09 0.00 0.00 178.44 179.31 3dby h LYS 119 N 0.37 0.00 -0.64 1.13 1.57 -1.17 -2.28 116.57 115.56 3dby h LYS 119 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3dby h LYS 119 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 3dby h LYS 119 CO 0.06 0.10 0.00 0.36 -0.57 0.00 0.00 179.45 179.40 3dby n LYS 120 N -3.94 2.87 -1.05 3.15 2.85 -0.99 -4.86 118.16 116.19 3dby n LYS 120 Ca -0.02 -2.56 -0.02 0.00 -1.05 0.00 0.00 58.31 54.66 3dby n LYS 120 Cb 0.19 -1.54 -0.01 0.00 -0.65 0.00 0.00 35.03 33.02 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 1.33 0.54 3.89 2.58 0.00 -0.86 -5.03 105.19 107.65 3dby n GLY 121 Ca 0.22 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.68 3.66 0.04 1.61 2.02 -0.65 -4.98 118.70 118.73 3dby s GLU 122 Ca 0.00 -0.00 -0.30 0.00 0.02 0.00 0.00 54.97 54.68 3dby s GLU 122 Cb 0.00 -2.78 -0.08 0.00 0.10 0.00 0.00 34.13 31.37 3dby s GLU 122 CO 0.00 0.41 1.67 0.08 0.02 0.00 0.00 175.26 177.43 3dby s VAL 123 N -1.74 3.15 0.25 2.63 1.01 -1.26 -3.99 120.40 120.44 3dby s VAL 123 Ca 0.43 0.51 -0.30 0.00 0.00 0.00 0.00 61.98 62.61 3dby s VAL 123 Cb -0.12 -3.33 -0.11 0.00 0.00 0.00 0.00 36.38 32.83 3dby s VAL 123 CO 0.24 -0.01 1.52 -2.84 0.00 0.00 0.00 175.10 174.01 3dby s PRO 124 N 2.99 4.21 0.82 2.72 0.02 -1.26 -4.94 135.00 139.56 3dby s PRO 124 Ca 0.74 2.41 -0.11 0.00 0.02 0.00 0.00 61.00 64.06 3dby s PRO 124 Cb -0.39 -3.09 0.09 0.00 0.02 0.00 0.00 34.50 31.13 3dby s PRO 124 CO 0.32 -0.53 1.09 -1.25 -0.33 0.00 0.00 177.00 176.31 3dby s PRO 125 N -0.13 1.84 -0.42 5.54 0.04 -1.26 -4.96 135.00 135.64 3dby s PRO 125 Ca 0.63 1.08 -0.27 0.00 0.04 0.00 0.00 61.00 62.47 3dby s PRO 125 Cb -0.44 -1.86 0.02 0.00 0.04 0.00 0.00 34.50 32.27 3dby s PRO 125 CO 0.42 -1.91 1.01 0.08 0.04 0.00 0.00 177.00 176.64 3dby s VAL 126 N -2.90 4.43 1.08 -0.36 1.01 -1.26 -5.04 120.40 117.35 3dby s VAL 126 Ca 0.62 1.13 -0.14 0.00 0.00 0.00 0.00 61.98 63.60 3dby s VAL 126 Cb -0.18 -4.46 0.23 0.00 0.00 0.00 0.00 36.38 31.98 3dby s VAL 126 CO 0.57 -0.77 1.08 -0.36 0.00 0.00 0.00 175.10 175.62 3dby s PHE 127 N 3.88 1.67 0.46 5.22 0.08 -1.26 -4.96 117.98 123.07 3dby s PHE 127 Ca 0.42 0.92 -0.25 0.00 0.12 0.00 0.00 56.93 58.14 3dby s PHE 127 Cb -0.10 -3.25 -0.08 0.00 -0.57 0.00 0.00 43.02 39.02 3dby s PHE 127 CO 0.25 -3.31 1.36 -1.58 -0.10 0.00 0.00 175.22 171.84 3dby s HIS 128 N -2.86 2.55 0.35 0.36 5.65 -1.26 -4.74 115.29 115.34 3dby s HIS 128 Ca 0.67 1.34 0.08 0.00 0.25 0.00 0.00 55.06 57.40 3dby s HIS 128 Cb -0.19 -3.79 0.78 0.00 -1.18 0.00 0.00 32.58 28.20 3dby s HIS 128 CO 0.59 -2.60 1.88 1.05 -0.65 0.00 0.00 174.74 175.00 3dby h GLU 129 N 2.25 0.71 0.00 2.88 4.11 -1.93 -0.10 114.58 122.50 3dby h GLU 129 Ca -0.50 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 58.86 3dby h GLU 129 Cb 1.27 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.35 3dby h GLU 129 CO 0.61 0.47 -0.11 -0.07 0.07 0.00 0.00 179.01 179.98 3dby h LEU 130 N 0.73 0.00 0.07 3.06 3.38 -1.97 -1.64 115.31 118.94 3dby h LEU 130 Ca 0.44 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.42 3dby h LEU 130 Cb 0.64 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 3dby h LEU 130 CO -0.20 0.11 -0.14 -0.74 0.09 0.00 0.00 178.44 177.56 3dby h HIS 131 N 0.00 -0.37 -0.64 1.13 2.76 -1.36 -1.33 115.15 115.34 3dby h HIS 131 Ca -0.00 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 3dby h HIS 131 Cb 0.29 0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.38 3dby h HIS 131 CO 0.00 -0.22 0.36 1.88 -1.30 0.00 0.00 177.93 178.66 3dby h TYR 132 N -0.28 0.86 -0.77 5.26 0.05 -1.43 -2.29 116.97 118.38 3dby h TYR 132 Ca 0.03 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 3dby h TYR 132 Cb 0.30 -0.28 -0.04 0.00 1.01 0.00 0.00 36.73 37.73 3dby h TYR 132 CO -0.16 0.60 0.39 0.45 -1.05 0.00 0.00 178.16 178.39 3dby h HIS 133 N 0.87 1.08 0.00 4.88 3.86 -1.17 0.11 115.15 124.78 3dby h HIS 133 Ca 0.23 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3dby h HIS 133 Cb 0.02 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.15 3dby h HIS 133 CO -0.01 0.78 0.00 -0.07 0.86 0.00 0.00 177.93 179.49 3dby h LEU 134 N 1.07 0.00 0.01 2.43 3.38 -0.85 -2.01 115.31 119.34 3dby h LEU 134 Ca 0.27 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.90 3dby h LEU 134 Cb 0.08 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 3dby h LEU 134 CO -0.04 0.00 -1.86 0.52 0.09 0.00 0.00 178.44 177.16 3dby n VAL 135 N -2.96 1.55 0.51 1.22 0.31 -0.90 -4.70 118.33 113.35 3dby n VAL 135 Ca 0.00 -0.23 0.12 0.00 -0.01 0.00 0.00 64.34 64.22 3dby n VAL 135 Cb 0.25 -1.93 0.15 0.00 -0.91 0.00 0.00 33.84 31.39 3dby n VAL 135 CO 0.00 0.00 0.00 -0.50 -1.32 0.00 0.00 176.83 175.01 3dby h TRP 136 N -0.89 0.00 -0.14 3.52 4.06 -0.74 -3.29 115.95 118.47 3dby h TRP 136 Ca -0.50 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.40 3dby h TRP 136 Cb 1.50 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.65 3dby h TRP 136 CO 0.02 0.00 -0.09 -0.07 -3.56 0.00 0.00 178.44 174.74 3dby h LEU 137 N 0.00 0.32 -1.21 -4.49 3.38 -1.56 -1.23 115.31 110.52 3dby h LEU 137 Ca 0.00 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.48 3dby h LEU 137 Cb 0.78 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 3dby h LEU 137 CO 0.00 0.69 -0.02 0.71 0.09 0.00 0.00 178.44 179.92 3dby h THR 138 N -0.04 1.20 -0.05 0.22 1.35 -1.81 -1.85 112.91 111.93 3dby h THR 138 Ca 0.03 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 3dby h THR 138 Cb 0.58 0.97 -0.00 0.00 -1.73 0.00 0.00 68.15 67.97 3dby h THR 138 CO 0.03 0.28 0.03 -0.78 -0.25 0.00 0.00 175.52 174.82 3dby h ASP 139 N 0.50 0.06 -0.72 5.36 3.58 -1.59 -0.92 116.42 122.69 3dby h ASP 139 Ca 0.11 -0.01 0.02 0.00 0.42 0.00 0.00 57.03 57.56 3dby h ASP 139 Cb 0.35 -0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.34 3dby h ASP 139 CO 0.01 0.05 0.47 0.00 -2.88 0.00 0.00 179.24 176.89 3dby h ALA 140 N 1.01 0.92 -0.77 -0.78 0.00 -0.97 0.70 119.26 119.37 3dby h ALA 140 Ca 0.02 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.91 3dby h ALA 140 Cb -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 3dby h ALA 140 CO -0.00 0.30 0.50 0.00 0.00 0.00 0.00 179.25 180.05 3dby h ALA 141 N 1.28 0.99 -0.37 0.00 0.00 -1.22 -0.24 119.26 119.69 3dby h ALA 141 Ca 0.27 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 3dby h ALA 141 Cb -0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 3dby h ALA 141 CO -0.08 0.35 -0.24 0.78 0.00 0.00 0.00 179.25 180.07 3dby h GLY 142 N 1.00 0.80 0.83 0.00 0.00 -0.71 0.15 103.07 105.15 3dby h GLY 142 Ca 0.29 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 3dby h GLY 142 CO -0.08 0.63 -0.18 0.45 0.00 0.00 0.00 176.54 177.35 3dby h HIS 143 N 0.65 -0.48 -0.70 5.60 3.86 -0.40 0.14 115.15 123.81 3dby h HIS 143 Ca 0.09 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.24 3dby h HIS 143 Cb 0.74 0.18 -0.03 0.00 1.06 0.00 0.00 27.41 29.36 3dby h HIS 143 CO 0.04 -0.28 0.19 0.00 0.86 0.00 0.00 177.93 178.74 3dby h ALA 144 N 0.31 1.02 0.00 2.45 0.00 -0.86 -2.29 119.26 119.89 3dby h ALA 144 Ca -0.01 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 3dby h ALA 144 Cb 0.38 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3dby h ALA 144 CO -0.02 0.65 -0.29 0.78 0.00 0.00 0.00 179.25 180.37 3dby h GLY 145 N 1.09 0.00 1.98 0.00 0.00 -0.63 -1.24 103.07 104.26 3dby h GLY 145 Ca 0.22 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.41 3dby h GLY 145 CO -0.00 0.00 -0.71 1.48 0.00 0.00 0.00 176.54 177.31 3dby h SER 146 N 0.00 0.00 -0.03 0.19 4.64 -0.62 -1.65 113.55 116.08 3dby h SER 146 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3dby h SER 146 Cb 0.67 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.76 3dby h SER 146 CO 0.04 0.69 -0.01 0.40 -0.87 0.00 0.00 176.83 177.08 3dby h ILE 147 N 0.00 1.31 -0.44 0.95 2.04 -0.94 -1.51 117.51 118.91 3dby h ILE 147 Ca -0.01 -0.93 0.09 0.00 1.00 0.00 0.00 64.86 65.01 3dby h ILE 147 Cb 1.54 1.87 -0.09 0.00 -0.74 0.00 0.00 36.82 39.40 3dby h ILE 147 CO 0.09 0.25 -0.16 -1.28 0.00 0.00 0.00 178.15 177.04 3dby h SER 148 N -0.31 -0.57 1.12 1.72 0.87 -1.23 -1.54 113.55 113.61 3dby h SER 148 Ca 0.01 0.15 -0.04 0.00 -1.23 0.00 0.00 61.79 60.68 3dby h SER 148 Cb 0.41 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 62.70 3dby h SER 148 CO 0.00 -0.20 -0.18 1.23 -0.53 0.00 0.00 176.83 177.15 3dby h GLY 149 N -0.07 0.00 0.22 5.77 0.00 -1.26 -3.14 103.07 104.60 3dby h GLY 149 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 3dby h GLY 149 CO -0.49 0.00 -0.41 0.61 0.00 0.00 0.00 176.54 176.25 3dby n GLY 150 N 0.35 -0.71 3.77 4.60 0.00 -0.57 -4.92 105.19 107.71 3dby n GLY 150 Ca 0.01 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.66 4.36 0.54 0.99 1.43 -0.63 -1.28 118.68 121.43 3dby s LEU 151 Ca 0.19 2.06 -0.20 0.00 -1.03 0.00 0.00 54.13 55.15 3dby s LEU 151 Cb 0.18 -3.92 -0.08 0.00 0.03 0.00 0.00 46.19 42.41 3dby s LEU 151 CO 0.60 -0.23 0.76 -0.67 0.23 0.00 0.00 176.35 177.04 3dby n ASP 152 N 0.61 -0.01 -0.39 2.29 2.03 -0.68 -4.87 116.55 115.54 3dby n ASP 152 Ca 0.02 0.83 0.33 0.00 0.52 0.00 0.00 54.79 56.49 3dby n ASP 152 Cb 0.48 -1.27 0.65 0.00 -0.72 0.00 0.00 41.12 40.25 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 0.61 0.22 -0.95 -2.67 5.85 -1.95 -1.58 115.31 114.84 3dby h LEU 153 Ca -0.46 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.33 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 0.50 -0.02 -0.00 1.33 -0.34 0.00 0.00 178.44 179.91 3dby n VAL 154 N -4.46 0.00 -2.12 1.05 0.24 -1.26 -4.40 118.33 107.38 3dby n VAL 154 Ca 0.31 -0.25 -0.41 0.00 -2.04 0.00 0.00 64.34 61.95 3dby n VAL 154 Cb 1.25 0.49 -0.00 0.00 -1.47 0.00 0.00 33.84 34.11 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 0.15 4.14 -0.16 7.34 -0.58 -0.60 -4.73 120.64 126.21 3dby n GLU 155 Ca 0.19 -3.45 -0.09 0.00 -0.42 0.00 0.00 57.16 53.39 3dby n GLU 155 Cb 0.35 -2.76 -0.00 0.00 -0.57 0.00 0.00 31.44 28.46 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 5.11 0.75 -0.53 3.49 1.79 -1.83 -1.80 116.57 123.54 3dby h LYS 156 Ca 0.57 -0.19 -0.08 0.00 -2.18 0.00 0.00 60.65 58.77 3dby h LYS 156 Cb 0.44 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.98 3dby h LYS 156 CO 1.56 0.75 -0.01 0.07 -1.08 0.00 0.00 179.45 180.74 3dby h ARG 157 N 0.62 0.91 -0.35 3.15 -0.00 -1.98 -1.46 114.38 115.26 3dby h ARG 157 Ca 0.14 -0.27 -0.12 0.00 -0.00 0.00 0.00 59.98 59.73 3dby h ARG 157 Cb 0.35 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.97 30.22 3dby h ARG 157 CO 0.01 0.91 -0.27 -0.07 -0.00 0.00 0.00 179.97 180.54 3dby h LEU 158 N 0.84 0.75 -0.72 0.08 3.38 -1.94 -2.41 115.31 115.29 3dby h LEU 158 Ca 0.16 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 3dby h LEU 158 Cb 0.51 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 3dby h LEU 158 CO 0.03 0.99 0.27 0.11 0.09 0.00 0.00 178.44 179.93 3dby h LYS 159 N 0.63 1.08 -0.85 1.13 1.57 -1.24 -2.12 116.57 116.77 3dby h LYS 159 Ca 0.08 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 3dby h LYS 159 Cb 0.79 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.89 3dby h LYS 159 CO 0.06 0.90 0.46 0.93 -0.57 0.00 0.00 179.45 181.23 3dby h GLU 160 N 1.03 1.19 -0.25 3.15 5.08 -1.10 -0.45 114.58 123.23 3dby h GLU 160 Ca 0.24 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 3dby h GLU 160 Cb 0.23 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3dby h GLU 160 CO -0.02 0.88 -0.05 -0.22 -1.00 0.00 0.00 179.01 178.60 3dby h LYS 161 N 1.19 0.48 -0.24 2.33 1.63 -1.39 -1.67 116.57 118.90 3dby h LYS 161 Ca 0.30 -0.18 -0.16 0.00 -0.85 0.00 0.00 60.65 59.76 3dby h LYS 161 Cb 0.04 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 3dby h LYS 161 CO -0.05 0.70 -0.50 0.66 -3.45 0.00 0.00 179.45 176.81 3dby h SER 162 N 0.23 0.73 -0.95 4.20 4.64 -1.19 -1.48 113.55 119.73 3dby h SER 162 Ca 0.07 -0.37 0.15 0.00 -0.47 0.00 0.00 61.79 61.16 3dby h SER 162 Cb 0.51 -0.21 -0.08 0.00 -0.31 0.00 0.00 62.40 62.31 3dby h SER 162 CO 0.02 1.10 0.60 -0.33 -0.87 0.00 0.00 176.83 177.36 3dby h GLU 163 N 0.52 0.78 -0.33 4.77 5.08 -1.08 0.20 114.58 124.53 3dby h GLU 163 Ca 0.02 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 3dby h GLU 163 Cb 1.06 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 3dby h GLU 163 CO 0.10 0.52 -0.19 1.49 -1.00 0.00 0.00 179.01 179.93 3dby h GLU 164 N 0.81 0.71 -0.50 2.33 4.81 -0.74 -1.53 114.58 120.46 3dby h GLU 164 Ca 0.49 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 59.44 3dby h GLU 164 Cb 0.68 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.01 3dby h GLU 164 CO -0.26 0.93 0.24 0.74 -0.73 0.00 0.00 179.01 179.93 3dby h PHE 165 N 0.47 0.44 -0.44 0.92 0.04 -0.89 -1.63 116.94 115.86 3dby h PHE 165 Ca 0.07 0.02 0.09 0.00 2.80 0.00 0.00 57.97 60.95 3dby h PHE 165 Cb 0.74 -0.13 -0.08 0.00 2.20 0.00 0.00 35.95 38.68 3dby h PHE 165 CO 0.06 0.21 -0.09 1.15 -0.60 0.00 0.00 178.31 179.04 3dby h THR 166 N 0.47 0.58 -0.10 -1.55 2.02 -0.78 -1.51 112.91 112.04 3dby h THR 166 Ca 0.22 -0.01 0.00 0.00 0.77 0.00 0.00 66.41 67.40 3dby h THR 166 Cb 0.15 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 3dby h THR 166 CO -0.17 0.00 0.06 0.50 0.37 0.00 0.00 175.52 176.28 3dby h LYS 167 N 0.02 0.12 -0.65 6.66 3.64 -1.03 -0.80 116.57 124.52 3dby h LYS 167 Ca 0.21 -0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.65 3dby h LYS 167 Cb 0.32 -0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.06 3dby h LYS 167 CO -0.44 0.08 0.35 0.45 -2.27 0.00 0.00 179.45 177.61 3dby h HIS 168 N 0.12 0.63 -0.32 1.91 3.86 -1.01 -0.39 115.15 119.94 3dby h HIS 168 Ca 0.04 0.03 -0.17 0.00 -1.16 0.00 0.00 60.37 59.10 3dby h HIS 168 Cb -0.01 -0.19 -0.00 0.00 1.06 0.00 0.00 27.41 28.27 3dby h HIS 168 CO -0.08 0.28 -0.46 0.74 0.86 0.00 0.00 177.93 179.27 3dby h PHE 169 N 0.63 1.05 -0.58 2.45 0.04 -1.09 -1.33 116.94 118.13 3dby h PHE 169 Ca 0.30 -0.34 0.02 0.00 2.80 0.00 0.00 57.97 60.75 3dby h PHE 169 Cb 0.23 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.13 3dby h PHE 169 CO -0.09 1.16 0.36 0.93 -0.60 0.00 0.00 178.31 180.07 3dby h GLU 170 N 0.68 0.71 -0.59 1.51 5.08 -0.97 -0.20 114.58 120.81 3dby h GLU 170 Ca 0.04 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 3dby h GLU 170 Cb 1.05 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 3dby h GLU 170 CO 0.11 0.47 0.10 1.96 -1.00 0.00 0.00 179.01 180.65 3dby h GLN 171 N 0.73 0.97 -0.88 2.33 4.20 -1.00 -2.13 115.11 119.32 3dby h GLN 171 Ca 0.22 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.68 3dby h GLN 171 Cb -0.03 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.60 3dby h GLN 171 CO -0.08 0.91 0.57 0.74 -0.67 0.00 0.00 178.83 180.31 3dby h PHE 172 N 0.87 1.12 -0.58 2.96 0.04 -1.09 -2.13 116.94 118.12 3dby h PHE 172 Ca 0.18 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.97 3dby h PHE 172 Cb 0.41 -0.38 -0.03 0.00 2.20 0.00 0.00 35.95 38.16 3dby h PHE 172 CO 0.03 0.71 0.38 -0.92 -0.60 0.00 0.00 178.31 177.91 3dby h TYR 173 N 1.20 0.73 -0.88 -0.55 3.20 -0.49 -0.23 116.97 119.94 3dby h TYR 173 Ca 0.32 0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.23 3dby h TYR 173 Cb -0.12 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 37.85 3dby h TYR 173 CO -0.01 0.47 0.57 -0.07 -1.64 0.00 0.00 178.16 177.49 3dby h LEU 174 N 0.78 0.96 -0.43 2.82 3.38 -1.05 0.04 115.31 121.81 3dby h LEU 174 Ca 0.21 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3dby h LEU 174 Cb -0.08 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3dby h LEU 174 CO -0.04 0.67 0.28 0.50 0.09 0.00 0.00 178.44 179.93 3dby h LYS 175 N 1.13 0.57 -0.99 1.13 3.64 -0.98 -2.83 116.57 118.23 3dby h LYS 175 Ca 0.35 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.70 3dby h LYS 175 Cb -0.02 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 31.62 3dby h LYS 175 CO -0.11 0.39 0.66 0.00 -2.27 0.00 0.00 179.45 178.12 3dby h ALA 176 N 1.15 1.27 -0.63 5.00 0.00 -0.28 0.12 119.26 125.89 3dby h ALA 176 Ca 0.16 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.07 3dby h ALA 176 Cb -0.05 -0.40 -0.06 0.00 0.00 0.00 0.00 17.79 17.29 3dby h ALA 176 CO -0.03 0.64 0.33 0.28 0.00 0.00 0.00 179.25 180.46 3dby h VAL 177 N 1.34 0.93 -0.07 0.00 2.07 -0.94 0.14 116.25 119.71 3dby h VAL 177 Ca 0.37 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.64 3dby h VAL 177 Cb -0.13 0.27 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 3dby h VAL 177 CO -0.09 0.11 -0.14 -0.33 0.02 0.00 0.00 177.57 177.15 3dby h GLU 178 N 0.60 0.22 -0.72 1.57 4.39 -1.21 -3.05 114.58 116.37 3dby h GLU 178 Ca 0.29 -0.14 0.11 0.00 0.34 0.00 0.00 59.36 59.96 3dby h GLU 178 Cb 0.22 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 28.84 3dby h GLU 178 CO -0.20 0.73 0.48 0.52 -1.16 0.00 0.00 179.01 179.37 3dby h MET 179 N -0.26 0.52 -0.48 2.33 2.86 -0.52 -0.44 114.93 118.93 3dby h MET 179 Ca 0.00 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 3dby h MET 179 Cb 0.72 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 3dby h MET 179 CO 0.03 0.34 0.16 1.15 1.06 0.00 0.00 176.91 179.65 3dby h THR 180 N 0.53 1.19 -0.18 2.22 2.02 -0.87 -2.63 112.91 115.20 3dby h THR 180 Ca 0.34 -0.64 -0.11 0.00 0.77 0.00 0.00 66.41 66.77 3dby h THR 180 Cb 0.61 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 3dby h THR 180 CO -0.12 0.24 -0.37 1.23 0.37 0.00 0.00 175.52 176.88 3dby h GLY 181 N 0.87 0.43 1.04 2.16 0.00 -1.02 -2.92 103.07 103.62 3dby h GLY 181 Ca 0.16 -0.40 0.07 0.00 0.00 0.00 0.00 47.33 47.16 3dby h GLY 181 CO -0.01 0.36 0.47 -0.97 0.00 0.00 0.00 176.54 176.39 3dby h TYR 182 N 0.34 0.74 0.00 5.60 0.05 -0.97 -2.34 116.97 120.39 3dby h TYR 182 Ca 0.04 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.84 3dby h TYR 182 Cb 0.80 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 38.30 3dby h TYR 182 CO 0.02 0.39 0.36 1.28 -1.05 0.00 0.00 178.16 179.16 3dby n LEU 183 N -4.48 0.22 0.23 3.88 4.77 -1.10 -1.18 117.00 119.34 3dby n LEU 183 Ca 0.11 0.44 0.15 0.00 -0.03 0.00 0.00 56.01 56.68 3dby n LEU 183 Cb 0.24 -0.37 0.54 0.00 -2.33 0.00 0.00 43.42 41.49 3dby n LEU 183 CO 0.34 -0.52 0.93 0.03 -1.33 0.00 0.00 177.39 176.84 3dby h ARG 184 N 0.00 0.00 0.00 3.23 3.08 -1.60 -0.31 114.38 118.78 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 0.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.76 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 -2.89 1.27 -1.17 2.04 -2.24 -0.32 -4.88 114.28 106.08 3dby n THR 185 Ca 0.02 0.32 -0.06 0.00 -2.27 0.00 0.00 64.05 62.06 3dby n THR 185 Cb 0.34 -1.19 -0.03 0.00 -2.10 0.00 0.00 70.33 67.36 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 -1.43 -1.44 -3.26 -0.78 1.02 -0.13 -4.99 120.64 109.64 3dby n GLU 186 Ca 0.02 0.64 -0.40 0.00 -0.02 0.00 0.00 57.16 57.41 3dby n GLU 186 Cb 0.08 -4.85 -0.08 0.00 -0.02 0.00 0.00 31.44 26.58 3dby n GLU 186 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3dby s LEU 187 N -1.36 4.08 -0.02 -4.62 1.43 -1.26 -4.95 118.68 111.99 3dby s LEU 187 Ca 0.00 0.42 0.20 0.00 -1.03 0.00 0.00 54.13 53.71 3dby s LEU 187 Cb 0.00 -2.62 -0.27 0.00 0.03 0.00 0.00 46.19 43.33 3dby s LEU 187 CO 0.00 -0.30 0.58 1.41 0.23 0.00 0.00 176.35 178.27 3dby n HIS 188 N 5.54 0.00 -4.32 0.29 8.25 -1.26 -4.44 115.22 119.28 3dby n HIS 188 Ca -0.05 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.21 3dby n HIS 188 Cb 0.50 -0.27 -0.16 0.00 1.12 0.00 0.00 29.99 31.17 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 -3.15 0.90 -0.02 4.41 3.76 -1.26 -5.04 115.29 114.89 3dby s HIS 189 Ca -0.02 -0.25 -0.28 0.00 -0.15 0.00 0.00 55.06 54.37 3dby s HIS 189 Cb 0.13 -0.69 0.06 0.00 1.11 0.00 0.00 32.58 33.20 3dby s HIS 189 CO 0.81 -0.14 0.61 -0.59 -0.85 0.00 0.00 174.74 174.57 3dby s PHE 190 N 0.48 -0.57 0.31 1.40 -0.12 -1.26 -5.08 117.98 113.15 3dby s PHE 190 Ca -0.07 0.89 0.05 0.00 -0.05 0.00 0.00 56.93 57.75 3dby s PHE 190 Cb -0.11 0.38 0.69 0.00 -0.63 0.00 0.00 43.02 43.34 3dby s PHE 190 CO 0.01 -0.60 1.83 -1.35 -0.05 0.00 0.00 175.22 175.05 3dby h PRO 191 N 3.01 0.82 -0.22 1.99 0.11 -2.00 -1.78 132.00 133.92 3dby h PRO 191 Ca -0.28 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 3dby h PRO 191 Cb 1.16 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 3dby h PRO 191 CO 0.39 0.54 -0.01 0.00 -0.21 0.00 0.00 178.00 178.71 3dby h ALA 192 N 1.58 1.57 -0.20 -0.75 0.00 -1.99 -1.12 119.26 118.35 3dby h ALA 192 Ca 0.50 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.20 3dby h ALA 192 Cb 0.67 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 3dby h ALA 192 CO -0.27 0.31 -0.14 1.25 0.00 0.00 0.00 179.25 180.40 3dby h LEU 193 N 0.32 0.47 -0.58 0.00 5.85 -1.75 -1.61 115.31 118.01 3dby h LEU 193 Ca 0.07 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 3dby h LEU 193 Cb 0.24 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.11 3dby h LEU 193 CO 0.01 0.82 0.33 0.11 -0.34 0.00 0.00 178.44 179.37 3dby h LYS 194 N 0.14 0.80 -0.19 1.25 1.79 -1.21 -1.35 116.57 117.79 3dby h LYS 194 Ca 0.04 -0.09 0.01 0.00 -2.18 0.00 0.00 60.65 58.43 3dby h LYS 194 Cb 0.66 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 31.13 3dby h LYS 194 CO 0.04 0.60 0.10 -0.22 -1.08 0.00 0.00 179.45 178.89 3dby h LYS 195 N 0.79 0.20 -0.18 3.15 1.63 -1.27 -2.19 116.57 118.70 3dby h LYS 195 Ca 0.21 -0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.05 3dby h LYS 195 Cb 0.02 -0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 31.54 3dby h LYS 195 CO -0.04 0.13 -0.26 0.35 -3.45 0.00 0.00 179.45 176.19 3dby h PHE 196 N 0.21 -0.69 -0.66 1.91 3.57 -1.02 0.84 116.94 121.10 3dby h PHE 196 Ca 0.08 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3dby h PHE 196 Cb 0.01 0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 3dby h PHE 196 CO -0.09 -0.34 0.42 1.15 -2.23 0.00 0.00 178.31 177.22 3dby h THR 197 N -0.30 1.18 -0.55 4.41 2.02 -1.07 -0.25 112.91 118.35 3dby h THR 197 Ca 0.12 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.91 3dby h THR 197 Cb 0.48 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 3dby h THR 197 CO -0.35 0.18 0.20 0.50 0.37 0.00 0.00 175.52 176.42 3dby h LYS 198 N 0.90 0.83 -0.27 6.66 3.64 -0.68 -1.18 116.57 126.46 3dby h LYS 198 Ca 0.24 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3dby h LYS 198 Cb -0.07 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 3dby h LYS 198 CO -0.05 0.73 0.17 -0.44 -2.27 0.00 0.00 179.45 177.60 3dby h ASP 199 N 0.75 0.32 -0.44 4.20 3.32 0.51 -2.18 116.42 122.90 3dby h ASP 199 Ca 0.18 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.24 3dby h ASP 199 Cb 0.22 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 3dby h ASP 199 CO -0.01 0.25 0.22 0.58 -1.72 0.00 0.00 179.24 178.55 3dby h VAL 200 N 0.36 0.96 -0.79 -1.35 2.07 -1.10 -2.22 116.25 114.17 3dby h VAL 200 Ca 0.10 -0.15 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3dby h VAL 200 Cb -0.02 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 3dby h VAL 200 CO -0.02 0.08 0.53 0.28 0.02 0.00 0.00 177.57 178.45 3dby h SER 201 N 0.44 0.88 -0.56 0.57 0.02 -0.94 -0.49 113.55 113.47 3dby h SER 201 Ca 0.19 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 61.03 3dby h SER 201 Cb 0.10 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 3dby h SER 201 CO -0.14 0.63 -0.01 0.25 -1.14 0.00 0.00 176.83 176.42 3dby h LEU 202 N 1.03 0.98 -0.60 5.07 5.85 -1.21 -1.99 115.31 124.45 3dby h LEU 202 Ca 0.30 -0.31 -0.13 0.00 0.84 0.00 0.00 57.88 58.58 3dby h LEU 202 Cb -0.05 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 40.70 3dby h LEU 202 CO -0.08 1.05 -0.28 -0.08 -0.34 0.00 0.00 178.44 178.72 3dby h GLU 203 N 0.89 0.82 -0.60 1.25 4.57 -0.78 -1.51 114.58 119.21 3dby h GLU 203 Ca 0.16 -0.36 0.01 0.00 -1.18 0.00 0.00 59.36 57.99 3dby h GLU 203 Cb 0.55 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.09 3dby h GLU 203 CO 0.03 0.99 0.40 -0.07 -1.18 0.00 0.00 179.01 179.18 3dby h LEU 204 N 0.70 0.69 0.03 1.64 3.38 -1.07 0.10 115.31 120.78 3dby h LEU 204 Ca 0.08 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3dby h LEU 204 Cb 0.81 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3dby h LEU 204 CO 0.07 0.50 -0.02 0.11 0.09 0.00 0.00 178.44 179.19 3dby h LYS 205 N 0.81 -0.04 -0.75 1.13 6.56 -0.89 0.72 116.57 124.11 3dby h LYS 205 Ca 0.22 0.00 0.12 0.00 -1.06 0.00 0.00 60.65 59.93 3dby h LYS 205 Cb -0.08 0.01 -0.08 0.00 -0.57 0.00 0.00 32.23 31.51 3dby h LYS 205 CO -0.05 0.29 0.36 -0.07 -2.06 0.00 0.00 179.45 177.92 3dby h LEU 206 N -0.38 0.43 -0.47 2.94 3.38 -1.07 -2.25 115.31 117.89 3dby h LEU 206 Ca -0.00 0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 3dby h LEU 206 Cb 0.35 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3dby h LEU 206 CO 0.01 0.22 -0.56 0.15 0.09 0.00 0.00 178.44 178.35 3dby h PHE 207 N 0.57 0.76 -0.77 1.13 3.57 -0.61 -1.96 116.94 119.64 3dby h PHE 207 Ca 0.39 -0.27 -0.04 0.00 3.53 0.00 0.00 57.97 61.58 3dby h PHE 207 Cb 0.49 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 3dby h PHE 207 CO -0.12 1.02 0.33 0.77 -2.23 0.00 0.00 178.31 178.09 3dby h SER 208 N 0.46 1.05 -0.43 0.41 0.02 -0.59 0.70 113.55 115.16 3dby h SER 208 Ca 0.01 -0.16 0.01 0.00 -0.84 0.00 0.00 61.79 60.81 3dby h SER 208 Cb 1.11 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.36 3dby h SER 208 CO 0.11 0.92 0.27 -0.74 -1.14 0.00 0.00 176.83 176.24 3dby h HIS 209 N 1.11 0.51 -0.58 3.45 -0.00 -1.16 -0.45 115.15 118.01 3dby h HIS 209 Ca 0.26 0.01 0.02 0.00 -0.00 0.00 0.00 60.37 60.67 3dby h HIS 209 Cb 0.18 -0.17 -0.04 0.00 -0.00 0.00 0.00 27.41 27.39 3dby h HIS 209 CO 0.02 0.31 0.36 0.35 -0.00 0.00 0.00 177.93 178.96 3dby h PHE 210 N 0.55 0.68 -0.90 5.26 3.57 -1.02 -2.17 116.94 122.90 3dby h PHE 210 Ca 0.16 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.69 3dby h PHE 210 Cb -0.03 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.45 3dby h PHE 210 CO -0.06 0.39 0.60 -0.07 -2.23 0.00 0.00 178.31 176.94 3dby h LEU 211 N 0.72 1.04 -1.23 0.59 3.38 -0.54 -0.65 115.31 118.61 3dby h LEU 211 Ca 0.23 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 3dby h LEU 211 Cb 0.00 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3dby h LEU 211 CO -0.09 0.75 0.12 0.45 0.09 0.00 0.00 178.44 179.76 3dby h HIS 212 N 1.22 0.66 -0.22 1.13 3.86 -0.85 0.03 115.15 120.98 3dby h HIS 212 Ca 0.33 -0.05 -0.12 0.00 -1.16 0.00 0.00 60.37 59.37 3dby h HIS 212 Cb -0.14 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 28.13 3dby h HIS 212 CO -0.01 0.56 -0.35 1.49 0.86 0.00 0.00 177.93 180.48 3dby h GLU 213 N 0.64 0.62 -0.52 2.45 4.81 -1.19 -0.99 114.58 120.41 3dby h GLU 213 Ca 0.15 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 58.99 3dby h GLU 213 Cb 0.23 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 3dby h GLU 213 CO -0.01 0.99 0.28 0.28 -0.73 0.00 0.00 179.01 179.82 3dby h VAL 214 N 0.32 1.18 -0.47 0.32 2.07 -0.90 0.06 116.25 118.82 3dby h VAL 214 Ca 0.02 -0.46 0.06 0.00 0.82 0.00 0.00 66.70 67.13 3dby h VAL 214 Cb 0.94 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 31.20 3dby h VAL 214 CO 0.08 0.19 0.19 -0.08 0.02 0.00 0.00 177.57 177.97 3dby h GLU 215 N 0.69 0.37 -0.51 1.57 4.81 -0.91 -0.10 114.58 120.50 3dby h GLU 215 Ca 0.18 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 3dby h GLU 215 Cb 0.06 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3dby h GLU 215 CO -0.03 0.24 0.16 0.93 -0.73 0.00 0.00 179.01 179.58 3dby h GLU 216 N 0.38 0.79 -0.74 1.92 4.39 -0.99 -0.20 114.58 120.13 3dby h GLU 216 Ca 0.22 -0.17 0.12 0.00 0.34 0.00 0.00 59.36 59.87 3dby h GLU 216 Cb 0.20 -0.11 -0.08 0.00 -0.10 0.00 0.00 28.75 28.65 3dby h GLU 216 CO -0.20 0.73 0.34 -0.07 -1.16 0.00 0.00 179.01 178.65 3dby h LEU 217 N 0.69 0.39 -0.22 1.33 3.38 -0.68 -1.94 115.31 118.26 3dby h LEU 217 Ca 0.16 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 3dby h LEU 217 Cb 0.27 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3dby h LEU 217 CO -0.01 0.19 -0.05 -0.33 0.09 0.00 0.00 178.44 178.33 3dby h GLU 218 N 0.54 0.43 -0.19 1.13 4.39 -0.40 0.13 114.58 120.61 3dby h GLU 218 Ca 0.39 -0.16 0.06 0.00 0.34 0.00 0.00 59.36 59.98 3dby h GLU 218 Cb 0.50 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 3dby h GLU 218 CO -0.33 0.67 0.14 -0.07 -1.16 0.00 0.00 179.01 178.26 3dby h LEU 219 N 0.16 0.00 -1.32 1.33 3.38 -0.83 -1.96 115.31 116.08 3dby h LEU 219 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3dby h LEU 219 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3dby h LEU 219 CO 0.02 0.00 -0.25 -1.54 0.09 0.00 0.00 178.44 176.77 3dby n SER 220 N -4.44 2.25 -1.61 -0.43 3.41 -0.75 -4.95 113.62 107.11 3dby n SER 220 Ca 0.02 -1.63 -0.16 0.00 -0.26 0.00 0.00 58.87 56.84 3dby n SER 220 Cb 0.28 0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.48 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 0.46 -4.74 -0.31 4.04 3.02 -0.47 -4.89 115.26 112.36 3dby n ASN 221 Ca 0.10 0.11 0.13 0.00 -0.03 0.00 0.00 54.58 54.88 3dby n ASN 221 Cb 0.47 -3.80 0.31 0.00 -0.61 0.00 0.00 39.78 36.15 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 -2.51 0.96 -4.86 3.52 1.02 0.34 -4.82 120.64 114.30 3dby n GLU 222 Ca -0.18 -0.63 -0.30 0.00 -0.02 0.00 0.00 57.16 56.03 3dby n GLU 222 Cb 0.60 -1.49 -0.14 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 -2.47 2.27 -0.21 2.62 0.11 -1.22 -5.03 120.40 116.47 3dby s VAL 223 Ca 0.24 -1.35 -0.15 0.00 -2.93 0.00 0.00 61.98 57.79 3dby s VAL 223 Cb 0.19 -1.90 -0.04 0.00 -1.53 0.00 0.00 36.38 33.10 3dby s VAL 223 CO 0.52 0.36 0.35 -0.76 -3.33 0.00 0.00 175.10 172.24 3dby s LEU 224 N -1.28 4.15 0.00 2.54 1.43 -1.26 -4.91 118.68 119.35 3dby s LEU 224 Ca 0.12 0.44 -0.29 0.00 -1.03 0.00 0.00 54.13 53.37 3dby s LEU 224 Cb -0.10 -2.43 0.11 0.00 0.03 0.00 0.00 46.19 43.80 3dby s LEU 224 CO 0.03 -0.04 1.26 -0.94 0.23 0.00 0.00 176.35 176.88 3dby s SER 225 N 1.03 -0.05 -0.23 2.29 1.04 -1.26 -1.68 113.70 114.83 3dby s SER 225 Ca 0.17 -0.18 0.14 0.00 0.48 0.00 0.00 55.95 56.55 3dby s SER 225 Cb -0.14 0.19 0.58 0.00 0.10 0.00 0.00 66.02 66.75 3dby s SER 225 CO 0.07 -0.36 1.52 1.33 0.98 0.00 0.00 173.24 176.77 3dby n VAL 226 N -0.56 2.48 -2.35 5.02 0.24 -0.40 -4.91 118.33 117.85 3dby n VAL 226 Ca -0.06 -2.00 -0.25 0.00 -2.04 0.00 0.00 64.34 59.99 3dby n VAL 226 Cb 0.62 -0.29 0.10 0.00 -1.47 0.00 0.00 33.84 32.80 3dby n VAL 226 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3dby s LEU 227 N -2.95 2.91 0.10 1.34 1.43 -1.26 -5.04 118.68 115.21 3dby s LEU 227 Ca 0.46 0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.63 3dby s LEU 227 Cb 0.38 -2.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 3dby s LEU 227 CO 0.08 -1.86 -0.07 -0.94 0.23 0.00 0.00 176.35 173.79 3dby s SER 228 N -4.66 1.19 0.24 2.29 1.04 -1.26 -5.02 113.70 107.52 3dby s SER 228 Ca 0.65 -0.95 -0.05 0.00 0.48 0.00 0.00 55.95 56.08 3dby s SER 228 Cb -0.07 0.07 0.37 0.00 0.10 0.00 0.00 66.02 66.49 3dby s SER 228 CO 0.45 -0.42 1.83 0.00 0.98 0.00 0.00 173.24 176.09 3dby h ALA 229 N 3.13 1.19 -0.77 5.32 0.00 -1.88 -2.69 119.26 123.56 3dby h ALA 229 Ca -0.36 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 3dby h ALA 229 Cb 1.17 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 3dby h ALA 229 CO 0.62 0.19 0.40 -0.09 0.00 0.00 0.00 179.25 180.36 3dby h ARG 230 N 0.89 1.08 -0.77 0.00 2.43 -1.95 -0.31 114.38 115.75 3dby h ARG 230 Ca 0.39 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 3dby h ARG 230 Cb 0.27 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 29.58 3dby h ARG 230 CO -0.21 0.82 0.49 1.98 -1.51 0.00 0.00 179.97 181.53 3dby h MET 231 N 1.08 1.02 -0.39 0.20 4.05 -1.91 -0.00 114.93 118.99 3dby h MET 231 Ca 0.27 -0.08 -0.03 0.00 -0.28 0.00 0.00 59.70 59.58 3dby h MET 231 Cb 0.07 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 30.63 3dby h MET 231 CO -0.04 0.70 0.13 0.00 0.23 0.00 0.00 176.91 177.93 3dby h ALA 232 N 1.26 0.50 -0.11 0.39 0.00 -1.11 -0.46 119.26 119.73 3dby h ALA 232 Ca 0.28 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.05 3dby h ALA 232 Cb -0.08 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3dby h ALA 232 CO -0.06 0.14 -0.05 0.22 0.00 0.00 0.00 179.25 179.51 3dby h ASP 233 N 0.48 -0.17 -0.38 0.00 3.58 -0.98 -1.40 116.42 117.55 3dby h ASP 233 Ca 0.12 0.04 0.08 0.00 0.42 0.00 0.00 57.03 57.69 3dby h ASP 233 Cb 0.25 0.10 -0.07 0.00 1.72 0.00 0.00 39.33 41.32 3dby h ASP 233 CO -0.00 -0.07 -0.07 -0.74 -2.88 0.00 0.00 179.24 175.48 3dby h HIS 234 N -0.04 -0.15 -0.63 0.28 2.76 -0.81 -0.45 115.15 116.11 3dby h HIS 234 Ca 0.06 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.28 3dby h HIS 234 Cb 0.13 0.13 -0.04 0.00 1.55 0.00 0.00 27.41 29.18 3dby h HIS 234 CO -0.18 -0.14 0.40 0.52 -1.30 0.00 0.00 177.93 177.24 3dby h MET 235 N 0.03 0.78 -0.36 5.26 2.86 -0.89 -1.77 114.93 120.85 3dby h MET 235 Ca 0.19 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.68 3dby h MET 235 Cb 0.28 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 3dby h MET 235 CO -0.37 0.52 -0.19 0.00 1.06 0.00 0.00 176.91 177.93 3dby h ALA 236 N 1.25 0.99 -0.41 6.32 0.00 -0.89 -0.14 119.26 126.39 3dby h ALA 236 Ca 0.24 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3dby h ALA 236 Cb -0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3dby h ALA 236 CO -0.08 0.59 0.09 0.00 0.00 0.00 0.00 179.25 179.86 3dby h ARG 237 N 0.60 0.66 -0.70 0.00 3.08 -0.84 -1.10 114.38 116.08 3dby h ARG 237 Ca 0.09 -0.16 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 3dby h ARG 237 Cb 0.66 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.59 3dby h ARG 237 CO 0.05 0.69 0.34 0.93 -1.07 0.00 0.00 179.97 180.90 3dby h GLU 238 N 0.52 1.00 -0.38 0.04 5.08 -1.14 -1.52 114.58 118.18 3dby h GLU 238 Ca 0.13 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 3dby h GLU 238 Cb 0.33 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 3dby h GLU 238 CO 0.00 0.79 0.03 0.93 -1.00 0.00 0.00 179.01 179.76 3dby h GLU 239 N 0.97 0.59 -0.58 2.33 4.39 -0.84 -1.60 114.58 119.83 3dby h GLU 239 Ca 0.24 -0.12 -0.03 0.00 0.34 0.00 0.00 59.36 59.79 3dby h GLU 239 Cb 0.11 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 3dby h GLU 239 CO -0.03 0.59 0.25 0.00 -1.16 0.00 0.00 179.01 178.66 3dby h TYR 241 N 0.80 0.22 -0.19 0.00 3.20 -0.70 -0.26 116.97 120.04 3dby h TYR 241 Ca 0.20 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.11 3dby h TYR 241 Cb 0.17 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 3dby h TYR 241 CO 0.01 0.13 -0.03 -0.92 -1.64 0.00 0.00 178.16 175.70 3dby h TYR 242 N 0.26 -0.07 -0.32 -3.82 3.20 -1.24 -0.80 116.97 114.17 3dby h TYR 242 Ca 0.10 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.05 3dby h TYR 242 Cb 0.03 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 3dby h TYR 242 CO -0.10 -0.07 -0.02 1.25 -1.64 0.00 0.00 178.16 177.59 3dby h LEU 243 N 0.02 -0.17 -0.21 2.82 5.85 -1.02 -1.10 115.31 121.50 3dby h LEU 243 Ca 0.09 0.08 0.05 0.00 0.84 0.00 0.00 57.88 58.94 3dby h LEU 243 Cb 0.13 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 3dby h LEU 243 CO -0.18 -0.05 -0.13 0.25 -0.34 0.00 0.00 178.44 177.99 3dby h LEU 244 N 0.07 -0.43 -0.99 2.25 5.85 -0.73 -1.10 115.31 120.23 3dby h LEU 244 Ca 0.15 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.98 3dby h LEU 244 Cb 0.21 0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 3dby h LEU 244 CO -0.27 -0.17 0.65 0.11 -0.34 0.00 0.00 178.44 178.42 3dby h LYS 245 N -0.12 1.29 -0.50 1.25 1.79 -1.00 -0.35 116.57 118.93 3dby h LYS 245 Ca 0.12 -0.08 -0.06 0.00 -2.18 0.00 0.00 60.65 58.45 3dby h LYS 245 Cb 0.30 -0.29 -0.02 0.00 -1.58 0.00 0.00 32.23 30.64 3dby h LYS 245 CO -0.28 0.85 0.08 -0.07 -1.08 0.00 0.00 179.45 178.95 3dby h LEU 246 N 1.33 0.79 -0.35 2.94 3.38 -0.88 0.86 115.31 123.38 3dby h LEU 246 Ca 0.37 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3dby h LEU 246 Cb -0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 3dby h LEU 246 CO -0.08 0.85 0.20 0.00 0.09 0.00 0.00 178.44 179.49 3dby h ALA 247 N 0.97 0.44 -0.30 1.53 0.00 -0.88 0.22 119.26 121.24 3dby h ALA 247 Ca 0.15 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3dby h ALA 247 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3dby h ALA 247 CO 0.01 -0.04 -0.13 1.96 0.00 0.00 0.00 179.25 181.04 3dby h GLN 248 N 0.44 0.62 -0.02 0.00 4.20 -0.97 -0.90 115.11 118.48 3dby h GLN 248 Ca 0.12 -0.27 -0.21 0.00 0.06 0.00 0.00 58.65 58.36 3dby h GLN 248 Cb 0.04 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 3dby h GLN 248 CO -0.02 0.84 -0.87 0.66 -0.67 0.00 0.00 178.83 178.77 3dby h SER 249 N 0.38 0.47 0.40 1.46 4.64 -0.77 -3.33 113.55 116.80 3dby h SER 249 Ca 0.07 -0.35 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 3dby h SER 249 Cb 0.65 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3dby h SER 249 CO 0.04 1.14 -1.15 -0.24 -0.87 0.00 0.00 176.83 175.75 3dby n SER 250 N -3.75 0.58 -0.47 4.97 2.88 0.76 -4.71 113.62 113.88 3dby n SER 250 Ca -0.05 -0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.30 3dby n SER 250 Cb 0.79 0.93 0.00 0.00 -0.75 0.00 0.00 64.21 65.19 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 1.34 0.82 3.80 0.46 0.00 -0.51 -5.04 105.19 106.07 3dby n GLY 251 Ca 0.01 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.95 3.37 0.39 0.99 1.43 -0.46 -5.04 118.68 118.40 3dby s LEU 252 Ca 0.00 -0.73 -0.27 0.00 -1.03 0.00 0.00 54.13 52.10 3dby s LEU 252 Cb 0.00 -1.90 -0.10 0.00 0.03 0.00 0.00 46.19 44.22 3dby s LEU 252 CO 0.00 -0.43 1.41 -0.70 0.23 0.00 0.00 176.35 176.86 3dby s GLU 253 N -3.96 4.04 0.47 1.70 2.12 -1.26 -4.61 118.70 117.19 3dby s GLU 253 Ca 0.41 2.41 -0.24 0.00 0.36 0.00 0.00 54.97 57.92 3dby s GLU 253 Cb -0.03 -2.89 -0.07 0.00 0.26 0.00 0.00 34.13 31.41 3dby s GLU 253 CO 0.25 -0.53 1.29 -1.64 -0.54 0.00 0.00 175.26 174.09 3dby s MET 254 N -2.14 3.64 0.48 4.30 -1.94 -1.26 -4.85 119.30 117.52 3dby s MET 254 Ca 0.54 2.09 -0.20 0.00 -1.71 0.00 0.00 55.69 56.42 3dby s MET 254 Cb -0.43 -2.50 -0.09 0.00 2.01 0.00 0.00 34.83 33.82 3dby s MET 254 CO 0.58 -0.75 1.01 -1.25 -0.01 0.00 0.00 175.02 174.60 3dby s PRO 255 N -2.58 3.89 -1.13 2.03 0.04 -1.26 -4.98 135.00 131.00 3dby s PRO 255 Ca 0.63 1.27 -0.09 0.00 0.04 0.00 0.00 61.00 62.85 3dby s PRO 255 Cb -0.37 -2.12 0.27 0.00 0.04 0.00 0.00 34.50 32.33 3dby s PRO 255 CO 0.45 -0.34 1.16 1.63 0.04 0.00 0.00 177.00 179.94 3dby n LYS 256 N -0.97 3.54 -3.45 4.56 5.02 -1.26 -4.92 118.16 120.67 3dby n LYS 256 Ca 0.09 -4.39 -0.13 0.00 -2.02 0.00 0.00 58.31 51.85 3dby n LYS 256 Cb 0.53 -2.61 -0.03 0.00 -0.02 0.00 0.00 35.03 32.90 3dby n LYS 256 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dby s ASN 258 N -2.44 4.42 0.44 0.00 2.47 -1.26 -4.98 114.94 113.58 3dby s ASN 258 Ca -0.01 -0.73 0.30 0.00 0.42 0.00 0.00 52.86 52.83 3dby s ASN 258 Cb -0.01 -1.71 1.16 0.00 -1.45 0.00 0.00 41.25 39.24 3dby s ASN 258 CO -0.08 -0.11 1.87 -0.65 -3.72 0.00 0.00 177.10 174.40 3dby h PRO 259 N 8.07 0.00 0.00 0.43 0.11 -1.90 -3.24 132.00 135.47 3dby h PRO 259 Ca -0.35 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.54 3dby h PRO 259 Cb 1.12 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 3dby h PRO 259 CO 0.59 0.00 -1.22 -0.07 -0.21 0.00 0.00 178.00 177.09 3dby h LEU 260 N 0.00 0.00 -6.99 2.35 3.38 -1.93 -3.44 115.31 108.68 3dby h LEU 260 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3dby h LEU 260 Cb 0.51 0.00 -0.22 0.00 0.09 0.00 0.00 40.66 41.04 3dby h LEU 260 CO 0.00 0.94 0.10 -0.70 0.09 0.00 0.00 178.44 178.87 3dby s GLU 261 N -2.71 0.61 0.93 1.13 2.12 -1.22 -4.93 118.70 114.63 3dby s GLU 261 Ca -0.01 1.10 -0.16 0.00 0.36 0.00 0.00 54.97 56.26 3dby s GLU 261 Cb 0.09 0.18 0.21 0.00 0.26 0.00 0.00 34.13 34.87 3dby s GLU 261 CO 0.82 -0.14 1.26 0.41 -0.54 0.00 0.00 175.26 177.07 3dby n GLY 262 N 4.26 -1.49 0.20 -1.50 0.00 -1.26 -4.65 105.19 100.75 3dby n GLY 262 Ca -0.19 -1.71 0.11 0.00 0.00 0.00 0.00 46.02 44.24 3dby n GLY 262 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 3dby h HIS 263 N -1.73 0.00 0.00 1.61 2.07 -1.99 -3.38 115.15 111.73 3dby h HIS 263 Ca -0.41 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 56.97 3dby h HIS 263 Cb 1.12 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.08 3dby h HIS 263 CO 0.00 0.04 -1.52 1.58 -3.07 0.00 0.00 177.93 174.96 3dby n HIS 264 N -3.06 0.00 -2.73 6.12 -0.00 -1.26 -4.91 115.22 109.38 3dby n HIS 264 Ca 0.03 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.32 3dby n HIS 264 Cb 0.55 -0.37 -0.01 0.00 -0.00 0.00 0.00 29.99 30.17 3dby n HIS 264 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 3dby s HIS 265 N -2.18 3.00 0.02 1.57 3.76 -1.26 -4.83 115.29 115.36 3dby s HIS 265 Ca -0.07 -1.64 -0.29 0.00 -0.15 0.00 0.00 55.06 52.91 3dby s HIS 265 Cb 0.03 -4.56 0.11 0.00 1.11 0.00 0.00 32.58 29.27 3dby s HIS 265 CO 0.27 -1.67 1.22 -3.38 -0.85 0.00 0.00 174.74 170.34 3dby s HIS 266 N 3.35 -0.06 -0.27 1.40 -0.00 -1.26 -4.46 115.29 113.99 3dby s HIS 266 Ca 0.47 -0.09 0.12 0.00 -0.00 0.00 0.00 55.06 55.56 3dby s HIS 266 Cb 0.00 0.57 0.47 0.00 -0.00 0.00 0.00 32.58 33.62 3dby s HIS 266 CO 0.01 -0.39 1.17 0.72 -0.00 0.00 0.00 174.74 176.25 3dby n HIS 267 N -0.50 2.21 0.18 0.38 8.25 -1.26 -5.19 115.22 119.29 3dby n HIS 267 Ca -0.08 -2.15 0.02 0.00 -0.26 0.00 0.00 57.72 55.26 3dby n HIS 267 Cb 0.62 -0.30 0.02 0.00 1.12 0.00 0.00 29.99 31.45 3dby n HIS 267 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59