#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dby n GLU 3 N 0.00 1.20 -2.90 3.23 2.13 -1.26 -4.91 120.64 118.13 3dby n GLU 3 Ca 0.00 0.42 -0.40 0.00 0.66 0.00 0.00 57.16 57.84 3dby n GLU 3 Cb 0.00 -1.87 -0.05 0.00 0.27 0.00 0.00 31.44 29.79 3dby n GLU 3 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3dby s ARG 4 N -0.72 4.54 0.30 5.31 0.52 -1.26 -5.06 118.95 122.58 3dby s ARG 4 Ca 0.69 1.17 0.11 0.00 -0.52 0.00 0.00 55.73 57.17 3dby s ARG 4 Cb -0.81 -3.39 -0.05 0.00 0.52 0.00 0.00 34.95 31.22 3dby s ARG 4 CO 0.54 0.20 -0.13 0.54 0.02 0.00 0.00 175.30 176.47 3dby s ASN 5 N 0.20 3.80 0.11 0.23 2.20 -1.26 -5.03 114.94 115.19 3dby s ASN 5 Ca 0.42 -1.01 -0.24 0.00 -0.94 0.00 0.00 52.86 51.09 3dby s ASN 5 Cb -0.21 -0.41 -0.09 0.00 -2.00 0.00 0.00 41.25 38.55 3dby s ASN 5 CO 0.24 -0.04 1.69 0.22 -2.94 0.00 0.00 177.10 176.27 3dby h TYR 6 N 2.12 -0.31 -0.49 1.54 3.20 -1.94 -1.50 116.97 119.59 3dby h TYR 6 Ca -0.41 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.47 3dby h TYR 6 Cb 1.26 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.63 3dby h TYR 6 CO 0.77 -0.18 0.32 1.49 -1.64 0.00 0.00 178.16 178.92 3dby h GLU 7 N -0.22 0.65 0.11 1.82 4.57 -1.98 -0.09 114.58 119.44 3dby h GLU 7 Ca 0.03 -0.05 -0.30 0.00 -1.18 0.00 0.00 59.36 57.87 3dby h GLU 7 Cb 0.26 -0.14 0.03 0.00 -0.16 0.00 0.00 28.75 28.73 3dby h GLU 7 CO -0.10 0.45 -1.23 0.93 -1.18 0.00 0.00 179.01 177.88 3dby h GLU 8 N 0.66 0.64 -0.07 1.92 5.08 -1.96 -2.12 114.58 118.74 3dby h GLU 8 Ca 0.18 -0.83 -0.00 0.00 -1.00 0.00 0.00 59.36 57.70 3dby h GLU 8 Cb -0.06 0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3dby h GLU 8 CO -0.04 1.38 0.03 0.77 -1.00 0.00 0.00 179.01 180.15 3dby h SER 9 N 0.29 0.09 -0.29 1.42 0.02 -1.18 -0.89 113.55 113.01 3dby h SER 9 Ca -0.18 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 3dby h SER 9 Cb 1.90 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 64.40 3dby h SER 9 CO 0.24 0.19 0.19 0.00 -1.14 0.00 0.00 176.83 176.31 3dby h ALA 10 N 0.90 0.37 -0.31 3.77 0.00 -1.07 0.16 119.26 123.08 3dby h ALA 10 Ca 0.02 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dby h ALA 10 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3dby h ALA 10 CO -0.00 -0.17 0.18 -0.07 0.00 0.00 0.00 179.25 179.19 3dby h LEU 11 N 0.39 0.29 -0.12 0.00 3.38 -1.36 -1.43 115.31 116.46 3dby h LEU 11 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3dby h LEU 11 Cb -0.04 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3dby h LEU 11 CO -0.03 0.21 0.08 0.15 0.09 0.00 0.00 178.44 178.94 3dby h PHE 12 N 0.37 0.15 -0.24 1.13 3.57 -0.95 -0.12 116.94 120.85 3dby h PHE 12 Ca 0.12 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 3dby h PHE 12 Cb -0.00 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 3dby h PHE 12 CO -0.08 0.09 0.04 0.93 -2.23 0.00 0.00 178.31 177.07 3dby h GLU 13 N 0.16 0.39 -0.14 1.11 4.39 -0.52 -0.28 114.58 119.69 3dby h GLU 13 Ca 0.04 -0.11 0.03 0.00 0.34 0.00 0.00 59.36 59.67 3dby h GLU 13 Cb -0.02 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3dby h GLU 13 CO -0.01 0.53 -0.07 0.45 -1.16 0.00 0.00 179.01 178.75 3dby h HIS 14 N 0.20 -0.16 -0.85 4.33 3.86 -1.32 0.04 115.15 121.25 3dby h HIS 14 Ca 0.07 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 3dby h HIS 14 Cb 0.32 0.10 -0.04 0.00 1.06 0.00 0.00 27.41 28.85 3dby h HIS 14 CO 0.02 -0.11 0.47 1.96 0.86 0.00 0.00 177.93 181.13 3dby h GLN 15 N -0.06 1.17 0.18 2.45 4.20 -0.80 -0.52 115.11 121.73 3dby h GLN 15 Ca 0.08 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 3dby h GLN 15 Cb 0.18 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.72 3dby h GLN 15 CO -0.18 0.85 -0.09 0.35 -0.67 0.00 0.00 178.83 179.09 3dby h PHE 16 N 1.18 -0.22 0.03 2.96 3.57 -0.85 -2.92 116.94 120.69 3dby h PHE 16 Ca 0.30 -0.01 -0.22 0.00 3.53 0.00 0.00 57.97 61.57 3dby h PHE 16 Cb 0.01 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 3dby h PHE 16 CO 0.01 0.06 -1.02 -1.49 -2.23 0.00 0.00 178.31 173.64 3dby h TRP 17 N -0.50 0.17 0.00 0.41 4.06 -0.86 -1.85 115.95 117.39 3dby h TRP 17 Ca -0.02 -0.12 -0.11 0.00 2.06 0.00 0.00 58.89 60.70 3dby h TRP 17 Cb 0.38 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.51 3dby h TRP 17 CO 0.01 1.05 -0.53 -0.07 -3.56 0.00 0.00 178.44 175.34 3dby h LEU 18 N 0.04 0.00 -0.03 -4.49 3.38 -1.18 -0.01 115.31 113.01 3dby h LEU 18 Ca -0.05 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.66 3dby h LEU 18 Cb 1.74 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.51 3dby h LEU 18 CO 0.15 0.53 -1.01 0.50 0.09 0.00 0.00 178.44 178.69 3dby h LYS 19 N 0.00 0.68 -0.62 1.13 3.64 -1.40 -1.67 116.57 118.33 3dby h LYS 19 Ca -0.01 -0.72 0.07 0.00 -1.27 0.00 0.00 60.65 58.72 3dby h LYS 19 Cb 1.12 0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 33.08 3dby h LYS 19 CO 0.07 1.30 0.31 0.28 -2.27 0.00 0.00 179.45 179.14 3dby h VAL 20 N 0.39 0.91 -0.10 2.00 2.07 -1.02 -0.84 116.25 119.66 3dby h VAL 20 Ca -0.12 -0.20 -0.16 0.00 0.82 0.00 0.00 66.70 67.05 3dby h VAL 20 Cb 1.66 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 3dby h VAL 20 CO 0.20 0.10 -0.62 -0.07 0.02 0.00 0.00 177.57 177.20 3dby h LEU 21 N 0.57 0.40 -0.90 2.57 3.38 -0.99 -0.98 115.31 119.35 3dby h LEU 21 Ca 0.29 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 58.03 3dby h LEU 21 Cb 0.24 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 3dby h LEU 21 CO -0.21 0.92 0.59 0.74 0.09 0.00 0.00 178.44 180.56 3dby h THR 22 N 0.26 1.24 -0.51 0.22 2.02 -0.88 -1.73 112.91 113.52 3dby h THR 22 Ca -0.01 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 66.72 3dby h THR 22 Cb 1.15 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 3dby h THR 22 CO 0.10 0.23 0.26 0.44 0.37 0.00 0.00 175.52 176.92 3dby h ASP 23 N 1.23 0.65 -0.71 4.18 3.45 -0.69 -0.40 116.42 124.12 3dby h ASP 23 Ca 0.33 -0.11 -0.00 0.00 0.43 0.00 0.00 57.03 57.67 3dby h ASP 23 Cb -0.13 -0.17 -0.03 0.00 -0.56 0.00 0.00 39.33 38.44 3dby h ASP 23 CO -0.07 0.58 0.44 0.45 -1.57 0.00 0.00 179.24 179.07 3dby h HIS 24 N 0.68 0.93 -0.32 4.55 3.86 -0.94 0.32 115.15 124.23 3dby h HIS 24 Ca 0.18 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.34 3dby h HIS 24 Cb 0.09 -0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 3dby h HIS 24 CO -0.01 0.62 0.03 0.00 0.86 0.00 0.00 177.93 179.43 3dby h ALA 25 N 1.23 0.43 -0.62 2.45 0.00 -1.11 -1.16 119.26 120.49 3dby h ALA 25 Ca 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3dby h ALA 25 Cb -0.05 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3dby h ALA 25 CO -0.05 0.16 0.31 0.37 0.00 0.00 0.00 179.25 180.04 3dby h GLN 26 N 0.37 0.89 -0.09 0.00 5.75 -0.59 -1.03 115.11 120.42 3dby h GLN 26 Ca 0.10 -0.13 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 3dby h GLN 26 Cb 0.40 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 3dby h GLN 26 CO 0.01 0.71 0.01 0.74 -2.65 0.00 0.00 178.83 177.65 3dby h PHE 27 N 0.85 0.01 -0.45 3.99 0.04 -0.30 -1.89 116.94 119.20 3dby h PHE 27 Ca 0.21 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.98 3dby h PHE 27 Cb 0.11 0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 3dby h PHE 27 CO -0.00 0.00 0.23 -0.07 -0.60 0.00 0.00 178.31 177.87 3dby h LEU 28 N 0.04 0.58 -0.53 1.54 3.38 -1.10 -1.03 115.31 118.20 3dby h LEU 28 Ca 0.04 -0.12 0.10 0.00 0.09 0.00 0.00 57.88 58.00 3dby h LEU 28 Cb 0.04 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 40.55 3dby h LEU 28 CO -0.06 0.53 0.02 0.25 0.09 0.00 0.00 178.44 179.27 3dby h LEU 29 N 0.59 -0.18 -0.01 1.67 5.85 -1.07 -2.17 115.31 119.99 3dby h LEU 29 Ca 0.16 0.12 -0.12 0.00 0.84 0.00 0.00 57.88 58.88 3dby h LEU 29 Cb 0.10 0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 3dby h LEU 29 CO -0.02 -0.06 -0.56 0.44 -0.34 0.00 0.00 178.44 177.90 3dby h ASP 30 N 0.14 0.00 1.32 1.25 3.45 -1.01 -3.17 116.42 118.39 3dby h ASP 30 Ca 0.27 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.73 3dby h ASP 30 Cb 0.41 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.18 3dby h ASP 30 CO -0.43 0.56 0.00 0.00 -1.57 0.00 0.00 179.24 177.80 3dby n ALA 31 N -2.24 2.19 -1.96 3.45 0.00 -0.42 -4.87 120.51 116.66 3dby n ALA 31 Ca 0.02 -0.01 -0.41 0.00 0.00 0.00 0.00 53.44 53.04 3dby n ALA 31 Cb 0.76 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.71 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 -4.39 4.50 0.50 0.00 1.43 -0.84 -0.07 118.68 119.81 3dby s LEU 32 Ca 0.10 2.20 -0.23 0.00 -1.03 0.00 0.00 54.13 55.17 3dby s LEU 32 Cb 0.12 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.67 3dby s LEU 32 CO 0.56 -0.25 1.31 0.00 0.23 0.00 0.00 176.35 178.20 3dby s ALA 33 N -0.49 2.94 0.56 4.21 0.00 -1.00 -4.88 121.76 123.10 3dby s ALA 33 Ca 0.49 1.23 0.31 0.00 0.00 0.00 0.00 51.96 53.99 3dby s ALA 33 Cb -0.31 -3.51 1.46 0.00 0.00 0.00 0.00 23.12 20.75 3dby s ALA 33 CO 0.38 -1.11 1.85 -1.35 0.00 0.00 0.00 175.76 175.53 3dby h PRO 34 N 1.81 0.00 0.00 0.00 0.11 -1.95 0.27 132.00 132.24 3dby h PRO 34 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3dby h PRO 34 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3dby h PRO 34 CO 0.59 0.00 0.00 1.57 -0.21 0.00 0.00 178.00 179.95 3dby h LYS 35 N 0.00 0.00 -2.78 1.05 2.10 -1.96 -3.36 116.57 111.61 3dby h LYS 35 Ca 0.36 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 58.37 3dby h LYS 35 Cb 1.63 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.93 3dby h LYS 35 CO -0.00 0.00 3.03 0.39 -2.00 0.00 0.00 179.45 180.86 3dby n GLU 36 N -2.38 3.79 -0.36 0.07 -0.58 0.08 -4.71 120.64 116.55 3dby n GLU 36 Ca 0.02 -2.47 0.07 0.00 -0.42 0.00 0.00 57.16 54.36 3dby n GLU 36 Cb 0.27 -2.67 0.24 0.00 -0.57 0.00 0.00 31.44 28.71 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 4.67 0.97 0.04 3.49 1.79 -1.84 0.63 116.57 126.34 3dby h LYS 37 Ca 0.76 -0.06 -0.00 0.00 -2.18 0.00 0.00 60.65 59.17 3dby h LYS 37 Cb 0.39 -0.22 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 3dby h LYS 37 CO 1.55 0.64 -0.02 1.49 -1.08 0.00 0.00 179.45 182.04 3dby h GLU 38 N 1.00 -0.06 -0.02 3.15 4.81 -1.96 -1.02 114.58 120.48 3dby h GLU 38 Ca 0.49 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.56 3dby h GLU 38 Cb 0.48 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 3dby h GLU 38 CO -0.26 0.02 -0.76 -0.44 -0.73 0.00 0.00 179.01 176.85 3dby h ASP 39 N -0.12 0.20 -0.37 1.04 3.32 -1.88 -2.26 116.42 116.34 3dby h ASP 39 Ca -0.01 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 56.94 3dby h ASP 39 Cb 0.11 -0.06 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 3dby h ASP 39 CO 0.01 0.88 0.16 0.40 -1.72 0.00 0.00 179.24 178.97 3dby h ILE 40 N 0.10 0.93 -0.74 0.35 2.04 -0.80 0.29 117.51 119.68 3dby h ILE 40 Ca -0.02 -0.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 3dby h ILE 40 Cb 1.33 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.95 3dby h ILE 40 CO 0.11 0.06 0.36 0.50 0.00 0.00 0.00 178.15 179.19 3dby h LYS 41 N 0.33 1.06 -0.51 2.37 3.64 -0.97 -0.05 116.57 122.44 3dby h LYS 41 Ca 0.17 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3dby h LYS 41 Cb 0.11 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.72 3dby h LYS 41 CO -0.15 0.82 0.29 0.87 -2.27 0.00 0.00 179.45 179.02 3dby h LYS 42 N 1.03 0.71 -0.51 1.90 1.57 -1.17 -1.11 116.57 119.00 3dby h LYS 42 Ca 0.26 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.86 3dby h LYS 42 Cb 0.10 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 3dby h LYS 42 CO -0.03 0.53 -0.10 0.00 -0.57 0.00 0.00 179.45 179.28 3dby h ALA 43 N 1.13 0.87 -0.39 3.86 0.00 -0.82 -0.21 119.26 123.71 3dby h ALA 43 Ca 0.18 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 3dby h ALA 43 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3dby h ALA 43 CO -0.03 0.64 0.22 1.15 0.00 0.00 0.00 179.25 181.24 3dby h THR 44 N 0.84 1.14 -0.55 0.00 2.02 -0.87 -1.63 112.91 113.85 3dby h THR 44 Ca 0.14 -0.33 0.11 0.00 0.77 0.00 0.00 66.41 67.10 3dby h THR 44 Cb 0.63 0.65 -0.09 0.00 -1.74 0.00 0.00 68.15 67.60 3dby h THR 44 CO 0.04 0.14 0.02 0.22 0.37 0.00 0.00 175.52 176.31 3dby h TYR 45 N 0.50 -0.00 -0.31 3.16 3.20 -0.78 -1.92 116.97 120.81 3dby h TYR 45 Ca 0.14 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.93 3dby h TYR 45 Cb 0.02 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 3dby h TYR 45 CO -0.03 -0.12 -0.30 0.74 -1.64 0.00 0.00 178.16 176.81 3dby h PHE 46 N 0.14 0.76 -0.23 -3.82 0.04 -0.73 0.18 116.94 113.28 3dby h PHE 46 Ca 0.28 -0.19 0.00 0.00 2.80 0.00 0.00 57.97 60.86 3dby h PHE 46 Cb 0.43 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 38.40 3dby h PHE 46 CO -0.32 0.88 0.15 0.28 -0.60 0.00 0.00 178.31 178.70 3dby h VAL 47 N 0.56 1.07 -0.71 -0.55 2.07 -1.19 0.10 116.25 117.60 3dby h VAL 47 Ca 0.07 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 3dby h VAL 47 Cb 0.80 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3dby h VAL 47 CO 0.07 0.07 0.27 -0.33 0.02 0.00 0.00 177.57 177.67 3dby h GLU 48 N 0.30 1.08 -0.57 1.57 5.08 -1.07 -1.31 114.58 119.67 3dby h GLU 48 Ca 0.08 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 3dby h GLU 48 Cb -0.01 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 3dby h GLU 48 CO -0.02 0.90 -0.03 1.15 -1.00 0.00 0.00 179.01 180.01 3dby h THR 49 N 1.03 1.27 0.13 1.13 2.02 -0.22 -1.68 112.91 116.58 3dby h THR 49 Ca 0.24 -1.17 -0.29 0.00 0.77 0.00 0.00 66.41 65.95 3dby h THR 49 Cb 0.24 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 3dby h THR 49 CO -0.02 0.42 -1.40 -0.26 0.37 0.00 0.00 175.52 174.64 3dby h PHE 50 N 0.90 0.49 -0.57 3.16 0.04 -0.75 -1.39 116.94 118.83 3dby h PHE 50 Ca 0.16 -0.36 -0.01 0.00 2.80 0.00 0.00 57.97 60.56 3dby h PHE 50 Cb 0.58 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.69 3dby h PHE 50 CO 0.04 1.34 0.32 1.15 -0.60 0.00 0.00 178.31 180.56 3dby h THR 51 N 0.07 1.17 0.08 -1.55 2.02 -1.19 0.16 112.91 113.68 3dby h THR 51 Ca -0.19 -0.40 -0.27 0.00 0.77 0.00 0.00 66.41 66.31 3dby h THR 51 Cb 2.00 0.39 0.03 0.00 -1.74 0.00 0.00 68.15 68.83 3dby h THR 51 CO 0.19 0.18 -1.11 0.78 0.37 0.00 0.00 175.52 175.93 3dby h ASN 52 N 0.79 0.83 -0.23 4.18 2.35 -1.16 -2.36 115.58 119.97 3dby h ASN 52 Ca 0.20 -0.81 0.04 0.00 -0.55 0.00 0.00 56.30 55.19 3dby h ASN 52 Cb 0.00 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.07 3dby h ASN 52 CO -0.04 1.55 -0.03 -0.07 -1.65 0.00 0.00 177.43 177.19 3dby h LEU 53 N 0.22 -0.16 -0.51 1.61 3.38 -0.92 -2.88 115.31 116.06 3dby h LEU 53 Ca -0.16 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 3dby h LEU 53 Cb 1.79 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.63 3dby h LEU 53 CO 0.21 -0.05 0.30 0.25 0.09 0.00 0.00 178.44 179.24 3dby h LEU 54 N 0.03 0.61 -2.36 1.67 5.85 -0.96 -1.93 115.31 118.22 3dby h LEU 54 Ca 0.11 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3dby h LEU 54 Cb 0.16 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 3dby h LEU 54 CO -0.21 0.50 -0.03 0.78 -0.34 0.00 0.00 178.44 179.13 3dby h ASN 55 N 0.68 0.00 -0.21 1.25 -0.26 -1.36 -2.86 115.58 112.81 3dby h ASN 55 Ca 0.18 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.92 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 -0.03 0.03 0.00 2.29 -1.06 0.00 0.00 177.43 178.66 3dby n LYS 56 N -3.66 2.77 -0.17 0.81 2.85 -0.76 -4.67 118.16 115.33 3dby n LYS 56 Ca -0.03 -2.12 0.00 0.00 -1.05 0.00 0.00 58.31 55.11 3dby n LYS 56 Cb 0.13 -1.34 0.25 0.00 -0.65 0.00 0.00 35.03 33.42 3dby n LYS 56 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 177.40 177.11 3dby h VAL 57 N 1.30 1.19 -0.15 0.58 3.04 -1.22 -1.88 116.25 119.12 3dby h VAL 57 Ca 0.00 -0.46 -0.03 0.00 -1.01 0.00 0.00 66.70 65.20 3dby h VAL 57 Cb 0.84 0.29 -0.02 0.00 -2.01 0.00 0.00 31.29 30.39 3dby h VAL 57 CO 0.04 0.21 0.04 0.54 -1.01 0.00 0.00 177.57 177.39 3dby n ARG 58 N -4.39 1.66 0.00 4.17 1.74 -1.26 -4.08 116.66 114.51 3dby n ARG 58 Ca 0.06 -0.65 0.00 0.00 -0.77 0.00 0.00 57.85 56.49 3dby n ARG 58 Cb 0.09 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 29.98 3dby n ARG 58 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3dby n ASN 59 N 0.14 0.87 -3.88 0.55 3.02 -0.71 -5.08 115.26 110.17 3dby n ASN 59 Ca 0.08 -1.12 -0.10 0.00 -0.03 0.00 0.00 54.58 53.41 3dby n ASN 59 Cb 0.53 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.61 3dby n ASN 59 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3dby s VAL 60 N -0.12 0.10 -0.29 2.41 -7.23 -1.25 -5.11 120.40 108.91 3dby s VAL 60 Ca 0.00 -0.86 -0.41 0.00 -1.81 0.00 0.00 61.98 58.90 3dby s VAL 60 Cb 0.00 -0.68 -0.16 0.00 0.56 0.00 0.00 36.38 36.10 3dby s VAL 60 CO 0.00 -0.47 1.71 -3.20 -0.31 0.00 0.00 175.10 172.83 3dby n ASN 61 N 1.07 2.21 0.07 4.85 2.85 -1.26 -4.85 115.26 120.20 3dby n ASN 61 Ca -0.21 1.09 -0.01 0.00 -0.11 0.00 0.00 54.58 55.34 3dby n ASN 61 Cb 0.57 -1.11 0.27 0.00 1.24 0.00 0.00 39.78 40.76 3dby n ASN 61 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3dby h LEU 62 N 6.84 0.33 -0.25 1.20 3.38 -1.97 0.34 115.31 125.17 3dby h LEU 62 Ca -0.46 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.37 3dby h LEU 62 Cb 1.33 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 3dby h LEU 62 CO 0.96 0.58 0.02 0.24 0.09 0.00 0.00 178.44 180.33 3dby h MET 63 N 0.30 0.43 0.00 1.13 2.86 -1.89 0.84 114.93 118.60 3dby h MET 63 Ca 0.05 -0.13 -0.15 0.00 -2.06 0.00 0.00 59.70 57.41 3dby h MET 63 Cb 0.60 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.19 3dby h MET 63 CO 0.04 0.58 -0.71 0.00 1.06 0.00 0.00 176.91 177.88 3dby h ALA 64 N 0.83 0.75 -0.46 6.32 0.00 -1.84 -2.92 119.26 121.94 3dby h ALA 64 Ca 0.07 -0.65 -0.08 0.00 0.00 0.00 0.00 54.91 54.25 3dby h ALA 64 Cb 0.38 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3dby h ALA 64 CO 0.01 0.89 -0.04 0.35 0.00 0.00 0.00 179.25 180.46 3dby h PHE 65 N 0.00 0.85 -0.91 0.00 3.57 -0.68 -2.94 116.94 116.83 3dby h PHE 65 Ca -0.01 -0.13 0.05 0.00 3.53 0.00 0.00 57.97 61.41 3dby h PHE 65 Cb 1.32 -0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.77 3dby h PHE 65 CO 0.00 0.81 0.59 0.77 -2.23 0.00 0.00 178.31 178.25 3dby h SER 66 N 0.73 0.94 -0.37 0.41 0.02 -0.65 -0.49 113.55 114.15 3dby h SER 66 Ca 0.14 -0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.00 3dby h SER 66 Cb 0.50 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 3dby h SER 66 CO 0.03 0.62 -0.09 0.11 -1.14 0.00 0.00 176.83 176.36 3dby h LYS 67 N 1.08 0.80 -0.28 3.45 1.57 -1.45 -1.42 116.57 120.30 3dby h LYS 67 Ca 0.38 -0.26 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 3dby h LYS 67 Cb 0.12 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3dby h LYS 67 CO -0.13 0.86 -0.04 1.49 -0.57 0.00 0.00 179.45 181.06 3dby h GLU 68 N 0.72 0.53 -0.85 3.15 4.81 -1.19 -2.61 114.58 119.14 3dby h GLU 68 Ca 0.13 -0.19 0.04 0.00 -0.13 0.00 0.00 59.36 59.21 3dby h GLU 68 Cb 0.57 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.86 3dby h GLU 68 CO 0.03 0.71 0.54 0.00 -0.73 0.00 0.00 179.01 179.57 3dby h ALA 69 N 0.80 1.13 -1.00 2.92 0.00 -1.12 -2.45 119.26 119.54 3dby h ALA 69 Ca 0.08 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3dby h ALA 69 Cb 0.50 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 3dby h ALA 69 CO 0.02 0.35 0.66 1.49 0.00 0.00 0.00 179.25 181.77 3dby h GLU 70 N 1.04 1.21 -0.21 0.00 4.81 -1.17 0.08 114.58 120.34 3dby h GLU 70 Ca 0.35 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.46 3dby h GLU 70 Cb 0.05 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 3dby h GLU 70 CO -0.13 0.80 -0.04 0.37 -0.73 0.00 0.00 179.01 179.28 3dby h GLN 71 N 1.25 0.39 -0.73 1.92 5.75 -1.06 -0.87 115.11 121.77 3dby h GLN 71 Ca 0.41 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.74 3dby h GLN 71 Cb 0.04 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 3dby h GLN 71 CO -0.13 0.63 0.37 0.00 -2.65 0.00 0.00 178.83 177.04 3dby h ALA 72 N 0.75 0.94 -0.56 3.38 0.00 -1.26 -1.78 119.26 120.73 3dby h ALA 72 Ca 0.05 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.86 3dby h ALA 72 Cb 0.48 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3dby h ALA 72 CO 0.02 0.48 0.33 0.00 0.00 0.00 0.00 179.25 180.08 3dby h ALA 73 N 1.19 0.73 -0.17 0.00 0.00 -0.82 -1.87 119.26 118.31 3dby h ALA 73 Ca 0.25 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3dby h ALA 73 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3dby h ALA 73 CO -0.04 0.04 -0.08 0.87 0.00 0.00 0.00 179.25 180.05 3dby h LYS 74 N 0.65 0.26 -0.06 0.00 1.57 -0.81 0.15 116.57 118.33 3dby h LYS 74 Ca 0.23 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.92 3dby h LYS 74 Cb 0.05 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3dby h LYS 74 CO -0.11 0.36 -0.10 0.93 -0.57 0.00 0.00 179.45 179.95 3dby h GLU 75 N 0.25 0.17 -0.00 3.15 5.08 -0.77 -2.33 114.58 120.13 3dby h GLU 75 Ca 0.05 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.23 3dby h GLU 75 Cb 0.31 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3dby h GLU 75 CO 0.02 0.68 -0.39 0.97 -1.00 0.00 0.00 179.01 179.29 3dby h ILE 76 N -0.33 1.28 -0.28 3.13 2.10 -1.28 -0.62 117.51 121.52 3dby h ILE 76 Ca 0.00 -1.33 0.05 0.00 1.08 0.00 0.00 64.86 64.67 3dby h ILE 76 Cb 0.67 1.71 -0.05 0.00 -1.09 0.00 0.00 36.82 38.07 3dby h ILE 76 CO 0.02 0.38 -0.02 -0.09 -1.08 0.00 0.00 178.15 177.36 3dby h ARG 77 N 0.01 0.06 -0.50 2.19 2.43 -0.83 0.00 114.38 117.74 3dby h ARG 77 Ca -0.00 -0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.05 3dby h ARG 77 Cb 0.68 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.21 3dby h ARG 77 CO 0.05 0.04 -0.14 0.00 -1.51 0.00 0.00 179.97 178.41 3dby h ALA 78 N 1.25 0.81 -0.88 2.80 0.00 -0.83 -1.67 119.26 120.73 3dby h ALA 78 Ca 0.13 -0.36 0.10 0.00 0.00 0.00 0.00 54.91 54.79 3dby h ALA 78 Cb 0.18 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 17.72 3dby h ALA 78 CO -0.24 0.66 0.52 0.35 0.00 0.00 0.00 179.25 180.54 3dby h PHE 79 N 0.85 0.95 -0.24 0.00 3.57 -0.83 -1.17 116.94 120.06 3dby h PHE 79 Ca 0.13 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 3dby h PHE 79 Cb 0.69 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.14 3dby h PHE 79 CO 0.04 0.38 -0.41 0.87 -2.23 0.00 0.00 178.31 176.97 3dby h LYS 80 N 0.86 0.71 -0.19 1.11 1.57 -0.30 -2.33 116.57 118.00 3dby h LYS 80 Ca 0.43 -0.44 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 3dby h LYS 80 Cb 0.39 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3dby h LYS 80 CO -0.25 1.06 -0.28 -0.07 -0.57 0.00 0.00 179.45 179.34 3dby h LEU 81 N 0.43 0.36 -0.60 2.94 3.38 -1.09 -1.80 115.31 118.92 3dby h LEU 81 Ca 0.02 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 3dby h LEU 81 Cb 1.01 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3dby h LEU 81 CO 0.09 0.63 0.14 -1.13 0.09 0.00 0.00 178.44 178.27 3dby h ASN 82 N 0.32 0.92 -0.21 -0.43 -1.24 -1.08 0.11 115.58 113.97 3dby h ASN 82 Ca 0.05 -0.24 -0.00 0.00 0.71 0.00 0.00 56.30 56.82 3dby h ASN 82 Cb 0.66 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 39.45 3dby h ASN 82 CO 0.05 0.92 0.12 0.40 -1.29 0.00 0.00 177.43 177.63 3dby h ILE 83 N 0.88 1.09 -0.37 2.57 2.04 -1.18 -0.01 117.51 122.53 3dby h ILE 83 Ca 0.19 -0.24 0.02 0.00 1.00 0.00 0.00 64.86 65.83 3dby h ILE 83 Cb 0.36 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 3dby h ILE 83 CO 0.00 0.09 0.20 0.40 0.00 0.00 0.00 178.15 178.84 3dby h ILE 84 N 0.24 1.01 -0.23 -0.67 2.04 -1.14 -0.11 117.51 118.64 3dby h ILE 84 Ca 0.07 -0.14 0.06 0.00 1.00 0.00 0.00 64.86 65.85 3dby h ILE 84 Cb 0.04 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 36.62 3dby h ILE 84 CO -0.01 0.07 -0.19 -0.61 0.00 0.00 0.00 178.15 177.41 3dby h GLN 85 N 0.41 -0.18 -0.97 2.37 4.15 -0.63 -0.14 115.11 120.12 3dby h GLN 85 Ca 0.15 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.69 3dby h GLN 85 Cb 0.04 0.04 -0.08 0.00 0.21 0.00 0.00 27.48 27.69 3dby h GLN 85 CO -0.09 -0.12 0.62 0.87 -1.93 0.00 0.00 178.83 178.18 3dby h LYS 86 N -0.19 0.94 -0.42 1.69 1.57 -0.73 -2.46 116.57 116.97 3dby h LYS 86 Ca 0.13 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 3dby h LYS 86 Cb 0.39 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 3dby h LYS 86 CO -0.35 0.62 0.21 1.96 -0.57 0.00 0.00 179.45 181.32 3dby h GLN 87 N 0.97 0.60 0.00 3.15 4.20 -0.02 0.48 115.11 124.49 3dby h GLN 87 Ca 0.46 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 59.09 3dby h GLN 87 Cb 0.45 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3dby h GLN 87 CO -0.23 0.51 0.00 -0.07 -0.67 0.00 0.00 178.83 178.38 3dby h LEU 88 N 0.54 0.00 -1.87 1.46 3.38 -0.74 -1.82 115.31 116.25 3dby h LEU 88 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dby h LEU 88 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3dby h LEU 88 CO -0.02 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.89 3dby n GLU 89 N -2.48 1.14 -2.33 1.13 1.02 -0.80 -4.99 120.64 113.32 3dby n GLU 89 Ca -0.00 -1.34 -0.10 0.00 -0.02 0.00 0.00 57.16 55.70 3dby n GLU 89 Cb 0.15 -1.19 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 0.44 0.01 0.77 0.62 0.00 0.15 -4.95 105.19 102.23 3dby n GLY 90 Ca 0.07 -0.43 0.05 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.07 2.14 -3.59 1.61 5.02 0.14 -5.00 118.16 116.41 3dby n LYS 91 Ca -0.10 -2.92 -0.16 0.00 -2.02 0.00 0.00 58.31 53.11 3dby n LYS 91 Cb 0.58 -1.75 -0.07 0.00 -0.02 0.00 0.00 35.03 33.78 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 -3.00 0.00 -0.30 -0.18 2.07 -1.26 -4.90 121.20 113.64 3dby s ILE 92 Ca 0.40 -0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.55 3dby s ILE 92 Cb 0.35 -0.96 0.01 0.00 0.13 0.00 0.00 42.46 41.99 3dby s ILE 92 CO 0.04 -0.01 0.09 -0.89 -1.91 0.00 0.00 174.94 172.25 3dby s THR 93 N -0.44 4.01 -0.03 4.00 2.01 -1.26 -4.83 115.64 119.09 3dby s THR 93 Ca -0.06 -0.69 -0.10 0.00 0.31 0.00 0.00 61.69 61.15 3dby s THR 93 Cb -0.03 -3.07 0.02 0.00 0.01 0.00 0.00 72.50 69.43 3dby s THR 93 CO 0.05 0.07 0.23 -0.51 -0.69 0.00 0.00 174.62 173.77 3dby s ILE 94 N 1.50 0.05 -0.65 1.82 2.07 -1.26 -2.37 121.20 122.36 3dby s ILE 94 Ca 0.03 -0.40 -0.01 0.00 -1.41 0.00 0.00 60.65 58.86 3dby s ILE 94 Cb -0.17 -0.46 0.46 0.00 0.13 0.00 0.00 42.46 42.42 3dby s ILE 94 CO 0.03 -0.22 2.01 1.41 -1.91 0.00 0.00 174.94 176.26 3dby n HIS 95 N 1.89 3.22 -4.98 3.50 8.25 0.90 -4.80 115.22 123.20 3dby n HIS 95 Ca -0.19 -2.95 -0.27 0.00 -0.26 0.00 0.00 57.72 54.05 3dby n HIS 95 Cb 0.57 -1.40 -0.15 0.00 1.12 0.00 0.00 29.99 30.12 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 -3.79 1.83 0.72 4.41 2.99 -1.26 -4.98 117.98 117.90 3dby s PHE 96 Ca 0.64 -0.35 -0.11 0.00 0.00 0.00 0.00 56.93 57.11 3dby s PHE 96 Cb 0.51 -1.17 0.02 0.00 0.00 0.00 0.00 43.02 42.38 3dby s PHE 96 CO -0.00 -0.02 1.08 0.95 -0.00 0.00 0.00 175.22 177.22 3dby s THR 97 N -0.50 3.64 0.49 0.64 -4.23 -1.26 -4.92 115.64 109.50 3dby s THR 97 Ca 0.08 0.53 0.14 0.00 -1.18 0.00 0.00 61.69 61.26 3dby s THR 97 Cb -0.08 -3.38 0.27 0.00 1.34 0.00 0.00 72.50 70.66 3dby s THR 97 CO -0.01 -0.70 2.12 -0.65 -0.54 0.00 0.00 174.62 174.85 3dby h PRO 98 N -0.78 0.14 -0.31 3.99 0.11 -1.98 -2.56 132.00 130.62 3dby h PRO 98 Ca -0.45 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 3dby h PRO 98 Cb 1.24 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3dby h PRO 98 CO 0.60 0.09 -0.33 1.15 -0.21 0.00 0.00 178.00 179.31 3dby h THR 99 N 0.14 1.28 -0.41 -1.15 2.02 -1.98 0.23 112.91 113.06 3dby h THR 99 Ca 0.05 -1.46 -0.04 0.00 0.77 0.00 0.00 66.41 65.72 3dby h THR 99 Cb 0.02 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 3dby h THR 99 CO -0.01 0.47 0.08 0.15 0.37 0.00 0.00 175.52 176.59 3dby h PHE 100 N 0.57 0.70 -0.20 3.16 3.57 -1.84 0.32 116.94 123.22 3dby h PHE 100 Ca 0.06 -0.09 -0.13 0.00 3.53 0.00 0.00 57.97 61.34 3dby h PHE 100 Cb 0.83 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 3dby h PHE 100 CO 0.04 0.68 -0.43 0.82 -2.23 0.00 0.00 178.31 177.18 3dby h ILE 101 N 0.52 1.31 -0.79 1.41 2.04 -1.37 -1.67 117.51 118.96 3dby h ILE 101 Ca 0.12 -1.61 0.04 0.00 1.00 0.00 0.00 64.86 64.41 3dby h ILE 101 Cb 0.34 1.63 -0.05 0.00 -0.74 0.00 0.00 36.82 38.01 3dby h ILE 101 CO 0.00 0.50 0.52 -1.13 0.00 0.00 0.00 178.15 178.04 3dby h ASN 102 N 0.39 0.82 -0.65 1.72 -1.24 -0.09 -1.50 115.58 115.03 3dby h ASN 102 Ca 0.03 -0.01 -0.05 0.00 0.71 0.00 0.00 56.30 56.98 3dby h ASN 102 Cb 0.92 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 39.76 3dby h ASN 102 CO 0.08 0.56 0.22 0.45 -1.29 0.00 0.00 177.43 177.45 3dby h HIS 103 N 0.95 1.03 -0.62 0.67 3.86 0.14 -1.65 115.15 119.54 3dby h HIS 103 Ca 0.32 -0.10 0.06 0.00 -1.16 0.00 0.00 60.37 59.50 3dby h HIS 103 Cb 0.08 -0.30 -0.04 0.00 1.06 0.00 0.00 27.41 28.21 3dby h HIS 103 CO -0.00 0.83 0.41 0.52 0.86 0.00 0.00 177.93 180.55 3dby h MET 104 N 0.93 0.58 -0.20 2.45 2.86 -0.63 -2.05 114.93 118.87 3dby h MET 104 Ca 0.21 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.74 3dby h MET 104 Cb 0.27 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.80 3dby h MET 104 CO -0.01 0.38 -0.16 0.28 1.06 0.00 0.00 176.91 178.46 3dby h VAL 105 N 0.59 1.32 -0.81 -2.22 2.07 -0.79 -1.97 116.25 114.45 3dby h VAL 105 Ca 0.27 -1.29 0.19 0.00 0.82 0.00 0.00 66.70 66.69 3dby h VAL 105 Cb 0.29 1.72 -0.12 0.00 -1.52 0.00 0.00 31.29 31.66 3dby h VAL 105 CO -0.08 0.39 0.22 0.78 0.02 0.00 0.00 177.57 178.90 3dby h ASN 106 N 0.15 0.04 0.61 0.57 2.35 -0.97 -1.18 115.58 117.14 3dby h ASN 106 Ca 0.04 0.17 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 3dby h ASN 106 Cb 0.69 0.22 0.01 0.00 0.05 0.00 0.00 38.32 39.28 3dby h ASN 106 CO 0.04 -0.07 -0.29 -0.33 -1.65 0.00 0.00 177.43 175.13 3dby h GLU 107 N 0.27 -0.79 -0.87 0.81 5.08 -1.17 -2.43 114.58 115.48 3dby h GLU 107 Ca 0.48 0.05 0.16 0.00 -1.00 0.00 0.00 59.36 59.05 3dby h GLU 107 Cb 0.88 0.18 -0.07 0.00 0.50 0.00 0.00 28.75 30.24 3dby h GLU 107 CO -0.57 -0.48 0.57 -0.24 -1.00 0.00 0.00 179.01 177.29 3dby h VAL 108 N -1.08 0.79 -0.33 3.13 3.04 -1.24 -0.58 116.25 119.98 3dby h VAL 108 Ca -0.08 -0.21 -0.04 0.00 -1.01 0.00 0.00 66.70 65.36 3dby h VAL 108 Cb 0.68 0.14 -0.02 0.00 -2.01 0.00 0.00 31.29 30.08 3dby h VAL 108 CO 0.14 0.11 0.05 -0.33 -1.01 0.00 0.00 177.57 176.53 3dby h GLU 109 N 0.60 0.49 -0.77 4.17 5.08 -1.10 0.21 114.58 123.26 3dby h GLU 109 Ca 0.44 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.69 3dby h GLU 109 Cb 0.83 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.96 3dby h GLU 109 CO -0.19 0.48 0.38 0.93 -1.00 0.00 0.00 179.01 179.61 3dby h GLU 110 N 0.48 1.10 -0.40 2.33 4.39 -0.62 -1.81 114.58 120.06 3dby h GLU 110 Ca 0.11 -0.15 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 3dby h GLU 110 Cb 0.24 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 3dby h GLU 110 CO 0.00 0.84 -0.14 -0.92 -1.16 0.00 0.00 179.01 177.63 3dby h TYR 111 N 1.10 0.92 -0.71 4.33 3.20 -0.53 -2.25 116.97 123.03 3dby h TYR 111 Ca 0.27 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 61.93 3dby h TYR 111 Cb 0.10 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.12 3dby h TYR 111 CO 0.01 0.95 0.47 0.82 -1.64 0.00 0.00 178.16 178.77 3dby h ILE 112 N 0.62 1.18 -0.02 1.81 2.04 -0.93 0.44 117.51 122.66 3dby h ILE 112 Ca 0.10 -0.33 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 3dby h ILE 112 Cb 0.68 0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 36.88 3dby h ILE 112 CO 0.05 0.18 -0.53 0.00 0.00 0.00 0.00 178.15 177.84 3dby h ALA 113 N 1.56 1.08 -0.11 1.87 0.00 -1.14 -2.46 119.26 120.07 3dby h ALA 113 Ca 0.26 -0.49 -0.22 0.00 0.00 0.00 0.00 54.91 54.46 3dby h ALA 113 Cb -0.11 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.60 3dby h ALA 113 CO -0.06 0.67 -0.81 0.28 0.00 0.00 0.00 179.25 179.34 3dby h VAL 114 N 0.04 1.31 0.00 0.00 2.07 -0.73 -3.23 116.25 115.71 3dby h VAL 114 Ca -0.00 -2.08 -0.03 0.00 0.82 0.00 0.00 66.70 65.41 3dby h VAL 114 Cb 0.96 2.09 -0.00 0.00 -1.52 0.00 0.00 31.29 32.81 3dby h VAL 114 CO 0.07 0.65 -0.15 -0.07 0.02 0.00 0.00 177.57 178.09 3dby h LEU 115 N 0.43 0.00 -0.58 2.57 3.38 -0.58 -1.70 115.31 118.84 3dby h LEU 115 Ca -0.06 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.96 3dby h LEU 115 Cb 1.42 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.13 3dby h LEU 115 CO 0.16 0.15 0.31 -0.33 0.09 0.00 0.00 178.44 178.82 3dby h GLU 116 N 0.00 0.58 -0.08 1.13 5.08 -1.46 0.79 114.58 120.62 3dby h GLU 116 Ca -0.00 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3dby h GLU 116 Cb 0.32 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 3dby h GLU 116 CO 0.02 0.39 -0.10 0.74 -1.00 0.00 0.00 179.01 179.05 3dby h PHE 117 N 0.60 0.26 -0.76 4.33 0.04 -1.50 -3.34 116.94 116.56 3dby h PHE 117 Ca 0.25 -0.08 0.03 0.00 2.80 0.00 0.00 57.97 60.97 3dby h PHE 117 Cb 0.13 -0.05 -0.04 0.00 2.20 0.00 0.00 35.95 38.19 3dby h PHE 117 CO -0.09 0.67 0.50 -0.07 -0.60 0.00 0.00 178.31 178.73 3dby h LEU 118 N -0.23 0.81 -1.90 1.54 3.38 -0.79 -1.85 115.31 116.27 3dby h LEU 118 Ca 0.01 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dby h LEU 118 Cb 0.64 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 3dby h LEU 118 CO 0.02 0.56 0.01 0.11 0.09 0.00 0.00 178.44 179.24 3dby h LYS 119 N 0.94 0.07 -0.63 1.13 1.57 -0.98 -1.93 116.57 116.74 3dby h LYS 119 Ca 0.30 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 3dby h LYS 119 Cb 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3dby h LYS 119 CO -0.08 0.07 0.00 0.36 -0.57 0.00 0.00 179.45 179.22 3dby n LYS 120 N -4.50 4.35 -1.39 3.15 2.85 -0.76 -4.84 118.16 117.01 3dby n LYS 120 Ca -0.02 -3.05 -0.12 0.00 -1.05 0.00 0.00 58.31 54.08 3dby n LYS 120 Cb 0.11 -2.09 -0.05 0.00 -0.65 0.00 0.00 35.03 32.35 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 0.92 1.18 3.89 2.58 0.00 -0.72 -5.01 105.19 108.02 3dby n GLY 121 Ca 0.27 -0.49 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.08 3.68 -0.14 1.61 2.02 -0.79 -4.98 118.70 117.03 3dby s GLU 122 Ca 0.00 0.03 -0.29 0.00 0.02 0.00 0.00 54.97 54.73 3dby s GLU 122 Cb 0.00 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.33 3dby s GLU 122 CO 0.00 0.48 1.27 0.08 0.02 0.00 0.00 175.26 177.12 3dby s VAL 123 N -1.59 4.23 0.34 2.63 1.01 -1.26 -3.83 120.40 121.93 3dby s VAL 123 Ca 0.39 1.51 -0.29 0.00 0.00 0.00 0.00 61.98 63.59 3dby s VAL 123 Cb -0.13 -3.97 -0.11 0.00 0.00 0.00 0.00 36.38 32.17 3dby s VAL 123 CO 0.22 -0.11 1.53 -0.81 0.00 0.00 0.00 175.10 175.93 3dby n PRO 124 N 6.36 2.66 -1.59 2.72 -0.04 -1.26 -4.95 135.00 138.89 3dby n PRO 124 Ca 0.13 0.94 -0.30 0.00 -0.04 0.00 0.00 63.50 64.23 3dby n PRO 124 Cb 0.45 -2.69 0.07 0.00 -0.04 0.00 0.00 33.50 31.29 3dby n PRO 124 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3dby s PRO 125 N -1.34 2.60 -0.21 0.54 0.04 -1.26 -4.99 135.00 130.37 3dby s PRO 125 Ca 0.58 0.78 -0.22 0.00 0.04 0.00 0.00 61.00 62.19 3dby s PRO 125 Cb -0.49 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.06 3dby s PRO 125 CO 0.57 -1.29 0.67 0.08 0.04 0.00 0.00 177.00 177.07 3dby s VAL 126 N -3.12 4.98 0.99 -0.36 1.01 -1.26 -5.04 120.40 117.60 3dby s VAL 126 Ca 0.59 1.27 -0.14 0.00 0.00 0.00 0.00 61.98 63.70 3dby s VAL 126 Cb -0.14 -3.98 0.18 0.00 0.00 0.00 0.00 36.38 32.44 3dby s VAL 126 CO 0.54 0.06 1.14 -0.36 0.00 0.00 0.00 175.10 176.49 3dby s PHE 127 N 2.15 1.95 0.42 5.22 0.08 -1.26 -4.96 117.98 121.58 3dby s PHE 127 Ca 0.30 0.75 -0.27 0.00 0.12 0.00 0.00 56.93 57.84 3dby s PHE 127 Cb -0.16 -3.45 -0.09 0.00 -0.57 0.00 0.00 43.02 38.74 3dby s PHE 127 CO 0.10 -2.80 1.45 -1.58 -0.10 0.00 0.00 175.22 172.29 3dby s HIS 128 N -3.23 2.52 0.29 0.36 5.65 -1.26 -4.68 115.29 114.94 3dby s HIS 128 Ca 0.67 1.22 0.04 0.00 0.25 0.00 0.00 55.06 57.23 3dby s HIS 128 Cb -0.13 -3.97 0.67 0.00 -1.18 0.00 0.00 32.58 27.97 3dby s HIS 128 CO 0.55 -2.96 1.79 1.05 -0.65 0.00 0.00 174.74 174.51 3dby h GLU 129 N 2.63 0.79 -0.64 2.88 4.11 -1.92 -0.96 114.58 121.46 3dby h GLU 129 Ca -0.51 -0.05 0.11 0.00 0.07 0.00 0.00 59.36 58.98 3dby h GLU 129 Cb 1.25 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 30.29 3dby h GLU 129 CO 0.62 0.52 0.43 -0.07 0.07 0.00 0.00 179.01 180.59 3dby h LEU 130 N 0.81 0.40 -0.34 3.06 3.38 -1.97 -1.23 115.31 119.41 3dby h LEU 130 Ca 0.55 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.60 3dby h LEU 130 Cb 0.77 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 3dby h LEU 130 CO -0.35 0.23 -0.10 -0.74 0.09 0.00 0.00 178.44 177.57 3dby h HIS 131 N 0.44 -0.22 -0.41 1.13 2.76 -1.53 -0.03 115.15 117.30 3dby h HIS 131 Ca 0.30 0.03 -0.13 0.00 -2.20 0.00 0.00 60.37 58.37 3dby h HIS 131 Cb 0.59 0.15 -0.01 0.00 1.55 0.00 0.00 27.41 29.69 3dby h HIS 131 CO -0.00 -0.16 -0.26 1.88 -1.30 0.00 0.00 177.93 178.09 3dby h TYR 132 N -0.02 0.98 -0.46 5.26 0.05 -1.33 -2.60 116.97 118.85 3dby h TYR 132 Ca 0.17 -0.24 -0.00 0.00 0.05 0.00 0.00 58.73 58.70 3dby h TYR 132 Cb 0.27 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 3dby h TYR 132 CO -0.33 1.01 0.28 0.45 -1.05 0.00 0.00 178.16 178.53 3dby h HIS 133 N 0.73 0.60 0.00 4.88 3.86 -1.01 0.17 115.15 124.39 3dby h HIS 133 Ca 0.09 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.30 3dby h HIS 133 Cb 0.80 -0.20 -0.00 0.00 1.06 0.00 0.00 27.41 29.07 3dby h HIS 133 CO 0.05 0.41 -0.02 -0.07 0.86 0.00 0.00 177.93 179.17 3dby h LEU 134 N 0.61 0.00 0.06 2.43 3.38 -0.76 -2.26 115.31 118.78 3dby h LEU 134 Ca 0.17 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.78 3dby h LEU 134 Cb -0.02 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 3dby h LEU 134 CO -0.03 0.02 -1.99 0.52 0.09 0.00 0.00 178.44 177.04 3dby n VAL 135 N -4.13 1.65 1.02 1.22 0.31 -1.00 -4.66 118.33 112.75 3dby n VAL 135 Ca -0.03 -0.48 0.11 0.00 -0.01 0.00 0.00 64.34 63.93 3dby n VAL 135 Cb 0.10 -1.75 0.06 0.00 -0.91 0.00 0.00 33.84 31.34 3dby n VAL 135 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 3dby n TRP 136 N -3.71 0.00 -0.03 3.52 7.02 0.57 -3.54 117.44 121.27 3dby n TRP 136 Ca -0.37 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 55.96 3dby n TRP 136 Cb 0.95 -0.09 -0.12 0.00 -2.42 0.00 0.00 31.31 29.62 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 0.46 0.18 -1.16 -0.99 3.38 -1.60 -2.24 115.31 113.35 3dby h LEU 137 Ca 0.00 -0.85 -0.03 0.00 0.09 0.00 0.00 57.88 57.09 3dby h LEU 137 Cb 0.54 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 3dby h LEU 137 CO 0.00 1.01 0.27 0.71 0.09 0.00 0.00 178.44 180.52 3dby h THR 138 N -0.62 1.20 -0.58 0.22 1.35 -1.80 -1.24 112.91 111.44 3dby h THR 138 Ca -0.04 -0.60 0.08 0.00 -0.55 0.00 0.00 66.41 65.30 3dby h THR 138 Cb 1.07 0.46 -0.07 0.00 -1.73 0.00 0.00 68.15 67.88 3dby h THR 138 CO 0.05 0.25 0.22 -0.78 -0.25 0.00 0.00 175.52 175.01 3dby h ASP 139 N 0.86 0.24 -0.36 5.36 3.58 -1.60 -0.75 116.42 123.74 3dby h ASP 139 Ca 0.21 0.07 -0.15 0.00 0.42 0.00 0.00 57.03 57.57 3dby h ASP 139 Cb 0.12 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.21 3dby h ASP 139 CO -0.02 0.15 -0.38 0.00 -2.88 0.00 0.00 179.24 176.11 3dby h ALA 140 N 1.39 0.53 -0.69 -0.78 0.00 -0.91 -0.22 119.26 118.57 3dby h ALA 140 Ca 0.29 -0.45 0.05 0.00 0.00 0.00 0.00 54.91 54.80 3dby h ALA 140 Cb 0.33 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3dby h ALA 140 CO -0.28 0.63 0.40 0.00 0.00 0.00 0.00 179.25 180.00 3dby h ALA 141 N 0.75 0.93 -0.55 0.00 0.00 -1.13 -1.34 119.26 117.91 3dby h ALA 141 Ca 0.05 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3dby h ALA 141 Cb 0.97 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.58 3dby h ALA 141 CO 0.09 0.10 0.23 0.78 0.00 0.00 0.00 179.25 180.45 3dby h GLY 142 N 0.74 0.84 0.80 0.00 0.00 -0.76 0.30 103.07 105.00 3dby h GLY 142 Ca 0.30 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.18 3dby h GLY 142 CO -0.17 0.40 -0.35 0.45 0.00 0.00 0.00 176.54 176.87 3dby h HIS 143 N 0.78 -0.90 -0.84 5.60 3.86 -0.69 -0.21 115.15 122.74 3dby h HIS 143 Ca 0.19 -0.02 0.12 0.00 -1.16 0.00 0.00 60.37 59.50 3dby h HIS 143 Cb 0.14 0.30 -0.08 0.00 1.06 0.00 0.00 27.41 28.83 3dby h HIS 143 CO 0.01 -0.54 0.47 0.00 0.86 0.00 0.00 177.93 178.72 3dby h ALA 144 N -1.10 1.24 -0.43 2.45 0.00 -1.19 -1.34 119.26 118.89 3dby h ALA 144 Ca -0.10 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3dby h ALA 144 Cb 0.77 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3dby h ALA 144 CO 0.16 0.02 0.12 0.78 0.00 0.00 0.00 179.25 180.34 3dby h GLY 145 N 0.73 0.68 2.00 0.00 0.00 -0.38 -0.87 103.07 105.23 3dby h GLY 145 Ca 0.43 -0.36 -0.17 0.00 0.00 0.00 0.00 47.33 47.23 3dby h GLY 145 CO -0.30 0.34 -0.82 1.48 0.00 0.00 0.00 176.54 177.24 3dby h SER 146 N 0.62 0.00 -0.14 0.19 4.64 -0.36 -0.94 113.55 117.56 3dby h SER 146 Ca 0.14 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.46 3dby h SER 146 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 3dby h SER 146 CO -0.01 0.82 0.05 0.40 -0.87 0.00 0.00 176.83 177.23 3dby h ILE 147 N 0.00 1.16 -0.78 0.95 2.04 -0.97 0.17 117.51 120.08 3dby h ILE 147 Ca -0.01 -0.48 0.06 0.00 1.00 0.00 0.00 64.86 65.44 3dby h ILE 147 Cb 1.57 1.22 -0.06 0.00 -0.74 0.00 0.00 36.82 38.81 3dby h ILE 147 CO 0.11 0.15 0.47 -1.28 0.00 0.00 0.00 178.15 177.59 3dby h SER 148 N 0.06 0.72 1.29 1.72 0.87 -1.04 -2.18 113.55 114.99 3dby h SER 148 Ca 0.05 0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.58 3dby h SER 148 Cb 0.18 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 3dby h SER 148 CO -0.00 0.46 -0.25 1.23 -0.53 0.00 0.00 176.83 177.74 3dby h GLY 149 N 0.85 0.00 -1.24 5.77 0.00 -0.95 -3.22 103.07 104.29 3dby h GLY 149 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3dby h GLY 149 CO -0.18 0.00 0.00 0.61 0.00 0.00 0.00 176.54 176.97 3dby n GLY 150 N 0.63 0.58 3.84 4.60 0.00 0.03 -4.92 105.19 109.96 3dby n GLY 150 Ca 0.01 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.14 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 -1.89 4.20 0.75 0.99 1.43 -1.03 -0.81 118.68 122.31 3dby s LEU 151 Ca 0.34 1.20 -0.15 0.00 -1.03 0.00 0.00 54.13 54.49 3dby s LEU 151 Cb 0.20 -3.74 0.05 0.00 0.03 0.00 0.00 46.19 42.73 3dby s LEU 151 CO 0.31 -0.07 1.24 -0.67 0.23 0.00 0.00 176.35 177.39 3dby n ASP 152 N 0.15 1.44 -0.14 2.29 2.03 0.06 -4.86 116.55 117.52 3dby n ASP 152 Ca -0.00 0.68 0.25 0.00 0.52 0.00 0.00 54.79 56.24 3dby n ASP 152 Cb 0.52 -1.53 0.68 0.00 -0.72 0.00 0.00 41.12 40.08 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 -0.34 0.07 -0.10 -2.67 5.85 -1.96 -1.91 115.31 114.24 3dby h LEU 153 Ca -0.48 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3dby h LEU 153 Cb 1.32 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.34 3dby h LEU 153 CO 0.49 0.03 -0.18 1.33 -0.34 0.00 0.00 178.44 179.77 3dby n VAL 154 N -4.34 0.00 -1.59 1.05 0.24 -1.26 -4.38 118.33 108.05 3dby n VAL 154 Ca 0.16 -0.03 -0.39 0.00 -2.04 0.00 0.00 64.34 62.05 3dby n VAL 154 Cb 0.82 -0.14 -0.02 0.00 -1.47 0.00 0.00 33.84 33.03 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 -1.27 4.05 -0.24 7.34 -0.58 -0.72 -4.71 120.64 124.51 3dby n GLU 155 Ca 0.10 -2.71 -0.05 0.00 -0.42 0.00 0.00 57.16 54.07 3dby n GLU 155 Cb 0.31 -2.72 0.05 0.00 -0.57 0.00 0.00 31.44 28.52 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 4.79 0.91 -0.54 3.49 6.56 -1.83 -2.20 116.57 127.75 3dby h LYS 156 Ca 0.80 -0.07 -0.10 0.00 -1.06 0.00 0.00 60.65 60.22 3dby h LYS 156 Cb 0.31 -0.20 -0.02 0.00 -0.57 0.00 0.00 32.23 31.75 3dby h LYS 156 CO 1.64 0.63 -0.06 0.00 -2.06 0.00 0.00 179.45 179.59 3dby h ARG 157 N 0.93 1.00 -0.44 3.15 2.47 -1.98 -1.75 114.38 117.76 3dby h ARG 157 Ca 0.25 -0.35 -0.12 0.00 -1.26 0.00 0.00 59.98 58.49 3dby h ARG 157 Cb -0.07 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.16 3dby h ARG 157 CO -0.05 1.03 -0.21 -0.07 0.56 0.00 0.00 179.97 181.23 3dby h LEU 158 N 0.88 0.95 -0.44 3.04 3.38 -1.93 -2.36 115.31 118.83 3dby h LEU 158 Ca 0.15 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 3dby h LEU 158 Cb 0.62 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3dby h LEU 158 CO 0.04 1.14 0.22 0.11 0.09 0.00 0.00 178.44 180.04 3dby h LYS 159 N 0.76 0.62 -0.96 1.13 1.57 -1.38 -0.07 116.57 118.24 3dby h LYS 159 Ca 0.10 -0.08 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3dby h LYS 159 Cb 0.78 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.91 3dby h LYS 159 CO 0.06 0.52 0.62 0.93 -0.57 0.00 0.00 179.45 181.01 3dby h GLU 160 N 0.57 1.02 -0.19 3.15 5.08 -1.25 0.22 114.58 123.18 3dby h GLU 160 Ca 0.15 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 3dby h GLU 160 Cb 0.09 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 3dby h GLU 160 CO -0.02 0.68 -0.32 -0.22 -1.00 0.00 0.00 179.01 178.13 3dby h LYS 161 N 1.05 0.55 0.00 2.33 1.63 -1.13 -2.47 116.57 118.53 3dby h LYS 161 Ca 0.43 -0.34 -0.12 0.00 -0.85 0.00 0.00 60.65 59.78 3dby h LYS 161 Cb 0.29 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.94 3dby h LYS 161 CO -0.19 0.94 -0.56 0.66 -3.45 0.00 0.00 179.45 176.85 3dby h SER 162 N 0.21 0.00 -0.30 4.20 4.64 -0.46 -2.43 113.55 119.41 3dby h SER 162 Ca 0.01 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.26 3dby h SER 162 Cb 0.91 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.98 3dby h SER 162 CO 0.07 0.56 -0.05 -0.33 -0.87 0.00 0.00 176.83 176.21 3dby h GLU 163 N 0.00 0.69 -0.40 4.77 5.08 -0.61 -1.28 114.58 122.83 3dby h GLU 163 Ca -0.01 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.06 3dby h GLU 163 Cb 1.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 3dby h GLU 163 CO 0.07 0.74 -0.16 1.49 -1.00 0.00 0.00 179.01 180.15 3dby h GLU 164 N 0.64 0.82 -0.61 2.33 4.81 -1.06 -1.37 114.58 120.14 3dby h GLU 164 Ca 0.12 -0.34 0.02 0.00 -0.13 0.00 0.00 59.36 59.02 3dby h GLU 164 Cb 0.48 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 3dby h GLU 164 CO 0.02 0.97 0.39 0.74 -0.73 0.00 0.00 179.01 180.41 3dby h PHE 165 N 0.63 0.74 -0.17 0.92 0.04 -1.23 -1.37 116.94 116.49 3dby h PHE 165 Ca 0.09 0.02 0.02 0.00 2.80 0.00 0.00 57.97 60.90 3dby h PHE 165 Cb 0.71 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 3dby h PHE 165 CO 0.05 0.44 0.05 1.15 -0.60 0.00 0.00 178.31 179.41 3dby h THR 166 N 0.78 0.95 -0.26 -1.55 2.02 -1.03 -0.40 112.91 113.43 3dby h THR 166 Ca 0.24 -0.05 0.04 0.00 0.77 0.00 0.00 66.41 67.41 3dby h THR 166 Cb -0.04 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 3dby h THR 166 CO -0.08 0.02 0.03 0.50 0.37 0.00 0.00 175.52 176.37 3dby h LYS 167 N 0.13 0.11 -0.69 6.66 3.64 -1.03 -1.31 116.57 124.09 3dby h LYS 167 Ca 0.07 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3dby h LYS 167 Cb 0.05 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3dby h LYS 167 CO -0.08 0.08 0.45 0.45 -2.27 0.00 0.00 179.45 178.08 3dby h HIS 168 N 0.12 0.88 -0.41 1.91 3.86 -0.82 -0.81 115.15 119.87 3dby h HIS 168 Ca 0.12 0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.28 3dby h HIS 168 Cb 0.14 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.30 3dby h HIS 168 CO -0.18 0.56 -0.01 0.74 0.86 0.00 0.00 177.93 179.90 3dby h PHE 169 N 0.94 0.80 -0.47 2.45 0.04 -0.82 0.12 116.94 119.99 3dby h PHE 169 Ca 0.25 -0.14 0.03 0.00 2.80 0.00 0.00 57.97 60.91 3dby h PHE 169 Cb -0.10 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 37.81 3dby h PHE 169 CO -0.02 0.81 0.26 0.93 -0.60 0.00 0.00 178.31 179.69 3dby h GLU 170 N 0.56 0.50 -0.46 1.51 5.08 -1.10 0.72 114.58 121.38 3dby h GLU 170 Ca 0.11 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 3dby h GLU 170 Cb 0.50 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 3dby h GLU 170 CO 0.02 0.33 -0.02 1.96 -1.00 0.00 0.00 179.01 180.31 3dby h GLN 171 N 0.51 0.77 -0.86 2.33 4.20 -0.99 -1.61 115.11 119.45 3dby h GLN 171 Ca 0.20 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 3dby h GLN 171 Cb 0.07 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 3dby h GLN 171 CO -0.12 0.79 0.45 0.74 -0.67 0.00 0.00 178.83 180.02 3dby h PHE 172 N 0.72 1.20 -0.02 2.96 0.04 -0.29 -2.49 116.94 119.06 3dby h PHE 172 Ca 0.14 -0.04 -0.00 0.00 2.80 0.00 0.00 57.97 60.87 3dby h PHE 172 Cb 0.46 -0.38 -0.00 0.00 2.20 0.00 0.00 35.95 38.23 3dby h PHE 172 CO 0.02 0.85 0.01 -0.92 -0.60 0.00 0.00 178.31 177.67 3dby h TYR 173 N 1.21 0.03 -0.86 -0.55 3.20 -0.34 -1.18 116.97 118.48 3dby h TYR 173 Ca 0.30 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.30 3dby h TYR 173 Cb 0.06 -0.01 -0.09 0.00 1.54 0.00 0.00 36.73 38.24 3dby h TYR 173 CO 0.01 0.14 0.48 -0.07 -1.64 0.00 0.00 178.16 177.08 3dby h LEU 174 N -0.09 0.63 -0.49 2.82 3.38 -1.21 -1.04 115.31 119.30 3dby h LEU 174 Ca 0.01 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3dby h LEU 174 Cb 0.12 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3dby h LEU 174 CO -0.00 0.30 0.20 0.50 0.09 0.00 0.00 178.44 179.53 3dby h LYS 175 N 0.72 0.74 -0.17 1.13 3.64 -1.08 -2.41 116.57 119.13 3dby h LYS 175 Ca 0.45 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.67 3dby h LYS 175 Cb 0.55 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 3dby h LYS 175 CO -0.31 0.65 -0.03 0.00 -2.27 0.00 0.00 179.45 177.49 3dby h ALA 176 N 1.05 1.63 -0.30 5.00 0.00 -0.53 -0.82 119.26 125.29 3dby h ALA 176 Ca 0.16 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 3dby h ALA 176 Cb 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3dby h ALA 176 CO -0.01 0.27 -0.14 0.28 0.00 0.00 0.00 179.25 179.65 3dby h VAL 177 N 0.25 1.29 -0.42 0.00 2.07 -0.98 -0.82 116.25 117.65 3dby h VAL 177 Ca 0.06 -1.23 -0.02 0.00 0.82 0.00 0.00 66.70 66.33 3dby h VAL 177 Cb 0.22 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 3dby h VAL 177 CO 0.01 0.39 0.18 -0.33 0.02 0.00 0.00 177.57 177.84 3dby h GLU 178 N 0.39 0.62 -0.22 1.57 4.39 -1.00 -3.04 114.58 117.29 3dby h GLU 178 Ca 0.07 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 3dby h GLU 178 Cb 0.65 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.19 3dby h GLU 178 CO 0.04 0.56 -0.12 0.52 -1.16 0.00 0.00 179.01 178.86 3dby h MET 179 N 0.54 0.36 -1.00 2.33 2.86 -1.04 -1.43 114.93 117.55 3dby h MET 179 Ca 0.14 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.72 3dby h MET 179 Cb 0.16 -0.04 -0.06 0.00 0.06 0.00 0.00 31.60 31.72 3dby h MET 179 CO -0.01 0.48 0.66 1.15 1.06 0.00 0.00 176.91 180.24 3dby h THR 180 N 0.34 1.19 -0.77 2.22 2.02 -1.06 -1.52 112.91 115.33 3dby h THR 180 Ca 0.07 -0.44 -0.03 0.00 0.77 0.00 0.00 66.41 66.78 3dby h THR 180 Cb 0.42 -0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 66.59 3dby h THR 180 CO 0.02 0.23 0.37 1.23 0.37 0.00 0.00 175.52 177.75 3dby h GLY 181 N 1.29 1.18 2.00 2.16 0.00 -1.18 -2.34 103.07 106.18 3dby h GLY 181 Ca 0.39 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 3dby h GLY 181 CO -0.11 0.54 -0.00 -0.97 0.00 0.00 0.00 176.54 176.00 3dby h TYR 182 N 1.09 0.00 0.00 5.60 0.05 -0.54 -1.73 116.97 121.44 3dby h TYR 182 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.05 3dby h TYR 182 Cb 0.11 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.85 3dby h TYR 182 CO 0.01 0.00 0.00 -0.07 -1.05 0.00 0.00 178.16 177.05 3dby h LEU 183 N 0.00 0.00 -1.89 3.88 3.38 -1.13 -0.87 115.31 118.67 3dby h LEU 183 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dby h LEU 183 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 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 -1.46 0.54 114.38 117.66 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 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 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 -2.87 0.61 -0.85 2.04 -2.24 -0.33 -4.84 114.28 105.81 3dby n THR 185 Ca -0.01 0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 3dby n THR 185 Cb 0.18 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 67.44 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 -1.24 -0.71 -3.08 -0.78 1.02 0.18 -4.97 120.64 111.05 3dby n GLU 186 Ca 0.06 0.18 -0.43 0.00 -0.02 0.00 0.00 57.16 56.95 3dby n GLU 186 Cb 0.08 -4.07 -0.06 0.00 -0.02 0.00 0.00 31.44 27.36 3dby n GLU 186 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3dby s LEU 187 N 0.00 4.41 0.00 -4.62 2.96 -1.26 -4.96 118.68 115.21 3dby s LEU 187 Ca 0.00 -0.21 0.22 0.00 -0.22 0.00 0.00 54.13 53.92 3dby s LEU 187 Cb 0.00 -2.78 -0.04 0.00 0.50 0.00 0.00 46.19 43.87 3dby s LEU 187 CO 0.00 -0.77 1.05 1.41 -1.32 0.00 0.00 176.35 176.73 3dby n HIS 188 N 6.30 0.00 -3.75 5.38 8.25 -1.26 -4.50 115.22 125.64 3dby n HIS 188 Ca -0.01 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.33 3dby n HIS 188 Cb 0.48 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.47 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 -2.53 -0.35 -0.00 4.41 3.76 -1.26 -5.04 115.29 114.27 3dby s HIS 189 Ca 0.17 0.82 -0.28 0.00 -0.15 0.00 0.00 55.06 55.61 3dby s HIS 189 Cb 0.18 0.09 0.08 0.00 1.11 0.00 0.00 32.58 34.05 3dby s HIS 189 CO 0.61 -0.21 0.74 -0.59 -0.85 0.00 0.00 174.74 174.44 3dby s PHE 190 N 0.80 -0.53 0.25 1.40 -0.12 -1.26 -5.07 117.98 113.44 3dby s PHE 190 Ca -0.05 0.68 -0.03 0.00 -0.05 0.00 0.00 56.93 57.48 3dby s PHE 190 Cb -0.07 0.48 0.46 0.00 -0.63 0.00 0.00 43.02 43.26 3dby s PHE 190 CO -0.05 -0.62 1.78 -1.35 -0.05 0.00 0.00 175.22 174.93 3dby h PRO 191 N 2.49 0.66 -0.63 1.99 0.11 -2.01 -1.36 132.00 133.26 3dby h PRO 191 Ca -0.27 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.85 3dby h PRO 191 Cb 1.21 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 3dby h PRO 191 CO 0.36 0.44 0.42 0.00 -0.21 0.00 0.00 178.00 179.01 3dby h ALA 192 N 1.50 1.72 0.01 -0.75 0.00 -1.99 -0.44 119.26 119.32 3dby h ALA 192 Ca 0.42 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.31 3dby h ALA 192 Cb 0.51 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3dby h ALA 192 CO -0.31 0.20 -0.01 1.25 0.00 0.00 0.00 179.25 180.39 3dby h LEU 193 N 0.69 -0.01 -0.58 0.00 5.85 -1.67 -1.02 115.31 118.56 3dby h LEU 193 Ca 0.26 -0.39 0.07 0.00 0.84 0.00 0.00 57.88 58.67 3dby h LEU 193 Cb 0.17 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.14 3dby h LEU 193 CO -0.08 0.38 0.25 0.11 -0.34 0.00 0.00 178.44 178.77 3dby h LYS 194 N -0.41 0.45 -0.35 1.25 1.79 -1.28 -0.42 116.57 117.60 3dby h LYS 194 Ca -0.00 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 3dby h LYS 194 Cb 0.40 -0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 3dby h LYS 194 CO 0.00 0.30 0.18 -0.22 -1.08 0.00 0.00 179.45 178.63 3dby h LYS 195 N 0.47 0.49 -0.26 3.15 1.63 -1.07 -1.87 116.57 119.10 3dby h LYS 195 Ca 0.28 -0.06 0.06 0.00 -0.85 0.00 0.00 60.65 60.08 3dby h LYS 195 Cb 0.28 -0.09 -0.07 0.00 -0.60 0.00 0.00 32.23 31.75 3dby h LYS 195 CO -0.24 0.42 -0.24 0.35 -3.45 0.00 0.00 179.45 176.29 3dby h PHE 196 N 0.43 -0.63 -0.94 1.91 3.57 -0.86 0.50 116.94 120.93 3dby h PHE 196 Ca 0.12 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.65 3dby h PHE 196 Cb 0.08 0.32 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 3dby h PHE 196 CO -0.02 -0.31 0.56 1.15 -2.23 0.00 0.00 178.31 177.45 3dby h THR 197 N -0.24 1.26 -0.17 4.41 2.02 -0.77 -0.64 112.91 118.78 3dby h THR 197 Ca 0.14 -0.58 0.03 0.00 0.77 0.00 0.00 66.41 66.77 3dby h THR 197 Cb 0.45 -0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 66.78 3dby h THR 197 CO -0.39 0.28 -0.03 0.11 0.37 0.00 0.00 175.52 175.86 3dby h LYS 198 N 1.30 0.02 -0.85 6.66 1.57 -0.63 -1.20 116.57 123.44 3dby h LYS 198 Ca 0.34 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.10 3dby h LYS 198 Cb -0.04 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 3dby h LYS 198 CO -0.06 0.01 0.47 -0.44 -0.57 0.00 0.00 179.45 178.86 3dby h ASP 199 N 0.02 1.06 -0.49 0.86 3.32 0.16 -2.09 116.42 119.26 3dby h ASP 199 Ca 0.08 -0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.05 3dby h ASP 199 Cb 0.12 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 3dby h ASP 199 CO -0.16 0.85 0.31 0.58 -1.72 0.00 0.00 179.24 179.10 3dby h VAL 200 N 1.19 1.08 -0.32 -1.35 2.07 -1.03 -1.98 116.25 115.91 3dby h VAL 200 Ca 0.30 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.60 3dby h VAL 200 Cb 0.02 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 3dby h VAL 200 CO -0.05 0.11 0.16 0.28 0.02 0.00 0.00 177.57 178.09 3dby h SER 201 N 0.62 0.41 -0.61 0.57 0.02 -0.81 0.06 113.55 113.81 3dby h SER 201 Ca 0.19 -0.12 0.10 0.00 -0.84 0.00 0.00 61.79 61.12 3dby h SER 201 Cb -0.02 -0.11 -0.08 0.00 0.14 0.00 0.00 62.40 62.33 3dby h SER 201 CO -0.07 0.42 0.20 0.25 -1.14 0.00 0.00 176.83 176.49 3dby h LEU 202 N 0.38 0.16 -0.66 5.07 6.46 -1.36 -0.56 115.31 124.80 3dby h LEU 202 Ca 0.11 0.09 -0.05 0.00 -0.12 0.00 0.00 57.88 57.91 3dby h LEU 202 Cb 0.11 0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.10 3dby h LEU 202 CO -0.01 0.09 0.21 -0.08 -0.62 0.00 0.00 178.44 178.02 3dby h GLU 203 N 0.36 1.02 -0.95 1.25 4.57 -0.53 -1.76 114.58 118.55 3dby h GLU 203 Ca 0.32 -0.22 0.08 0.00 -1.18 0.00 0.00 59.36 58.36 3dby h GLU 203 Cb 0.43 -0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 28.80 3dby h GLU 203 CO -0.34 0.89 0.61 -0.07 -1.18 0.00 0.00 179.01 178.92 3dby h LEU 204 N 0.96 0.93 -0.03 1.64 3.38 -0.69 0.29 115.31 121.80 3dby h LEU 204 Ca 0.21 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.21 3dby h LEU 204 Cb 0.29 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3dby h LEU 204 CO -0.01 0.58 -0.02 0.11 0.09 0.00 0.00 178.44 179.19 3dby h LYS 205 N 1.05 -0.03 -0.66 1.13 6.56 -0.56 0.24 116.57 124.30 3dby h LYS 205 Ca 0.42 0.00 0.01 0.00 -1.06 0.00 0.00 60.65 60.03 3dby h LYS 205 Cb 0.26 0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.89 3dby h LYS 205 CO -0.17 -0.02 0.43 -0.07 -2.06 0.00 0.00 179.45 177.55 3dby h LEU 206 N -0.03 0.73 -0.18 2.94 3.38 -0.90 -1.90 115.31 119.34 3dby h LEU 206 Ca 0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3dby h LEU 206 Cb 0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3dby h LEU 206 CO -0.04 0.52 0.02 0.15 0.09 0.00 0.00 178.44 179.18 3dby h PHE 207 N 0.86 0.33 -0.93 1.13 3.57 -0.20 -1.49 116.94 120.22 3dby h PHE 207 Ca 0.25 -0.05 0.15 0.00 3.53 0.00 0.00 57.97 61.85 3dby h PHE 207 Cb -0.06 -0.09 -0.10 0.00 2.79 0.00 0.00 35.95 38.49 3dby h PHE 207 CO -0.03 0.48 0.54 0.77 -2.23 0.00 0.00 178.31 177.83 3dby h SER 208 N 0.09 0.70 -0.44 0.41 0.02 -0.37 0.13 113.55 114.09 3dby h SER 208 Ca 0.05 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.06 3dby h SER 208 Cb 0.33 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 3dby h SER 208 CO 0.01 0.30 0.18 0.45 -1.14 0.00 0.00 176.83 176.63 3dby h HIS 209 N 0.75 0.66 -0.99 3.45 3.86 -0.82 -1.64 115.15 120.43 3dby h HIS 209 Ca 0.51 -0.05 0.05 0.00 -1.16 0.00 0.00 60.37 59.72 3dby h HIS 209 Cb 0.69 -0.20 -0.06 0.00 1.06 0.00 0.00 27.41 28.90 3dby h HIS 209 CO -0.04 0.57 0.64 0.35 0.86 0.00 0.00 177.93 180.30 3dby h PHE 210 N 0.57 1.19 -0.36 2.45 3.57 -0.39 -1.19 116.94 122.78 3dby h PHE 210 Ca 0.15 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.56 3dby h PHE 210 Cb 0.18 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 3dby h PHE 210 CO -0.00 0.64 -0.27 -0.07 -2.23 0.00 0.00 178.31 176.39 3dby h LEU 211 N 1.19 0.76 -0.52 0.59 3.38 -0.39 -0.51 115.31 119.82 3dby h LEU 211 Ca 0.42 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3dby h LEU 211 Cb 0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3dby h LEU 211 CO -0.16 0.99 0.08 0.45 0.09 0.00 0.00 178.44 179.90 3dby h HIS 212 N 0.64 0.92 -0.04 1.13 3.86 -0.79 0.22 115.15 121.09 3dby h HIS 212 Ca 0.08 -0.13 0.02 0.00 -1.16 0.00 0.00 60.37 59.18 3dby h HIS 212 Cb 0.78 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.97 3dby h HIS 212 CO 0.04 0.83 -0.08 1.49 0.86 0.00 0.00 177.93 181.06 3dby h GLU 213 N 0.75 -0.12 -0.64 2.45 4.81 -1.01 -0.51 114.58 120.31 3dby h GLU 213 Ca 0.16 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 3dby h GLU 213 Cb 0.41 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 3dby h GLU 213 CO 0.01 -0.08 0.42 0.28 -0.73 0.00 0.00 179.01 178.91 3dby h VAL 214 N -0.12 1.14 -0.51 0.32 2.07 -0.69 -0.22 116.25 118.24 3dby h VAL 214 Ca 0.05 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.33 3dby h VAL 214 Cb 0.19 0.23 -0.05 0.00 -1.52 0.00 0.00 31.29 30.14 3dby h VAL 214 CO -0.12 0.15 0.23 -0.08 0.02 0.00 0.00 177.57 177.77 3dby h GLU 215 N 0.84 0.43 -0.63 1.57 4.81 -0.39 0.27 114.58 121.49 3dby h GLU 215 Ca 0.24 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.36 3dby h GLU 215 Cb -0.07 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 3dby h GLU 215 CO -0.06 0.28 0.08 0.93 -0.73 0.00 0.00 179.01 179.51 3dby h GLU 216 N 0.44 1.06 -0.71 1.92 4.39 -0.68 -0.71 114.58 120.30 3dby h GLU 216 Ca 0.23 -0.30 0.08 0.00 0.34 0.00 0.00 59.36 59.72 3dby h GLU 216 Cb 0.19 -0.12 -0.06 0.00 -0.10 0.00 0.00 28.75 28.66 3dby h GLU 216 CO -0.19 0.99 0.38 -0.07 -1.16 0.00 0.00 179.01 178.95 3dby h LEU 217 N 0.97 0.53 -0.49 1.33 3.38 -0.70 -1.72 115.31 118.60 3dby h LEU 217 Ca 0.19 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 58.13 3dby h LEU 217 Cb 0.46 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3dby h LEU 217 CO 0.02 0.32 0.02 -0.33 0.09 0.00 0.00 178.44 178.56 3dby h GLU 218 N 0.66 0.84 0.00 1.13 4.39 -0.44 -0.27 114.58 120.90 3dby h GLU 218 Ca 0.34 -0.26 -0.05 0.00 0.34 0.00 0.00 59.36 59.73 3dby h GLU 218 Cb 0.29 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 3dby h GLU 218 CO -0.23 0.87 -0.23 -0.07 -1.16 0.00 0.00 179.01 178.19 3dby h LEU 219 N 0.70 0.00 -2.02 1.33 3.38 -0.88 -2.35 115.31 115.47 3dby h LEU 219 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dby h LEU 219 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3dby h LEU 219 CO 0.02 0.23 0.00 -1.54 0.09 0.00 0.00 178.44 177.24 3dby n SER 220 N -3.67 3.11 -2.20 -0.43 3.41 -0.67 -4.96 113.62 108.20 3dby n SER 220 Ca -0.01 -1.99 -0.17 0.00 -0.26 0.00 0.00 58.87 56.43 3dby n SER 220 Cb 0.35 -0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 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 1.37 -4.99 0.06 4.04 3.02 -0.71 -4.89 115.26 113.16 3dby n ASN 221 Ca 0.16 0.15 0.13 0.00 -0.03 0.00 0.00 54.58 54.99 3dby n ASN 221 Cb 0.60 -4.25 0.31 0.00 -0.61 0.00 0.00 39.78 35.83 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 -2.75 0.21 -4.62 3.52 1.02 -0.19 -4.84 120.64 112.99 3dby n GLU 222 Ca -0.20 0.11 -0.31 0.00 -0.02 0.00 0.00 57.16 56.73 3dby n GLU 222 Cb 0.64 -1.68 -0.12 0.00 -0.02 0.00 0.00 31.44 30.26 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 -3.11 3.13 -0.28 2.62 0.11 -1.21 -5.05 120.40 116.61 3dby s VAL 223 Ca 0.09 -0.98 -0.11 0.00 -2.93 0.00 0.00 61.98 58.05 3dby s VAL 223 Cb 0.14 -2.32 -0.05 0.00 -1.53 0.00 0.00 36.38 32.62 3dby s VAL 223 CO 0.65 0.39 0.19 -0.76 -3.33 0.00 0.00 175.10 172.24 3dby s LEU 224 N -1.34 4.03 0.00 2.54 1.43 -1.26 -4.90 118.68 119.19 3dby s LEU 224 Ca 0.15 -0.05 -0.18 0.00 -1.03 0.00 0.00 54.13 53.03 3dby s LEU 224 Cb -0.11 -2.11 0.06 0.00 0.03 0.00 0.00 46.19 44.06 3dby s LEU 224 CO 0.05 -0.06 0.85 -1.54 0.23 0.00 0.00 176.35 175.88 3dby n SER 225 N 5.06 -1.32 -0.41 2.29 3.41 -1.26 -0.76 113.62 120.63 3dby n SER 225 Ca -0.14 -1.65 0.07 0.00 -0.26 0.00 0.00 58.87 56.89 3dby n SER 225 Cb 0.52 2.14 0.13 0.00 -0.26 0.00 0.00 64.21 66.73 3dby n SER 225 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3dby n VAL 226 N -0.60 1.50 -2.31 -3.33 0.24 0.01 -4.91 118.33 108.92 3dby n VAL 226 Ca -0.01 -2.05 -0.25 0.00 -2.04 0.00 0.00 64.34 59.99 3dby n VAL 226 Cb 0.46 -0.01 0.15 0.00 -1.47 0.00 0.00 33.84 32.98 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 -0.95 0.00 -4.05 1.34 4.77 -1.26 -5.04 117.00 111.81 3dby n LEU 227 Ca 0.13 -1.82 -0.07 0.00 -0.03 0.00 0.00 56.01 54.22 3dby n LEU 227 Cb 0.71 -0.79 -0.10 0.00 -2.33 0.00 0.00 43.42 40.91 3dby n LEU 227 CO -0.01 -1.17 -0.33 -0.94 -1.33 0.00 0.00 177.39 173.61 3dby s SER 228 N -5.35 0.43 0.27 -1.43 1.04 -1.26 -5.04 113.70 102.36 3dby s SER 228 Ca 0.69 -0.93 -0.03 0.00 0.48 0.00 0.00 55.95 56.16 3dby s SER 228 Cb -0.03 0.21 0.35 0.00 0.10 0.00 0.00 66.02 66.66 3dby s SER 228 CO 0.47 -0.60 1.84 0.00 0.98 0.00 0.00 173.24 175.93 3dby h ALA 229 N 3.17 1.21 -0.99 5.32 0.00 -1.87 -2.65 119.26 123.45 3dby h ALA 229 Ca -0.34 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.42 3dby h ALA 229 Cb 1.15 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 3dby h ALA 229 CO 0.64 0.57 0.65 -0.09 0.00 0.00 0.00 179.25 181.02 3dby h ARG 230 N 0.95 1.25 -0.51 0.00 2.43 -1.96 0.58 114.38 117.12 3dby h ARG 230 Ca 0.22 -0.08 -0.11 0.00 -0.81 0.00 0.00 59.98 59.21 3dby h ARG 230 Cb 0.19 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 3dby h ARG 230 CO -0.02 0.83 -0.10 1.98 -1.51 0.00 0.00 179.97 181.15 3dby h MET 231 N 1.29 0.97 -0.37 0.20 4.05 -1.92 -0.24 114.93 118.91 3dby h MET 231 Ca 0.38 -0.36 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 3dby h MET 231 Cb -0.08 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 30.64 3dby h MET 231 CO -0.10 1.03 0.24 0.00 0.23 0.00 0.00 176.91 178.31 3dby h ALA 232 N 0.91 0.48 -0.82 0.39 0.00 -1.08 -0.14 119.26 119.00 3dby h ALA 232 Ca 0.13 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3dby h ALA 232 Cb 0.66 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 3dby h ALA 232 CO 0.05 -0.04 0.52 0.22 0.00 0.00 0.00 179.25 179.99 3dby h ASP 233 N 0.50 0.97 -0.46 0.00 3.58 -0.70 -1.55 116.42 118.75 3dby h ASP 233 Ca 0.14 -0.05 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 3dby h ASP 233 Cb -0.02 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.76 3dby h ASP 233 CO -0.03 0.73 0.20 -0.74 -2.88 0.00 0.00 179.24 176.52 3dby h HIS 234 N 1.12 0.69 -0.29 0.28 2.76 -0.71 -0.08 115.15 118.93 3dby h HIS 234 Ca 0.30 -0.04 -0.12 0.00 -2.20 0.00 0.00 60.37 58.30 3dby h HIS 234 Cb -0.09 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 28.65 3dby h HIS 234 CO -0.01 0.57 -0.33 0.52 -1.30 0.00 0.00 177.93 177.38 3dby h MET 235 N 0.60 0.63 -0.38 5.26 2.86 -0.65 -2.26 114.93 120.98 3dby h MET 235 Ca 0.16 -0.29 -0.13 0.00 -2.06 0.00 0.00 59.70 57.38 3dby h MET 235 Cb 0.16 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 3dby h MET 235 CO -0.02 0.87 -0.26 0.00 1.06 0.00 0.00 176.91 178.56 3dby h ALA 236 N 1.10 0.55 -0.80 6.32 0.00 -0.91 -1.78 119.26 123.74 3dby h ALA 236 Ca 0.06 -0.40 0.04 0.00 0.00 0.00 0.00 54.91 54.60 3dby h ALA 236 Cb 0.83 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3dby h ALA 236 CO 0.07 0.56 0.51 0.00 0.00 0.00 0.00 179.25 180.38 3dby h ARG 237 N 0.66 0.95 -0.48 0.00 3.08 -0.79 -0.79 114.38 117.02 3dby h ARG 237 Ca 0.07 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 3dby h ARG 237 Cb 0.84 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.65 3dby h ARG 237 CO 0.07 0.63 -0.09 0.93 -1.07 0.00 0.00 179.97 180.44 3dby h GLU 238 N 0.98 0.87 -0.57 0.04 5.08 -1.26 -1.90 114.58 117.82 3dby h GLU 238 Ca 0.32 -0.29 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 3dby h GLU 238 Cb 0.03 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 3dby h GLU 238 CO -0.12 0.93 0.06 0.93 -1.00 0.00 0.00 179.01 179.80 3dby h GLU 239 N 0.79 0.94 -0.21 2.33 4.39 -0.87 -1.21 114.58 120.74 3dby h GLU 239 Ca 0.13 -0.25 0.03 0.00 0.34 0.00 0.00 59.36 59.61 3dby h GLU 239 Cb 0.60 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.11 3dby h GLU 239 CO 0.04 0.90 0.02 0.00 -1.16 0.00 0.00 179.01 178.80 3dby h TYR 241 N 0.09 0.33 -0.29 0.00 3.20 -1.17 0.99 116.97 120.13 3dby h TYR 241 Ca 0.10 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.02 3dby h TYR 241 Cb 0.11 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.24 3dby h TYR 241 CO -0.16 0.18 0.04 -0.92 -1.64 0.00 0.00 178.16 175.65 3dby h TYR 242 N 0.37 0.05 -0.53 -3.82 3.20 -0.84 -1.76 116.97 113.65 3dby h TYR 242 Ca 0.15 0.02 0.08 0.00 3.14 0.00 0.00 58.73 62.13 3dby h TYR 242 Cb 0.07 0.02 -0.07 0.00 1.54 0.00 0.00 36.73 38.29 3dby h TYR 242 CO -0.10 -0.01 0.15 1.25 -1.64 0.00 0.00 178.16 177.82 3dby h LEU 243 N 0.13 0.10 -0.51 2.82 5.85 0.18 -1.31 115.31 122.58 3dby h LEU 243 Ca 0.13 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 3dby h LEU 243 Cb 0.16 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 3dby h LEU 243 CO -0.20 0.08 0.28 0.25 -0.34 0.00 0.00 178.44 178.51 3dby h LEU 244 N 0.31 0.64 -0.73 2.25 5.85 -0.47 -1.44 115.31 121.72 3dby h LEU 244 Ca 0.27 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 3dby h LEU 244 Cb 0.33 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 3dby h LEU 244 CO -0.30 0.55 0.12 0.11 -0.34 0.00 0.00 178.44 178.57 3dby h LYS 245 N 0.68 1.08 -0.58 1.25 1.79 -1.03 -0.22 116.57 119.54 3dby h LYS 245 Ca 0.18 -0.28 -0.00 0.00 -2.18 0.00 0.00 60.65 58.37 3dby h LYS 245 Cb 0.05 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 30.54 3dby h LYS 245 CO -0.03 0.98 0.35 -0.07 -1.08 0.00 0.00 179.45 179.61 3dby h LEU 246 N 1.01 0.70 -0.68 2.94 3.38 -1.09 0.14 115.31 121.70 3dby h LEU 246 Ca 0.20 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 3dby h LEU 246 Cb 0.42 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3dby h LEU 246 CO 0.01 0.55 0.20 0.00 0.09 0.00 0.00 178.44 179.29 3dby h ALA 247 N 1.18 0.90 -0.04 1.53 0.00 -0.94 0.11 119.26 121.99 3dby h ALA 247 Ca 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3dby h ALA 247 Cb -0.02 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 3dby h ALA 247 CO -0.04 0.59 -0.06 1.96 0.00 0.00 0.00 179.25 181.70 3dby h GLN 248 N 1.01 0.11 -0.50 0.00 4.20 -0.93 -0.10 115.11 118.90 3dby h GLN 248 Ca 0.22 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.76 3dby h GLN 248 Cb 0.32 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 3dby h GLN 248 CO -0.00 0.63 -0.09 0.66 -0.67 0.00 0.00 178.83 179.35 3dby h SER 249 N -0.40 0.90 0.24 1.46 4.64 -0.74 -3.27 113.55 116.38 3dby h SER 249 Ca 0.00 -0.28 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3dby h SER 249 Cb 0.62 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 3dby h SER 249 CO 0.01 1.01 -0.88 -0.24 -0.87 0.00 0.00 176.83 175.86 3dby n SER 250 N -4.16 0.73 -1.56 4.97 2.88 0.39 -4.65 113.62 112.22 3dby n SER 250 Ca 0.02 -0.58 -0.04 0.00 -1.33 0.00 0.00 58.87 56.94 3dby n SER 250 Cb 0.37 0.76 0.02 0.00 -0.75 0.00 0.00 64.21 64.62 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 1.47 0.26 3.84 0.46 0.00 -0.20 -5.02 105.19 105.99 3dby n GLY 251 Ca 0.04 -0.34 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.00 2.65 0.23 0.99 1.43 -0.35 -5.04 118.68 115.59 3dby s LEU 252 Ca 0.00 -1.34 -0.30 0.00 -1.03 0.00 0.00 54.13 51.46 3dby s LEU 252 Cb -0.00 -1.10 -0.10 0.00 0.03 0.00 0.00 46.19 45.02 3dby s LEU 252 CO 0.17 -0.94 1.42 -0.70 0.23 0.00 0.00 176.35 176.53 3dby s GLU 253 N -4.10 4.29 0.31 1.70 2.12 -1.26 -4.67 118.70 117.09 3dby s GLU 253 Ca 0.27 2.24 -0.29 0.00 0.36 0.00 0.00 54.97 57.55 3dby s GLU 253 Cb -0.00 -3.13 -0.11 0.00 0.26 0.00 0.00 34.13 31.14 3dby s GLU 253 CO 0.16 -0.39 1.54 -1.64 -0.54 0.00 0.00 175.26 174.39 3dby s MET 254 N -0.19 4.15 0.61 4.30 -1.94 -1.26 -4.82 119.30 120.14 3dby s MET 254 Ca 0.59 2.53 -0.19 0.00 -1.71 0.00 0.00 55.69 56.91 3dby s MET 254 Cb -0.41 -3.02 -0.03 0.00 2.01 0.00 0.00 34.83 33.38 3dby s MET 254 CO 0.41 -0.57 1.25 -1.25 -0.01 0.00 0.00 175.02 174.85 3dby s PRO 255 N -0.88 2.86 -1.13 2.03 0.04 -1.26 -4.97 135.00 131.69 3dby s PRO 255 Ca 0.60 1.94 -0.07 0.00 0.04 0.00 0.00 61.00 63.51 3dby s PRO 255 Cb -0.46 -1.93 0.27 0.00 0.04 0.00 0.00 34.50 32.41 3dby s PRO 255 CO 0.51 -1.33 1.47 1.63 0.04 0.00 0.00 177.00 179.32 3dby n LYS 256 N -1.63 4.08 -3.51 4.56 4.76 -1.26 -4.94 118.16 120.22 3dby n LYS 256 Ca 0.14 -4.32 -0.15 0.00 -2.87 0.00 0.00 58.31 51.11 3dby n LYS 256 Cb 0.49 -2.62 -0.05 0.00 -1.84 0.00 0.00 35.03 31.01 3dby n LYS 256 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3dby s ASN 258 N -1.94 5.37 0.60 0.00 2.47 -1.26 -4.97 114.94 115.20 3dby s ASN 258 Ca -0.05 -0.99 0.40 0.00 0.42 0.00 0.00 52.86 52.64 3dby s ASN 258 Cb -0.01 -1.91 2.12 0.00 -1.45 0.00 0.00 41.25 40.01 3dby s ASN 258 CO -0.01 -0.30 2.22 -0.65 -3.72 0.00 0.00 177.10 174.63 3dby h PRO 259 N 8.27 0.00 0.00 0.43 0.11 -1.90 -3.16 132.00 135.76 3dby h PRO 259 Ca -0.26 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.61 3dby h PRO 259 Cb 1.10 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 3dby h PRO 259 CO 0.62 0.00 -1.69 1.28 -0.21 0.00 0.00 178.00 178.00 3dby n LEU 260 N -2.94 0.74 -3.63 2.35 4.77 -1.26 -4.73 117.00 112.29 3dby n LEU 260 Ca -0.02 0.34 -0.11 0.00 -0.03 0.00 0.00 56.01 56.19 3dby n LEU 260 Cb 0.09 0.17 -0.07 0.00 -2.33 0.00 0.00 43.42 41.28 3dby n LEU 260 CO 0.19 0.30 0.40 -0.70 -1.33 0.00 0.00 177.39 176.24 3dby s GLU 261 N -2.74 0.77 0.88 3.23 2.12 -1.19 -4.95 118.70 116.82 3dby s GLU 261 Ca -0.05 1.09 -0.11 0.00 0.36 0.00 0.00 54.97 56.27 3dby s GLU 261 Cb 0.08 0.28 0.18 0.00 0.26 0.00 0.00 34.13 34.93 3dby s GLU 261 CO 0.82 -0.12 1.21 0.20 -0.54 0.00 0.00 175.26 176.83 3dby s GLY 262 N 0.95 1.77 0.46 -1.50 0.00 -1.26 -4.59 107.32 103.15 3dby s GLY 262 Ca -0.04 -1.40 0.26 0.00 0.00 0.00 0.00 44.72 43.53 3dby s GLY 262 CO -0.09 -0.70 1.73 1.12 0.00 0.00 0.00 173.10 175.16 3dby h HIS 263 N -1.26 0.00 0.00 1.90 2.07 -1.98 -3.37 115.15 112.51 3dby h HIS 263 Ca -0.41 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.09 3dby h HIS 263 Cb 1.24 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.22 3dby h HIS 263 CO -0.83 0.06 -1.06 1.58 -3.07 0.00 0.00 177.93 174.61 3dby n HIS 264 N -3.13 0.00 -2.75 6.12 -0.00 -1.26 -4.90 115.22 109.30 3dby n HIS 264 Ca 0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.31 3dby n HIS 264 Cb 0.47 -0.04 0.00 0.00 -0.00 0.00 0.00 29.99 30.42 3dby n HIS 264 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 3dby n HIS 265 N -2.07 4.81 -3.66 1.57 8.25 -1.26 -4.86 115.22 117.99 3dby n HIS 265 Ca -0.01 -3.09 -0.04 0.00 -0.26 0.00 0.00 57.72 54.32 3dby n HIS 265 Cb 0.53 -2.42 -0.01 0.00 1.12 0.00 0.00 29.99 29.20 3dby n HIS 265 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 3dby s HIS 266 N 2.94 -0.17 -0.24 4.41 -0.00 -1.26 -4.56 115.29 116.40 3dby s HIS 266 Ca 0.49 -0.04 0.12 0.00 -0.00 0.00 0.00 55.06 55.62 3dby s HIS 266 Cb 0.01 0.59 0.45 0.00 -0.00 0.00 0.00 32.58 33.63 3dby s HIS 266 CO 0.04 -0.62 1.19 0.72 -0.00 0.00 0.00 174.74 176.07 3dby n HIS 267 N -0.39 1.61 0.42 0.38 8.25 -1.26 -5.18 115.22 119.05 3dby n HIS 267 Ca -0.07 -1.89 0.05 0.00 -0.26 0.00 0.00 57.72 55.55 3dby n HIS 267 Cb 0.61 -0.29 0.04 0.00 1.12 0.00 0.00 29.99 31.48 3dby n HIS 267 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59