#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2opf n GLU 2 N 0.00 0.95 -0.30 0.54 1.02 -1.26 -4.83 120.64 116.75 2opf n GLU 2 Ca 0.00 -1.13 0.04 0.00 -0.02 0.00 0.00 57.16 56.06 2opf n GLU 2 Cb 0.00 -0.03 0.12 0.00 -0.02 0.00 0.00 31.44 31.51 2opf n GLU 2 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2opf h GLY 3 N 0.08 0.67 1.01 0.62 0.00 -1.22 -1.77 103.07 102.45 2opf h GLY 3 Ca -0.10 0.26 0.01 0.00 0.00 0.00 0.00 47.33 47.50 2opf h GLY 3 CO 0.15 -0.33 0.36 -2.55 0.00 0.00 0.00 176.54 174.17 2opf h PRO 4 N 0.01 0.72 -0.55 4.80 0.11 -1.85 -1.68 132.00 133.55 2opf h PRO 4 Ca 0.42 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.39 2opf h PRO 4 Cb 0.67 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 2opf h PRO 4 CO -0.87 0.47 -0.04 0.93 -0.21 0.00 0.00 178.00 178.29 2opf h GLU 5 N 0.74 1.00 -0.63 1.05 3.07 -1.76 -1.68 114.58 116.37 2opf h GLU 5 Ca 0.20 -0.34 -0.07 0.00 -0.50 0.00 0.00 59.36 58.65 2opf h GLU 5 Cb -0.08 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 27.72 2opf h GLU 5 CO -0.04 1.01 0.09 0.82 -1.40 0.00 0.00 179.01 179.49 2opf h ILE 6 N 0.87 1.26 -0.18 3.13 1.08 -1.17 -0.17 117.51 122.33 2opf h ILE 6 Ca 0.15 -1.01 -0.14 0.00 -0.39 0.00 0.00 64.86 63.47 2opf h ILE 6 Cb 0.59 0.67 -0.01 0.00 -3.07 0.00 0.00 36.82 35.00 2opf h ILE 6 CO 0.04 0.38 -0.50 -0.09 -0.69 0.00 0.00 178.15 177.29 2opf h ARG 7 N 0.96 0.48 -0.66 2.37 9.65 -1.19 -0.22 114.38 125.77 2opf h ARG 7 Ca 0.19 -0.28 -0.06 0.00 -1.10 0.00 0.00 59.98 58.74 2opf h ARG 7 Cb 0.42 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.00 2opf h ARG 7 CO 0.01 0.87 0.20 0.00 2.80 0.00 0.00 179.97 183.85 2opf h ARG 8 N 0.38 1.04 0.13 0.20 3.08 -0.98 -0.35 114.38 117.88 2opf h ARG 8 Ca 0.02 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 2opf h ARG 8 Cb 1.01 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.91 2opf h ARG 8 CO 0.09 0.91 -0.06 0.00 -1.07 0.00 0.00 179.97 179.84 2opf h ALA 9 N 1.08 -0.18 -0.86 0.04 0.00 -0.69 -2.35 119.26 116.30 2opf h ALA 9 Ca 0.21 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.15 2opf h ALA 9 Cb 0.32 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 2opf h ALA 9 CO -0.00 -0.55 0.49 0.00 0.00 0.00 0.00 179.25 179.19 2opf h ALA 10 N 0.58 1.25 -0.77 0.00 0.00 -0.83 -0.12 119.26 119.37 2opf h ALA 10 Ca -0.02 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2opf h ALA 10 Cb 0.22 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2opf h ALA 10 CO 0.03 0.09 0.40 -0.44 0.00 0.00 0.00 179.25 179.33 2opf h ASP 11 N 0.80 0.98 -0.55 0.00 3.32 -0.87 -0.93 116.42 119.18 2opf h ASP 11 Ca 0.42 -0.11 -0.09 0.00 0.02 0.00 0.00 57.03 57.27 2opf h ASP 11 Cb 0.43 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 2opf h ASP 11 CO -0.27 0.82 0.02 0.78 -1.72 0.00 0.00 179.24 178.86 2opf h ASN 12 N 1.07 0.96 -0.34 6.45 2.35 -0.67 -1.27 115.58 124.14 2opf h ASN 12 Ca 0.27 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 2opf h ASN 12 Cb 0.07 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 2opf h ASN 12 CO -0.04 1.01 0.15 -0.07 -1.65 0.00 0.00 177.43 176.83 2opf h LEU 13 N 0.91 0.45 -0.54 1.61 3.38 -0.63 -1.49 115.31 118.99 2opf h LEU 13 Ca 0.17 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2opf h LEU 13 Cb 0.51 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 2opf h LEU 13 CO 0.02 0.47 0.28 -0.33 0.09 0.00 0.00 178.44 178.98 2opf h GLU 14 N 0.40 0.77 0.00 1.13 5.08 -0.99 -0.83 114.58 120.14 2opf h GLU 14 Ca 0.11 -0.10 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 2opf h GLU 14 Cb 0.15 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2opf h GLU 14 CO -0.01 0.61 -0.12 0.00 -1.00 0.00 0.00 179.01 178.49 2opf h ALA 15 N 1.12 1.71 0.00 3.43 0.00 -1.04 -0.30 119.26 124.18 2opf h ALA 15 Ca 0.19 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2opf h ALA 15 Cb 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2opf h ALA 15 CO -0.03 0.15 -0.00 0.00 0.00 0.00 0.00 179.25 179.37 2opf h ALA 16 N 1.88 -0.01 0.00 0.00 0.00 -0.52 -3.43 119.26 117.18 2opf h ALA 16 Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2opf h ALA 16 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2opf h ALA 16 CO 0.02 -0.03 0.00 0.44 0.00 0.00 0.00 179.25 179.68 2opf n ILE 17 N -4.65 0.15 -1.67 0.00 -5.35 -0.39 -4.67 119.36 102.79 2opf n ILE 17 Ca -0.09 -0.40 -0.47 0.00 -0.27 0.00 0.00 62.75 61.52 2opf n ILE 17 Cb 0.42 1.20 -0.04 0.00 -1.74 0.00 0.00 39.64 39.47 2opf n ILE 17 CO 0.00 0.00 0.00 1.17 -1.76 0.00 0.00 176.55 175.96 2opf n LYS 18 N -0.07 2.07 -0.29 6.28 4.81 -0.13 -1.70 118.16 129.12 2opf n LYS 18 Ca 0.00 0.75 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 2opf n LYS 18 Cb 0.15 -2.52 0.00 0.00 0.02 0.00 0.00 35.03 32.67 2opf n LYS 18 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2opf n GLY 19 N 3.55 2.27 3.78 3.14 0.00 0.11 -4.98 105.19 113.05 2opf n GLY 19 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2opf n GLY 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2opf s LYS 20 N -0.02 4.18 0.27 1.61 1.02 -0.69 -4.93 119.74 121.18 2opf s LYS 20 Ca 0.00 0.52 -0.30 0.00 0.02 0.00 0.00 55.97 56.20 2opf s LYS 20 Cb 0.00 -3.32 -0.11 0.00 -0.52 0.00 0.00 37.83 33.88 2opf s LYS 20 CO 0.00 0.44 1.58 -2.14 -0.92 0.00 0.00 175.35 174.31 2opf s PRO 21 N -0.31 4.15 -0.03 -1.68 0.02 -1.26 -4.39 135.00 131.50 2opf s PRO 21 Ca 0.26 2.52 -0.30 0.00 0.02 0.00 0.00 61.00 63.51 2opf s PRO 21 Cb -0.17 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.27 2opf s PRO 21 CO 0.14 -0.61 1.17 -0.51 -0.33 0.00 0.00 177.00 176.85 2opf s LEU 22 N -0.17 4.31 0.06 -5.54 1.43 0.40 -4.31 118.68 114.85 2opf s LEU 22 Ca 0.64 1.83 0.22 0.00 -1.03 0.00 0.00 54.13 55.80 2opf s LEU 22 Cb -0.47 -3.56 -0.12 0.00 0.03 0.00 0.00 46.19 42.07 2opf s LEU 22 CO 0.44 -0.52 0.83 0.35 0.23 0.00 0.00 176.35 177.68 2opf n THR 23 N 4.39 0.23 -3.56 5.49 -2.24 0.14 -0.89 114.28 117.84 2opf n THR 23 Ca 0.10 -0.41 -0.16 0.00 -2.27 0.00 0.00 64.05 61.31 2opf n THR 23 Cb 0.47 0.01 -0.06 0.00 -2.10 0.00 0.00 70.33 68.65 2opf n THR 23 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2opf s ASP 24 N -4.50 -0.65 -0.02 3.42 2.15 -1.10 -4.94 116.67 111.03 2opf s ASP 24 Ca -0.01 0.89 0.01 0.00 0.43 0.00 0.00 52.55 53.86 2opf s ASP 24 Cb 0.13 0.77 0.02 0.00 -0.30 0.00 0.00 42.92 43.54 2opf s ASP 24 CO 0.84 -0.47 -0.01 -0.69 -0.17 0.00 0.00 175.17 174.67 2opf s VAL 25 N -0.71 0.20 -0.04 1.11 1.01 -1.26 -1.07 120.40 119.64 2opf s VAL 25 Ca -0.07 0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.91 2opf s VAL 25 Cb -0.02 -0.26 0.02 0.00 0.00 0.00 0.00 36.38 36.12 2opf s VAL 25 CO 0.06 0.13 0.10 0.86 0.00 0.00 0.00 175.10 176.25 2opf s TRP 26 N 0.72 -0.11 -0.02 5.22 -0.00 -0.18 -4.75 118.94 119.82 2opf s TRP 26 Ca -0.07 0.30 0.04 0.00 -0.00 0.00 0.00 56.10 56.36 2opf s TRP 26 Cb -0.10 -0.02 -0.01 0.00 -0.00 0.00 0.00 33.47 33.34 2opf s TRP 26 CO -0.01 -0.08 -0.13 -0.06 -0.00 0.00 0.00 176.95 176.66 2opf s PHE 27 N 0.41 1.27 0.14 5.86 0.08 -1.26 -0.43 117.98 124.06 2opf s PHE 27 Ca -0.03 -0.29 -0.03 0.00 0.12 0.00 0.00 56.93 56.70 2opf s PHE 27 Cb -0.04 -0.85 -0.05 0.00 -0.57 0.00 0.00 43.02 41.51 2opf s PHE 27 CO -0.02 -0.07 1.34 0.00 -0.10 0.00 0.00 175.22 176.38 2opf h ALA 28 N 6.04 0.44 -2.45 5.36 0.00 -1.58 -3.44 119.26 123.63 2opf h ALA 28 Ca -0.34 -0.69 -0.54 0.00 0.00 0.00 0.00 54.91 53.35 2opf h ALA 28 Cb 1.17 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.93 2opf h ALA 28 CO 0.49 0.82 0.75 -0.06 0.00 0.00 0.00 179.25 181.24 2opf s PHE 29 N -3.34 3.09 0.33 0.00 0.08 -1.26 -4.92 117.98 111.96 2opf s PHE 29 Ca -0.05 0.95 0.07 0.00 0.12 0.00 0.00 56.93 58.01 2opf s PHE 29 Cb 0.09 -3.63 0.75 0.00 -0.57 0.00 0.00 43.02 39.66 2opf s PHE 29 CO 0.85 -2.23 1.84 -1.35 -0.10 0.00 0.00 175.22 174.23 2opf h PRO 30 N 7.29 0.75 0.00 0.24 0.11 -2.02 0.28 132.00 138.66 2opf h PRO 30 Ca -0.40 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2opf h PRO 30 Cb 1.20 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2opf h PRO 30 CO 0.87 0.50 0.00 1.96 -0.21 0.00 0.00 178.00 181.12 2opf h GLN 31 N 0.78 0.00 0.00 1.05 7.50 -1.98 -2.75 115.11 119.71 2opf h GLN 31 Ca 0.49 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.64 2opf h GLN 31 Cb 0.72 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.25 2opf h GLN 31 CO -0.25 0.00 -0.91 1.28 -1.50 0.00 0.00 178.83 177.45 2opf n LEU 32 N -2.60 0.87 -0.23 1.46 4.77 0.06 -4.52 117.00 116.81 2opf n LEU 32 Ca 0.00 -0.49 0.13 0.00 -0.03 0.00 0.00 56.01 55.63 2opf n LEU 32 Cb 0.20 0.00 0.43 0.00 -2.33 0.00 0.00 43.42 41.72 2opf n LEU 32 CO 0.20 0.22 1.22 0.11 -1.33 0.00 0.00 177.39 177.81 2opf h LYS 33 N 0.00 0.56 0.00 3.23 1.79 -1.16 -1.44 116.57 119.56 2opf h LYS 33 Ca 0.00 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2opf h LYS 33 Cb 0.45 -0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 30.98 2opf h LYS 33 CO 0.00 0.37 -0.01 0.00 -1.08 0.00 0.00 179.45 178.73 2opf h THR 34 N 0.58 0.15 -0.00 -0.16 1.03 -1.79 -2.01 112.91 110.70 2opf h THR 34 Ca 0.42 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.75 2opf h THR 34 Cb 0.78 1.06 0.00 0.00 -1.07 0.00 0.00 68.15 68.92 2opf h THR 34 CO -0.17 0.01 -0.20 -1.22 -0.01 0.00 0.00 175.52 173.92 2opf n TYR 35 N -3.28 0.00 0.27 0.00 4.01 -0.54 -4.16 117.16 113.46 2opf n TYR 35 Ca -0.03 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.56 2opf n TYR 35 Cb 0.10 -0.22 -0.08 0.00 -0.31 0.00 0.00 39.34 38.83 2opf n TYR 35 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2opf h GLN 36 N 0.55 -0.64 -0.35 -0.72 4.20 -1.49 -1.93 115.11 114.73 2opf h GLN 36 Ca 0.00 0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 2opf h GLN 36 Cb 0.43 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.34 2opf h GLN 36 CO 0.00 -0.38 -0.08 0.77 -0.67 0.00 0.00 178.83 178.48 2opf h SER 37 N -0.77 0.57 0.36 1.46 0.02 -1.78 -2.84 113.55 110.56 2opf h SER 37 Ca -0.07 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 60.71 2opf h SER 37 Cb 0.56 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.94 2opf h SER 37 CO 0.11 0.69 -0.15 -0.61 -1.14 0.00 0.00 176.83 175.73 2opf h GLN 38 N 0.55 0.00 0.00 3.45 4.15 -1.69 -3.18 115.11 118.39 2opf h GLN 38 Ca 0.10 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.52 2opf h GLN 38 Cb 0.47 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.16 2opf h GLN 38 CO 0.02 0.15 -1.61 1.28 -1.93 0.00 0.00 178.83 176.75 2opf n LEU 39 N -3.77 0.39 -4.71 -2.39 4.77 -0.74 -4.80 117.00 105.75 2opf n LEU 39 Ca -0.02 -0.19 -0.42 0.00 -0.03 0.00 0.00 56.01 55.35 2opf n LEU 39 Cb 0.26 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 2opf n LEU 39 CO 0.32 0.10 1.26 -0.63 -1.33 0.00 0.00 177.39 177.10 2opf s ILE 40 N -3.32 2.68 0.00 -0.08 1.01 -1.11 -1.15 121.20 119.22 2opf s ILE 40 Ca -0.02 0.43 0.00 0.00 0.00 0.00 0.00 60.65 61.06 2opf s ILE 40 Cb 0.15 -3.27 0.00 0.00 0.01 0.00 0.00 42.46 39.34 2opf s ILE 40 CO 0.89 0.03 0.00 0.61 0.00 0.00 0.00 174.94 176.47 2opf n GLY 41 N 3.82 3.46 3.46 6.18 0.00 -0.07 -4.97 105.19 117.08 2opf n GLY 41 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2opf n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2opf n GLN 42 N -1.98 -0.50 -3.88 1.61 1.13 -0.30 -4.55 117.38 108.90 2opf n GLN 42 Ca 0.00 -2.19 -0.09 0.00 -1.94 0.00 0.00 57.00 52.78 2opf n GLN 42 Cb 0.00 -0.85 -0.08 0.00 0.11 0.00 0.00 30.24 29.42 2opf n GLN 42 CO 0.00 0.00 0.00 -3.38 -1.44 0.00 0.00 177.06 172.24 2opf s HIS 43 N -3.09 0.15 0.02 1.08 -3.43 -1.26 -0.46 115.29 108.30 2opf s HIS 43 Ca 0.63 -0.48 -0.30 0.00 -0.80 0.00 0.00 55.06 54.10 2opf s HIS 43 Cb -0.03 -0.09 -0.04 0.00 -1.43 0.00 0.00 32.58 30.99 2opf s HIS 43 CO 0.43 -0.45 1.14 0.08 -2.00 0.00 0.00 174.74 173.94 2opf s VAL 44 N -3.07 4.30 -0.08 -5.38 1.01 -1.26 -0.60 120.40 115.31 2opf s VAL 44 Ca -0.01 1.64 -0.07 0.00 0.00 0.00 0.00 61.98 63.54 2opf s VAL 44 Cb 0.01 -4.05 -0.28 0.00 0.00 0.00 0.00 36.38 32.06 2opf s VAL 44 CO -0.07 0.10 0.51 0.71 0.00 0.00 0.00 175.10 176.35 2opf h THR 45 N 4.69 0.77 -1.82 3.92 1.35 -1.14 0.35 112.91 121.03 2opf h THR 45 Ca -0.40 -2.44 0.15 0.00 -0.55 0.00 0.00 66.41 63.17 2opf h THR 45 Cb 1.20 2.61 -0.19 0.00 -1.73 0.00 0.00 68.15 70.05 2opf h THR 45 CO 0.81 0.87 0.62 -1.38 -0.25 0.00 0.00 175.52 176.19 2opf s HIS 46 N -2.57 -0.28 -0.35 4.73 -3.43 -1.24 -4.71 115.29 107.44 2opf s HIS 46 Ca -0.19 0.27 -0.04 0.00 -0.80 0.00 0.00 55.06 54.30 2opf s HIS 46 Cb 0.06 0.51 0.06 0.00 -1.43 0.00 0.00 32.58 31.78 2opf s HIS 46 CO 0.81 -0.37 0.10 0.08 -2.00 0.00 0.00 174.74 173.35 2opf s VAL 47 N -2.33 3.38 0.13 -5.38 1.01 -1.26 -1.50 120.40 114.45 2opf s VAL 47 Ca 0.05 -1.49 -0.06 0.00 0.00 0.00 0.00 61.98 60.47 2opf s VAL 47 Cb -0.01 -3.04 -0.06 0.00 0.00 0.00 0.00 36.38 33.27 2opf s VAL 47 CO -0.05 -0.31 0.39 -0.70 0.00 0.00 0.00 175.10 174.43 2opf s GLU 48 N 1.28 3.66 0.06 2.72 2.12 0.68 -4.91 118.70 124.31 2opf s GLU 48 Ca -0.00 -0.00 0.06 0.00 0.36 0.00 0.00 54.97 55.38 2opf s GLU 48 Cb -0.21 -2.88 -0.03 0.00 0.26 0.00 0.00 34.13 31.28 2opf s GLU 48 CO -0.01 0.49 -0.16 0.95 -0.54 0.00 0.00 175.26 175.99 2opf s THR 49 N -1.59 1.24 -0.35 -1.70 -4.23 -1.26 0.10 115.64 107.84 2opf s THR 49 Ca 0.39 -1.19 -0.00 0.00 -1.18 0.00 0.00 61.69 59.71 2opf s THR 49 Cb -0.12 -1.14 0.14 0.00 1.34 0.00 0.00 72.50 72.71 2opf s THR 49 CO 0.22 -0.06 0.21 -0.13 -0.54 0.00 0.00 174.62 174.32 2opf s ARG 50 N -1.44 0.58 7.07 3.99 0.52 -0.28 -4.99 118.95 124.39 2opf s ARG 50 Ca 0.02 -1.32 0.00 0.00 -0.52 0.00 0.00 55.73 53.91 2opf s ARG 50 Cb -0.09 -1.38 0.00 0.00 0.52 0.00 0.00 34.95 34.00 2opf s ARG 50 CO 0.02 -1.19 0.00 0.41 0.02 0.00 0.00 175.30 174.56 2opf n GLY 51 N 4.10 1.97 0.55 -3.53 0.00 -1.26 -1.98 105.19 105.04 2opf n GLY 51 Ca 0.10 -0.40 0.13 0.00 0.00 0.00 0.00 46.02 45.85 2opf n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2opf n LYS 52 N 12.85 1.74 -3.10 1.61 5.02 -1.26 -4.61 118.16 130.40 2opf n LYS 52 Ca 0.00 -1.10 -0.39 0.00 -2.02 0.00 0.00 58.31 54.80 2opf n LYS 52 Cb 0.00 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 33.50 2opf n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2opf s ALA 53 N -1.91 3.45 -0.09 7.82 0.00 -0.84 -4.39 121.76 125.80 2opf s ALA 53 Ca 0.36 0.17 0.03 0.00 0.00 0.00 0.00 51.96 52.51 2opf s ALA 53 Cb 0.20 -2.85 -0.01 0.00 0.00 0.00 0.00 23.12 20.46 2opf s ALA 53 CO 0.31 0.18 -0.19 -1.17 0.00 0.00 0.00 175.76 174.89 2opf s LEU 54 N -0.41 2.39 -0.23 0.00 0.20 -0.26 -1.13 118.68 119.24 2opf s LEU 54 Ca 0.34 -0.42 0.02 0.00 0.69 0.00 0.00 54.13 54.76 2opf s LEU 54 Cb -0.20 -1.49 0.05 0.00 -0.43 0.00 0.00 46.19 44.12 2opf s LEU 54 CO 0.21 0.21 -0.13 -0.76 -0.29 0.00 0.00 176.35 175.59 2opf s LEU 55 N 0.09 2.92 -0.49 -0.68 1.02 0.28 -1.40 118.68 120.42 2opf s LEU 55 Ca -0.09 -1.14 -0.17 0.00 0.02 0.00 0.00 54.13 52.75 2opf s LEU 55 Cb -0.15 -1.47 0.07 0.00 0.02 0.00 0.00 46.19 44.66 2opf s LEU 55 CO 0.06 -0.14 0.52 -0.89 0.02 0.00 0.00 176.35 175.91 2opf s THR 56 N 1.20 5.05 0.08 5.49 2.01 -0.25 -0.23 115.64 129.00 2opf s THR 56 Ca -0.04 -0.80 -0.24 0.00 0.31 0.00 0.00 61.69 60.91 2opf s THR 56 Cb -0.18 -4.22 -0.06 0.00 0.01 0.00 0.00 72.50 68.04 2opf s THR 56 CO -0.07 -0.71 0.74 -1.00 -0.69 0.00 0.00 174.62 172.88 2opf s HIS 57 N 2.14 3.79 0.26 4.92 3.76 -0.56 -1.14 115.29 128.46 2opf s HIS 57 Ca 0.09 1.48 0.08 0.00 -0.15 0.00 0.00 55.06 56.57 2opf s HIS 57 Cb -0.22 -2.76 -0.04 0.00 1.11 0.00 0.00 32.58 30.67 2opf s HIS 57 CO 0.09 0.38 0.08 -0.06 -0.85 0.00 0.00 174.74 174.39 2opf s PHE 58 N -0.50 2.88 -1.38 1.40 0.08 -0.45 -0.59 117.98 119.42 2opf s PHE 58 Ca 0.36 -0.17 0.09 0.00 0.12 0.00 0.00 56.93 57.33 2opf s PHE 58 Cb -0.21 -1.29 0.42 0.00 -0.57 0.00 0.00 43.02 41.38 2opf s PHE 58 CO 0.23 0.58 1.16 -1.13 -0.10 0.00 0.00 175.22 175.96 2opf n SER 59 N -1.00 0.00 -1.12 1.36 3.41 0.23 -2.17 113.62 114.32 2opf n SER 59 Ca -0.07 0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.74 2opf n SER 59 Cb 0.58 -0.31 0.23 0.00 -0.26 0.00 0.00 64.21 64.45 2opf n SER 59 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2opf n ASN 60 N -1.31 3.19 0.00 4.04 6.94 -1.26 -4.96 115.26 121.90 2opf n ASN 60 Ca 0.04 -3.43 0.00 0.00 -0.02 0.00 0.00 54.58 51.17 2opf n ASN 60 Cb 0.07 -0.61 0.00 0.00 -2.36 0.00 0.00 39.78 36.88 2opf n ASN 60 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 2opf n ASP 61 N -0.85 -2.55 -4.88 0.53 8.00 -0.92 -5.01 116.55 110.86 2opf n ASP 61 Ca 0.30 0.00 -0.30 0.00 0.71 0.00 0.00 54.79 55.50 2opf n ASP 61 Cb 1.02 -1.64 -0.02 0.00 -0.02 0.00 0.00 41.12 40.46 2opf n ASP 61 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2opf s LEU 62 N 0.00 3.78 -0.03 0.64 1.43 -1.26 -4.21 118.68 119.03 2opf s LEU 62 Ca 0.00 1.08 -0.01 0.00 -1.03 0.00 0.00 54.13 54.18 2opf s LEU 62 Cb 0.00 -3.98 0.03 0.00 0.03 0.00 0.00 46.19 42.27 2opf s LEU 62 CO 0.00 -0.44 0.03 -0.89 0.23 0.00 0.00 176.35 175.28 2opf s THR 63 N -2.46 -0.01 -0.28 5.49 2.01 -0.52 -1.34 115.64 118.52 2opf s THR 63 Ca 0.50 0.27 -0.20 0.00 0.31 0.00 0.00 61.69 62.57 2opf s THR 63 Cb -0.10 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.23 2opf s THR 63 CO 0.35 0.14 0.62 -0.22 -0.69 0.00 0.00 174.62 174.82 2opf s LEU 64 N 1.53 4.11 -0.20 4.42 2.96 -0.29 0.10 118.68 131.31 2opf s LEU 64 Ca -0.03 0.54 -0.12 0.00 -0.22 0.00 0.00 54.13 54.30 2opf s LEU 64 Cb -0.13 -2.82 -0.05 0.00 0.50 0.00 0.00 46.19 43.69 2opf s LEU 64 CO -0.03 -0.43 0.23 -0.47 -1.32 0.00 0.00 176.35 174.33 2opf s TYR 65 N 2.56 3.40 0.00 5.38 6.14 0.89 -1.09 117.35 134.64 2opf s TYR 65 Ca 0.25 0.44 0.00 0.00 0.64 0.00 0.00 57.07 58.40 2opf s TYR 65 Cb -0.15 -2.30 -0.00 0.00 0.42 0.00 0.00 41.96 39.93 2opf s TYR 65 CO 0.10 0.18 -0.00 -1.54 0.64 0.00 0.00 175.55 174.93 2opf s SER 66 N 0.64 0.04 -0.09 4.32 1.04 -0.49 -0.89 113.70 118.28 2opf s SER 66 Ca 0.12 -0.07 -0.01 0.00 0.48 0.00 0.00 55.95 56.48 2opf s SER 66 Cb -0.13 0.01 0.03 0.00 0.10 0.00 0.00 66.02 66.03 2opf s SER 66 CO 0.03 -0.04 -0.03 -2.28 0.98 0.00 0.00 173.24 171.89 2opf s HIS 67 N -0.20 1.02 -0.66 5.02 5.04 -0.59 -1.10 115.29 123.82 2opf s HIS 67 Ca -0.02 -0.41 0.25 0.00 -1.54 0.00 0.00 55.06 53.34 2opf s HIS 67 Cb -0.01 -0.98 0.89 0.00 0.04 0.00 0.00 32.58 32.52 2opf s HIS 67 CO -0.00 -0.40 1.75 0.09 -2.34 0.00 0.00 174.74 173.84 2opf n ASN 68 N 5.00 0.69 0.00 9.88 5.03 -1.26 -4.08 115.26 130.52 2opf n ASN 68 Ca -0.10 0.60 0.00 0.00 0.87 0.00 0.00 54.58 55.95 2opf n ASN 68 Cb 0.50 -0.77 0.00 0.00 -1.02 0.00 0.00 39.78 38.49 2opf n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2opf n GLN 69 N -2.19 0.00 0.00 3.52 6.02 -1.26 -0.90 117.38 122.57 2opf n GLN 69 Ca 0.04 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.14 2opf n GLN 69 Cb 0.34 0.00 0.03 0.00 1.02 0.00 0.00 30.24 31.63 2opf n GLN 69 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2opf n LEU 70 N 0.00 1.31 0.00 1.08 4.77 -1.26 -4.61 117.00 118.30 2opf n LEU 70 Ca 0.00 -0.50 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2opf n LEU 70 Cb 0.00 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 2opf n LEU 70 CO 0.00 0.27 -0.03 0.00 -1.33 0.00 0.00 177.39 176.30 2opf n TYR 71 N -0.86 0.00 -2.16 -1.77 0.18 -0.48 -4.87 117.16 107.20 2opf n TYR 71 Ca 0.07 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.51 2opf n TYR 71 Cb 0.38 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.35 2opf n TYR 71 CO 0.00 0.00 0.00 0.20 -2.08 0.00 0.00 176.86 174.98 2opf s GLY 72 N -0.31 2.44 -0.20 -7.48 0.00 -0.08 -4.64 107.32 97.06 2opf s GLY 72 Ca 0.00 0.68 -0.16 0.00 0.00 0.00 0.00 44.72 45.24 2opf s GLY 72 CO 0.00 1.02 0.52 0.14 0.00 0.00 0.00 173.10 174.78 2opf s VAL 73 N -2.01 -0.01 0.19 1.40 1.01 -0.71 -4.84 120.40 115.43 2opf s VAL 73 Ca 0.70 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.69 2opf s VAL 73 Cb -0.21 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2opf s VAL 73 CO 0.30 0.01 0.38 0.26 0.00 0.00 0.00 175.10 176.05 2opf s TRP 74 N 0.74 3.48 -0.04 5.22 0.52 -1.26 -0.85 118.94 126.75 2opf s TRP 74 Ca -0.04 0.36 -0.02 0.00 0.02 0.00 0.00 56.10 56.42 2opf s TRP 74 Cb -0.05 -1.86 0.03 0.00 -1.15 0.00 0.00 33.47 30.43 2opf s TRP 74 CO -0.05 0.40 0.10 0.50 0.02 0.00 0.00 176.95 177.91 2opf s ARG 75 N -3.21 0.07 -0.23 4.98 3.52 0.58 -4.97 118.95 119.69 2opf s ARG 75 Ca 0.39 0.24 -0.08 0.00 -0.13 0.00 0.00 55.73 56.15 2opf s ARG 75 Cb -0.11 -0.11 -0.04 0.00 -1.56 0.00 0.00 34.95 33.13 2opf s ARG 75 CO 0.28 -0.11 0.09 0.08 -0.81 0.00 0.00 175.30 174.84 2opf s VAL 76 N 0.73 4.68 0.22 7.11 1.01 -1.26 -0.58 120.40 132.32 2opf s VAL 76 Ca -0.06 -0.05 0.01 0.00 0.00 0.00 0.00 61.98 61.88 2opf s VAL 76 Cb -0.08 -3.17 -0.05 0.00 0.00 0.00 0.00 36.38 33.08 2opf s VAL 76 CO -0.03 0.36 0.06 0.68 0.00 0.00 0.00 175.10 176.17 2opf s VAL 77 N 1.21 0.61 0.23 2.92 -7.23 -0.39 -5.01 120.40 112.74 2opf s VAL 77 Ca 0.05 -1.99 -0.30 0.00 -1.81 0.00 0.00 61.98 57.93 2opf s VAL 77 Cb -0.14 -2.42 -0.09 0.00 0.56 0.00 0.00 36.38 34.29 2opf s VAL 77 CO 0.04 -0.20 0.97 -1.81 -0.31 0.00 0.00 175.10 173.80 2opf s ASP 78 N -3.26 7.56 0.14 4.85 1.01 -1.26 -1.03 116.67 124.68 2opf s ASP 78 Ca 0.32 1.98 -0.34 0.00 0.71 0.00 0.00 52.55 55.22 2opf s ASP 78 Cb 0.07 -2.61 -0.15 0.00 1.01 0.00 0.00 42.92 41.24 2opf s ASP 78 CO 0.10 0.07 1.35 0.41 0.21 0.00 0.00 175.17 177.30 2opf n THR 79 N 1.67 0.36 0.00 -1.27 -1.04 0.13 -1.77 114.28 112.35 2opf n THR 79 Ca -0.01 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 2opf n THR 79 Cb 0.47 -1.04 0.00 0.00 -1.82 0.00 0.00 70.33 67.94 2opf n THR 79 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2opf n GLY 80 N 2.51 2.87 3.75 3.41 0.00 -1.26 -5.01 105.19 111.45 2opf n GLY 80 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 2opf n GLY 80 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2opf s GLU 81 N -0.11 4.74 -0.23 1.61 0.41 -0.73 -5.05 118.70 119.35 2opf s GLU 81 Ca 0.00 1.58 0.02 0.00 -0.41 0.00 0.00 54.97 56.16 2opf s GLU 81 Cb 0.00 -3.28 0.04 0.00 -1.78 0.00 0.00 34.13 29.11 2opf s GLU 81 CO 0.00 0.33 -0.14 -2.00 -0.49 0.00 0.00 175.26 172.96 2opf s GLU 82 N -0.87 2.60 0.50 1.61 2.12 -1.26 -4.84 118.70 118.56 2opf s GLU 82 Ca 0.44 -1.11 -0.22 0.00 0.36 0.00 0.00 54.97 54.45 2opf s GLU 82 Cb -0.27 -2.76 -0.08 0.00 0.26 0.00 0.00 34.13 31.28 2opf s GLU 82 CO 0.34 -0.41 1.08 -0.35 -0.54 0.00 0.00 175.26 175.38 2opf n PRO 83 N 4.53 1.33 -2.77 4.30 -0.05 -1.26 -4.92 135.00 136.16 2opf n PRO 83 Ca -0.17 0.49 -0.42 0.00 -0.05 0.00 0.00 63.50 63.34 2opf n PRO 83 Cb 0.46 -2.21 -0.03 0.00 -0.05 0.00 0.00 33.50 31.66 2opf n PRO 83 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 175.50 174.31 2opf s GLN 84 N -2.42 3.20 0.07 0.54 0.74 -1.26 -4.96 119.66 115.56 2opf s GLN 84 Ca 0.68 -0.80 -0.23 0.00 0.05 0.00 0.00 55.36 55.07 2opf s GLN 84 Cb -0.48 -4.35 0.06 0.00 1.10 0.00 0.00 33.01 29.34 2opf s GLN 84 CO 0.53 -1.92 0.54 -0.08 -0.55 0.00 0.00 175.29 173.81 2opf s THR 85 N 4.39 0.02 -2.60 -0.34 -1.32 -1.26 -5.02 115.64 109.51 2opf s THR 85 Ca 0.28 -0.20 0.25 0.00 -1.21 0.00 0.00 61.69 60.80 2opf s THR 85 Cb -0.13 -1.00 0.21 0.00 -1.51 0.00 0.00 72.50 70.07 2opf s THR 85 CO 0.08 -0.11 1.32 0.35 -2.21 0.00 0.00 174.62 174.05 2opf n THR 86 N 0.22 0.00 -1.88 5.08 -2.24 -1.26 -4.96 114.28 109.25 2opf n THR 86 Ca -0.18 -0.38 -0.35 0.00 -2.27 0.00 0.00 64.05 60.88 2opf n THR 86 Cb 0.61 1.20 0.04 0.00 -2.10 0.00 0.00 70.33 70.09 2opf n THR 86 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2opf s ARG 87 N -2.15 2.82 -0.16 -0.78 0.52 -1.26 -4.98 118.95 112.96 2opf s ARG 87 Ca 0.27 1.71 -0.25 0.00 -0.52 0.00 0.00 55.73 56.94 2opf s ARG 87 Cb 0.20 -1.92 -0.02 0.00 0.52 0.00 0.00 34.95 33.73 2opf s ARG 87 CO 0.39 -1.30 0.80 0.54 0.02 0.00 0.00 175.30 175.75 2opf s VAL 88 N -1.83 4.91 0.12 3.52 0.11 -1.26 -4.91 120.40 121.06 2opf s VAL 88 Ca 0.74 1.58 -0.30 0.00 -2.93 0.00 0.00 61.98 61.07 2opf s VAL 88 Cb -0.27 -4.11 -0.06 0.00 -1.53 0.00 0.00 36.38 30.40 2opf s VAL 88 CO 0.36 0.06 1.10 -0.22 -3.33 0.00 0.00 175.10 173.07 2opf s LEU 89 N 1.99 4.45 -0.02 2.54 2.96 -1.26 -0.09 118.68 129.24 2opf s LEU 89 Ca 0.37 1.99 0.03 0.00 -0.22 0.00 0.00 54.13 56.31 2opf s LEU 89 Cb -0.17 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2opf s LEU 89 CO 0.13 -0.28 0.03 0.54 -1.32 0.00 0.00 176.35 175.46 2opf n ARG 90 N 2.99 2.31 -3.75 1.98 5.12 0.66 -4.66 116.66 121.32 2opf n ARG 90 Ca 0.05 -0.01 -0.13 0.00 -1.93 0.00 0.00 57.85 55.83 2opf n ARG 90 Cb 0.47 -1.08 -0.11 0.00 -1.16 0.00 0.00 32.46 30.58 2opf n ARG 90 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2opf s VAL 91 N -2.13 -0.00 -0.09 1.55 1.01 -0.96 -1.64 120.40 118.14 2opf s VAL 91 Ca -0.01 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 2opf s VAL 91 Cb 0.01 -0.51 0.03 0.00 0.00 0.00 0.00 36.38 35.91 2opf s VAL 91 CO 0.13 0.00 -0.02 -0.75 0.00 0.00 0.00 175.10 174.46 2opf s LYS 92 N 0.30 0.91 -0.29 2.72 2.36 0.43 -1.37 119.74 124.79 2opf s LYS 92 Ca -0.01 -0.01 0.02 0.00 -2.55 0.00 0.00 55.97 53.42 2opf s LYS 92 Cb -0.03 -1.17 0.07 0.00 -1.05 0.00 0.00 37.83 35.65 2opf s LYS 92 CO -0.01 -0.29 -0.04 -0.51 1.55 0.00 0.00 175.35 176.05 2opf s LEU 93 N 1.89 3.93 -0.10 5.43 1.43 -0.70 -1.01 118.68 129.54 2opf s LEU 93 Ca 0.05 -1.59 -0.01 0.00 -1.03 0.00 0.00 54.13 51.55 2opf s LEU 93 Cb -0.12 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 2opf s LEU 93 CO -0.06 -0.26 -0.05 -1.58 0.23 0.00 0.00 176.35 174.62 2opf s GLN 94 N 1.08 3.08 0.48 1.70 0.74 -0.23 -1.34 119.66 125.16 2opf s GLN 94 Ca -0.03 -0.53 0.02 0.00 0.05 0.00 0.00 55.36 54.88 2opf s GLN 94 Cb -0.20 -2.71 -0.02 0.00 1.10 0.00 0.00 33.01 31.18 2opf s GLN 94 CO -0.05 0.53 0.05 0.95 -0.55 0.00 0.00 175.29 176.21 2opf s THR 95 N -0.43 0.96 0.18 -0.34 -4.23 -0.26 0.29 115.64 111.81 2opf s THR 95 Ca 0.07 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.41 2opf s THR 95 Cb -0.12 -2.23 0.14 0.00 1.34 0.00 0.00 72.50 71.63 2opf s THR 95 CO 0.02 0.00 1.64 0.00 -0.54 0.00 0.00 174.62 175.74 2opf h ALA 96 N 1.50 0.24 0.00 3.99 0.00 -1.96 -3.34 119.26 119.69 2opf h ALA 96 Ca -0.41 0.18 -0.44 0.00 0.00 0.00 0.00 54.91 54.24 2opf h ALA 96 Cb 1.30 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 19.44 2opf h ALA 96 CO 0.68 -0.49 -2.50 -3.47 0.00 0.00 0.00 179.25 173.47 2opf n ASP 97 N -5.37 1.95 -4.65 0.00 -0.08 -1.26 -4.70 116.55 102.43 2opf n ASP 97 Ca 0.04 0.20 -0.28 0.00 -1.51 0.00 0.00 54.79 53.23 2opf n ASP 97 Cb 0.27 -0.69 -0.08 0.00 2.34 0.00 0.00 41.12 42.97 2opf n ASP 97 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2opf s LYS 98 N -2.50 2.40 -0.01 -0.67 -0.14 -1.26 0.19 119.74 117.75 2opf s LYS 98 Ca -0.37 -0.99 0.02 0.00 -1.36 0.00 0.00 55.97 53.27 2opf s LYS 98 Cb 0.13 -2.41 -0.01 0.00 -1.68 0.00 0.00 37.83 33.86 2opf s LYS 98 CO 0.51 0.50 -0.08 0.99 -0.76 0.00 0.00 175.35 176.51 2opf s THR 99 N -1.47 0.61 -0.05 2.17 2.01 -0.20 -1.10 115.64 117.60 2opf s THR 99 Ca 0.26 -0.34 0.03 0.00 0.31 0.00 0.00 61.69 61.95 2opf s THR 99 Cb -0.11 -0.51 -0.03 0.00 0.01 0.00 0.00 72.50 71.86 2opf s THR 99 CO 0.17 0.17 -0.13 0.27 -0.69 0.00 0.00 174.62 174.41 2opf s ILE 100 N -0.19 3.16 -0.05 1.82 -4.36 -0.45 -1.26 121.20 119.87 2opf s ILE 100 Ca 0.03 -0.71 0.04 0.00 -0.26 0.00 0.00 60.65 59.75 2opf s ILE 100 Cb -0.03 -2.26 -0.00 0.00 1.25 0.00 0.00 42.46 41.42 2opf s ILE 100 CO -0.00 0.58 -0.17 -0.76 0.24 0.00 0.00 174.94 174.82 2opf s LEU 101 N -0.80 1.90 -0.23 0.37 1.43 0.26 -1.73 118.68 119.88 2opf s LEU 101 Ca 0.12 -0.37 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 2opf s LEU 101 Cb -0.11 -1.01 -0.01 0.00 0.03 0.00 0.00 46.19 45.09 2opf s LEU 101 CO 0.01 0.14 -0.01 -0.22 0.23 0.00 0.00 176.35 176.51 2opf s LEU 102 N 0.13 3.11 0.09 1.79 2.96 -0.47 -0.30 118.68 125.99 2opf s LEU 102 Ca -0.06 -0.39 0.05 0.00 -0.22 0.00 0.00 54.13 53.51 2opf s LEU 102 Cb -0.13 -1.79 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 2opf s LEU 102 CO 0.03 -0.04 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.70 2opf s TYR 103 N 1.51 2.97 0.00 5.38 1.51 -0.03 -0.24 117.35 128.44 2opf s TYR 103 Ca 0.06 -0.04 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 2opf s TYR 103 Cb -0.15 -1.53 0.00 0.00 -0.11 0.00 0.00 41.96 40.18 2opf s TYR 103 CO -0.01 0.48 0.00 0.43 -1.11 0.00 0.00 175.55 175.34 2opf n SER 104 N 0.56 0.00 -4.56 2.29 7.64 0.87 -1.74 113.62 118.67 2opf n SER 104 Ca -0.11 0.00 -0.45 0.00 1.01 0.00 0.00 58.87 59.32 2opf n SER 104 Cb 0.52 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 2opf n SER 104 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2opf n ALA 105 N 0.00 -0.58 -0.01 -0.43 0.00 -1.26 -4.68 120.51 113.54 2opf n ALA 105 Ca 0.00 0.38 0.03 0.00 0.00 0.00 0.00 53.44 53.85 2opf n ALA 105 Cb 0.00 -1.96 -0.08 0.00 0.00 0.00 0.00 19.45 17.41 2opf n ALA 105 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2opf n SER 106 N 1.29 2.62 -4.39 0.00 3.41 -1.26 -4.83 113.62 110.47 2opf n SER 106 Ca 0.11 0.00 -0.45 0.00 -0.26 0.00 0.00 58.87 58.26 2opf n SER 106 Cb 0.32 1.31 -0.02 0.00 -0.26 0.00 0.00 64.21 65.55 2opf n SER 106 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2opf s ASP 107 N -3.42 6.65 -0.05 4.04 -1.08 -1.26 -4.97 116.67 116.58 2opf s ASP 107 Ca -0.04 -2.30 -0.00 0.00 -0.52 0.00 0.00 52.55 49.69 2opf s ASP 107 Cb 0.06 -2.30 0.03 0.00 -1.46 0.00 0.00 42.92 39.24 2opf s ASP 107 CO 0.42 -0.84 -0.01 -0.63 0.52 0.00 0.00 175.17 174.64 2opf s ILE 108 N 1.49 0.32 -0.02 4.11 1.01 -1.26 -1.54 121.20 125.31 2opf s ILE 108 Ca 0.24 0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.90 2opf s ILE 108 Cb -0.09 -0.43 0.01 0.00 0.01 0.00 0.00 42.46 41.96 2opf s ILE 108 CO -0.08 0.21 0.13 -1.61 0.00 0.00 0.00 174.94 173.59 2opf s GLU 109 N 1.40 0.34 -0.22 2.79 0.41 -0.07 -5.00 118.70 118.35 2opf s GLU 109 Ca -0.04 -0.15 -0.16 0.00 -0.41 0.00 0.00 54.97 54.20 2opf s GLU 109 Cb -0.13 0.15 -0.04 0.00 -1.78 0.00 0.00 34.13 32.33 2opf s GLU 109 CO -0.03 -0.07 0.43 1.41 -0.49 0.00 0.00 175.26 176.51 2opf s MET 110 N -0.76 4.13 -0.01 1.61 1.75 -1.26 -0.07 119.30 124.68 2opf s MET 110 Ca -0.08 0.22 0.04 0.00 -1.25 0.00 0.00 55.69 54.61 2opf s MET 110 Cb -0.05 -3.58 -0.03 0.00 2.84 0.00 0.00 34.83 34.01 2opf s MET 110 CO 0.01 -0.15 -0.10 -0.51 -0.65 0.00 0.00 175.02 173.62 2opf s LEU 111 N 1.67 3.01 0.28 4.11 1.43 0.12 -4.96 118.68 124.34 2opf s LEU 111 Ca 0.19 -0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.15 2opf s LEU 111 Cb -0.15 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 2opf s LEU 111 CO 0.09 0.30 0.42 -0.13 0.23 0.00 0.00 176.35 177.25 2opf s ARG 112 N -1.24 3.38 0.27 1.70 0.52 -1.26 -1.44 118.95 120.89 2opf s ARG 112 Ca 0.15 -0.73 -0.05 0.00 -0.52 0.00 0.00 55.73 54.58 2opf s ARG 112 Cb -0.11 -2.83 0.54 0.00 0.52 0.00 0.00 34.95 33.06 2opf s ARG 112 CO 0.05 0.30 1.60 -1.35 0.02 0.00 0.00 175.30 175.92 2opf h PRO 113 N 1.04 0.04 -0.10 3.54 0.11 -1.98 0.13 132.00 134.77 2opf h PRO 113 Ca -0.50 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2opf h PRO 113 Cb 1.23 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2opf h PRO 113 CO 0.60 0.03 0.02 0.93 -0.21 0.00 0.00 178.00 179.36 2opf h GLU 114 N 0.04 0.13 0.00 1.05 3.07 -1.97 -1.64 114.58 115.26 2opf h GLU 114 Ca 0.48 -0.01 -0.09 0.00 -0.50 0.00 0.00 59.36 59.24 2opf h GLU 114 Cb 0.88 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.75 2opf h GLU 114 CO -0.83 0.13 -0.42 1.96 -1.40 0.00 0.00 179.01 178.45 2opf h GLN 115 N 0.13 0.00 0.21 2.33 4.20 -1.15 -3.29 115.11 117.54 2opf h GLN 115 Ca 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 2opf h GLN 115 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 2opf h GLN 115 CO -0.00 0.42 -0.10 1.25 -0.67 0.00 0.00 178.83 179.73 2opf h LEU 116 N 0.00 -0.24 -2.24 1.46 7.12 -0.55 -0.97 115.31 119.89 2opf h LEU 116 Ca -0.00 -0.26 -0.01 0.00 0.13 0.00 0.00 57.88 57.73 2opf h LEU 116 Cb 1.29 0.06 -0.00 0.00 -0.53 0.00 0.00 40.66 41.48 2opf h LEU 116 CO 0.05 0.17 -0.05 0.71 -0.13 0.00 0.00 178.44 179.20 2opf h THR 117 N -0.70 0.34 0.00 1.05 1.35 -1.64 -3.10 112.91 110.21 2opf h THR 117 Ca -0.03 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2opf h THR 117 Cb 0.49 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.12 2opf h THR 117 CO 0.05 0.05 -0.04 0.35 -0.25 0.00 0.00 175.52 175.67 2opf n THR 118 N -3.46 1.68 -1.88 6.82 -2.24 -1.22 -4.79 114.28 109.20 2opf n THR 118 Ca -0.02 -2.01 -0.41 0.00 -2.27 0.00 0.00 64.05 59.33 2opf n THR 118 Cb 0.17 -0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 2opf n THR 118 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2opf s HIS 119 N -2.54 2.88 0.25 4.78 5.04 -0.37 -4.84 115.29 120.48 2opf s HIS 119 Ca 0.28 0.87 -0.05 0.00 -1.54 0.00 0.00 55.06 54.61 2opf s HIS 119 Cb 0.24 -3.96 0.47 0.00 0.04 0.00 0.00 32.58 29.37 2opf s HIS 119 CO 0.03 -3.22 1.66 -1.35 -2.34 0.00 0.00 174.74 169.51 2opf h PRO 120 N 5.05 0.17 0.08 2.88 0.11 -1.94 0.27 132.00 138.63 2opf h PRO 120 Ca -0.46 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2opf h PRO 120 Cb 1.22 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2opf h PRO 120 CO 0.80 0.11 -0.04 0.35 -0.21 0.00 0.00 178.00 179.01 2opf h PHE 121 N 0.18 -0.10 -0.07 0.65 3.57 -1.99 -2.89 116.94 116.29 2opf h PHE 121 Ca 0.42 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.94 2opf h PHE 121 Cb 0.75 0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 2opf h PHE 121 CO -0.34 0.43 0.10 -0.07 -2.23 0.00 0.00 178.31 176.20 2opf h LEU 122 N -0.91 0.00 0.00 0.59 3.38 -1.87 -1.26 115.31 115.24 2opf h LEU 122 Ca -0.01 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.78 2opf h LEU 122 Cb 0.57 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 2opf h LEU 122 CO 0.02 0.00 -1.10 -0.61 0.09 0.00 0.00 178.44 176.84 2opf h GLN 123 N 0.00 0.00 0.00 1.13 4.15 -0.53 -3.37 115.11 116.49 2opf h GLN 123 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2opf h GLN 123 Cb 0.23 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.92 2opf h GLN 123 CO -0.00 0.56 -1.67 2.89 -1.93 0.00 0.00 178.83 178.67 2opf n ARG 124 N -3.13 0.53 -2.07 1.69 1.85 -0.57 -4.99 116.66 109.98 2opf n ARG 124 Ca -0.05 -0.12 -0.37 0.00 -1.00 0.00 0.00 57.85 56.31 2opf n ARG 124 Cb 0.87 -1.56 0.02 0.00 -1.05 0.00 0.00 32.46 30.74 2opf n ARG 124 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2opf s VAL 125 N -3.40 2.72 0.09 8.89 -7.23 -0.64 -4.36 120.40 116.47 2opf s VAL 125 Ca -0.04 0.50 -0.00 0.00 -1.81 0.00 0.00 61.98 60.62 2opf s VAL 125 Cb 0.14 -3.23 0.02 0.00 0.56 0.00 0.00 36.38 33.87 2opf s VAL 125 CO 0.88 -0.05 0.13 0.61 -0.31 0.00 0.00 175.10 176.36 2opf n GLY 126 N 0.50 0.61 3.66 2.32 0.00 0.54 -4.90 105.19 107.92 2opf n GLY 126 Ca 0.11 -1.94 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 2opf n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2opf n PRO 127 N -1.24 0.97 -2.99 1.61 -0.04 -1.26 -3.90 135.00 128.15 2opf n PRO 127 Ca 0.02 0.38 -0.40 0.00 -0.04 0.00 0.00 63.50 63.46 2opf n PRO 127 Cb 0.07 -2.32 -0.04 0.00 -0.04 0.00 0.00 33.50 31.17 2opf n PRO 127 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2opf s ASP 128 N -1.32 7.05 0.59 3.54 -1.08 -1.26 -0.59 116.67 123.60 2opf s ASP 128 Ca 0.79 1.26 0.36 0.00 -0.52 0.00 0.00 52.55 54.45 2opf s ASP 128 Cb -0.40 -2.44 1.83 0.00 -1.46 0.00 0.00 42.92 40.46 2opf s ASP 128 CO 0.44 -0.14 2.17 -0.37 0.52 0.00 0.00 175.17 177.79 2opf h VAL 129 N 4.76 0.16 -0.01 1.11 -1.51 -1.81 -1.10 116.25 117.86 2opf h VAL 129 Ca -0.41 -0.30 0.00 0.00 -1.23 0.00 0.00 66.70 64.76 2opf h VAL 129 Cb 1.20 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 2opf h VAL 129 CO 0.75 0.03 -0.26 0.18 -1.23 0.00 0.00 177.57 177.04 2opf n LEU 130 N -3.25 1.00 -4.65 4.19 4.77 -1.26 -4.80 117.00 112.99 2opf n LEU 130 Ca -0.02 -0.25 -0.43 0.00 -0.03 0.00 0.00 56.01 55.29 2opf n LEU 130 Cb 0.19 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 2opf n LEU 130 CO 0.25 0.19 1.36 -0.62 -1.33 0.00 0.00 177.39 177.24 2opf s ASP 131 N -2.51 6.57 0.54 -1.43 -1.08 -0.42 -4.87 116.67 113.46 2opf s ASP 131 Ca 0.24 1.98 0.24 0.00 -0.52 0.00 0.00 52.55 54.49 2opf s ASP 131 Cb 0.19 -2.53 1.41 0.00 -1.46 0.00 0.00 42.92 40.53 2opf s ASP 131 CO 0.52 -1.05 2.05 -0.65 0.52 0.00 0.00 175.17 176.57 2opf h PRO 132 N 9.95 0.00 0.00 4.34 0.11 -1.89 -1.15 132.00 143.37 2opf h PRO 132 Ca -0.36 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.72 2opf h PRO 132 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 2opf h PRO 132 CO 0.97 0.00 -0.12 -0.91 -0.21 0.00 0.00 178.00 177.73 2opf h ASN 133 N 0.00 0.00 -3.24 -2.05 2.35 -1.94 -3.43 115.58 107.27 2opf h ASN 133 Ca 0.16 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.36 2opf h ASN 133 Cb 0.68 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.03 2opf h ASN 133 CO -0.00 0.12 0.55 -0.22 -1.65 0.00 0.00 177.43 176.23 2opf s LEU 134 N -6.43 4.32 0.30 1.61 2.96 -0.44 -5.03 118.68 115.97 2opf s LEU 134 Ca 0.02 1.75 0.11 0.00 -0.22 0.00 0.00 54.13 55.79 2opf s LEU 134 Cb 0.08 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.16 2opf s LEU 134 CO 0.62 -0.44 -0.17 0.42 -1.32 0.00 0.00 176.35 175.46 2opf s THR 135 N 1.58 2.40 0.44 3.68 -4.23 -1.26 -4.93 115.64 113.32 2opf s THR 135 Ca 0.54 -2.35 0.16 0.00 -1.18 0.00 0.00 61.69 58.85 2opf s THR 135 Cb -0.23 -2.38 0.35 0.00 1.34 0.00 0.00 72.50 71.57 2opf s THR 135 CO 0.24 -0.35 1.96 -0.65 -0.54 0.00 0.00 174.62 175.28 2opf h PRO 136 N 2.21 0.37 0.16 3.99 0.11 -1.96 -0.74 132.00 136.13 2opf h PRO 136 Ca -0.40 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.68 2opf h PRO 136 Cb 1.26 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2opf h PRO 136 CO 0.63 0.24 -0.07 0.93 -0.21 0.00 0.00 178.00 179.52 2opf h GLU 137 N 0.38 -0.20 -0.43 1.05 3.07 -1.95 0.23 114.58 116.73 2opf h GLU 137 Ca 0.31 0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 59.15 2opf h GLU 137 Cb 0.71 0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.64 2opf h GLU 137 CO -0.09 -0.06 0.11 0.28 -1.40 0.00 0.00 179.01 177.85 2opf h VAL 138 N -0.29 1.19 -0.46 3.13 2.07 -1.76 -1.11 116.25 119.03 2opf h VAL 138 Ca -0.02 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 66.77 2opf h VAL 138 Cb 0.23 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2opf h VAL 138 CO 0.04 0.25 0.08 0.58 0.02 0.00 0.00 177.57 178.53 2opf h VAL 139 N 0.63 1.24 -0.49 2.57 2.07 -0.67 -0.64 116.25 120.97 2opf h VAL 139 Ca 0.14 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 2opf h VAL 139 Cb 0.23 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2opf h VAL 139 CO -0.00 0.31 0.29 0.11 0.02 0.00 0.00 177.57 178.30 2opf h LYS 140 N 0.62 0.66 -0.56 1.57 1.57 -0.04 -0.94 116.57 119.45 2opf h LYS 140 Ca 0.14 -0.06 0.09 0.00 -1.87 0.00 0.00 60.65 58.94 2opf h LYS 140 Cb 0.38 -0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.48 2opf h LYS 140 CO 0.01 0.49 0.20 1.49 -0.57 0.00 0.00 179.45 181.06 2opf h GLU 141 N 0.65 0.36 -0.14 3.15 4.81 -0.91 -1.80 114.58 120.70 2opf h GLU 141 Ca 0.17 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 2opf h GLU 141 Cb -0.00 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2opf h GLU 141 CO -0.03 0.24 0.07 -0.09 -0.73 0.00 0.00 179.01 178.46 2opf h ARG 142 N 0.37 0.21 -0.89 1.92 2.43 -0.50 -1.88 114.38 116.04 2opf h ARG 142 Ca 0.28 -0.03 0.10 0.00 -0.81 0.00 0.00 59.98 59.52 2opf h ARG 142 Cb 0.34 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.79 2opf h ARG 142 CO -0.29 0.27 0.57 -0.07 -1.51 0.00 0.00 179.97 178.94 2opf h LEU 143 N 0.10 0.79 0.00 3.80 3.38 -0.68 -2.30 115.31 120.39 2opf h LEU 143 Ca 0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2opf h LEU 143 Cb 0.13 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2opf h LEU 143 CO -0.01 0.46 -0.38 0.18 0.09 0.00 0.00 178.44 178.78 2opf n LEU 144 N -4.53 0.41 -4.70 1.67 4.77 -0.72 -2.10 117.00 111.80 2opf n LEU 144 Ca 0.15 0.17 -0.36 0.00 -0.03 0.00 0.00 56.01 55.94 2opf n LEU 144 Cb 0.32 -0.30 0.08 0.00 -2.33 0.00 0.00 43.42 41.18 2opf n LEU 144 CO 0.31 0.06 0.81 -1.54 -1.33 0.00 0.00 177.39 175.70 2opf n SER 145 N -1.61 1.59 0.12 -1.43 3.41 -0.72 -4.54 113.62 110.45 2opf n SER 145 Ca 0.06 0.76 0.16 0.00 -0.26 0.00 0.00 58.87 59.59 2opf n SER 145 Cb 0.35 -1.52 0.72 0.00 -0.26 0.00 0.00 64.21 63.50 2opf n SER 145 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2opf h PRO 146 N 0.15 0.00 -0.08 4.33 0.13 -1.91 0.78 132.00 135.39 2opf h PRO 146 Ca -0.49 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.56 2opf h PRO 146 Cb 1.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2opf h PRO 146 CO 0.51 0.00 -0.30 -0.09 -0.23 0.00 0.00 178.00 177.88 2opf h ARG 147 N 0.00 0.15 0.00 0.86 2.43 -1.90 -3.36 114.38 112.56 2opf h ARG 147 Ca 0.14 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2opf h ARG 147 Cb 0.62 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 2opf h ARG 147 CO -0.00 0.44 -0.87 1.19 -1.51 0.00 0.00 179.97 179.22 2opf n PHE 148 N -4.14 0.00 0.08 2.20 3.72 -0.76 -4.77 117.46 113.79 2opf n PHE 148 Ca -0.01 0.00 0.21 0.00 -0.05 0.00 0.00 57.45 57.59 2opf n PHE 148 Cb 0.38 -0.01 0.72 0.00 -0.94 0.00 0.00 39.48 39.64 2opf n PHE 148 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 2opf h ARG 149 N 0.00 0.00 -0.50 -1.08 0.11 -0.31 -1.41 114.38 111.19 2opf h ARG 149 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2opf h ARG 149 Cb 0.01 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.09 2opf h ARG 149 CO 0.00 0.00 0.00 -1.71 0.10 0.00 0.00 179.97 178.36 2opf n ASN 150 N -3.61 3.65 -4.73 0.08 5.15 -1.26 -2.31 115.26 112.22 2opf n ASN 150 Ca 0.08 -2.19 -0.38 0.00 -0.60 0.00 0.00 54.58 51.49 2opf n ASN 150 Cb 0.69 -0.40 -0.06 0.00 -0.53 0.00 0.00 39.78 39.49 2opf n ASN 150 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2opf s ARG 151 N -1.35 4.34 0.35 1.20 1.81 -0.53 -4.98 118.95 119.78 2opf s ARG 151 Ca 0.37 0.54 -0.28 0.00 -1.72 0.00 0.00 55.73 54.64 2opf s ARG 151 Cb 0.22 -3.42 -0.10 0.00 -0.45 0.00 0.00 34.95 31.19 2opf s ARG 151 CO 0.21 0.18 1.32 -0.65 -0.68 0.00 0.00 175.30 175.68 2opf s GLN 152 N 0.53 4.27 0.36 3.54 -0.21 -1.26 -4.36 119.66 122.53 2opf s GLN 152 Ca 0.28 2.23 0.04 0.00 0.02 0.00 0.00 55.36 57.93 2opf s GLN 152 Cb -0.16 -3.00 0.69 0.00 1.00 0.00 0.00 33.01 31.54 2opf s GLN 152 CO 0.12 -0.27 1.98 0.74 -2.12 0.00 0.00 175.29 175.74 2opf h PHE 153 N 3.22 0.63 -0.84 0.91 0.04 -0.56 -1.76 116.94 118.57 2opf h PHE 153 Ca -0.49 -0.01 0.19 0.00 2.80 0.00 0.00 57.97 60.45 2opf h PHE 153 Cb 1.23 -0.20 -0.11 0.00 2.20 0.00 0.00 35.95 39.06 2opf h PHE 153 CO 0.55 0.46 0.35 0.00 -0.60 0.00 0.00 178.31 179.07 2opf h ALA 154 N 1.61 1.27 0.03 2.45 0.00 -1.11 -1.04 119.26 122.46 2opf h ALA 154 Ca 0.17 0.14 -0.32 0.00 0.00 0.00 0.00 54.91 54.90 2opf h ALA 154 Cb 0.06 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2opf h ALA 154 CO -0.02 -0.28 -1.88 0.41 0.00 0.00 0.00 179.25 177.47 2opf n GLY 155 N -1.34 -0.88 0.26 0.00 0.00 -1.11 -4.35 105.19 97.77 2opf n GLY 155 Ca 0.19 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 2opf n GLY 155 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2opf h LEU 156 N 0.02 0.75 0.00 0.99 5.85 -0.82 -2.71 115.31 119.39 2opf h LEU 156 Ca -0.36 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.31 2opf h LEU 156 Cb 2.04 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.88 2opf h LEU 156 CO 0.07 0.58 0.00 0.18 -0.34 0.00 0.00 178.44 178.93 2opf n LEU 157 N -4.60 0.00 -0.00 2.25 4.32 -0.44 -1.98 117.00 116.55 2opf n LEU 157 Ca 0.05 0.14 0.06 0.00 -0.02 0.00 0.00 56.01 56.24 2opf n LEU 157 Cb 0.05 -0.14 -0.08 0.00 -1.62 0.00 0.00 43.42 41.63 2opf n LEU 157 CO 0.36 -0.06 -0.22 0.18 -1.22 0.00 0.00 177.39 176.43 2opf n LEU 158 N -1.14 0.38 -4.61 2.23 4.77 -1.04 -4.32 117.00 113.27 2opf n LEU 158 Ca 0.11 -0.34 -0.43 0.00 -0.03 0.00 0.00 56.01 55.32 2opf n LEU 158 Cb 0.10 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 2opf n LEU 158 CO 0.12 0.09 1.04 -0.62 -1.33 0.00 0.00 177.39 176.69 2opf s ASP 159 N -2.52 6.65 0.01 -1.43 -1.08 -0.84 -4.90 116.67 112.57 2opf s ASP 159 Ca 0.02 0.61 0.10 0.00 -0.52 0.00 0.00 52.55 52.75 2opf s ASP 159 Cb 0.09 -2.55 0.43 0.00 -1.46 0.00 0.00 42.92 39.43 2opf s ASP 159 CO 0.49 -1.21 1.32 0.00 0.52 0.00 0.00 175.17 176.29 2opf n GLN 160 N 7.71 0.01 0.15 4.34 1.13 -1.26 -1.57 117.38 127.88 2opf n GLN 160 Ca 0.12 0.34 0.13 0.00 -1.94 0.00 0.00 57.00 55.65 2opf n GLN 160 Cb 0.49 -1.51 0.34 0.00 0.11 0.00 0.00 30.24 29.66 2opf n GLN 160 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2opf h ALA 161 N 2.33 1.00 -0.13 -1.58 0.00 -1.91 0.15 119.26 119.13 2opf h ALA 161 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2opf h ALA 161 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2opf h ALA 161 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 179.25 179.59 2opf n PHE 162 N -2.56 0.00 -3.85 0.00 7.35 -0.61 -3.72 117.46 114.08 2opf n PHE 162 Ca 0.05 0.00 -0.21 0.00 -0.76 0.00 0.00 57.45 56.53 2opf n PHE 162 Cb 0.45 -0.29 -0.17 0.00 0.35 0.00 0.00 39.48 39.82 2opf n PHE 162 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2opf s LEU 163 N -4.29 0.76 0.15 -2.13 1.43 -1.21 -4.04 118.68 109.35 2opf s LEU 163 Ca 0.00 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 52.73 2opf s LEU 163 Cb 0.00 -0.38 -0.07 0.00 0.03 0.00 0.00 46.19 45.77 2opf s LEU 163 CO 0.00 -0.16 1.09 0.00 0.23 0.00 0.00 176.35 177.50 2opf s ALA 164 N 1.67 3.35 0.00 4.21 0.00 0.24 -3.83 121.76 127.40 2opf s ALA 164 Ca 0.00 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.74 2opf s ALA 164 Cb -0.13 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2opf s ALA 164 CO -0.04 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2opf n GLY 165 N 2.19 2.20 3.73 0.00 0.00 -1.26 -2.33 105.19 109.72 2opf n GLY 165 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2opf n GLY 165 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2opf s LEU 166 N 0.00 4.46 0.00 0.99 1.43 -1.25 -0.79 118.68 123.52 2opf s LEU 166 Ca 0.00 2.00 0.00 0.00 -1.03 0.00 0.00 54.13 55.10 2opf s LEU 166 Cb 0.00 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.63 2opf s LEU 166 CO 0.00 -0.24 0.00 0.61 0.23 0.00 0.00 176.35 176.95 2opf n GLY 167 N 2.33 5.20 0.31 -3.19 0.00 -1.26 -4.69 105.19 103.89 2opf n GLY 167 Ca 0.04 -1.87 -0.07 0.00 0.00 0.00 0.00 46.02 44.11 2opf n GLY 167 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2opf h ASN 168 N 0.00 0.98 -0.25 1.61 -1.24 -1.96 0.29 115.58 115.01 2opf h ASN 168 Ca 0.00 -0.25 -0.17 0.00 0.71 0.00 0.00 56.30 56.59 2opf h ASN 168 Cb 0.00 -0.26 -0.00 0.00 0.73 0.00 0.00 38.32 38.78 2opf h ASN 168 CO 0.00 1.01 -0.47 0.10 -1.29 0.00 0.00 177.43 176.78 2opf h TYR 169 N 0.94 1.00 -0.55 0.67 -0.00 -1.97 -1.94 116.97 115.12 2opf h TYR 169 Ca 0.18 -0.33 -0.10 0.00 0.00 0.00 0.00 58.73 58.48 2opf h TYR 169 Cb 0.49 -0.20 -0.02 0.00 0.00 0.00 0.00 36.73 37.00 2opf h TYR 169 CO 0.03 1.12 -0.05 -0.07 -0.00 0.00 0.00 178.16 179.20 2opf h LEU 170 N 0.65 0.97 -0.03 0.10 3.38 -1.93 -0.54 115.31 117.91 2opf h LEU 170 Ca 0.04 -0.29 0.03 0.00 0.09 0.00 0.00 57.88 57.74 2opf h LEU 170 Cb 1.05 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2opf h LEU 170 CO 0.10 1.05 -0.14 -0.09 0.09 0.00 0.00 178.44 179.46 2opf h ARG 171 N 0.89 -0.21 -0.07 1.13 2.43 -0.75 0.94 114.38 118.74 2opf h ARG 171 Ca 0.15 0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.18 2opf h ARG 171 Cb 0.59 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 2opf h ARG 171 CO 0.04 -0.14 -0.65 -0.39 -1.51 0.00 0.00 179.97 177.31 2opf h VAL 172 N -0.22 1.39 -0.13 0.20 -1.51 -1.19 -2.59 116.25 112.19 2opf h VAL 172 Ca 0.06 -2.06 -0.18 0.00 -1.23 0.00 0.00 66.70 63.28 2opf h VAL 172 Cb 0.30 2.05 -0.00 0.00 -2.13 0.00 0.00 31.29 31.50 2opf h VAL 172 CO -0.16 0.61 -0.67 -0.33 -1.23 0.00 0.00 177.57 175.80 2opf h GLU 173 N 0.21 0.54 -0.10 5.19 4.39 -0.95 -2.12 114.58 121.74 2opf h GLU 173 Ca -0.01 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 59.27 2opf h GLU 173 Cb 1.19 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2opf h GLU 173 CO 0.10 1.02 -0.01 0.82 -1.16 0.00 0.00 179.01 179.79 2opf h ILE 174 N 0.38 1.27 -0.36 3.13 2.04 -0.79 -1.44 117.51 121.73 2opf h ILE 174 Ca -0.02 -0.86 -0.06 0.00 1.00 0.00 0.00 64.86 64.92 2opf h ILE 174 Cb 1.25 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.95 2opf h ILE 174 CO 0.12 0.24 -0.04 -0.07 0.00 0.00 0.00 178.15 178.41 2opf h LEU 175 N -0.11 0.56 -0.31 1.44 3.38 -1.49 -2.44 115.31 116.34 2opf h LEU 175 Ca 0.03 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.78 2opf h LEU 175 Cb 0.38 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2opf h LEU 175 CO 0.01 0.66 -0.18 -0.25 0.09 0.00 0.00 178.44 178.76 2opf h TRP 176 N 0.55 0.77 -0.78 1.13 7.01 -1.34 0.27 115.95 123.57 2opf h TRP 176 Ca 0.11 -0.20 0.11 0.00 2.11 0.00 0.00 58.89 61.02 2opf h TRP 176 Cb 0.41 -0.17 -0.08 0.00 -2.10 0.00 0.00 29.16 27.22 2opf h TRP 176 CO 0.02 0.91 0.40 0.37 -2.79 0.00 0.00 178.44 177.35 2opf h GLN 177 N 0.42 0.63 -0.53 2.65 5.75 -0.87 -1.16 115.11 122.00 2opf h GLN 177 Ca 0.06 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2opf h GLN 177 Cb 0.72 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 29.13 2opf h GLN 177 CO 0.05 0.42 0.00 1.33 -2.65 0.00 0.00 178.83 177.98 2opf n VAL 178 N -4.84 0.80 -3.12 2.39 0.24 -0.95 -4.95 118.33 107.91 2opf n VAL 178 Ca 0.14 -0.71 -0.21 0.00 -2.04 0.00 0.00 64.34 61.52 2opf n VAL 178 Cb 0.33 0.28 0.05 0.00 -1.47 0.00 0.00 33.84 33.02 2opf n VAL 178 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2opf n GLY 179 N 1.23 -0.40 3.38 7.63 0.00 -0.44 -4.98 105.19 111.61 2opf n GLY 179 Ca 0.17 0.08 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 2opf n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2opf s LEU 180 N -6.24 2.31 0.68 0.99 1.43 0.02 -1.79 118.68 116.08 2opf s LEU 180 Ca 0.36 -0.48 -0.08 0.00 -1.03 0.00 0.00 54.13 52.90 2opf s LEU 180 Cb -0.16 -1.39 0.03 0.00 0.03 0.00 0.00 46.19 44.71 2opf s LEU 180 CO 0.44 0.28 1.02 0.42 0.23 0.00 0.00 176.35 178.74 2opf s THR 181 N -0.78 3.04 -0.92 5.49 -4.23 -0.17 -4.45 115.64 113.62 2opf s THR 181 Ca 0.12 0.06 0.20 0.00 -1.18 0.00 0.00 61.69 60.89 2opf s THR 181 Cb -0.10 -3.28 0.18 0.00 1.34 0.00 0.00 72.50 70.63 2opf s THR 181 CO 0.02 -0.33 1.63 0.61 -0.54 0.00 0.00 174.62 176.01 2opf n GLY 182 N -2.88 -1.20 0.11 3.99 0.00 -1.26 -3.49 105.19 100.46 2opf n GLY 182 Ca 0.06 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.18 2opf n GLY 182 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2opf n ASN 183 N -1.63 0.52 -4.75 1.61 0.23 -1.26 -0.55 115.26 109.43 2opf n ASN 183 Ca 0.04 -0.49 -0.33 0.00 -0.53 0.00 0.00 54.58 53.28 2opf n ASN 183 Cb 0.23 -0.04 0.07 0.00 -2.08 0.00 0.00 39.78 37.96 2opf n ASN 183 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2opf s HIS 184 N -2.59 2.44 0.04 -2.53 3.76 -1.23 -4.67 115.29 110.50 2opf s HIS 184 Ca 0.25 1.58 0.06 0.00 -0.15 0.00 0.00 55.06 56.79 2opf s HIS 184 Cb 0.19 -3.22 -0.02 0.00 1.11 0.00 0.00 32.58 30.64 2opf s HIS 184 CO 0.51 -1.96 -0.16 0.15 -0.85 0.00 0.00 174.74 172.43 2opf s LYS 185 N -4.20 1.10 0.49 1.40 1.02 -1.26 -0.63 119.74 117.66 2opf s LYS 185 Ca 0.68 -0.79 0.25 0.00 0.02 0.00 0.00 55.97 56.12 2opf s LYS 185 Cb -0.22 -1.14 1.32 0.00 -0.52 0.00 0.00 37.83 37.27 2opf s LYS 185 CO 0.45 0.29 1.91 0.00 -0.92 0.00 0.00 175.35 177.08 2opf h ALA 186 N 5.00 2.52 0.00 5.17 0.00 -1.75 -1.41 119.26 128.79 2opf h ALA 186 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2opf h ALA 186 Cb 1.17 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2opf h ALA 186 CO 0.44 -0.76 0.00 0.36 0.00 0.00 0.00 179.25 179.30 2opf n LYS 187 N -4.38 0.13 0.00 0.00 2.85 -0.98 -2.92 118.16 112.86 2opf n LYS 187 Ca 0.16 0.33 0.09 0.00 -1.05 0.00 0.00 58.31 57.84 2opf n LYS 187 Cb 0.76 -1.73 0.06 0.00 -0.65 0.00 0.00 35.03 33.47 2opf n LYS 187 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2opf n ASP 188 N -1.97 2.36 -4.84 -5.58 8.00 -0.53 -4.99 116.55 108.99 2opf n ASP 188 Ca 0.03 -1.68 -0.33 0.00 0.71 0.00 0.00 54.79 53.53 2opf n ASP 188 Cb 0.23 0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.41 2opf n ASP 188 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2opf s LEU 189 N -1.76 4.03 0.76 0.64 1.43 -1.15 -5.02 118.68 117.61 2opf s LEU 189 Ca 0.20 1.39 -0.09 0.00 -1.03 0.00 0.00 54.13 54.60 2opf s LEU 189 Cb 0.16 -4.21 0.07 0.00 0.03 0.00 0.00 46.19 42.23 2opf s LEU 189 CO 0.30 -0.25 1.10 0.54 0.23 0.00 0.00 176.35 178.27 2opf s ASN 190 N -2.25 4.65 0.27 2.29 2.20 -1.26 -4.81 114.94 116.02 2opf s ASN 190 Ca 0.56 0.63 -0.02 0.00 -0.94 0.00 0.00 52.86 53.10 2opf s ASN 190 Cb -0.10 -1.20 0.44 0.00 -2.00 0.00 0.00 41.25 38.39 2opf s ASN 190 CO 0.16 -1.76 1.86 0.00 -2.94 0.00 0.00 177.10 174.42 2opf h ALA 191 N -0.84 1.38 -0.63 3.54 0.00 -1.99 -1.42 119.26 119.31 2opf h ALA 191 Ca -0.45 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 2opf h ALA 191 Cb 1.32 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 2opf h ALA 191 CO 0.63 0.33 0.19 0.00 0.00 0.00 0.00 179.25 180.40 2opf h ALA 192 N 1.47 0.82 -0.32 0.00 0.00 -2.00 -1.63 119.26 117.61 2opf h ALA 192 Ca 0.44 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 2opf h ALA 192 Cb 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2opf h ALA 192 CO -0.21 0.50 -0.08 1.96 0.00 0.00 0.00 179.25 181.42 2opf h GLN 193 N 0.91 0.63 -0.78 0.00 4.20 -1.82 -2.04 115.11 116.20 2opf h GLN 193 Ca 0.20 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.68 2opf h GLN 193 Cb 0.30 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.01 2opf h GLN 193 CO -0.00 0.81 0.52 1.25 -0.67 0.00 0.00 178.83 180.73 2opf h LEU 194 N 0.41 0.89 -0.25 1.46 5.85 -1.16 -0.20 115.31 122.31 2opf h LEU 194 Ca 0.08 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2opf h LEU 194 Cb 0.58 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2opf h LEU 194 CO 0.03 0.65 0.09 -0.78 -0.34 0.00 0.00 178.44 178.09 2opf h ASP 195 N 1.06 0.35 -0.37 1.25 3.58 -1.20 -0.17 116.42 120.91 2opf h ASP 195 Ca 0.29 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.56 2opf h ASP 195 Cb -0.12 -0.09 -0.02 0.00 1.72 0.00 0.00 39.33 40.82 2opf h ASP 195 CO -0.06 0.43 0.24 0.00 -2.88 0.00 0.00 179.24 176.96 2opf h ALA 196 N 0.93 0.47 0.17 -0.78 0.00 -1.01 -1.54 119.26 117.50 2opf h ALA 196 Ca 0.08 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2opf h ALA 196 Cb 0.19 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 2opf h ALA 196 CO -0.01 -0.06 -0.09 1.25 0.00 0.00 0.00 179.25 180.34 2opf h LEU 197 N 0.49 -0.23 -0.83 0.00 6.46 -0.91 0.14 115.31 120.44 2opf h LEU 197 Ca 0.13 0.01 0.14 0.00 -0.12 0.00 0.00 57.88 58.05 2opf h LEU 197 Cb -0.03 0.06 -0.09 0.00 -0.73 0.00 0.00 40.66 39.87 2opf h LEU 197 CO -0.03 -0.15 0.41 0.00 -0.62 0.00 0.00 178.44 178.05 2opf h ALA 198 N 0.59 1.22 -0.15 1.25 0.00 -0.81 0.28 119.26 121.63 2opf h ALA 198 Ca -0.02 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2opf h ALA 198 Cb 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2opf h ALA 198 CO 0.03 -0.09 -0.50 0.45 0.00 0.00 0.00 179.25 179.14 2opf h HIS 199 N 0.61 0.80 -0.54 0.00 3.86 -1.01 -3.27 115.15 115.59 2opf h HIS 199 Ca 0.45 -0.32 -0.02 0.00 -1.16 0.00 0.00 60.37 59.31 2opf h HIS 199 Cb 0.62 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.92 2opf h HIS 199 CO -0.10 1.10 0.24 0.00 0.86 0.00 0.00 177.93 180.03 2opf h ALA 200 N 0.54 1.40 -0.03 2.45 0.00 -0.16 0.17 119.26 123.63 2opf h ALA 200 Ca -0.02 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2opf h ALA 200 Cb 1.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2opf h ALA 200 CO 0.11 0.46 0.05 -0.07 0.00 0.00 0.00 179.25 179.80 2opf h LEU 201 N 0.77 0.00 0.00 0.00 3.38 -1.02 -2.16 115.31 116.28 2opf h LEU 201 Ca 0.19 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.89 2opf h LEU 201 Cb 0.12 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2opf h LEU 201 CO -0.02 0.00 -2.00 0.18 0.09 0.00 0.00 178.44 176.69 2opf n LEU 202 N -3.67 2.74 -0.14 1.67 4.77 -0.74 -4.53 117.00 117.10 2opf n LEU 202 Ca -0.02 -0.05 -0.10 0.00 -0.03 0.00 0.00 56.01 55.81 2opf n LEU 202 Cb 0.13 -0.60 -0.01 0.00 -2.33 0.00 0.00 43.42 40.61 2opf n LEU 202 CO 0.26 0.74 0.79 -0.33 -1.33 0.00 0.00 177.39 177.51 2opf h GLU 203 N -0.10 0.70 -0.10 3.23 5.08 -0.67 -2.09 114.58 120.64 2opf h GLU 203 Ca -0.40 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 2opf h GLU 203 Cb 1.58 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 30.76 2opf h GLU 203 CO -0.09 0.79 0.06 0.82 -1.00 0.00 0.00 179.01 179.58 2opf h ILE 204 N 0.53 1.04 -0.68 3.13 1.08 -1.61 0.29 117.51 121.29 2opf h ILE 204 Ca 0.11 -0.10 -0.06 0.00 -0.39 0.00 0.00 64.86 64.42 2opf h ILE 204 Cb 0.47 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 35.13 2opf h ILE 204 CO 0.02 0.04 0.19 -0.65 -0.69 0.00 0.00 178.15 177.06 2opf h PRO 205 N 0.11 1.08 0.00 2.37 0.11 -1.76 -1.01 132.00 132.90 2opf h PRO 205 Ca 0.03 -0.24 -0.07 0.00 0.11 0.00 0.00 66.00 65.83 2opf h PRO 205 Cb 0.01 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 30.96 2opf h PRO 205 CO -0.01 0.94 -0.32 0.00 -0.21 0.00 0.00 178.00 178.41 2opf h ARG 206 N 1.01 0.00 -0.05 1.05 3.08 -1.10 -0.82 114.38 117.56 2opf h ARG 206 Ca 0.22 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.02 2opf h ARG 206 Cb 0.33 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.40 2opf h ARG 206 CO -0.00 0.32 -0.95 0.35 -1.07 0.00 0.00 179.97 178.62 2opf h PHE 207 N 0.00 1.00 -0.24 3.04 3.57 0.06 -2.03 116.94 122.34 2opf h PHE 207 Ca -0.00 -0.51 -0.04 0.00 3.53 0.00 0.00 57.97 60.95 2opf h PHE 207 Cb 0.64 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 2opf h PHE 207 CO 0.00 1.34 0.01 1.03 -2.23 0.00 0.00 178.31 178.46 2opf h SER 208 N 0.42 0.41 -0.61 0.41 0.87 -0.95 -0.51 113.55 113.59 2opf h SER 208 Ca -0.10 -0.30 0.08 0.00 -1.23 0.00 0.00 61.79 60.24 2opf h SER 208 Cb 1.59 -0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 63.38 2opf h SER 208 CO 0.19 0.61 0.27 0.22 -0.53 0.00 0.00 176.83 177.59 2opf h TYR 209 N 0.20 0.48 0.00 2.24 3.20 -1.16 0.94 116.97 122.88 2opf h TYR 209 Ca 0.07 0.03 -0.19 0.00 3.14 0.00 0.00 58.73 61.78 2opf h TYR 209 Cb 0.40 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 2opf h TYR 209 CO 0.03 0.17 -0.86 0.00 -1.64 0.00 0.00 178.16 175.87 2opf h ALA 210 N 1.38 0.57 0.00 1.82 0.00 -1.24 -3.42 119.26 118.37 2opf h ALA 210 Ca 0.30 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2opf h ALA 210 Cb 0.31 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2opf h ALA 210 CO -0.26 0.97 -0.88 0.25 0.00 0.00 0.00 179.25 179.33 2opf n THR 211 N -3.61 0.00 0.01 0.00 -2.24 -0.21 -2.73 114.28 105.51 2opf n THR 211 Ca -0.02 -0.01 0.07 0.00 -2.27 0.00 0.00 64.05 61.82 2opf n THR 211 Cb 0.80 0.47 0.48 0.00 -2.10 0.00 0.00 70.33 69.98 2opf n THR 211 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2opf h ARG 212 N 0.00 0.42 -3.23 -0.78 2.43 -0.96 -3.41 114.38 108.85 2opf h ARG 212 Ca 0.00 -0.03 -0.14 0.00 -0.81 0.00 0.00 59.98 59.01 2opf h ARG 212 Cb 0.00 -0.10 -0.21 0.00 -0.42 0.00 0.00 29.97 29.24 2opf h ARG 212 CO 0.00 0.28 -0.38 0.20 -1.51 0.00 0.00 179.97 178.56 2opf s GLY 213 N -3.77 -0.08 0.00 2.80 0.00 -1.26 -4.96 107.32 100.05 2opf s GLY 213 Ca -0.08 0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.86 2opf s GLY 213 CO 0.73 0.06 0.00 -0.18 0.00 0.00 0.00 173.10 173.71 2opf n GLN 214 N 1.64 0.00 -1.26 2.90 0.00 -1.26 -4.77 117.38 114.63 2opf n GLN 214 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.80 2opf n GLN 214 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.80 2opf n GLN 214 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.06 178.61 2opf n VAL 215 N 0.00 -3.16 -2.73 1.69 3.14 -1.10 -5.06 118.33 111.11 2opf n VAL 215 Ca 0.00 1.46 -0.08 0.00 -2.96 0.00 0.00 64.34 62.76 2opf n VAL 215 Cb 0.00 -2.22 0.04 0.00 -1.06 0.00 0.00 33.84 30.60 2opf n VAL 215 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2opf n ASP 216 N -1.81 -5.60 0.00 6.55 9.92 -1.25 -5.02 116.55 119.34 2opf n ASP 216 Ca 0.00 -0.39 0.00 0.00 -0.53 0.00 0.00 54.79 53.87 2opf n ASP 216 Cb 0.23 -3.97 0.00 0.00 -0.64 0.00 0.00 41.12 36.74 2opf n ASP 216 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2opf n ALA 223 N -2.43 0.00 -2.36 2.24 0.00 -1.26 -5.11 120.51 111.59 2opf n ALA 223 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.09 2opf n ALA 223 Cb 0.56 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.86 2opf n ALA 223 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2opf s LEU 224 N 0.00 2.23 0.36 0.00 1.02 -1.26 -5.03 118.68 116.01 2opf s LEU 224 Ca 0.00 -0.48 -0.27 0.00 0.02 0.00 0.00 54.13 53.41 2opf s LEU 224 Cb 0.00 -1.37 -0.12 0.00 0.02 0.00 0.00 46.19 44.72 2opf s LEU 224 CO 0.00 0.29 1.13 0.33 0.02 0.00 0.00 176.35 178.12 2opf n PHE 225 N 2.09 1.65 -3.54 0.29 7.35 -1.26 -5.01 117.46 119.03 2opf n PHE 225 Ca -0.16 0.59 -0.16 0.00 -0.76 0.00 0.00 57.45 56.96 2opf n PHE 225 Cb 0.52 -2.31 -0.06 0.00 0.35 0.00 0.00 39.48 37.98 2opf n PHE 225 CO 0.00 0.00 0.00 -0.98 -0.76 0.00 0.00 176.76 175.02 2opf s ARG 226 N -1.87 1.04 0.03 -4.13 1.70 -1.26 -4.78 118.95 109.68 2opf s ARG 226 Ca 0.59 0.02 -0.30 0.00 -0.47 0.00 0.00 55.73 55.56 2opf s ARG 226 Cb -0.59 0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 34.23 2opf s ARG 226 CO 0.59 -0.35 1.12 -0.06 -1.08 0.00 0.00 175.30 175.52 2opf s PHE 227 N -1.80 3.50 -0.12 5.89 0.08 -1.26 -4.94 117.98 119.32 2opf s PHE 227 Ca -0.08 1.44 0.13 0.00 0.12 0.00 0.00 56.93 58.53 2opf s PHE 227 Cb -0.01 -3.31 -0.24 0.00 -0.57 0.00 0.00 43.02 38.89 2opf s PHE 227 CO 0.04 -0.83 0.36 1.63 -0.10 0.00 0.00 175.22 176.32 2opf n LYS 228 N 4.04 0.66 0.00 0.44 4.76 -1.26 -4.77 118.16 122.04 2opf n LYS 228 Ca 0.08 0.17 0.00 0.00 -2.87 0.00 0.00 58.31 55.69 2opf n LYS 228 Cb 0.48 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 32.00 2opf n LYS 228 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 2opf n VAL 229 N -2.96 0.00 -1.64 -0.18 0.24 -1.26 -4.77 118.33 107.76 2opf n VAL 229 Ca -0.26 0.00 -0.49 0.00 -2.04 0.00 0.00 64.34 61.55 2opf n VAL 229 Cb 1.09 -0.18 -0.05 0.00 -1.47 0.00 0.00 33.84 33.23 2opf n VAL 229 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 2opf n PHE 230 N -0.78 2.15 -1.65 6.34 7.35 -1.26 -1.08 117.46 128.53 2opf n PHE 230 Ca 0.00 0.09 -0.17 0.00 -0.76 0.00 0.00 57.45 56.62 2opf n PHE 230 Cb 0.10 -2.63 -0.06 0.00 0.35 0.00 0.00 39.48 37.25 2opf n PHE 230 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 2opf n HIS 231 N 7.50 -0.16 -1.29 -5.13 8.25 -1.26 -4.88 115.22 118.25 2opf n HIS 231 Ca 0.27 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.75 2opf n HIS 231 Cb 0.28 -2.98 0.21 0.00 1.12 0.00 0.00 29.99 28.62 2opf n HIS 231 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2opf n ARG 232 N -2.53 2.06 -1.92 -0.41 1.74 -0.24 -5.02 116.66 110.33 2opf n ARG 232 Ca -0.17 -3.03 -0.41 0.00 -0.77 0.00 0.00 57.85 53.47 2opf n ARG 232 Cb 0.57 -1.77 -0.01 0.00 -1.02 0.00 0.00 32.46 30.23 2opf n ARG 232 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2opf s ASP 233 N -2.46 6.48 0.00 0.55 -4.77 -1.26 -1.47 116.67 113.74 2opf s ASP 233 Ca 0.42 2.91 0.00 0.00 -3.30 0.00 0.00 52.55 52.58 2opf s ASP 233 Cb 0.37 -2.66 0.00 0.00 -1.09 0.00 0.00 42.92 39.54 2opf s ASP 233 CO 0.02 -0.76 0.00 0.61 0.70 0.00 0.00 175.17 175.74 2opf n GLY 234 N 0.59 1.47 3.83 2.12 0.00 0.24 -4.96 105.19 108.47 2opf n GLY 234 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 2opf n GLY 234 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2opf s GLU 235 N -0.54 2.98 0.11 1.61 2.02 -0.54 -4.83 118.70 119.50 2opf s GLU 235 Ca 0.00 -0.88 -0.30 0.00 0.02 0.00 0.00 54.97 53.81 2opf s GLU 235 Cb 0.00 -2.67 -0.06 0.00 0.10 0.00 0.00 34.13 31.50 2opf s GLU 235 CO 0.00 0.47 1.12 -1.25 0.02 0.00 0.00 175.26 175.62 2opf s PRO 236 N -3.30 4.53 0.25 0.39 0.04 -1.26 -0.85 135.00 134.78 2opf s PRO 236 Ca 0.32 1.70 -0.31 0.00 0.04 0.00 0.00 61.00 62.74 2opf s PRO 236 Cb -0.10 -3.33 -0.12 0.00 0.04 0.00 0.00 34.50 31.00 2opf s PRO 236 CO 0.24 -0.07 1.67 0.00 0.04 0.00 0.00 177.00 178.88 2opf n GLU 238 N 3.13 0.08 -0.09 0.00 0.28 -1.26 -0.67 120.64 122.12 2opf n GLU 238 Ca 0.13 0.22 -0.23 0.00 -0.16 0.00 0.00 57.16 57.12 2opf n GLU 238 Cb 0.36 -1.63 -0.12 0.00 1.43 0.00 0.00 31.44 31.48 2opf n GLU 238 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2opf n ARG 239 N -1.79 0.62 0.00 3.44 0.63 -1.26 -4.75 116.66 113.56 2opf n ARG 239 Ca 0.04 0.40 0.00 0.00 -0.92 0.00 0.00 57.85 57.37 2opf n ARG 239 Cb 0.27 -1.66 0.00 0.00 0.45 0.00 0.00 32.46 31.51 2opf n ARG 239 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2opf n GLY 241 N 0.45 2.59 3.69 0.00 0.00 0.16 -4.95 105.19 107.13 2opf n GLY 241 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2opf n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2opf s SER 242 N -2.98 3.24 -0.21 1.61 0.01 -1.26 -4.08 113.70 110.03 2opf s SER 242 Ca 0.00 1.97 -0.25 0.00 1.31 0.00 0.00 55.95 58.97 2opf s SER 242 Cb 0.00 -2.50 -0.01 0.00 0.21 0.00 0.00 66.02 63.72 2opf s SER 242 CO 0.00 -2.86 0.84 -0.63 0.41 0.00 0.00 173.24 171.00 2opf s ILE 243 N -2.73 4.85 0.32 1.44 -1.09 -1.26 0.18 121.20 122.91 2opf s ILE 243 Ca 0.65 1.62 -0.29 0.00 -2.23 0.00 0.00 60.65 60.40 2opf s ILE 243 Cb -0.21 -4.14 -0.11 0.00 -1.58 0.00 0.00 42.46 36.43 2opf s ILE 243 CO 0.58 -0.03 1.42 -0.63 -1.23 0.00 0.00 174.94 175.05 2opf s ILE 244 N 2.53 2.43 0.36 2.92 1.01 -0.03 -4.59 121.20 125.83 2opf s ILE 244 Ca 0.37 0.41 0.08 0.00 0.00 0.00 0.00 60.65 61.51 2opf s ILE 244 Cb -0.16 -3.26 -0.06 0.00 0.01 0.00 0.00 42.46 39.00 2opf s ILE 244 CO 0.10 0.09 0.05 -1.61 0.00 0.00 0.00 174.94 173.56 2opf s GLU 245 N -1.47 2.10 -0.05 2.79 2.02 0.06 -0.59 118.70 123.56 2opf s GLU 245 Ca 0.54 -1.79 0.00 0.00 0.02 0.00 0.00 54.97 53.74 2opf s GLU 245 Cb -0.43 -1.92 0.02 0.00 0.10 0.00 0.00 34.13 31.90 2opf s GLU 245 CO 0.54 0.07 -0.04 0.21 0.02 0.00 0.00 175.26 176.06 2opf s LYS 246 N -3.75 0.84 -0.05 1.61 2.20 -1.26 -1.56 119.74 117.77 2opf s LYS 246 Ca 0.36 -0.07 -0.11 0.00 -0.36 0.00 0.00 55.97 55.79 2opf s LYS 246 Cb 0.01 -0.92 0.02 0.00 -1.51 0.00 0.00 37.83 35.43 2opf s LYS 246 CO 0.20 -0.14 0.25 -0.08 -0.36 0.00 0.00 175.35 175.22 2opf s THR 247 N 1.19 0.04 -0.15 3.43 -1.32 -0.37 -4.92 115.64 113.53 2opf s THR 247 Ca -0.07 -0.33 -0.29 0.00 -1.21 0.00 0.00 61.69 59.79 2opf s THR 247 Cb -0.14 -0.47 -0.01 0.00 -1.51 0.00 0.00 72.50 70.36 2opf s THR 247 CO -0.02 -0.18 1.20 -0.89 -2.21 0.00 0.00 174.62 172.52 2opf s THR 248 N -0.73 4.37 -0.05 5.08 2.01 -1.26 0.62 115.64 125.68 2opf s THR 248 Ca -0.08 1.67 0.00 0.00 0.31 0.00 0.00 61.69 63.59 2opf s THR 248 Cb -0.04 -4.07 0.02 0.00 0.01 0.00 0.00 72.50 68.42 2opf s THR 248 CO 0.02 -0.11 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.06 2opf s LEU 249 N 3.10 1.09 -1.40 4.42 1.43 -0.78 -4.82 118.68 121.72 2opf s LEU 249 Ca 0.53 -0.10 -0.10 0.00 -1.03 0.00 0.00 54.13 53.42 2opf s LEU 249 Cb -0.21 -0.42 0.03 0.00 0.03 0.00 0.00 46.19 45.62 2opf s LEU 249 CO 0.15 -0.10 1.15 -1.20 0.23 0.00 0.00 176.35 176.57 2opf n SER 250 N 4.39 -6.06 -1.37 2.29 7.64 -1.26 -2.66 113.62 116.58 2opf n SER 250 Ca -0.20 -0.59 -0.16 0.00 1.01 0.00 0.00 58.87 58.93 2opf n SER 250 Cb 0.50 -4.78 -0.05 0.00 -1.01 0.00 0.00 64.21 58.87 2opf n SER 250 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2opf n SER 251 N -2.98 -4.87 -3.80 6.43 7.64 -1.26 -4.97 113.62 109.80 2opf n SER 251 Ca 0.02 0.29 -0.12 0.00 1.01 0.00 0.00 58.87 60.06 2opf n SER 251 Cb 0.55 -3.83 -0.11 0.00 -1.01 0.00 0.00 64.21 59.81 2opf n SER 251 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2opf s ALA 252 N -2.64 -0.59 0.13 -0.43 0.00 -1.09 -5.12 121.76 112.02 2opf s ALA 252 Ca 0.00 0.43 -0.31 0.00 0.00 0.00 0.00 51.96 52.08 2opf s ALA 252 Cb 0.00 -0.19 -0.11 0.00 0.00 0.00 0.00 23.12 22.83 2opf s ALA 252 CO 0.00 -0.17 1.84 -2.14 0.00 0.00 0.00 175.76 175.29 2opf s PRO 253 N -0.53 4.13 -0.29 0.00 0.02 -1.26 -1.87 135.00 135.20 2opf s PRO 253 Ca -0.06 2.62 -0.09 0.00 0.02 0.00 0.00 61.00 63.48 2opf s PRO 253 Cb -0.04 -3.58 -0.01 0.00 0.02 0.00 0.00 34.50 30.89 2opf s PRO 253 CO 0.01 -0.85 0.13 0.12 -0.33 0.00 0.00 177.00 176.08 2opf s PHE 254 N 2.71 3.16 -0.17 6.54 5.36 0.20 -4.89 117.98 130.89 2opf s PHE 254 Ca 0.81 -0.54 -0.12 0.00 -0.96 0.00 0.00 56.93 56.13 2opf s PHE 254 Cb -0.47 -2.32 -0.05 0.00 -0.34 0.00 0.00 43.02 39.85 2opf s PHE 254 CO 0.37 -0.43 0.22 0.71 -1.46 0.00 0.00 175.22 174.63 2opf s TYR 255 N 1.61 3.47 0.19 10.12 1.51 -1.26 -1.24 117.35 131.74 2opf s TYR 255 Ca 0.05 0.50 -0.22 0.00 -1.01 0.00 0.00 57.07 56.39 2opf s TYR 255 Cb -0.17 -2.23 0.05 0.00 -0.11 0.00 0.00 41.96 39.51 2opf s TYR 255 CO 0.06 0.32 0.62 1.67 -1.11 0.00 0.00 175.55 177.11 2opf s TRP 256 N 0.22 -0.42 -0.25 2.71 1.48 -0.60 -4.83 118.94 117.24 2opf s TRP 256 Ca 0.13 0.14 -0.06 0.00 -1.06 0.00 0.00 56.10 55.26 2opf s TRP 256 Cb -0.12 0.58 -0.01 0.00 -1.16 0.00 0.00 33.47 32.76 2opf s TRP 256 CO 0.02 -0.94 0.03 0.00 -4.06 0.00 0.00 176.95 171.99 2opf h PRO 258 N 8.18 0.00 0.00 0.00 0.11 -1.84 -1.12 132.00 137.33 2opf h PRO 258 Ca -0.37 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.56 2opf h PRO 258 Cb 1.15 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 2opf h PRO 258 CO 0.59 0.00 -0.88 0.78 -0.21 0.00 0.00 178.00 178.29 2opf h GLY 259 N 1.55 0.00 0.00 -0.55 0.00 -1.93 -3.39 103.07 98.75 2opf h GLY 259 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2opf h GLY 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2opf s GLN 261 N -0.29 3.16 0.00 0.00 -0.21 -0.43 -4.48 119.66 117.41 2opf s GLN 261 Ca 0.00 -0.75 0.00 0.00 0.02 0.00 0.00 55.36 54.63 2opf s GLN 261 Cb 0.00 -2.93 0.00 0.00 1.00 0.00 0.00 33.01 31.08 2opf s GLN 261 CO 0.00 -0.25 0.10 0.72 -2.12 0.00 0.00 175.29 173.73