#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hoa s THR 2 N 0.00 3.21 0.40 1.12 -4.23 -1.26 -4.87 115.64 110.01 3hoa s THR 2 Ca 0.00 0.39 0.09 0.00 -1.18 0.00 0.00 61.69 60.99 3hoa s THR 2 Cb 0.00 -2.96 0.20 0.00 1.34 0.00 0.00 72.50 71.08 3hoa s THR 2 CO 0.00 -0.51 1.98 1.55 -0.54 0.00 0.00 174.62 177.10 3hoa h PRO 3 N -1.18 0.34 -0.31 3.99 0.13 -1.99 -2.30 132.00 130.68 3hoa h PRO 3 Ca -0.46 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3hoa h PRO 3 Cb 1.25 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 3hoa h PRO 3 CO 0.54 0.35 0.20 0.93 -0.23 0.00 0.00 178.00 179.79 3hoa h GLU 4 N 0.33 0.41 -0.85 0.86 3.07 -1.92 -0.09 114.58 116.39 3hoa h GLU 4 Ca 0.08 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.88 3hoa h GLU 4 Cb 0.19 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 27.97 3hoa h GLU 4 CO 0.00 0.29 0.43 0.00 -1.40 0.00 0.00 179.01 178.33 3hoa h ALA 5 N 1.10 1.16 0.06 3.43 0.00 -1.82 0.45 119.26 123.63 3hoa h ALA 5 Ca 0.11 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hoa h ALA 5 Cb -0.03 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.43 3hoa h ALA 5 CO -0.02 0.65 -0.03 0.00 0.00 0.00 0.00 179.25 179.85 3hoa h ALA 6 N 1.27 -0.08 -0.91 0.00 0.00 -0.93 -1.09 119.26 117.53 3hoa h ALA 6 Ca 0.29 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.14 3hoa h ALA 6 Cb 0.08 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 3hoa h ALA 6 CO -0.04 -0.45 0.58 -0.92 0.00 0.00 0.00 179.25 178.43 3hoa h TYR 7 N -0.27 1.09 -0.54 0.00 3.20 -0.71 -0.35 116.97 119.40 3hoa h TYR 7 Ca -0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3hoa h TYR 7 Cb 0.24 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 3hoa h TYR 7 CO -0.01 0.61 0.28 0.37 -1.64 0.00 0.00 178.16 177.77 3hoa h GLN 8 N 1.12 0.76 -0.47 1.82 5.75 -0.68 0.16 115.11 123.57 3hoa h GLN 8 Ca 0.37 -0.10 -0.11 0.00 -0.15 0.00 0.00 58.65 58.66 3hoa h GLN 8 Cb 0.05 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 3hoa h GLN 8 CO -0.13 0.60 -0.14 -0.91 -2.65 0.00 0.00 178.83 175.60 3hoa h ASN 9 N 0.73 0.89 0.14 -0.69 2.35 -0.73 -1.96 115.58 116.30 3hoa h ASN 9 Ca 0.19 -0.29 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 3hoa h ASN 9 Cb 0.07 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.20 3hoa h ASN 9 CO -0.03 1.03 -0.07 0.25 -1.65 0.00 0.00 177.43 176.97 3hoa h LEU 10 N 0.79 -0.15 -0.07 1.61 5.85 -0.63 -0.16 115.31 122.54 3hoa h LEU 10 Ca 0.12 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.72 3hoa h LEU 10 Cb 0.67 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.69 3hoa h LEU 10 CO 0.05 0.07 -0.22 0.25 -0.34 0.00 0.00 178.44 178.25 3hoa h LEU 11 N -0.38 -0.67 -0.32 2.25 5.85 -0.65 0.24 115.31 121.64 3hoa h LEU 11 Ca -0.02 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.82 3hoa h LEU 11 Cb 0.30 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 3hoa h LEU 11 CO 0.03 -0.28 0.18 -0.33 -0.34 0.00 0.00 178.44 177.70 3hoa h GLU 12 N -0.31 0.35 -0.35 1.25 5.08 -1.31 -0.38 114.58 118.91 3hoa h GLU 12 Ca 0.08 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3hoa h GLU 12 Cb 0.43 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3hoa h GLU 12 CO -0.25 0.23 0.12 0.35 -1.00 0.00 0.00 179.01 178.46 3hoa h PHE 13 N 0.36 0.56 -0.36 4.33 3.57 -0.66 -1.92 116.94 122.82 3hoa h PHE 13 Ca 0.13 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.50 3hoa h PHE 13 Cb 0.02 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 3hoa h PHE 13 CO -0.08 0.54 -0.09 1.96 -2.23 0.00 0.00 178.31 178.40 3hoa h GLN 14 N 0.42 0.62 -0.17 1.11 1.08 -0.34 -2.33 115.11 115.50 3hoa h GLN 14 Ca 0.11 -0.18 -0.17 0.00 -1.45 0.00 0.00 58.65 56.96 3hoa h GLN 14 Cb 0.24 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.60 3hoa h GLN 14 CO -0.01 0.71 -0.61 0.00 -0.95 0.00 0.00 178.83 177.98 3hoa h ARG 15 N 0.57 0.57 -0.52 1.46 3.08 -0.95 -1.69 114.38 116.91 3hoa h ARG 15 Ca 0.11 -0.39 0.05 0.00 0.07 0.00 0.00 59.98 59.82 3hoa h ARG 15 Cb 0.50 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.56 3hoa h ARG 15 CO 0.03 1.01 0.25 1.49 -1.07 0.00 0.00 179.97 181.68 3hoa h GLU 16 N 0.43 0.47 -0.75 0.04 4.57 -1.12 0.28 114.58 118.49 3hoa h GLU 16 Ca -0.00 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3hoa h GLU 16 Cb 1.17 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 29.61 3hoa h GLU 16 CO 0.11 0.31 0.42 1.15 -1.18 0.00 0.00 179.01 179.83 3hoa h THR 17 N 0.49 1.22 -0.49 0.32 2.02 -1.23 -1.13 112.91 114.10 3hoa h THR 17 Ca 0.24 -0.54 -0.01 0.00 0.77 0.00 0.00 66.41 66.86 3hoa h THR 17 Cb 0.17 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 66.75 3hoa h THR 17 CO -0.18 0.24 0.25 0.00 0.37 0.00 0.00 175.52 176.21 3hoa h ALA 18 N 1.41 0.63 -0.61 6.16 0.00 0.08 0.76 119.26 127.69 3hoa h ALA 18 Ca 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3hoa h ALA 18 Cb 0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3hoa h ALA 18 CO -0.04 0.18 0.33 1.88 0.00 0.00 0.00 179.25 181.60 3hoa h TYR 19 N 0.65 0.85 -0.47 0.00 -1.99 0.18 -0.50 116.97 115.69 3hoa h TYR 19 Ca 0.17 -0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.83 3hoa h TYR 19 Cb 0.09 -0.27 -0.02 0.00 2.00 0.00 0.00 36.73 38.53 3hoa h TYR 19 CO -0.01 0.61 0.10 -0.07 -0.00 0.00 0.00 178.16 178.79 3hoa h LEU 20 N 0.83 0.73 -1.47 3.88 3.38 -0.97 -2.54 115.31 119.15 3hoa h LEU 20 Ca 0.21 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 3hoa h LEU 20 Cb 0.05 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 3hoa h LEU 20 CO -0.03 0.79 -0.13 0.00 0.09 0.00 0.00 178.44 179.16 3hoa h ALA 21 N 0.97 1.56 0.00 1.53 0.00 -0.50 -2.06 119.26 120.77 3hoa h ALA 21 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hoa h ALA 21 Cb 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hoa h ALA 21 CO 0.00 0.32 0.00 0.66 0.00 0.00 0.00 179.25 180.23 3hoa h SER 22 N 0.18 0.00 0.36 0.00 4.64 -0.66 -0.43 113.55 117.65 3hoa h SER 22 Ca 0.04 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.22 3hoa h SER 22 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 3hoa h SER 22 CO 0.02 0.00 -0.57 -0.07 -0.87 0.00 0.00 176.83 175.34 3hoa h LEU 23 N 0.00 0.24 -0.67 5.97 3.38 -1.31 -2.45 115.31 120.48 3hoa h LEU 23 Ca 0.00 -0.13 -0.12 0.00 0.09 0.00 0.00 57.88 57.72 3hoa h LEU 23 Cb 0.33 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3hoa h LEU 23 CO 0.00 0.76 -0.26 1.23 0.09 0.00 0.00 178.44 180.26 3hoa h GLY 24 N 1.46 0.82 1.00 0.83 0.00 -1.16 -2.05 103.07 103.98 3hoa h GLY 24 Ca -0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 3hoa h GLY 24 CO 0.09 0.66 0.39 0.00 0.00 0.00 0.00 176.54 177.68 3hoa h ALA 25 N 1.05 0.85 -0.51 3.60 0.00 -1.23 0.36 119.26 123.37 3hoa h ALA 25 Ca 0.08 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3hoa h ALA 25 Cb 0.78 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3hoa h ALA 25 CO 0.06 0.33 0.17 1.25 0.00 0.00 0.00 179.25 181.07 3hoa h LEU 26 N 0.90 0.69 -0.64 0.00 5.85 -1.13 0.25 115.31 121.23 3hoa h LEU 26 Ca 0.24 -0.09 -0.13 0.00 0.84 0.00 0.00 57.88 58.73 3hoa h LEU 26 Cb -0.01 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 3hoa h LEU 26 CO -0.04 0.65 -0.36 0.00 -0.34 0.00 0.00 178.44 178.34 3hoa h ALA 27 N 1.45 0.82 -0.25 1.25 0.00 -0.66 -0.96 119.26 120.91 3hoa h ALA 27 Ca 0.17 -0.42 -0.17 0.00 0.00 0.00 0.00 54.91 54.49 3hoa h ALA 27 Cb 0.20 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hoa h ALA 27 CO -0.01 0.64 -0.52 0.00 0.00 0.00 0.00 179.25 179.36 3hoa h ALA 28 N 1.05 0.61 -0.01 0.00 0.00 -0.38 0.63 119.26 121.16 3hoa h ALA 28 Ca 0.06 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.46 3hoa h ALA 28 Cb 0.87 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3hoa h ALA 28 CO 0.08 0.68 0.00 2.35 0.00 0.00 0.00 179.25 182.36 3hoa h TRP 29 N 0.55 0.01 -1.00 0.00 7.01 -0.81 -3.02 115.95 118.70 3hoa h TRP 29 Ca 0.02 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.04 3hoa h TRP 29 Cb 1.09 -0.00 -0.05 0.00 -2.10 0.00 0.00 29.16 28.10 3hoa h TRP 29 CO 0.06 0.20 0.66 0.22 -2.79 0.00 0.00 178.44 176.79 3hoa h ASP 30 N -0.18 1.13 -0.33 2.65 1.82 -1.10 -2.42 116.42 117.97 3hoa h ASP 30 Ca 0.00 -0.02 0.04 0.00 -0.39 0.00 0.00 57.03 56.66 3hoa h ASP 30 Cb 0.20 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 39.92 3hoa h ASP 30 CO -0.00 0.79 0.22 -0.61 -1.61 0.00 0.00 179.24 178.04 3hoa h GLN 31 N 1.32 0.27 -0.09 0.28 4.15 -0.75 -0.94 115.11 119.34 3hoa h GLN 31 Ca 0.38 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.79 3hoa h GLN 31 Cb -0.08 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.55 3hoa h GLN 31 CO -0.10 0.18 0.00 0.54 -1.93 0.00 0.00 178.83 177.51 3hoa n ARG 32 N -4.48 2.31 0.09 1.69 1.74 -0.95 -4.63 116.66 112.42 3hoa n ARG 32 Ca 0.03 -1.92 0.00 0.00 -0.77 0.00 0.00 57.85 55.19 3hoa n ARG 32 Cb 0.20 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 3hoa n ARG 32 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3hoa n THR 33 N 1.29 0.56 0.20 0.55 -2.24 -0.74 -4.51 114.28 109.38 3hoa n THR 33 Ca 0.15 0.19 0.08 0.00 -2.27 0.00 0.00 64.05 62.19 3hoa n THR 33 Cb 0.58 -1.06 -0.11 0.00 -2.10 0.00 0.00 70.33 67.64 3hoa n THR 33 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3hoa n MET 34 N -3.40 0.93 -1.64 -0.78 2.81 -0.60 -5.02 117.12 109.43 3hoa n MET 34 Ca 0.00 -0.10 -0.45 0.00 -1.81 0.00 0.00 57.70 55.34 3hoa n MET 34 Cb 0.03 -1.32 -0.02 0.00 -0.71 0.00 0.00 33.22 31.21 3hoa n MET 34 CO 0.00 0.00 0.00 1.51 1.51 0.00 0.00 175.97 178.99 3hoa n ILE 35 N -1.84 1.49 -1.34 2.02 3.06 -0.46 -4.95 119.36 117.35 3hoa n ILE 35 Ca -0.01 -0.37 -0.31 0.00 -2.50 0.00 0.00 62.75 59.56 3hoa n ILE 35 Cb 0.35 -1.25 0.10 0.00 0.54 0.00 0.00 39.64 39.38 3hoa n ILE 35 CO 0.00 0.00 0.00 -2.16 -2.50 0.00 0.00 176.55 171.89 3hoa s PRO 36 N -1.08 2.08 0.25 9.51 0.04 -1.26 -4.93 135.00 139.61 3hoa s PRO 36 Ca 0.63 0.97 -0.04 0.00 0.04 0.00 0.00 61.00 62.60 3hoa s PRO 36 Cb -0.68 -1.89 0.46 0.00 0.04 0.00 0.00 34.50 32.43 3hoa s PRO 36 CO 0.56 -1.71 1.73 -0.22 0.04 0.00 0.00 177.00 177.41 3hoa h LYS 37 N -1.16 0.45 -0.06 4.56 3.64 -2.01 -2.40 116.57 119.59 3hoa h LYS 37 Ca -0.46 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 3hoa h LYS 37 Cb 1.25 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3hoa h LYS 37 CO 0.54 0.30 0.00 1.63 -2.27 0.00 0.00 179.45 179.65 3hoa n LYS 38 N -4.98 1.39 0.00 1.90 5.02 -1.26 -4.11 118.16 116.11 3hoa n LYS 38 Ca 0.15 -0.58 0.14 0.00 -2.02 0.00 0.00 58.31 55.99 3hoa n LYS 38 Cb 0.41 -1.41 0.47 0.00 -0.02 0.00 0.00 35.03 34.49 3hoa n LYS 38 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hoa n GLY 39 N 1.03 -0.15 0.18 0.72 0.00 -0.90 -4.46 105.19 101.61 3hoa n GLY 39 Ca 0.18 -0.44 -0.08 0.00 0.00 0.00 0.00 46.02 45.68 3hoa n GLY 39 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3hoa h HIS 40 N 2.09 0.53 -0.97 1.61 3.86 -1.75 -1.77 115.15 118.75 3hoa h HIS 40 Ca 0.00 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 3hoa h HIS 40 Cb 0.52 -0.18 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 3hoa h HIS 40 CO 0.00 0.36 0.64 0.93 0.86 0.00 0.00 177.93 180.72 3hoa h GLU 41 N 0.55 1.22 -0.42 2.45 5.08 -1.92 -0.94 114.58 120.60 3hoa h GLU 41 Ca 0.15 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.33 3hoa h GLU 41 Cb -0.02 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 28.94 3hoa h GLU 41 CO -0.03 0.81 -0.14 1.25 -1.00 0.00 0.00 179.01 179.90 3hoa h HIS 42 N 1.26 0.95 -0.64 4.33 2.76 -1.78 -2.67 115.15 119.36 3hoa h HIS 42 Ca 0.38 -0.22 0.01 0.00 -2.20 0.00 0.00 60.37 58.34 3hoa h HIS 42 Cb -0.04 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 28.66 3hoa h HIS 42 CO -0.00 0.97 0.42 -0.09 -1.30 0.00 0.00 177.93 177.93 3hoa h ARG 43 N 0.66 0.83 -0.79 5.26 9.65 -0.67 0.13 114.38 129.45 3hoa h ARG 43 Ca 0.10 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.94 3hoa h ARG 43 Cb 0.68 -0.19 -0.04 0.00 -1.39 0.00 0.00 29.97 29.04 3hoa h ARG 43 CO 0.05 0.55 0.52 0.00 2.80 0.00 0.00 179.97 183.89 3hoa h ALA 44 N 1.24 1.00 -0.09 2.80 0.00 -1.14 0.48 119.26 123.56 3hoa h ALA 44 Ca 0.24 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 3hoa h ALA 44 Cb -0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 3hoa h ALA 44 CO -0.06 0.41 -0.35 0.00 0.00 0.00 0.00 179.25 179.25 3hoa h ARG 45 N 1.06 0.18 -0.34 0.00 3.08 -0.97 -1.08 114.38 116.32 3hoa h ARG 45 Ca 0.29 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 60.22 3hoa h ARG 45 Cb -0.11 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 3hoa h ARG 45 CO -0.07 0.51 0.00 1.96 -1.07 0.00 0.00 179.97 181.31 3hoa h GLN 46 N 0.16 0.59 -0.60 0.04 4.20 0.10 -0.55 115.11 119.05 3hoa h GLN 46 Ca 0.02 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 3hoa h GLN 46 Cb 0.70 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 3hoa h GLN 46 CO 0.05 0.71 0.37 0.52 -0.67 0.00 0.00 178.83 179.82 3hoa h MET 47 N 0.40 0.81 -0.33 1.46 2.86 -0.48 -0.30 114.93 119.35 3hoa h MET 47 Ca 0.10 -0.07 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 3hoa h MET 47 Cb 0.45 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 3hoa h MET 47 CO 0.02 0.57 -0.16 0.00 1.06 0.00 0.00 176.91 178.40 3hoa h ALA 48 N 1.19 1.10 -0.32 6.32 0.00 -1.10 -0.47 119.26 125.98 3hoa h ALA 48 Ca 0.22 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 3hoa h ALA 48 Cb -0.04 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3hoa h ALA 48 CO -0.04 0.55 0.05 0.00 0.00 0.00 0.00 179.25 179.81 3hoa h ALA 49 N 1.29 0.43 -0.68 0.00 0.00 -0.44 -1.82 119.26 118.04 3hoa h ALA 49 Ca 0.09 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3hoa h ALA 49 Cb 0.58 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3hoa h ALA 49 CO 0.04 0.12 0.30 1.25 0.00 0.00 0.00 179.25 180.96 3hoa h LEU 50 N 0.36 0.91 -0.82 0.00 5.85 -0.87 -2.54 115.31 118.20 3hoa h LEU 50 Ca 0.10 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.69 3hoa h LEU 50 Cb 0.35 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 3hoa h LEU 50 CO 0.01 0.81 0.53 0.00 -0.34 0.00 0.00 178.44 179.45 3hoa h ALA 51 N 1.14 1.06 -0.20 1.25 0.00 -0.86 0.12 119.26 121.77 3hoa h ALA 51 Ca 0.23 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3hoa h ALA 51 Cb 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hoa h ALA 51 CO -0.02 0.39 0.12 0.00 0.00 0.00 0.00 179.25 179.73 3hoa h ARG 52 N 1.06 0.24 0.02 0.00 3.08 -1.06 -0.08 114.38 117.63 3hoa h ARG 52 Ca 0.32 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.35 3hoa h ARG 52 Cb -0.05 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 29.95 3hoa h ARG 52 CO -0.09 0.16 -0.01 1.25 -1.07 0.00 0.00 179.97 180.21 3hoa h LEU 53 N 0.25 -0.02 -0.89 3.04 5.85 -0.99 -2.66 115.31 119.89 3hoa h LEU 53 Ca 0.08 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3hoa h LEU 53 Cb -0.01 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 3hoa h LEU 53 CO -0.03 0.02 0.53 -0.07 -0.34 0.00 0.00 178.44 178.55 3hoa h LEU 54 N -0.06 1.08 -0.67 2.25 3.38 -0.62 -2.45 115.31 118.22 3hoa h LEU 54 Ca -0.00 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 57.96 3hoa h LEU 54 Cb 0.05 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.47 3hoa h LEU 54 CO 0.00 0.84 0.36 -0.74 0.09 0.00 0.00 178.44 178.99 3hoa h HIS 55 N 1.23 0.67 -0.41 1.13 2.76 -0.85 0.24 115.15 119.91 3hoa h HIS 55 Ca 0.32 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.53 3hoa h HIS 55 Cb -0.03 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.70 3hoa h HIS 55 CO 0.00 0.31 0.23 0.37 -1.30 0.00 0.00 177.93 177.54 3hoa h GLN 56 N 0.67 0.45 -0.54 5.26 5.75 -1.11 -1.64 115.11 123.95 3hoa h GLN 56 Ca 0.30 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.71 3hoa h GLN 56 Cb 0.21 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 3hoa h GLN 56 CO -0.19 0.30 0.08 0.00 -2.65 0.00 0.00 178.83 176.36 3hoa h ARG 57 N 0.47 0.90 0.00 1.69 3.08 -0.87 -1.76 114.38 117.89 3hoa h ARG 57 Ca 0.16 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3hoa h ARG 57 Cb 0.03 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3hoa h ARG 57 CO -0.09 0.88 0.00 0.52 -1.07 0.00 0.00 179.97 180.21 3hoa h MET 58 N 0.78 0.00 -0.21 0.04 2.86 -0.25 -2.86 114.93 115.29 3hoa h MET 58 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 3hoa h MET 58 Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 3hoa h MET 58 CO 0.01 0.00 0.00 0.25 1.06 0.00 0.00 176.91 178.23 3hoa n THR 59 N -3.01 0.69 -1.68 2.22 -2.24 -0.64 -4.75 114.28 104.87 3hoa n THR 59 Ca 0.00 -0.84 -0.49 0.00 -2.27 0.00 0.00 64.05 60.45 3hoa n THR 59 Cb 0.28 0.72 -0.05 0.00 -2.10 0.00 0.00 70.33 69.18 3hoa n THR 59 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hoa n ASP 60 N 0.42 3.19 0.25 3.42 -0.08 -0.67 -4.82 116.55 118.25 3hoa n ASP 60 Ca 0.09 1.02 0.16 0.00 -1.51 0.00 0.00 54.79 54.54 3hoa n ASP 60 Cb 0.35 -1.36 0.86 0.00 2.34 0.00 0.00 41.12 43.31 3hoa n ASP 60 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3hoa h PRO 61 N 8.03 0.00 -0.19 -0.67 0.13 -1.92 -1.37 132.00 136.01 3hoa h PRO 61 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 3hoa h PRO 61 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3hoa h PRO 61 CO 0.93 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 178.62 3hoa h ARG 62 N 0.00 0.30 -0.91 0.86 3.08 -1.97 -2.18 114.38 113.56 3hoa h ARG 62 Ca 0.00 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.00 3hoa h ARG 62 Cb 0.06 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 3hoa h ARG 62 CO 0.00 0.40 0.60 0.82 -1.07 0.00 0.00 179.97 180.71 3hoa h ILE 63 N 0.29 1.21 -0.31 2.04 2.04 -1.61 0.57 117.51 121.73 3hoa h ILE 63 Ca 0.06 -0.41 -0.08 0.00 1.00 0.00 0.00 64.86 65.43 3hoa h ILE 63 Cb 0.33 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 3hoa h ILE 63 CO 0.02 0.22 -0.10 1.23 0.00 0.00 0.00 178.15 179.51 3hoa h GLY 64 N 1.20 0.67 0.95 5.37 0.00 -1.56 -0.88 103.07 108.83 3hoa h GLY 64 Ca 0.34 -0.57 0.01 0.00 0.00 0.00 0.00 47.33 47.11 3hoa h GLY 64 CO -0.09 0.52 0.15 0.83 0.00 0.00 0.00 176.54 177.96 3hoa h GLU 65 N 0.39 0.31 -0.16 4.80 5.08 -0.95 -1.55 114.58 122.50 3hoa h GLU 65 Ca 0.08 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3hoa h GLU 65 Cb 0.61 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 3hoa h GLU 65 CO 0.04 0.20 0.01 -1.49 -1.00 0.00 0.00 179.01 176.77 3hoa h TRP 66 N 0.32 0.29 -0.97 4.33 6.55 -0.89 -2.95 115.95 122.63 3hoa h TRP 66 Ca 0.10 -0.05 0.12 0.00 0.95 0.00 0.00 58.89 60.02 3hoa h TRP 66 Cb -0.01 -0.08 -0.08 0.00 -0.86 0.00 0.00 29.16 28.13 3hoa h TRP 66 CO -0.07 0.47 0.62 -0.07 -1.05 0.00 0.00 178.44 178.33 3hoa h LEU 67 N 0.03 0.86 -1.27 -4.49 3.38 -1.03 -0.70 115.31 112.09 3hoa h LEU 67 Ca 0.05 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 3hoa h LEU 67 Cb 0.34 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3hoa h LEU 67 CO 0.01 0.45 -0.31 -0.08 0.09 0.00 0.00 178.44 178.60 3hoa h GLU 68 N 0.92 0.09 -0.10 1.13 4.81 -1.16 -0.61 114.58 119.66 3hoa h GLU 68 Ca 0.48 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.50 3hoa h GLU 68 Cb 0.54 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 3hoa h GLU 68 CO -0.25 0.39 -0.72 0.87 -0.73 0.00 0.00 179.01 178.57 3hoa h LYS 69 N 0.08 0.48 0.14 1.92 1.79 -0.98 -3.33 116.57 116.66 3hoa h LYS 69 Ca 0.01 -0.38 -0.32 0.00 -2.18 0.00 0.00 60.65 57.78 3hoa h LYS 69 Cb 0.59 0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.32 3hoa h LYS 69 CO 0.04 1.01 -1.57 0.28 -1.08 0.00 0.00 179.45 178.14 3hoa h VAL 70 N 0.33 1.12 -3.14 0.50 2.07 -1.13 -3.43 116.25 112.57 3hoa h VAL 70 Ca -0.03 -2.74 -0.53 0.00 0.82 0.00 0.00 66.70 64.22 3hoa h VAL 70 Cb 1.30 2.78 0.07 0.00 -1.52 0.00 0.00 31.29 33.92 3hoa h VAL 70 CO 0.13 0.82 0.90 -1.61 0.02 0.00 0.00 177.57 177.83 3hoa s GLU 71 N -2.61 4.15 0.00 1.57 2.02 -0.26 -1.68 118.70 121.89 3hoa s GLU 71 Ca -0.10 2.53 0.00 0.00 0.02 0.00 0.00 54.97 57.42 3hoa s GLU 71 Cb 0.06 -3.06 0.00 0.00 0.10 0.00 0.00 34.13 31.24 3hoa s GLU 71 CO 0.86 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.92 3hoa n GLY 72 N 2.71 1.32 3.96 -1.39 0.00 -1.26 -4.94 105.19 105.59 3hoa n GLY 72 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 3hoa n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hoa s SER 73 N -3.16 4.15 0.53 1.61 1.04 -0.68 -4.98 113.70 112.21 3hoa s SER 73 Ca 0.00 0.02 0.30 0.00 0.48 0.00 0.00 55.95 56.75 3hoa s SER 73 Cb 0.00 -0.39 1.46 0.00 0.10 0.00 0.00 66.02 67.19 3hoa s SER 73 CO 0.00 -2.02 2.05 -0.65 0.98 0.00 0.00 173.24 173.60 3hoa h PRO 74 N -0.83 0.00 -0.00 4.02 0.11 -1.96 -2.99 132.00 130.35 3hoa h PRO 74 Ca -0.41 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.69 3hoa h PRO 74 Cb 1.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 3hoa h PRO 74 CO 0.45 0.10 -0.07 -0.07 -0.21 0.00 0.00 178.00 178.20 3hoa h LEU 75 N 0.00 0.00 -3.12 2.35 3.38 -1.94 -3.01 115.31 112.97 3hoa h LEU 75 Ca -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hoa h LEU 75 Cb 0.40 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3hoa h LEU 75 CO 0.01 0.07 0.00 1.33 0.09 0.00 0.00 178.44 179.94 3hoa n VAL 76 N -4.46 1.87 -0.35 1.22 0.24 -1.13 -4.29 118.33 111.43 3hoa n VAL 76 Ca -0.03 -1.70 -0.01 0.00 -2.04 0.00 0.00 64.34 60.56 3hoa n VAL 76 Cb 0.15 -0.04 0.12 0.00 -1.47 0.00 0.00 33.84 32.60 3hoa n VAL 76 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 3hoa h GLN 77 N 1.44 1.17 -5.97 7.34 4.20 -1.58 -3.36 115.11 118.35 3hoa h GLN 77 Ca 0.00 -0.07 -0.61 0.00 0.06 0.00 0.00 58.65 58.03 3hoa h GLN 77 Cb 1.16 -0.26 -0.11 0.00 0.30 0.00 0.00 27.48 28.57 3hoa h GLN 77 CO 0.13 0.77 0.49 0.34 -0.67 0.00 0.00 178.83 179.88 3hoa s ASP 78 N -5.97 6.53 0.65 1.46 3.68 -1.26 -4.93 116.67 116.83 3hoa s ASP 78 Ca -0.13 0.23 0.42 0.00 2.13 0.00 0.00 52.55 55.20 3hoa s ASP 78 Cb 0.18 -2.43 2.25 0.00 -1.45 0.00 0.00 42.92 41.48 3hoa s ASP 78 CO 0.81 -0.90 2.32 1.55 0.13 0.00 0.00 175.17 179.08 3hoa h PRO 79 N 8.77 0.00 -0.04 4.34 0.13 -1.97 -2.05 132.00 141.18 3hoa h PRO 79 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 3hoa h PRO 79 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3hoa h PRO 79 CO 0.97 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 180.03 3hoa n LEU 80 N -3.18 2.33 -4.77 1.56 4.77 -1.26 -4.27 117.00 112.17 3hoa n LEU 80 Ca -0.03 -0.80 -0.32 0.00 -0.03 0.00 0.00 56.01 54.83 3hoa n LEU 80 Cb 0.10 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 41.23 3hoa n LEU 80 CO 0.22 0.40 0.73 -0.94 -1.33 0.00 0.00 177.39 176.46 3hoa s SER 81 N -1.96 4.98 0.17 -1.43 1.04 -0.77 -4.86 113.70 110.86 3hoa s SER 81 Ca 0.33 1.92 -0.15 0.00 0.48 0.00 0.00 55.95 58.53 3hoa s SER 81 Cb 0.20 -2.54 0.12 0.00 0.10 0.00 0.00 66.02 63.90 3hoa s SER 81 CO 0.31 -1.71 1.73 0.44 0.98 0.00 0.00 173.24 174.99 3hoa h ASP 82 N -0.32 0.07 0.05 7.02 3.45 -1.93 -1.78 116.42 122.98 3hoa h ASP 82 Ca -0.46 0.06 0.01 0.00 0.43 0.00 0.00 57.03 57.08 3hoa h ASP 82 Cb 1.24 0.07 -0.02 0.00 -0.56 0.00 0.00 39.33 40.06 3hoa h ASP 82 CO 0.54 0.07 -0.10 0.00 -1.57 0.00 0.00 179.24 178.18 3hoa h ALA 83 N 1.30 -0.15 -0.41 3.45 0.00 -1.92 -1.75 119.26 119.79 3hoa h ALA 83 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hoa h ALA 83 Cb 0.23 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3hoa h ALA 83 CO -0.24 -0.61 0.26 0.00 0.00 0.00 0.00 179.25 178.66 3hoa h ALA 84 N 0.74 0.52 -0.22 0.00 0.00 -1.70 0.32 119.26 118.91 3hoa h ALA 84 Ca 0.02 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.93 3hoa h ALA 84 Cb 0.21 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3hoa h ALA 84 CO -0.06 -0.01 -0.07 0.28 0.00 0.00 0.00 179.25 179.39 3hoa h VAL 85 N 0.54 0.76 -0.57 0.00 2.07 -1.22 -0.45 116.25 117.38 3hoa h VAL 85 Ca 0.15 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.57 3hoa h VAL 85 Cb -0.03 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 3hoa h VAL 85 CO -0.03 0.00 -0.01 0.78 0.02 0.00 0.00 177.57 178.33 3hoa h ASN 86 N -0.02 0.99 -0.36 0.57 2.35 -1.04 -2.29 115.58 115.79 3hoa h ASN 86 Ca 0.11 -0.31 -0.07 0.00 -0.55 0.00 0.00 56.30 55.48 3hoa h ASN 86 Cb 0.18 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 3hoa h ASN 86 CO -0.24 1.06 -0.04 0.58 -1.65 0.00 0.00 177.43 177.15 3hoa h VAL 87 N 0.90 1.27 0.08 2.81 2.07 -0.69 0.92 116.25 123.60 3hoa h VAL 87 Ca 0.16 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.64 3hoa h VAL 87 Cb 0.56 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 3hoa h VAL 87 CO 0.03 0.35 -0.14 -0.09 0.02 0.00 0.00 177.57 177.74 3hoa h ARG 88 N 0.46 -0.26 -0.25 1.57 2.43 -1.04 -1.08 114.38 116.21 3hoa h ARG 88 Ca 0.10 0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 3hoa h ARG 88 Cb 0.52 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 3hoa h ARG 88 CO 0.03 -0.17 -0.22 0.93 -1.51 0.00 0.00 179.97 179.02 3hoa h GLU 89 N -0.27 0.46 -0.38 0.20 4.39 -1.34 -2.52 114.58 115.11 3hoa h GLU 89 Ca 0.02 -0.16 -0.13 0.00 0.34 0.00 0.00 59.36 59.43 3hoa h GLU 89 Cb 0.29 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3hoa h GLU 89 CO -0.08 0.65 -0.29 -1.49 -1.16 0.00 0.00 179.01 176.65 3hoa h TRP 90 N 0.41 0.94 -0.57 4.33 6.55 -0.49 -1.54 115.95 125.58 3hoa h TRP 90 Ca 0.07 -0.24 -0.05 0.00 0.95 0.00 0.00 58.89 59.61 3hoa h TRP 90 Cb 0.61 -0.21 -0.02 0.00 -0.86 0.00 0.00 29.16 28.68 3hoa h TRP 90 CO 0.02 1.00 0.15 -0.09 -1.05 0.00 0.00 178.44 178.46 3hoa h ARG 91 N 0.69 0.90 -0.10 0.49 9.65 -1.04 0.74 114.38 125.71 3hoa h ARG 91 Ca 0.08 -0.21 -0.01 0.00 -1.10 0.00 0.00 59.98 58.74 3hoa h ARG 91 Cb 0.83 -0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 29.28 3hoa h ARG 91 CO 0.07 0.84 0.04 0.37 2.80 0.00 0.00 179.97 184.09 3hoa h GLN 92 N 0.81 0.16 -0.77 0.20 4.15 -1.31 -0.50 115.11 117.85 3hoa h GLN 92 Ca 0.18 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.54 3hoa h GLN 92 Cb 0.33 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.96 3hoa h GLN 92 CO 0.00 0.26 0.34 0.00 -1.93 0.00 0.00 178.83 177.50 3hoa h ALA 93 N 0.89 1.15 -0.21 3.38 0.00 -1.16 -1.36 119.26 121.94 3hoa h ALA 93 Ca 0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3hoa h ALA 93 Cb 0.16 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3hoa h ALA 93 CO -0.00 0.63 0.10 -0.92 0.00 0.00 0.00 179.25 179.05 3hoa h TYR 94 N 1.10 0.31 -0.28 0.00 3.20 -0.66 -0.05 116.97 120.60 3hoa h TYR 94 Ca 0.26 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.06 3hoa h TYR 94 Cb 0.16 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 3hoa h TYR 94 CO 0.02 0.32 -0.06 0.93 -1.64 0.00 0.00 178.16 177.74 3hoa h GLU 95 N 0.21 0.43 0.36 1.82 4.39 -0.83 -1.53 114.58 119.43 3hoa h GLU 95 Ca 0.07 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.66 3hoa h GLU 95 Cb 0.13 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 3hoa h GLU 95 CO -0.01 0.51 -0.17 0.00 -1.16 0.00 0.00 179.01 178.18 3hoa h ARG 96 N 0.41 -0.46 -0.76 2.33 2.47 -0.97 -1.95 114.38 115.46 3hoa h ARG 96 Ca 0.09 0.03 0.15 0.00 -1.26 0.00 0.00 59.98 58.99 3hoa h ARG 96 Cb 0.36 0.11 -0.10 0.00 -1.65 0.00 0.00 29.97 28.69 3hoa h ARG 96 CO 0.02 -0.14 0.29 0.00 0.56 0.00 0.00 179.97 180.70 3hoa h ALA 97 N -0.46 1.07 -0.11 0.04 0.00 -0.88 -1.10 119.26 117.82 3hoa h ALA 97 Ca -0.05 0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 3hoa h ALA 97 Cb 0.53 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3hoa h ALA 97 CO 0.08 -0.23 -0.47 0.00 0.00 0.00 0.00 179.25 178.63 3hoa h ARG 98 N 0.42 0.27 -0.43 0.00 3.08 -1.30 -3.25 114.38 113.18 3hoa h ARG 98 Ca 0.42 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 60.25 3hoa h ARG 98 Cb 0.66 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 3hoa h ARG 98 CO -0.42 0.69 -0.04 0.00 -1.07 0.00 0.00 179.97 179.13 3hoa h ALA 99 N 1.29 0.59 -1.99 0.04 0.00 -0.39 -3.42 119.26 115.37 3hoa h ALA 99 Ca 0.01 -0.29 -0.57 0.00 0.00 0.00 0.00 54.91 54.06 3hoa h ALA 99 Cb 0.91 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 3hoa h ALA 99 CO 0.07 0.41 0.89 0.42 0.00 0.00 0.00 179.25 181.04 3hoa s ILE 100 N -4.93 4.39 0.38 0.00 1.01 -0.93 -4.99 121.20 116.13 3hoa s ILE 100 Ca -0.13 1.61 -0.27 0.00 0.00 0.00 0.00 60.65 61.86 3hoa s ILE 100 Cb 0.11 -4.27 -0.11 0.00 0.01 0.00 0.00 42.46 38.19 3hoa s ILE 100 CO 0.81 -0.40 1.37 -2.65 0.00 0.00 0.00 174.94 174.07 3hoa n PRO 101 N 6.91 2.30 -0.22 2.79 -0.02 -1.26 -4.86 135.00 140.64 3hoa n PRO 101 Ca 0.13 0.81 0.08 0.00 -2.02 0.00 0.00 63.50 62.50 3hoa n PRO 101 Cb 0.47 -2.49 0.35 0.00 -0.02 0.00 0.00 33.50 31.81 3hoa n PRO 101 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3hoa h GLU 102 N 2.58 0.74 -0.46 -0.52 4.22 -1.94 -1.89 114.58 117.30 3hoa h GLU 102 Ca -0.48 -0.04 -0.11 0.00 0.08 0.00 0.00 59.36 58.80 3hoa h GLU 102 Cb 1.27 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 3hoa h GLU 102 CO 0.62 0.49 -0.14 0.00 -2.18 0.00 0.00 179.01 177.80 3hoa h ARG 103 N 0.76 0.87 -0.23 1.92 2.47 -1.99 -2.00 114.38 116.18 3hoa h ARG 103 Ca 0.36 -0.32 -0.06 0.00 -1.26 0.00 0.00 59.98 58.70 3hoa h ARG 103 Cb 0.40 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 3hoa h ARG 103 CO -0.14 0.96 -0.08 1.25 0.56 0.00 0.00 179.97 182.52 3hoa h LEU 104 N 0.78 0.47 -0.71 3.04 5.85 -1.73 -0.70 115.31 122.30 3hoa h LEU 104 Ca 0.12 -0.38 0.02 0.00 0.84 0.00 0.00 57.88 58.48 3hoa h LEU 104 Cb 0.66 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 3hoa h LEU 104 CO 0.05 0.75 0.46 0.00 -0.34 0.00 0.00 178.44 179.35 3hoa h ALA 105 N 0.74 0.93 0.28 1.25 0.00 -1.35 0.22 119.26 121.32 3hoa h ALA 105 Ca 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3hoa h ALA 105 Cb 0.56 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hoa h ALA 105 CO 0.03 0.26 -0.13 0.28 0.00 0.00 0.00 179.25 179.69 3hoa h VAL 106 N 0.91 0.74 -0.65 0.00 2.07 -1.28 -0.99 116.25 117.04 3hoa h VAL 106 Ca 0.28 -0.63 0.08 0.00 0.82 0.00 0.00 66.70 67.25 3hoa h VAL 106 Cb -0.02 1.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.75 3hoa h VAL 106 CO -0.09 0.12 0.31 -0.33 0.02 0.00 0.00 177.57 177.60 3hoa h GLU 107 N -0.73 0.53 -0.61 1.57 5.08 -0.99 -0.26 114.58 119.18 3hoa h GLU 107 Ca -0.04 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 3hoa h GLU 107 Cb 0.49 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 3hoa h GLU 107 CO 0.06 0.35 0.38 1.25 -1.00 0.00 0.00 179.01 180.05 3hoa h LEU 108 N 0.55 0.72 -1.02 1.33 5.85 -0.52 0.29 115.31 122.50 3hoa h LEU 108 Ca 0.31 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 3hoa h LEU 108 Cb 0.31 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 3hoa h LEU 108 CO -0.25 0.55 0.23 0.00 -0.34 0.00 0.00 178.44 178.63 3hoa h ALA 109 N 1.20 1.22 -0.10 1.25 0.00 -0.25 -1.39 119.26 121.19 3hoa h ALA 109 Ca 0.22 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.74 3hoa h ALA 109 Cb -0.04 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.50 3hoa h ALA 109 CO -0.04 0.56 -0.80 0.37 0.00 0.00 0.00 179.25 179.34 3hoa h GLN 110 N 0.91 0.62 -0.42 0.00 4.15 -0.48 -1.88 115.11 118.01 3hoa h GLN 110 Ca 0.21 -0.53 -0.05 0.00 0.77 0.00 0.00 58.65 59.05 3hoa h GLN 110 Cb 0.21 0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 3hoa h GLN 110 CO -0.01 1.15 0.05 0.00 -1.93 0.00 0.00 178.83 178.09 3hoa h ALA 111 N 0.69 1.30 -0.02 3.38 0.00 -0.12 -1.59 119.26 122.91 3hoa h ALA 111 Ca -0.05 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 3hoa h ALA 111 Cb 1.41 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 19.04 3hoa h ALA 111 CO 0.15 0.48 -0.50 0.93 0.00 0.00 0.00 179.25 180.32 3hoa h GLU 112 N 0.63 0.37 -0.53 0.00 5.08 -1.24 -0.40 114.58 118.49 3hoa h GLU 112 Ca 0.14 -0.37 0.06 0.00 -1.00 0.00 0.00 59.36 58.19 3hoa h GLU 112 Cb 0.32 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.62 3hoa h GLU 112 CO 0.01 1.05 0.22 1.03 -1.00 0.00 0.00 179.01 180.32 3hoa h SER 113 N -0.17 0.27 -0.23 1.42 0.87 -1.20 0.11 113.55 114.62 3hoa h SER 113 Ca -0.06 0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.47 3hoa h SER 113 Cb 1.21 0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 63.17 3hoa h SER 113 CO 0.10 0.18 -0.18 -0.33 -0.53 0.00 0.00 176.83 176.08 3hoa h GLU 114 N 0.43 0.52 -0.79 2.24 5.08 -1.33 -1.99 114.58 118.75 3hoa h GLU 114 Ca 0.25 -0.26 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 3hoa h GLU 114 Cb 0.23 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 3hoa h GLU 114 CO -0.22 0.83 0.51 0.00 -1.00 0.00 0.00 179.01 179.13 3hoa h ALA 115 N 0.68 1.02 -0.23 3.43 0.00 -0.63 -1.68 119.26 121.86 3hoa h ALA 115 Ca 0.04 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3hoa h ALA 115 Cb 0.71 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3hoa h ALA 115 CO 0.05 0.35 -0.02 0.93 0.00 0.00 0.00 179.25 180.56 3hoa h GLU 116 N 1.01 0.41 0.20 0.00 5.08 -0.76 -1.31 114.58 119.21 3hoa h GLU 116 Ca 0.31 -0.14 0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3hoa h GLU 116 Cb -0.04 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 3hoa h GLU 116 CO -0.09 0.61 -0.27 1.03 -1.00 0.00 0.00 179.01 179.29 3hoa h SER 117 N 0.17 -0.74 -0.20 1.42 0.87 -1.08 -1.95 113.55 112.03 3hoa h SER 117 Ca 0.06 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.68 3hoa h SER 117 Cb 0.44 0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 3hoa h SER 117 CO 0.01 -0.37 0.07 0.15 -0.53 0.00 0.00 176.83 176.17 3hoa h PHE 118 N -0.53 0.37 0.79 2.24 3.57 -1.34 -3.23 116.94 118.81 3hoa h PHE 118 Ca 0.01 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 3hoa h PHE 118 Cb 0.52 -0.12 0.01 0.00 2.79 0.00 0.00 35.95 39.15 3hoa h PHE 118 CO -0.21 0.33 -0.38 2.35 -2.23 0.00 0.00 178.31 178.17 3hoa h TRP 119 N 0.38 -0.98 0.00 0.41 7.01 -0.55 0.29 115.95 122.50 3hoa h TRP 119 Ca 0.09 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.07 3hoa h TRP 119 Cb 0.13 0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.52 3hoa h TRP 119 CO 0.00 -0.61 0.09 -0.85 -2.79 0.00 0.00 178.44 174.29 3hoa n GLU 120 N -5.00 0.00 -0.04 2.65 0.28 -0.80 0.33 120.64 118.06 3hoa n GLU 120 Ca -0.13 0.19 -0.04 0.00 -0.16 0.00 0.00 57.16 57.02 3hoa n GLU 120 Cb 0.42 -1.59 -0.06 0.00 1.43 0.00 0.00 31.44 31.64 3hoa n GLU 120 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 3hoa n GLU 121 N -1.13 2.60 0.03 3.44 2.13 -1.12 -4.56 120.64 122.04 3hoa n GLU 121 Ca 0.00 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.95 3hoa n GLU 121 Cb 0.09 -1.19 0.38 0.00 0.27 0.00 0.00 31.44 30.99 3hoa n GLU 121 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hoa n ALA 122 N -2.31 2.80 -0.07 4.31 0.00 0.15 -3.70 120.51 121.69 3hoa n ALA 122 Ca -0.13 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 52.98 3hoa n ALA 122 Cb 0.74 -1.31 -0.13 0.00 0.00 0.00 0.00 19.45 18.76 3hoa n ALA 122 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3hoa h ARG 123 N 0.00 0.00 -0.30 0.00 2.43 -1.10 -2.42 114.38 112.98 3hoa h ARG 123 Ca 0.00 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.26 3hoa h ARG 123 Cb 0.59 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3hoa h ARG 123 CO 0.00 0.97 0.31 -1.35 -1.51 0.00 0.00 179.97 178.38 3hoa h PRO 124 N -1.00 0.00 -6.23 0.20 0.11 -1.80 -3.36 132.00 119.91 3hoa h PRO 124 Ca -0.02 0.00 -0.56 0.00 0.11 0.00 0.00 66.00 65.54 3hoa h PRO 124 Cb 0.98 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 3hoa h PRO 124 CO -0.01 0.00 -0.29 0.50 -0.21 0.00 0.00 178.00 177.99 3hoa s ARG 125 N -4.69 3.60 -0.37 1.05 3.52 -1.20 -4.96 118.95 115.89 3hoa s ARG 125 Ca -0.05 -0.14 -0.01 0.00 -0.13 0.00 0.00 55.73 55.40 3hoa s ARG 125 Cb 0.16 -2.81 0.24 0.00 -1.56 0.00 0.00 34.95 30.97 3hoa s ARG 125 CO 0.57 0.41 2.06 -3.47 -0.81 0.00 0.00 175.30 174.06 3hoa n ASP 126 N -0.27 6.63 -4.49 -2.12 2.03 -1.25 -4.72 116.55 112.35 3hoa n ASP 126 Ca -0.03 -3.16 -0.43 0.00 0.52 0.00 0.00 54.79 51.69 3hoa n ASP 126 Cb 0.53 -1.06 -0.03 0.00 -0.72 0.00 0.00 41.12 39.84 3hoa n ASP 126 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3hoa s ASP 127 N -0.05 6.51 -0.06 1.67 3.68 -0.92 -4.74 116.67 122.76 3hoa s ASP 127 Ca 0.36 -1.65 0.18 0.00 2.13 0.00 0.00 52.55 53.57 3hoa s ASP 127 Cb 0.28 -2.46 -0.22 0.00 -1.45 0.00 0.00 42.92 39.07 3hoa s ASP 127 CO -0.02 -1.28 0.47 1.87 0.13 0.00 0.00 175.17 176.34 3hoa n TRP 128 N 7.54 0.43 0.15 -5.34 -0.00 -1.26 -3.71 117.44 115.25 3hoa n TRP 128 Ca 0.22 0.14 0.01 0.00 -0.00 0.00 0.00 57.50 57.87 3hoa n TRP 128 Cb 0.49 -0.94 0.29 0.00 -0.00 0.00 0.00 31.31 31.15 3hoa n TRP 128 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 177.69 177.60 3hoa h ARG 129 N 0.00 0.06 0.07 5.87 2.43 -1.98 -0.69 114.38 120.14 3hoa h ARG 129 Ca -0.27 -0.03 -0.28 0.00 -0.81 0.00 0.00 59.98 58.59 3hoa h ARG 129 Cb 1.72 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 31.25 3hoa h ARG 129 CO 0.03 0.48 -1.42 0.78 -1.51 0.00 0.00 179.97 178.34 3hoa h GLY 130 N 1.28 0.16 1.56 2.80 0.00 -1.97 -3.37 103.07 103.55 3hoa h GLY 130 Ca 0.00 -0.41 -0.25 0.00 0.00 0.00 0.00 47.33 46.67 3hoa h GLY 130 CO 0.06 0.36 -1.06 -2.75 0.00 0.00 0.00 176.54 173.15 3hoa h PHE 131 N 0.04 0.58 -0.84 5.60 3.57 -1.61 -3.36 116.94 120.92 3hoa h PHE 131 Ca -0.19 -0.35 0.20 0.00 3.53 0.00 0.00 57.97 61.16 3hoa h PHE 131 Cb 1.95 -0.05 -0.15 0.00 2.79 0.00 0.00 35.95 40.49 3hoa h PHE 131 CO 0.04 1.21 0.02 1.25 -2.23 0.00 0.00 178.31 178.59 3hoa h LEU 132 N 0.18 -0.37 -0.85 0.59 5.85 -1.28 -0.06 115.31 119.36 3hoa h LEU 132 Ca -0.10 0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.89 3hoa h LEU 132 Cb 1.72 0.38 -0.06 0.00 0.37 0.00 0.00 40.66 43.08 3hoa h LEU 132 CO 0.18 -0.23 0.54 -0.65 -0.34 0.00 0.00 178.44 177.94 3hoa h PRO 133 N 0.09 0.98 -0.57 5.25 0.11 -1.79 0.14 132.00 136.22 3hoa h PRO 133 Ca 0.48 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.44 3hoa h PRO 133 Cb 0.89 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.75 3hoa h PRO 133 CO -0.75 0.65 0.01 1.88 -0.21 0.00 0.00 178.00 179.58 3hoa h TYR 134 N 1.01 1.05 -0.28 0.65 -1.99 -1.26 -2.56 116.97 113.58 3hoa h TYR 134 Ca 0.36 -0.17 -0.05 0.00 2.00 0.00 0.00 58.73 60.87 3hoa h TYR 134 Cb 0.11 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 38.55 3hoa h TYR 134 CO -0.03 0.93 -0.02 1.25 -0.00 0.00 0.00 178.16 180.30 3hoa h LEU 135 N 0.89 0.50 -1.35 3.88 5.85 -0.63 -2.48 115.31 121.98 3hoa h LEU 135 Ca 0.16 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3hoa h LEU 135 Cb 0.52 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 3hoa h LEU 135 CO 0.03 0.71 0.39 0.11 -0.34 0.00 0.00 178.44 179.34 3hoa h LYS 136 N 0.29 0.83 0.20 1.25 1.57 -0.90 0.29 116.57 120.10 3hoa h LYS 136 Ca 0.08 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hoa h LYS 136 Cb 0.46 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.59 3hoa h LYS 136 CO 0.02 0.57 -0.09 -0.09 -0.57 0.00 0.00 179.45 179.28 3hoa h ARG 137 N 0.86 -0.26 -0.59 3.15 2.43 -1.34 0.11 114.38 118.73 3hoa h ARG 137 Ca 0.23 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.47 3hoa h ARG 137 Cb -0.06 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 3hoa h ARG 137 CO -0.05 0.05 0.30 0.28 -1.51 0.00 0.00 179.97 179.05 3hoa h VAL 138 N -0.57 0.93 0.09 0.20 2.07 -1.08 -1.08 116.25 116.80 3hoa h VAL 138 Ca -0.03 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 3hoa h VAL 138 Cb 0.42 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 3hoa h VAL 138 CO 0.04 0.10 -0.04 0.22 0.02 0.00 0.00 177.57 177.92 3hoa h TYR 139 N 0.56 -0.11 -0.61 1.57 3.20 -0.34 0.28 116.97 121.53 3hoa h TYR 139 Ca 0.27 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.21 3hoa h TYR 139 Cb 0.20 0.04 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 3hoa h TYR 139 CO -0.10 -0.05 0.28 0.00 -1.64 0.00 0.00 178.16 176.65 3hoa h ALA 140 N 0.78 0.80 -0.06 1.82 0.00 -0.34 0.59 119.26 122.85 3hoa h ALA 140 Ca -0.01 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3hoa h ALA 140 Cb 0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3hoa h ALA 140 CO 0.02 -0.11 -0.54 -0.07 0.00 0.00 0.00 179.25 178.55 3hoa h LEU 141 N 0.50 0.19 -0.60 0.00 3.38 -1.03 -2.52 115.31 115.23 3hoa h LEU 141 Ca 0.29 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 58.02 3hoa h LEU 141 Cb 0.28 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3hoa h LEU 141 CO -0.24 0.69 -0.44 0.74 0.09 0.00 0.00 178.44 179.28 3hoa h THR 142 N 0.13 1.30 -0.16 0.22 2.02 0.02 -2.01 112.91 114.42 3hoa h THR 142 Ca 0.00 -1.63 -0.09 0.00 0.77 0.00 0.00 66.41 65.46 3hoa h THR 142 Cb 0.99 1.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.98 3hoa h THR 142 CO 0.08 0.51 -0.32 0.50 0.37 0.00 0.00 175.52 176.67 3hoa h LYS 143 N 0.49 0.32 -0.43 6.66 3.64 -0.73 -1.38 116.57 125.14 3hoa h LYS 143 Ca 0.03 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.19 3hoa h LYS 143 Cb 0.96 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 3hoa h LYS 143 CO 0.09 0.61 -0.13 1.49 -2.27 0.00 0.00 179.45 179.23 3hoa h GLU 144 N 0.28 0.84 -0.25 1.90 4.81 -1.23 -0.68 114.58 120.25 3hoa h GLU 144 Ca 0.04 -0.33 -0.00 0.00 -0.13 0.00 0.00 59.36 58.93 3hoa h GLU 144 Cb 0.70 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 3hoa h GLU 144 CO 0.05 0.97 0.16 -0.22 -0.73 0.00 0.00 179.01 179.24 3hoa h LYS 145 N 0.66 0.34 -0.63 1.92 3.64 -1.06 -1.65 116.57 119.80 3hoa h LYS 145 Ca 0.10 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.51 3hoa h LYS 145 Cb 0.67 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.37 3hoa h LYS 145 CO 0.05 0.26 0.34 0.00 -2.27 0.00 0.00 179.45 177.83 3hoa h ALA 146 N 1.06 0.83 -0.75 5.00 0.00 -1.05 -1.62 119.26 122.74 3hoa h ALA 146 Ca 0.09 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3hoa h ALA 146 Cb 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 3hoa h ALA 146 CO -0.02 0.01 0.28 0.93 0.00 0.00 0.00 179.25 180.46 3hoa h GLU 147 N 0.63 1.12 0.27 0.00 5.08 -0.76 0.25 114.58 121.18 3hoa h GLU 147 Ca 0.28 -0.21 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3hoa h GLU 147 Cb 0.17 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hoa h GLU 147 CO -0.18 0.92 -0.13 0.28 -1.00 0.00 0.00 179.01 178.90 3hoa h VAL 148 N 1.09 0.77 -0.30 3.13 2.07 -0.78 -2.29 116.25 119.95 3hoa h VAL 148 Ca 0.25 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.33 3hoa h VAL 148 Cb 0.23 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3hoa h VAL 148 CO -0.02 0.09 0.01 -0.07 0.02 0.00 0.00 177.57 177.60 3hoa h LEU 149 N -0.58 0.41 -1.16 2.57 3.38 -1.20 -2.74 115.31 116.01 3hoa h LEU 149 Ca -0.04 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 3hoa h LEU 149 Cb 0.42 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 3hoa h LEU 149 CO 0.06 0.47 -0.38 0.15 0.09 0.00 0.00 178.44 178.84 3hoa h PHE 150 N 0.43 0.00 0.00 1.13 3.57 -0.43 -2.60 116.94 119.05 3hoa h PHE 150 Ca 0.10 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.60 3hoa h PHE 150 Cb 0.27 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.01 3hoa h PHE 150 CO 0.01 0.38 0.00 0.00 -2.23 0.00 0.00 178.31 176.47 3hoa n ALA 151 N -2.38 2.36 -2.85 2.41 0.00 -0.87 -4.80 120.51 114.38 3hoa n ALA 151 Ca -0.01 -0.12 -0.29 0.00 0.00 0.00 0.00 53.44 53.01 3hoa n ALA 151 Cb 0.45 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.40 3hoa n ALA 151 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3hoa s LEU 152 N -2.69 4.06 0.47 0.00 1.43 -0.98 -5.08 118.68 115.88 3hoa s LEU 152 Ca 0.23 0.08 -0.24 0.00 -1.03 0.00 0.00 54.13 53.18 3hoa s LEU 152 Cb 0.19 -2.68 -0.07 0.00 0.03 0.00 0.00 46.19 43.65 3hoa s LEU 152 CO 0.45 0.13 1.27 -2.16 0.23 0.00 0.00 176.35 176.28 3hoa s PRO 153 N -2.69 3.65 1.21 1.29 0.04 -1.26 -5.00 135.00 132.24 3hoa s PRO 153 Ca 0.32 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 63.23 3hoa s PRO 153 Cb -0.12 -2.49 0.29 0.00 0.04 0.00 0.00 34.50 32.22 3hoa s PRO 153 CO 0.25 -0.72 1.07 -1.25 0.04 0.00 0.00 177.00 176.39 3hoa s PRO 154 N -2.59 -1.24 0.37 0.56 0.04 -1.26 -4.94 135.00 125.93 3hoa s PRO 154 Ca 0.63 0.12 -0.27 0.00 0.04 0.00 0.00 61.00 61.52 3hoa s PRO 154 Cb -0.36 -1.58 -0.10 0.00 0.04 0.00 0.00 34.50 32.51 3hoa s PRO 154 CO 0.44 -3.76 1.32 0.00 0.04 0.00 0.00 177.00 175.04 3hoa s ALA 155 N -2.84 3.39 0.28 8.56 0.00 -1.26 -4.90 121.76 124.99 3hoa s ALA 155 Ca 0.69 1.28 -0.29 0.00 0.00 0.00 0.00 51.96 53.64 3hoa s ALA 155 Cb -0.13 -3.50 -0.14 0.00 0.00 0.00 0.00 23.12 19.36 3hoa s ALA 155 CO 0.57 -0.77 1.14 -2.30 0.00 0.00 0.00 175.76 174.41 3hoa n PRO 156 N 0.45 1.59 0.00 0.00 -0.02 -1.26 -1.32 135.00 134.44 3hoa n PRO 156 Ca 0.02 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 3hoa n PRO 156 Cb 0.42 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 3hoa n PRO 156 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hoa n GLY 157 N 1.34 2.80 3.86 -1.23 0.00 -1.26 -5.03 105.19 105.68 3hoa n GLY 157 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 3hoa n GLY 157 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hoa s ASP 158 N -1.56 6.72 0.74 1.61 1.11 -0.43 -5.06 116.67 119.79 3hoa s ASP 158 Ca 0.00 1.08 -0.13 0.00 0.18 0.00 0.00 52.55 53.68 3hoa s ASP 158 Cb 0.00 -2.29 0.04 0.00 1.07 0.00 0.00 42.92 41.74 3hoa s ASP 158 CO 0.00 -0.09 1.12 -2.16 1.18 0.00 0.00 175.17 175.23 3hoa s PRO 159 N -2.71 2.31 0.83 8.23 0.04 -1.26 -4.83 135.00 137.61 3hoa s PRO 159 Ca 0.48 1.39 -0.11 0.00 0.04 0.00 0.00 61.00 62.80 3hoa s PRO 159 Cb -0.12 -1.89 0.10 0.00 0.04 0.00 0.00 34.50 32.63 3hoa s PRO 159 CO 0.20 -1.63 1.13 -1.25 0.04 0.00 0.00 177.00 175.49 3hoa s PRO 160 N -4.40 1.65 0.12 0.56 0.04 -1.26 -4.88 135.00 126.82 3hoa s PRO 160 Ca 0.66 1.41 -0.30 0.00 0.04 0.00 0.00 61.00 62.81 3hoa s PRO 160 Cb -0.21 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 3hoa s PRO 160 CO 0.49 -2.13 1.17 0.71 0.04 0.00 0.00 177.00 177.28 3hoa s TYR 161 N -2.69 3.47 -0.84 0.56 4.12 -1.26 -4.93 117.35 115.79 3hoa s TYR 161 Ca 0.65 1.40 0.24 0.00 0.02 0.00 0.00 57.07 59.38 3hoa s TYR 161 Cb -0.21 -3.38 0.22 0.00 -1.52 0.00 0.00 41.96 37.06 3hoa s TYR 161 CO 0.56 -1.09 1.19 0.41 0.02 0.00 0.00 175.55 176.64 3hoa n GLY 162 N 2.70 -1.21 3.61 0.71 0.00 -1.26 -4.99 105.19 104.75 3hoa n GLY 162 Ca 0.06 -0.40 -0.00 0.00 0.00 0.00 0.00 46.02 45.68 3hoa n GLY 162 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3hoa s GLU 163 N -3.08 0.27 0.27 1.61 -1.05 -1.26 -5.04 118.70 110.43 3hoa s GLU 163 Ca 0.08 -0.13 -0.04 0.00 -0.15 0.00 0.00 54.97 54.72 3hoa s GLU 163 Cb 0.16 0.10 0.54 0.00 -0.44 0.00 0.00 34.13 34.49 3hoa s GLU 163 CO 0.76 -0.12 1.61 1.25 0.95 0.00 0.00 175.26 179.71 3hoa h LEU 164 N 2.00 -0.46 -1.00 1.83 5.85 -1.94 -1.11 115.31 120.48 3hoa h LEU 164 Ca -0.21 0.24 0.16 0.00 0.84 0.00 0.00 57.88 58.91 3hoa h LEU 164 Cb 1.18 0.43 -0.10 0.00 0.37 0.00 0.00 40.66 42.54 3hoa h LEU 164 CO 0.26 -0.25 0.61 0.22 -0.34 0.00 0.00 178.44 178.93 3hoa h TYR 165 N 0.06 1.08 -0.43 1.25 3.20 -1.95 -1.70 116.97 118.49 3hoa h TYR 165 Ca 0.48 0.03 0.11 0.00 3.14 0.00 0.00 58.73 62.50 3hoa h TYR 165 Cb 0.89 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 3hoa h TYR 165 CO -0.49 0.32 0.31 -0.44 -1.64 0.00 0.00 178.16 176.21 3hoa h ASP 166 N 0.85 0.06 0.14 -2.11 3.32 -1.56 0.86 116.42 117.97 3hoa h ASP 166 Ca 0.54 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.57 3hoa h ASP 166 Cb 0.73 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.27 3hoa h ASP 166 CO -0.34 0.03 -0.11 0.00 -1.72 0.00 0.00 179.24 177.11 3hoa h ALA 167 N 1.78 1.71 0.11 3.45 0.00 -1.42 -0.36 119.26 124.54 3hoa h ALA 167 Ca 0.20 -0.10 -0.26 0.00 0.00 0.00 0.00 54.91 54.76 3hoa h ALA 167 Cb 0.73 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3hoa h ALA 167 CO -0.01 0.14 -1.29 -0.07 0.00 0.00 0.00 179.25 178.01 3hoa h LEU 168 N 0.00 0.38 -0.68 0.00 3.38 -0.98 -3.33 115.31 114.08 3hoa h LEU 168 Ca -0.00 -0.86 0.09 0.00 0.09 0.00 0.00 57.88 57.20 3hoa h LEU 168 Cb 0.21 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 3hoa h LEU 168 CO 0.01 1.57 0.33 -0.07 0.09 0.00 0.00 178.44 180.37 3hoa h LEU 169 N -0.35 0.42 -1.22 1.67 3.38 -1.09 -2.23 115.31 115.90 3hoa h LEU 169 Ca -0.27 0.06 0.12 0.00 0.09 0.00 0.00 57.88 57.88 3hoa h LEU 169 Cb 1.72 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 42.39 3hoa h LEU 169 CO 0.07 0.25 0.58 -0.78 0.09 0.00 0.00 178.44 178.64 3hoa h ASP 170 N 0.57 0.75 -0.60 -0.43 1.82 -1.20 0.12 116.42 117.44 3hoa h ASP 170 Ca 0.34 0.03 0.00 0.00 -0.39 0.00 0.00 57.03 57.01 3hoa h ASP 170 Cb 0.35 -0.12 -0.03 0.00 0.68 0.00 0.00 39.33 40.21 3hoa h ASP 170 CO -0.27 0.41 0.40 1.23 -1.61 0.00 0.00 179.24 179.40 3hoa h GLY 171 N 0.81 0.85 0.51 -0.78 0.00 -1.50 -2.49 103.07 100.48 3hoa h GLY 171 Ca 0.43 -0.32 -0.35 0.00 0.00 0.00 0.00 47.33 47.10 3hoa h GLY 171 CO -0.20 0.31 -2.06 -1.72 0.00 0.00 0.00 176.54 172.88 3hoa n TYR 172 N -4.44 0.72 -3.77 5.60 4.02 -0.84 -4.69 117.16 113.76 3hoa n TYR 172 Ca 0.06 0.20 -0.29 0.00 -0.01 0.00 0.00 57.90 57.86 3hoa n TYR 172 Cb 0.05 -1.11 -0.12 0.00 -0.02 0.00 0.00 39.34 38.13 3hoa n TYR 172 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3hoa s GLU 173 N -2.55 1.74 -0.39 -0.72 0.41 -0.03 -2.71 118.70 114.44 3hoa s GLU 173 Ca -0.16 -2.57 -0.43 0.00 -0.41 0.00 0.00 54.97 51.40 3hoa s GLU 173 Cb 0.07 -2.73 -0.18 0.00 -1.78 0.00 0.00 34.13 29.52 3hoa s GLU 173 CO 0.77 -1.23 1.70 -2.30 -0.49 0.00 0.00 175.26 173.71 3hoa n PRO 174 N 2.85 0.59 0.00 0.39 -0.02 -0.94 -0.81 135.00 137.06 3hoa n PRO 174 Ca 0.15 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 3hoa n PRO 174 Cb 0.36 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 3hoa n PRO 174 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hoa n GLY 175 N 4.22 2.29 3.77 -1.23 0.00 -1.26 -4.48 105.19 108.50 3hoa n GLY 175 Ca 0.29 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.94 3hoa n GLY 175 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hoa s MET 176 N -0.50 4.22 0.06 1.61 0.00 0.01 -4.66 119.30 120.03 3hoa s MET 176 Ca 0.00 1.69 0.02 0.00 0.00 0.00 0.00 55.69 57.40 3hoa s MET 176 Cb 0.00 -2.72 -0.03 0.00 0.00 0.00 0.00 34.83 32.08 3hoa s MET 176 CO 0.00 -0.14 -0.07 1.03 0.00 0.00 0.00 175.02 175.84 3hoa s ARG 177 N -2.21 0.60 0.60 4.11 1.81 -1.26 -4.10 118.95 118.51 3hoa s ARG 177 Ca 0.55 -0.90 0.31 0.00 -1.72 0.00 0.00 55.73 53.97 3hoa s ARG 177 Cb -0.27 -0.26 1.84 0.00 -0.45 0.00 0.00 34.95 35.81 3hoa s ARG 177 CO 0.34 0.03 2.21 0.00 -0.68 0.00 0.00 175.30 177.21 3hoa h ALA 178 N 4.11 1.54 -0.32 2.13 0.00 -1.95 -1.72 119.26 123.06 3hoa h ALA 178 Ca -0.36 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.61 3hoa h ALA 178 Cb 1.19 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 3hoa h ALA 178 CO 0.47 -0.10 0.02 -0.09 0.00 0.00 0.00 179.25 179.54 3hoa h ARG 179 N 0.00 0.11 0.00 0.00 2.43 -1.99 -2.21 114.38 112.72 3hoa h ARG 179 Ca 0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3hoa h ARG 179 Cb 0.17 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3hoa h ARG 179 CO -0.00 0.07 -0.48 1.49 -1.51 0.00 0.00 179.97 179.54 3hoa h GLU 180 N 0.12 0.00 0.07 0.20 4.81 -1.75 -3.38 114.58 114.64 3hoa h GLU 180 Ca 0.15 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3hoa h GLU 180 Cb 0.20 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.58 3hoa h GLU 180 CO -0.24 0.00 -0.03 -0.07 -0.73 0.00 0.00 179.01 177.94 3hoa h LEU 181 N 0.00 -0.07 -0.32 1.64 3.38 -1.04 -3.32 115.31 115.57 3hoa h LEU 181 Ca 0.00 -0.53 0.07 0.00 0.09 0.00 0.00 57.88 57.51 3hoa h LEU 181 Cb 0.99 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.68 3hoa h LEU 181 CO 0.00 0.55 -0.24 -0.07 0.09 0.00 0.00 178.44 178.77 3hoa h LEU 182 N -0.75 -0.78 -1.82 1.67 3.38 -1.59 -0.51 115.31 114.91 3hoa h LEU 182 Ca -0.01 0.15 0.08 0.00 0.09 0.00 0.00 57.88 58.19 3hoa h LEU 182 Cb 0.60 0.38 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 3hoa h LEU 182 CO 0.01 -0.27 0.28 1.55 0.09 0.00 0.00 178.44 180.11 3hoa h PRO 183 N -0.20 0.21 -0.34 1.13 0.13 -1.76 0.30 132.00 131.47 3hoa h PRO 183 Ca 0.16 -0.01 -0.14 0.00 -0.87 0.00 0.00 66.00 65.14 3hoa h PRO 183 Cb 0.46 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.54 3hoa h PRO 183 CO -0.44 0.14 -0.33 -0.07 -0.23 0.00 0.00 178.00 177.07 3hoa h LEU 184 N 0.22 0.88 -0.46 1.56 3.38 -1.25 -2.27 115.31 117.37 3hoa h LEU 184 Ca 0.18 -0.47 -0.17 0.00 0.09 0.00 0.00 57.88 57.52 3hoa h LEU 184 Cb 0.45 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3hoa h LEU 184 CO -0.03 1.17 -0.64 -0.26 0.09 0.00 0.00 178.44 178.77 3hoa h PHE 185 N 0.61 0.63 -0.26 1.13 -1.00 0.29 -1.21 116.94 117.13 3hoa h PHE 185 Ca 0.05 -0.25 -0.01 0.00 2.81 0.00 0.00 57.97 60.58 3hoa h PHE 185 Cb 0.92 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 40.36 3hoa h PHE 185 CO 0.07 0.99 0.12 0.00 -1.61 0.00 0.00 178.31 177.88 3hoa h ALA 186 N 0.95 0.34 0.07 2.45 0.00 -0.46 0.46 119.26 123.06 3hoa h ALA 186 Ca -0.01 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.83 3hoa h ALA 186 Cb 1.19 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 3hoa h ALA 186 CO 0.11 -0.10 -0.24 1.49 0.00 0.00 0.00 179.25 180.51 3hoa h GLU 187 N 0.29 -0.40 -0.64 0.00 4.81 -1.33 -1.36 114.58 115.94 3hoa h GLU 187 Ca 0.09 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.38 3hoa h GLU 187 Cb 0.12 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.55 3hoa h GLU 187 CO -0.01 -0.27 0.39 1.25 -0.73 0.00 0.00 179.01 179.64 3hoa h LEU 188 N -0.42 0.62 -0.82 1.64 5.85 -0.90 -1.52 115.31 119.76 3hoa h LEU 188 Ca 0.04 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.77 3hoa h LEU 188 Cb 0.47 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.33 3hoa h LEU 188 CO -0.17 0.43 0.52 0.50 -0.34 0.00 0.00 178.44 179.37 3hoa h LYS 189 N 0.75 1.10 -0.11 1.25 3.64 0.32 0.34 116.57 123.86 3hoa h LYS 189 Ca 0.27 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 3hoa h LYS 189 Cb 0.06 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 31.64 3hoa h LYS 189 CO -0.12 0.76 0.03 1.49 -2.27 0.00 0.00 179.45 179.34 3hoa h GLU 190 N 1.12 0.18 -0.41 1.90 4.57 -0.83 -2.08 114.58 119.02 3hoa h GLU 190 Ca 0.30 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.38 3hoa h GLU 190 Cb -0.08 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 3hoa h GLU 190 CO -0.06 0.33 0.05 0.78 -1.18 0.00 0.00 179.01 178.93 3hoa h GLY 191 N -0.01 0.75 1.03 1.92 0.00 -0.98 -3.16 103.07 102.63 3hoa h GLY 191 Ca 0.04 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 3hoa h GLY 191 CO -0.00 0.48 0.05 1.41 0.00 0.00 0.00 176.54 178.48 3hoa h LEU 192 N 0.54 0.94 -0.44 3.11 3.38 -0.95 -2.91 115.31 118.98 3hoa h LEU 192 Ca 0.12 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 57.90 3hoa h LEU 192 Cb 0.41 -0.25 -0.09 0.00 0.09 0.00 0.00 40.66 40.82 3hoa h LEU 192 CO 0.01 0.98 -0.14 0.11 0.09 0.00 0.00 178.44 179.50 3hoa h LYS 193 N 0.86 -0.03 -0.44 1.13 1.79 -1.34 -1.69 116.57 116.84 3hoa h LYS 193 Ca 0.17 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.53 3hoa h LYS 193 Cb 0.47 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 3hoa h LYS 193 CO 0.02 -0.02 -0.15 0.78 -1.08 0.00 0.00 179.45 179.00 3hoa h GLY 194 N -0.03 0.89 1.11 3.86 0.00 -1.51 -2.91 103.07 104.48 3hoa h GLY 194 Ca 0.21 -0.71 -0.14 0.00 0.00 0.00 0.00 47.33 46.69 3hoa h GLY 194 CO -0.47 0.65 -0.25 -2.00 0.00 0.00 0.00 176.54 174.47 3hoa h LEU 195 N 0.73 1.03 -1.39 3.11 5.85 -1.26 -2.34 115.31 121.03 3hoa h LEU 195 Ca 0.11 -0.41 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 3hoa h LEU 195 Cb 0.66 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3hoa h LEU 195 CO 0.05 1.21 0.16 -0.07 -0.34 0.00 0.00 178.44 179.44 3hoa h LEU 196 N 0.84 0.51 0.00 2.25 3.38 -1.30 -0.69 115.31 120.31 3hoa h LEU 196 Ca 0.10 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3hoa h LEU 196 Cb 0.83 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.45 3hoa h LEU 196 CO 0.07 0.47 -0.00 0.44 0.09 0.00 0.00 178.44 179.52 3hoa h ASP 197 N 0.57 -0.00 -0.80 -0.43 3.32 -1.29 -1.03 116.42 116.76 3hoa h ASP 197 Ca 0.14 -0.32 0.04 0.00 0.02 0.00 0.00 57.03 56.92 3hoa h ASP 197 Cb 0.12 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.62 3hoa h ASP 197 CO -0.01 0.32 0.50 0.03 -1.72 0.00 0.00 179.24 178.35 3hoa h ARG 198 N -0.32 0.92 -0.59 3.56 3.08 -1.04 -0.25 114.38 119.73 3hoa h ARG 198 Ca -0.00 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 3hoa h ARG 198 Cb 0.32 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 3hoa h ARG 198 CO 0.00 0.61 0.25 0.82 -1.07 0.00 0.00 179.97 180.58 3hoa h ILE 199 N 0.95 1.22 0.02 2.04 2.04 -1.03 -1.22 117.51 121.53 3hoa h ILE 199 Ca 0.33 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 3hoa h ILE 199 Cb 0.08 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.72 3hoa h ILE 199 CO -0.14 0.26 -0.01 0.25 0.00 0.00 0.00 178.15 178.51 3hoa h LEU 200 N 0.81 -0.02 0.00 1.44 5.85 -0.58 -2.20 115.31 120.61 3hoa h LEU 200 Ca 0.20 -0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.65 3hoa h LEU 200 Cb 0.17 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3hoa h LEU 200 CO -0.02 0.25 0.00 0.61 -0.34 0.00 0.00 178.44 178.94 3hoa n GLY 201 N -0.36 -0.55 3.77 3.75 0.00 -0.16 -4.79 105.19 106.85 3hoa n GLY 201 Ca -0.08 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 3hoa n GLY 201 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hoa s SER 202 N -2.03 6.99 0.00 1.61 0.15 -0.47 -4.94 113.70 115.00 3hoa s SER 202 Ca 0.25 2.25 0.28 0.00 0.70 0.00 0.00 55.95 59.43 3hoa s SER 202 Cb 0.12 -2.62 1.07 0.00 -1.71 0.00 0.00 66.02 62.88 3hoa s SER 202 CO 0.20 -0.34 1.79 0.61 1.20 0.00 0.00 173.24 176.70 3hoa n GLY 203 N 0.88 -1.28 3.75 9.45 0.00 -1.26 -4.81 105.19 111.91 3hoa n GLY 203 Ca 0.01 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 3hoa n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hoa s LYS 204 N -2.83 4.34 -0.05 1.61 1.02 -1.26 -5.07 119.74 117.49 3hoa s LYS 204 Ca 0.18 0.72 0.01 0.00 0.02 0.00 0.00 55.97 56.90 3hoa s LYS 204 Cb 0.19 -3.37 0.02 0.00 -0.52 0.00 0.00 37.83 34.16 3hoa s LYS 204 CO 0.55 0.30 -0.04 0.50 -0.92 0.00 0.00 175.35 175.75 3hoa s ARG 205 N 0.03 0.79 0.47 1.68 3.52 -1.26 -4.94 118.95 119.24 3hoa s ARG 205 Ca 0.31 -0.07 -0.21 0.00 -0.13 0.00 0.00 55.73 55.64 3hoa s ARG 205 Cb -0.18 -0.87 -0.09 0.00 -1.56 0.00 0.00 34.95 32.26 3hoa s ARG 205 CO 0.17 -0.12 1.02 -1.25 -0.81 0.00 0.00 175.30 174.30 3hoa s PRO 206 N 1.11 3.89 -1.14 5.12 0.04 -1.26 -4.98 135.00 137.78 3hoa s PRO 206 Ca -0.08 1.32 -0.08 0.00 0.04 0.00 0.00 61.00 62.20 3hoa s PRO 206 Cb -0.14 -2.13 0.26 0.00 0.04 0.00 0.00 34.50 32.53 3hoa s PRO 206 CO -0.01 -0.35 1.40 -3.47 0.04 0.00 0.00 177.00 174.61 3hoa n ASP 207 N -0.87 5.71 0.32 6.66 -0.08 -1.26 -4.81 116.55 122.23 3hoa n ASP 207 Ca 0.09 -3.16 0.20 0.00 -1.51 0.00 0.00 54.79 50.40 3hoa n ASP 207 Cb 0.53 -1.39 1.09 0.00 2.34 0.00 0.00 41.12 43.69 3hoa n ASP 207 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 3hoa h THR 208 N 3.75 0.23 -0.55 5.18 2.02 -1.94 -2.40 112.91 119.19 3hoa h THR 208 Ca 0.24 -0.01 0.14 0.00 0.77 0.00 0.00 66.41 67.55 3hoa h THR 208 Cb 0.75 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 3hoa h THR 208 CO 1.24 0.00 0.39 -1.28 0.37 0.00 0.00 175.52 176.24 3hoa h SER 209 N 0.00 0.12 -0.66 4.18 0.87 -1.98 -1.14 113.55 114.94 3hoa h SER 209 Ca -0.00 0.01 0.03 0.00 -1.23 0.00 0.00 61.79 60.59 3hoa h SER 209 Cb 0.00 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 61.91 3hoa h SER 209 CO 0.00 0.06 0.41 0.40 -0.53 0.00 0.00 176.83 177.18 3hoa h ILE 210 N 0.13 1.10 0.00 2.23 2.04 -1.85 -1.73 117.51 119.42 3hoa h ILE 210 Ca 0.26 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3hoa h ILE 210 Cb 0.88 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 3hoa h ILE 210 CO -0.03 0.15 0.00 -0.07 0.00 0.00 0.00 178.15 178.20 3hoa h LEU 211 N 0.81 0.00 -2.87 1.44 3.38 -1.41 -2.65 115.31 114.01 3hoa h LEU 211 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3hoa h LEU 211 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hoa h LEU 211 CO -0.10 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.84 3hoa n HIS 212 N -2.40 1.07 -1.94 1.13 8.25 -0.65 -1.71 115.22 118.98 3hoa n HIS 212 Ca 0.00 -0.53 -0.30 0.00 -0.26 0.00 0.00 57.72 56.63 3hoa n HIS 212 Cb 0.16 -0.07 0.20 0.00 1.12 0.00 0.00 29.99 31.40 3hoa n HIS 212 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3hoa s ARG 213 N -1.23 0.50 0.32 -0.41 0.52 -1.00 -4.73 118.95 112.91 3hoa s ARG 213 Ca 0.48 -0.47 -0.28 0.00 -0.52 0.00 0.00 55.73 54.94 3hoa s ARG 213 Cb 0.27 -1.84 -0.09 0.00 0.52 0.00 0.00 34.95 33.81 3hoa s ARG 213 CO 0.30 -2.50 1.07 -1.25 0.02 0.00 0.00 175.30 172.93 3hoa s PRO 214 N -5.92 4.50 -0.34 3.54 0.04 -1.26 -4.24 135.00 131.31 3hoa s PRO 214 Ca 0.75 1.68 0.00 0.00 0.04 0.00 0.00 61.00 63.47 3hoa s PRO 214 Cb -0.03 -2.98 0.14 0.00 0.04 0.00 0.00 34.50 31.67 3hoa s PRO 214 CO 0.53 0.12 0.24 0.71 0.04 0.00 0.00 177.00 178.64 3hoa s TYR 215 N -1.33 0.40 -0.16 0.56 1.51 0.72 -4.52 117.35 114.53 3hoa s TYR 215 Ca 0.49 -1.29 -0.42 0.00 -1.01 0.00 0.00 57.07 54.84 3hoa s TYR 215 Cb -0.28 -0.78 -0.19 0.00 -0.11 0.00 0.00 41.96 40.59 3hoa s TYR 215 CO 0.36 -0.86 1.32 -2.30 -1.11 0.00 0.00 175.55 172.96 3hoa n PRO 216 N 4.32 0.26 0.03 -1.71 -0.02 -1.26 -4.48 135.00 132.13 3hoa n PRO 216 Ca 0.09 0.09 0.04 0.00 -2.02 0.00 0.00 63.50 61.69 3hoa n PRO 216 Cb 0.40 -1.63 0.42 0.00 -0.02 0.00 0.00 33.50 32.67 3hoa n PRO 216 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3hoa h VAL 217 N 3.82 1.12 -0.16 -1.45 2.07 -1.92 -1.17 116.25 118.55 3hoa h VAL 217 Ca -0.48 -0.31 -0.13 0.00 0.82 0.00 0.00 66.70 66.59 3hoa h VAL 217 Cb 1.39 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.81 3hoa h VAL 217 CO 0.79 0.13 -0.46 -0.08 0.02 0.00 0.00 177.57 177.97 3hoa h GLU 218 N 0.48 0.40 -0.17 1.57 4.57 -2.00 -0.98 114.58 118.45 3hoa h GLU 218 Ca 0.12 -0.22 -0.14 0.00 -1.18 0.00 0.00 59.36 57.94 3hoa h GLU 218 Cb 0.04 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 3hoa h GLU 218 CO -0.02 0.78 -0.50 0.00 -1.18 0.00 0.00 179.01 178.10 3hoa h ALA 219 N 1.18 0.82 -0.65 2.92 0.00 -1.75 -2.14 119.26 119.65 3hoa h ALA 219 Ca 0.02 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 3hoa h ALA 219 Cb 0.94 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 3hoa h ALA 219 CO 0.08 0.67 0.14 1.96 0.00 0.00 0.00 179.25 182.10 3hoa h GLN 220 N 0.36 1.03 0.18 0.00 4.20 -0.75 -0.46 115.11 119.68 3hoa h GLN 220 Ca 0.02 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.47 3hoa h GLN 220 Cb 1.00 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.65 3hoa h GLN 220 CO 0.09 0.93 -0.09 -0.09 -0.67 0.00 0.00 178.83 179.00 3hoa h ARG 221 N 0.98 -0.24 -0.57 1.46 2.43 -1.01 0.91 114.38 118.34 3hoa h ARG 221 Ca 0.20 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 3hoa h ARG 221 Cb 0.37 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 3hoa h ARG 221 CO 0.00 0.05 0.38 0.00 -1.51 0.00 0.00 179.97 178.89 3hoa h ARG 222 N -0.53 0.59 -0.14 0.20 3.08 -1.28 0.43 114.38 116.74 3hoa h ARG 222 Ca -0.03 -0.04 -0.08 0.00 0.07 0.00 0.00 59.98 59.91 3hoa h ARG 222 Cb 0.40 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 3hoa h ARG 222 CO 0.04 0.39 -0.21 0.35 -1.07 0.00 0.00 179.97 179.48 3hoa h PHE 223 N 0.61 0.48 -0.57 3.04 3.57 -0.94 -2.79 116.94 120.35 3hoa h PHE 223 Ca 0.24 -0.16 0.05 0.00 3.53 0.00 0.00 57.97 61.63 3hoa h PHE 223 Cb 0.17 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 3hoa h PHE 223 CO -0.00 0.82 0.30 0.00 -2.23 0.00 0.00 178.31 177.20 3hoa h ALA 224 N 0.57 0.75 0.00 2.41 0.00 0.02 -1.04 119.26 121.97 3hoa h ALA 224 Ca 0.01 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3hoa h ALA 224 Cb 0.77 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 3hoa h ALA 224 CO 0.05 -0.04 -0.04 -0.07 0.00 0.00 0.00 179.25 179.15 3hoa h LEU 225 N 0.57 0.00 -0.23 0.00 3.38 -0.93 -1.36 115.31 116.75 3hoa h LEU 225 Ca 0.26 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.11 3hoa h LEU 225 Cb 0.16 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3hoa h LEU 225 CO -0.17 0.04 -0.29 -0.33 0.09 0.00 0.00 178.44 177.78 3hoa h GLU 226 N 0.00 0.60 -0.67 1.13 5.08 -0.92 -2.88 114.58 116.91 3hoa h GLU 226 Ca -0.00 -0.34 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 3hoa h GLU 226 Cb 0.07 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 3hoa h GLU 226 CO 0.01 0.94 0.16 -0.07 -1.00 0.00 0.00 179.01 179.05 3hoa h LEU 227 N 0.29 0.99 0.77 1.33 3.38 -0.79 -1.61 115.31 119.67 3hoa h LEU 227 Ca 0.03 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 3hoa h LEU 227 Cb 0.86 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.36 3hoa h LEU 227 CO 0.07 0.95 -0.37 -0.07 0.09 0.00 0.00 178.44 179.11 3hoa h LEU 228 N 1.00 -0.87 -1.27 1.67 3.38 -1.24 -1.20 115.31 116.78 3hoa h LEU 228 Ca 0.21 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 3hoa h LEU 228 Cb 0.35 0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 3hoa h LEU 228 CO 0.00 -0.62 -0.04 0.77 0.09 0.00 0.00 178.44 178.65 3hoa h SER 229 N -1.05 0.42 0.42 -0.43 4.64 -1.52 -1.65 113.55 114.40 3hoa h SER 229 Ca -0.11 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.05 3hoa h SER 229 Cb 0.79 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 3hoa h SER 229 CO 0.17 0.52 -0.37 0.00 -0.87 0.00 0.00 176.83 176.28 3hoa h ALA 230 N 1.54 1.32 -0.00 5.18 0.00 -1.14 -2.99 119.26 123.16 3hoa h ALA 230 Ca 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3hoa h ALA 230 Cb 0.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3hoa h ALA 230 CO 0.01 0.47 -0.33 0.00 0.00 0.00 0.00 179.25 179.41 3hoa n GLY 232 N 1.45 1.02 3.72 0.00 0.00 -1.09 -4.76 105.19 105.54 3hoa n GLY 232 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 3hoa n GLY 232 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hoa s TYR 233 N -2.00 3.53 -0.61 1.61 5.04 -0.67 -4.97 117.35 119.29 3hoa s TYR 233 Ca 0.00 1.47 -0.22 0.00 -2.44 0.00 0.00 57.07 55.88 3hoa s TYR 233 Cb 0.00 -3.31 0.07 0.00 0.35 0.00 0.00 41.96 39.07 3hoa s TYR 233 CO 0.00 -0.80 0.89 0.34 -1.34 0.00 0.00 175.55 174.64 3hoa s ASP 234 N 0.76 6.21 0.16 4.32 -1.08 -1.26 -4.25 116.67 121.53 3hoa s ASP 234 Ca 0.55 -0.92 0.21 0.00 -0.52 0.00 0.00 52.55 51.87 3hoa s ASP 234 Cb -0.27 -2.39 0.87 0.00 -1.46 0.00 0.00 42.92 39.66 3hoa s ASP 234 CO 0.30 -1.30 1.65 0.18 0.52 0.00 0.00 175.17 176.52 3hoa n LEU 235 N 7.32 0.44 -0.10 -1.34 4.32 -1.26 -1.65 117.00 124.73 3hoa n LEU 235 Ca -0.04 0.60 0.14 0.00 -0.02 0.00 0.00 56.01 56.69 3hoa n LEU 235 Cb 0.45 -0.53 0.51 0.00 -1.62 0.00 0.00 43.42 42.24 3hoa n LEU 235 CO 0.62 -0.41 0.77 -0.62 -1.22 0.00 0.00 177.39 176.54 3hoa n GLU 236 N -1.98 0.50 -0.27 3.23 1.02 -1.26 -3.25 120.64 118.63 3hoa n GLU 236 Ca 0.03 -0.20 0.07 0.00 -0.02 0.00 0.00 57.16 57.04 3hoa n GLU 236 Cb 0.23 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.27 3hoa n GLU 236 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hoa n ALA 237 N -1.07 2.36 -3.00 0.62 0.00 -0.66 -4.97 120.51 113.79 3hoa n ALA 237 Ca 0.11 -2.34 0.00 0.00 0.00 0.00 0.00 53.44 51.21 3hoa n ALA 237 Cb 0.31 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.34 3hoa n ALA 237 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hoa n GLY 238 N -1.03 1.34 3.59 0.00 0.00 -1.05 -0.80 105.19 107.24 3hoa n GLY 238 Ca 0.13 -0.84 -0.06 0.00 0.00 0.00 0.00 46.02 45.24 3hoa n GLY 238 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hoa s ARG 239 N -1.21 0.88 -0.13 1.61 1.70 -1.25 -4.76 118.95 115.80 3hoa s ARG 239 Ca 0.00 -0.39 0.02 0.00 -0.47 0.00 0.00 55.73 54.89 3hoa s ARG 239 Cb 0.00 0.36 0.01 0.00 -0.57 0.00 0.00 34.95 34.75 3hoa s ARG 239 CO 0.00 -0.39 -0.21 -1.17 -1.08 0.00 0.00 175.30 172.45 3hoa s LEU 240 N -2.63 2.05 0.05 -1.89 0.20 -1.26 -1.61 118.68 113.59 3hoa s LEU 240 Ca 0.08 -0.57 0.02 0.00 0.69 0.00 0.00 54.13 54.35 3hoa s LEU 240 Cb -0.01 -1.38 -0.03 0.00 -0.43 0.00 0.00 46.19 44.34 3hoa s LEU 240 CO -0.05 0.07 -0.08 -1.81 -0.29 0.00 0.00 176.35 174.20 3hoa s ASP 241 N 0.81 0.88 0.60 3.68 1.01 -1.01 -5.00 116.67 117.64 3hoa s ASP 241 Ca -0.08 -0.60 -0.14 0.00 0.71 0.00 0.00 52.55 52.45 3hoa s ASP 241 Cb -0.16 0.04 -0.04 0.00 1.01 0.00 0.00 42.92 43.78 3hoa s ASP 241 CO -0.01 -0.23 1.04 -2.16 0.21 0.00 0.00 175.17 174.01 3hoa s PRO 242 N -1.81 3.41 0.26 8.23 0.04 -1.26 -2.15 135.00 141.71 3hoa s PRO 242 Ca -0.08 1.02 -0.22 0.00 0.04 0.00 0.00 61.00 61.77 3hoa s PRO 242 Cb -0.08 -2.05 0.03 0.00 0.04 0.00 0.00 34.50 32.43 3hoa s PRO 242 CO -0.00 -0.73 0.73 -0.08 0.04 0.00 0.00 177.00 176.96 3hoa s THR 243 N -2.74 0.00 0.14 1.26 -1.32 -0.31 -4.80 115.64 107.87 3hoa s THR 243 Ca 0.60 -0.87 -0.06 0.00 -1.21 0.00 0.00 61.69 60.15 3hoa s THR 243 Cb -0.13 -1.89 -0.15 0.00 -1.51 0.00 0.00 72.50 68.81 3hoa s THR 243 CO 0.42 0.00 1.34 0.00 -2.21 0.00 0.00 174.62 174.18 3hoa h ALA 244 N 2.00 0.42 -3.01 11.08 0.00 -1.85 -3.39 119.26 124.50 3hoa h ALA 244 Ca -0.21 -0.64 -0.54 0.00 0.00 0.00 0.00 54.91 53.52 3hoa h ALA 244 Cb 1.25 -0.03 -0.40 0.00 0.00 0.00 0.00 17.79 18.62 3hoa h ALA 244 CO 0.25 0.75 -0.77 -1.01 0.00 0.00 0.00 179.25 178.47 3hoa s HIS 245 N -3.52 0.89 0.26 0.00 3.76 -1.26 -4.95 115.29 110.47 3hoa s HIS 245 Ca -0.07 -1.11 -0.28 0.00 -0.15 0.00 0.00 55.06 53.45 3hoa s HIS 245 Cb 0.09 -1.17 -0.15 0.00 1.11 0.00 0.00 32.58 32.46 3hoa s HIS 245 CO 0.87 -0.78 0.80 -0.35 -0.85 0.00 0.00 174.74 174.43 3hoa n PRO 246 N 5.09 0.80 -3.82 8.40 -0.04 -1.26 -4.97 135.00 139.19 3hoa n PRO 246 Ca -0.05 0.28 -0.08 0.00 -0.04 0.00 0.00 63.50 63.61 3hoa n PRO 246 Cb 0.43 -1.51 0.01 0.00 -0.04 0.00 0.00 33.50 32.40 3hoa n PRO 246 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3hoa s PHE 247 N -1.05 0.04 0.02 0.54 -0.12 -1.24 -4.99 117.98 111.17 3hoa s PHE 247 Ca 0.61 -0.67 0.01 0.00 -0.05 0.00 0.00 56.93 56.83 3hoa s PHE 247 Cb -0.79 0.81 -0.01 0.00 -0.63 0.00 0.00 43.02 42.40 3hoa s PHE 247 CO 0.58 -1.49 -0.04 -1.83 -0.05 0.00 0.00 175.22 172.39 3hoa s GLU 248 N -2.70 0.34 -0.13 1.99 4.04 -1.26 -1.70 118.70 119.28 3hoa s GLU 248 Ca 0.14 -0.46 -0.09 0.00 0.04 0.00 0.00 54.97 54.60 3hoa s GLU 248 Cb -0.05 -0.13 0.04 0.00 0.02 0.00 0.00 34.13 34.01 3hoa s GLU 248 CO 0.10 0.02 0.32 -1.50 -1.84 0.00 0.00 175.26 172.36 3hoa s ILE 249 N -0.92 -0.02 -0.34 1.83 1.10 -0.34 -5.02 121.20 117.50 3hoa s ILE 249 Ca -0.08 0.07 -0.15 0.00 -0.51 0.00 0.00 60.65 59.98 3hoa s ILE 249 Cb -0.07 -0.47 -0.01 0.00 0.15 0.00 0.00 42.46 42.06 3hoa s ILE 249 CO -0.00 0.03 0.36 0.00 -2.11 0.00 0.00 174.94 173.21 3hoa s ALA 250 N 0.85 3.50 0.01 1.50 0.00 -1.26 -1.17 121.76 125.19 3hoa s ALA 250 Ca -0.06 -1.19 -0.17 0.00 0.00 0.00 0.00 51.96 50.54 3hoa s ALA 250 Cb -0.07 -2.81 -0.35 0.00 0.00 0.00 0.00 23.12 19.90 3hoa s ALA 250 CO -0.06 -1.04 0.97 0.82 0.00 0.00 0.00 175.76 176.45 3hoa h ILE 251 N 5.53 1.34 0.00 0.00 1.08 -1.18 -3.48 117.51 120.79 3hoa h ILE 251 Ca -0.30 -2.66 0.00 0.00 -0.39 0.00 0.00 64.86 61.51 3hoa h ILE 251 Cb 1.15 3.09 0.00 0.00 -3.07 0.00 0.00 36.82 37.98 3hoa h ILE 251 CO 0.69 0.79 0.00 0.61 -0.69 0.00 0.00 178.15 179.54 3hoa n GLY 252 N 1.71 -1.81 3.66 5.37 0.00 -0.99 -4.86 105.19 108.28 3hoa n GLY 252 Ca -0.16 -1.13 -0.46 0.00 0.00 0.00 0.00 46.02 44.27 3hoa n GLY 252 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hoa n PRO 253 N -0.38 1.99 -0.99 1.61 -0.04 -1.26 -0.33 135.00 135.60 3hoa n PRO 253 Ca 0.00 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.17 3hoa n PRO 253 Cb 0.00 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.06 3hoa n PRO 253 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hoa n GLY 254 N 2.54 0.72 2.55 0.55 0.00 -1.26 -4.95 105.19 105.34 3hoa n GLY 254 Ca 0.14 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.96 3hoa n GLY 254 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hoa s ASP 255 N -2.50 0.85 -0.18 1.61 3.68 0.55 -4.29 116.67 116.38 3hoa s ASP 255 Ca 0.00 -2.40 0.01 0.00 2.13 0.00 0.00 52.55 52.29 3hoa s ASP 255 Cb 0.00 0.28 0.03 0.00 -1.45 0.00 0.00 42.92 41.78 3hoa s ASP 255 CO 0.00 -0.17 -0.15 -0.69 0.13 0.00 0.00 175.17 174.29 3hoa s VAL 256 N 0.60 1.81 0.10 1.11 1.01 0.02 -0.53 120.40 124.53 3hoa s VAL 256 Ca 0.28 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.39 3hoa s VAL 256 Cb -0.03 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 3hoa s VAL 256 CO -0.11 0.36 -0.05 -0.13 0.00 0.00 0.00 175.10 175.17 3hoa s ARG 257 N 1.36 2.33 0.21 2.72 0.52 -0.32 -3.78 118.95 121.99 3hoa s ARG 257 Ca 0.02 -0.95 0.04 0.00 -0.52 0.00 0.00 55.73 54.32 3hoa s ARG 257 Cb -0.14 -2.41 -0.05 0.00 0.52 0.00 0.00 34.95 32.86 3hoa s ARG 257 CO -0.10 0.52 -0.02 0.96 0.02 0.00 0.00 175.30 176.67 3hoa s ILE 258 N -1.30 1.03 0.08 1.52 -4.36 -0.63 -1.20 121.20 116.33 3hoa s ILE 258 Ca 0.24 -2.03 -0.07 0.00 -0.26 0.00 0.00 60.65 58.52 3hoa s ILE 258 Cb -0.11 -2.24 -0.01 0.00 1.25 0.00 0.00 42.46 41.35 3hoa s ILE 258 CO 0.16 -0.41 0.15 0.42 0.24 0.00 0.00 174.94 175.50 3hoa s THR 259 N -3.42 0.16 0.23 8.37 -4.23 -0.69 -2.39 115.64 113.66 3hoa s THR 259 Ca 0.26 -1.28 0.01 0.00 -1.18 0.00 0.00 61.69 59.50 3hoa s THR 259 Cb 0.05 -1.36 -0.00 0.00 1.34 0.00 0.00 72.50 72.53 3hoa s THR 259 CO 0.07 -0.71 0.28 1.07 -0.54 0.00 0.00 174.62 174.79 3hoa n THR 260 N -0.01 0.00 -3.62 3.99 5.66 -0.91 -3.72 114.28 115.67 3hoa n THR 260 Ca -0.15 -1.32 -0.17 0.00 -3.05 0.00 0.00 64.05 59.36 3hoa n THR 260 Cb 0.62 0.75 -0.15 0.00 -1.55 0.00 0.00 70.33 70.01 3hoa n THR 260 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3hoa s ARG 261 N -2.65 0.09 0.07 1.09 3.52 -1.26 -1.16 118.95 118.65 3hoa s ARG 261 Ca 0.22 0.46 -0.07 0.00 -0.13 0.00 0.00 55.73 56.20 3hoa s ARG 261 Cb -0.00 -0.58 -0.05 0.00 -1.56 0.00 0.00 34.95 32.76 3hoa s ARG 261 CO 0.15 -0.41 0.34 0.71 -0.81 0.00 0.00 175.30 175.28 3hoa s TYR 262 N 2.31 3.55 -0.18 5.12 1.51 -1.26 -2.70 117.35 125.69 3hoa s TYR 262 Ca 0.04 0.62 0.01 0.00 -1.01 0.00 0.00 57.07 56.73 3hoa s TYR 262 Cb -0.13 -2.04 0.03 0.00 -0.11 0.00 0.00 41.96 39.71 3hoa s TYR 262 CO -0.08 0.53 -0.14 0.71 -1.11 0.00 0.00 175.55 175.46 3hoa s TYR 263 N -1.44 2.52 0.57 2.71 1.51 -1.26 -4.95 117.35 117.01 3hoa s TYR 263 Ca 0.33 -1.56 0.29 0.00 -1.01 0.00 0.00 57.07 55.12 3hoa s TYR 263 Cb -0.13 -1.73 1.46 0.00 -0.11 0.00 0.00 41.96 41.45 3hoa s TYR 263 CO 0.20 -0.75 1.87 0.93 -1.11 0.00 0.00 175.55 176.69 3hoa h GLU 264 N 7.97 0.00 -0.26 -0.62 5.08 -1.97 -0.75 114.58 124.03 3hoa h GLU 264 Ca -0.35 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3hoa h GLU 264 Cb 1.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 3hoa h GLU 264 CO 0.53 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.14 3hoa n ASP 265 N -3.87 3.86 -3.28 1.42 3.85 -1.26 -0.20 116.55 117.07 3hoa n ASP 265 Ca 0.12 -3.03 -0.06 0.00 -0.71 0.00 0.00 54.79 51.11 3hoa n ASP 265 Cb 0.78 -0.55 -0.05 0.00 -1.35 0.00 0.00 41.12 39.96 3hoa n ASP 265 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.20 176.31 3hoa s PHE 266 N -2.84 -1.13 0.13 2.11 5.99 -0.29 -4.26 117.98 117.70 3hoa s PHE 266 Ca 0.42 0.66 -0.28 0.00 0.00 0.00 0.00 56.93 57.74 3hoa s PHE 266 Cb 0.34 0.01 -0.05 0.00 0.00 0.00 0.00 43.02 43.32 3hoa s PHE 266 CO 0.09 -0.93 1.60 0.35 -0.00 0.00 0.00 175.22 176.33 3hoa h PHE 267 N 8.13 -1.04 -0.56 10.12 3.57 -1.54 -3.34 116.94 132.28 3hoa h PHE 267 Ca -0.11 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.48 3hoa h PHE 267 Cb 1.14 0.47 -0.08 0.00 2.79 0.00 0.00 35.95 40.26 3hoa h PHE 267 CO 0.22 -0.45 -0.50 -0.91 -2.23 0.00 0.00 178.31 174.44 3hoa h ASN 268 N -0.49 -1.73 -0.77 0.41 4.21 -1.95 -3.11 115.58 112.16 3hoa h ASN 268 Ca 0.07 0.24 0.10 0.00 1.21 0.00 0.00 56.30 57.92 3hoa h ASN 268 Cb 0.60 0.73 -0.12 0.00 -1.12 0.00 0.00 38.32 38.41 3hoa h ASN 268 CO -0.33 -0.29 -0.49 0.00 -1.29 0.00 0.00 177.43 175.03 3hoa h ALA 269 N -0.01 -0.36 -0.44 -0.83 0.00 -1.87 0.16 119.26 115.91 3hoa h ALA 269 Ca 0.09 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3hoa h ALA 269 Cb 0.45 1.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.35 3hoa h ALA 269 CO -0.64 -0.86 0.06 0.78 0.00 0.00 0.00 179.25 178.59 3hoa h GLY 270 N -0.14 0.80 0.19 0.00 0.00 -1.53 -1.03 103.07 101.36 3hoa h GLY 270 Ca 0.19 -0.55 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 3hoa h GLY 270 CO -0.81 0.51 -0.05 -2.22 0.00 0.00 0.00 176.54 173.97 3hoa h ILE 271 N 0.60 0.82 0.00 2.60 1.08 -1.38 -2.53 117.51 118.70 3hoa h ILE 271 Ca 0.13 -1.36 0.00 0.00 -0.39 0.00 0.00 64.86 63.24 3hoa h ILE 271 Cb 0.41 1.46 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 3hoa h ILE 271 CO 0.01 0.25 0.00 -0.26 -0.69 0.00 0.00 178.15 177.46 3hoa h PHE 272 N -0.94 0.00 -0.30 1.37 -1.00 -0.84 -1.96 116.94 113.28 3hoa h PHE 272 Ca -0.01 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.64 3hoa h PHE 272 Cb 0.50 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.06 3hoa h PHE 272 CO 0.11 0.00 -0.32 0.78 -1.61 0.00 0.00 178.31 177.27 3hoa h GLY 273 N 2.83 0.81 0.91 -1.45 0.00 -1.22 -1.70 103.07 103.24 3hoa h GLY 273 Ca 0.00 -0.84 -0.01 0.00 0.00 0.00 0.00 47.33 46.49 3hoa h GLY 273 CO 0.00 0.76 0.07 -0.84 0.00 0.00 0.00 176.54 176.52 3hoa h THR 274 N 0.50 1.12 -0.75 4.70 2.02 -0.94 -2.47 112.91 117.09 3hoa h THR 274 Ca 0.05 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.86 3hoa h THR 274 Cb 0.89 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 3hoa h THR 274 CO 0.08 0.11 0.43 -0.07 0.37 0.00 0.00 175.52 176.44 3hoa h LEU 275 N 0.10 0.91 0.24 2.58 3.38 -1.38 -1.01 115.31 120.14 3hoa h LEU 275 Ca 0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3hoa h LEU 275 Cb 0.12 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3hoa h LEU 275 CO -0.01 0.72 -0.12 -0.74 0.09 0.00 0.00 178.44 178.38 3hoa h HIS 276 N 1.04 -0.32 0.00 1.13 2.76 -1.10 -1.79 115.15 116.87 3hoa h HIS 276 Ca 0.27 -0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.37 3hoa h HIS 276 Cb -0.01 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.05 3hoa h HIS 276 CO 0.01 -0.20 -0.31 0.93 -1.30 0.00 0.00 177.93 177.06 3hoa h GLU 277 N -0.34 0.00 -0.48 5.26 4.39 -1.28 -2.74 114.58 119.40 3hoa h GLU 277 Ca -0.03 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.65 3hoa h GLU 277 Cb 0.26 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 3hoa h GLU 277 CO 0.05 0.31 0.21 1.98 -1.16 0.00 0.00 179.01 180.40 3hoa h MET 278 N 0.00 0.71 -0.89 2.33 4.05 -0.72 -0.71 114.93 119.69 3hoa h MET 278 Ca -0.00 -0.12 0.10 0.00 -0.28 0.00 0.00 59.70 59.40 3hoa h MET 278 Cb 0.57 -0.12 -0.08 0.00 -0.80 0.00 0.00 31.60 31.17 3hoa h MET 278 CO 0.04 0.62 0.53 0.78 0.23 0.00 0.00 176.91 179.11 3hoa h GLY 279 N 0.63 1.41 0.93 1.39 0.00 -1.03 0.66 103.07 107.06 3hoa h GLY 279 Ca 0.16 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 3hoa h GLY 279 CO -0.02 0.14 0.12 0.45 0.00 0.00 0.00 176.54 177.23 3hoa h HIS 280 N 0.87 0.33 -0.37 5.60 -0.00 -1.37 -2.95 115.15 117.26 3hoa h HIS 280 Ca 0.43 -0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.71 3hoa h HIS 280 Cb 0.41 -0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 27.69 3hoa h HIS 280 CO -0.04 0.32 -0.10 0.00 -0.00 0.00 0.00 177.93 178.11 3hoa h ALA 281 N 0.98 1.15 -0.61 2.45 0.00 0.41 -2.57 119.26 121.08 3hoa h ALA 281 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 3hoa h ALA 281 Cb 0.10 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3hoa h ALA 281 CO -0.01 0.54 0.30 -0.07 0.00 0.00 0.00 179.25 180.01 3hoa h LEU 282 N 0.58 0.77 0.56 0.00 3.38 0.34 0.18 115.31 121.12 3hoa h LEU 282 Ca 0.11 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 3hoa h LEU 282 Cb 0.51 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 41.07 3hoa h LEU 282 CO 0.03 0.65 -0.27 0.22 0.09 0.00 0.00 178.44 179.16 3hoa h TYR 283 N 0.86 -0.70 -0.79 1.13 3.20 -1.31 -1.61 116.97 117.75 3hoa h TYR 283 Ca 0.21 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.13 3hoa h TYR 283 Cb 0.07 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.51 3hoa h TYR 283 CO 0.01 -0.39 0.47 0.93 -1.64 0.00 0.00 178.16 177.54 3hoa h GLU 284 N -0.86 0.83 0.00 1.82 4.39 -1.08 0.06 114.58 119.74 3hoa h GLU 284 Ca -0.08 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.57 3hoa h GLU 284 Cb 0.62 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 3hoa h GLU 284 CO 0.13 0.55 0.00 1.04 -1.16 0.00 0.00 179.01 179.57 3hoa n GLN 285 N -4.69 0.20 0.00 2.33 6.02 0.61 -2.41 117.38 119.44 3hoa n GLN 285 Ca 0.11 0.45 0.11 0.00 -0.01 0.00 0.00 57.00 57.65 3hoa n GLN 285 Cb 0.18 -1.89 -0.02 0.00 1.02 0.00 0.00 30.24 29.53 3hoa n GLN 285 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hoa n GLY 286 N -0.11 -1.06 3.76 1.08 0.00 -0.05 -4.95 105.19 103.86 3hoa n GLY 286 Ca 0.02 -0.53 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 3hoa n GLY 286 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hoa s LEU 287 N -2.99 3.78 -0.38 0.99 1.43 -0.84 -3.89 118.68 116.77 3hoa s LEU 287 Ca 0.09 2.47 -0.27 0.00 -1.03 0.00 0.00 54.13 55.38 3hoa s LEU 287 Cb 0.16 -4.45 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 3hoa s LEU 287 CO 0.82 -1.46 2.04 -2.16 0.23 0.00 0.00 176.35 175.82 3hoa s PRO 288 N -3.11 2.92 0.46 1.29 0.04 -1.26 -4.87 135.00 130.47 3hoa s PRO 288 Ca 0.73 1.45 0.16 0.00 0.04 0.00 0.00 61.00 63.39 3hoa s PRO 288 Cb -0.33 -4.35 1.12 0.00 0.04 0.00 0.00 34.50 30.98 3hoa s PRO 288 CO 0.37 -2.35 2.00 0.87 0.04 0.00 0.00 177.00 177.92 3hoa h LYS 289 N 15.15 0.28 0.00 4.56 1.57 -1.94 -0.91 116.57 135.29 3hoa h LYS 289 Ca -0.32 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.42 3hoa h LYS 289 Cb 1.21 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.45 3hoa h LYS 289 CO 1.07 0.19 -0.09 1.05 -0.57 0.00 0.00 179.45 181.10 3hoa h GLU 290 N 0.29 0.00 -0.51 3.15 9.09 -2.01 -2.69 114.58 121.91 3hoa h GLU 290 Ca 0.25 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.66 3hoa h GLU 290 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 3hoa h GLU 290 CO -0.05 0.09 0.00 0.72 0.05 0.00 0.00 179.01 179.81 3hoa n HIS 291 N -3.36 1.40 -1.75 2.06 8.25 -0.35 -5.01 115.22 116.46 3hoa n HIS 291 Ca -0.01 -0.69 -0.38 0.00 -0.26 0.00 0.00 57.72 56.37 3hoa n HIS 291 Cb 0.26 -0.30 0.04 0.00 1.12 0.00 0.00 29.99 31.11 3hoa n HIS 291 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 3hoa s TRP 292 N -2.22 2.25 -0.40 4.41 -0.00 -1.02 -2.14 118.94 119.83 3hoa s TRP 292 Ca 0.47 1.36 0.00 0.00 -0.00 0.00 0.00 56.10 57.93 3hoa s TRP 292 Cb 0.33 -3.83 0.00 0.00 -0.00 0.00 0.00 33.47 29.97 3hoa s TRP 292 CO 0.18 -2.99 0.00 0.41 -0.00 0.00 0.00 176.95 174.54 3hoa n GLY 293 N 0.73 0.67 2.95 5.86 0.00 -1.26 -4.99 105.19 109.15 3hoa n GLY 293 Ca 0.10 -0.73 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 3hoa n GLY 293 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hoa s THR 294 N -2.11 0.38 0.30 2.61 2.01 -0.91 -4.24 115.64 113.69 3hoa s THR 294 Ca 0.00 -0.20 0.06 0.00 0.31 0.00 0.00 61.69 61.86 3hoa s THR 294 Cb 0.00 -0.33 0.31 0.00 0.01 0.00 0.00 72.50 72.49 3hoa s THR 294 CO 0.00 0.11 1.67 -0.65 -0.69 0.00 0.00 174.62 175.06 3hoa h PRO 295 N 6.05 0.30 -0.37 4.92 0.11 -1.90 0.75 132.00 141.86 3hoa h PRO 295 Ca -0.28 -0.02 0.11 0.00 0.11 0.00 0.00 66.00 65.92 3hoa h PRO 295 Cb 1.19 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 3hoa h PRO 295 CO 0.50 0.20 0.30 -0.09 -0.21 0.00 0.00 178.00 178.70 3hoa h ARG 296 N 0.31 0.00 -0.55 1.05 9.65 -1.87 -1.00 114.38 121.97 3hoa h ARG 296 Ca 0.60 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.48 3hoa h ARG 296 Cb 1.25 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.83 3hoa h ARG 296 CO -0.60 0.00 0.00 0.41 2.80 0.00 0.00 179.97 182.58 3hoa n GLY 297 N -1.56 2.68 3.91 2.80 0.00 0.25 -3.57 105.19 109.71 3hoa n GLY 297 Ca 0.06 -0.62 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 3hoa n GLY 297 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hoa s ASP 298 N -1.02 6.45 0.33 1.61 1.01 -0.38 -4.69 116.67 119.98 3hoa s ASP 298 Ca 0.38 0.58 -0.29 0.00 0.71 0.00 0.00 52.55 53.93 3hoa s ASP 298 Cb 0.20 -2.08 -0.11 0.00 1.01 0.00 0.00 42.92 41.94 3hoa s ASP 298 CO 0.24 -0.06 1.41 0.00 0.21 0.00 0.00 175.17 176.97 3hoa s ALA 299 N -1.86 3.56 0.11 5.23 0.00 -1.26 -1.88 121.76 125.66 3hoa s ALA 299 Ca 0.41 1.40 -0.14 0.00 0.00 0.00 0.00 51.96 53.63 3hoa s ALA 299 Cb -0.11 -3.55 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 3hoa s ALA 299 CO 0.27 -0.82 1.44 -0.24 0.00 0.00 0.00 175.76 176.41 3hoa h VAL 300 N 3.10 1.29 -2.38 0.00 3.04 -1.94 -3.45 116.25 115.91 3hoa h VAL 300 Ca -0.49 -1.45 0.15 0.00 -1.01 0.00 0.00 66.70 63.89 3hoa h VAL 300 Cb 1.23 1.50 -0.10 0.00 -2.01 0.00 0.00 31.29 31.91 3hoa h VAL 300 CO 0.67 0.47 0.46 -0.94 -1.01 0.00 0.00 177.57 177.23 3hoa s SER 301 N -6.59 -0.25 0.32 3.17 1.04 -1.26 -4.70 113.70 105.43 3hoa s SER 301 Ca -0.12 -0.29 0.09 0.00 0.48 0.00 0.00 55.95 56.11 3hoa s SER 301 Cb 0.09 0.48 0.56 0.00 0.10 0.00 0.00 66.02 67.25 3hoa s SER 301 CO 0.84 -0.85 1.75 -0.07 0.98 0.00 0.00 173.24 175.89 3hoa h LEU 302 N 2.00 0.16 -0.08 2.42 3.38 -1.89 -0.45 115.31 120.85 3hoa h LEU 302 Ca -0.24 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 3hoa h LEU 302 Cb 1.24 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.94 3hoa h LEU 302 CO 0.27 0.53 0.02 1.23 0.09 0.00 0.00 178.44 180.59 3hoa h GLY 303 N 1.19 0.13 1.49 0.83 0.00 -1.82 0.55 103.07 105.44 3hoa h GLY 303 Ca 0.01 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 47.15 3hoa h GLY 303 CO 0.06 0.08 -0.28 -2.08 0.00 0.00 0.00 176.54 174.31 3hoa h VAL 304 N -0.07 1.28 -0.15 4.60 2.07 -1.87 0.84 116.25 122.94 3hoa h VAL 304 Ca 0.03 -1.37 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 3hoa h VAL 304 Cb 0.22 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3hoa h VAL 304 CO -0.00 0.44 0.05 -0.74 0.02 0.00 0.00 177.57 177.34 3hoa h HIS 305 N 0.51 0.24 0.00 1.57 6.17 -0.83 -2.58 115.15 120.23 3hoa h HIS 305 Ca 0.07 -0.02 -0.05 0.00 0.71 0.00 0.00 60.37 61.08 3hoa h HIS 305 Cb 0.75 -0.07 -0.01 0.00 2.52 0.00 0.00 27.41 30.60 3hoa h HIS 305 CO 0.03 0.34 -0.22 1.49 0.71 0.00 0.00 177.93 180.28 3hoa h GLU 306 N 0.07 0.00 -0.22 5.26 4.57 0.41 -1.71 114.58 122.96 3hoa h GLU 306 Ca 0.05 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.16 3hoa h GLU 306 Cb 0.21 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 3hoa h GLU 306 CO -0.00 0.22 -0.17 0.66 -1.18 0.00 0.00 179.01 178.54 3hoa h SER 307 N 0.00 0.37 -0.15 1.04 4.64 -0.47 -0.77 113.55 118.23 3hoa h SER 307 Ca -0.00 -0.10 -0.21 0.00 -0.47 0.00 0.00 61.79 61.01 3hoa h SER 307 Cb 0.47 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.47 3hoa h SER 307 CO 0.03 0.57 -0.73 1.56 -0.87 0.00 0.00 176.83 177.39 3hoa h GLN 308 N 0.35 0.75 -0.40 4.77 1.08 -0.97 -1.82 115.11 118.88 3hoa h GLN 308 Ca 0.06 -0.61 -0.08 0.00 -1.45 0.00 0.00 58.65 56.57 3hoa h GLN 308 Cb 0.51 0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 28.06 3hoa h GLN 308 CO 0.03 1.22 -0.05 0.66 -0.95 0.00 0.00 178.83 179.75 3hoa h SER 309 N 0.47 0.74 1.00 1.46 4.64 -1.17 -2.79 113.55 117.90 3hoa h SER 309 Ca -0.05 -0.34 -0.04 0.00 -0.47 0.00 0.00 61.79 60.89 3hoa h SER 309 Cb 1.36 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 3hoa h SER 309 CO 0.15 0.90 -0.21 0.03 -0.87 0.00 0.00 176.83 176.83 3hoa h ARG 310 N 0.56 0.00 -0.04 4.77 2.47 -1.20 -1.52 114.38 119.42 3hoa h ARG 310 Ca 0.11 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.82 3hoa h ARG 310 Cb 0.55 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.87 3hoa h ARG 310 CO 0.03 0.21 0.01 1.15 0.56 0.00 0.00 179.97 181.94 3hoa h THR 311 N 0.00 1.16 0.00 2.04 2.02 -1.07 -1.46 112.91 115.61 3hoa h THR 311 Ca -0.00 -0.49 -0.19 0.00 0.77 0.00 0.00 66.41 66.50 3hoa h THR 311 Cb 0.77 1.42 -0.03 0.00 -1.74 0.00 0.00 68.15 68.57 3hoa h THR 311 CO 0.03 0.13 -0.92 -0.50 0.37 0.00 0.00 175.52 174.63 3hoa h TRP 312 N -0.13 0.00 0.05 3.16 4.06 -1.39 0.34 115.95 122.05 3hoa h TRP 312 Ca 0.01 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.96 3hoa h TRP 312 Cb 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.36 3hoa h TRP 312 CO -0.01 0.92 -0.03 1.49 -3.56 0.00 0.00 178.44 177.26 3hoa h GLU 313 N 0.00 -0.07 0.00 0.49 4.81 -1.28 -0.26 114.58 118.27 3hoa h GLU 313 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3hoa h GLU 313 Cb 1.64 0.02 0.00 0.00 0.63 0.00 0.00 28.75 31.04 3hoa h GLU 313 CO 0.12 0.43 -0.68 0.09 -0.73 0.00 0.00 179.01 178.24 3hoa n ASN 314 N -4.87 1.50 -0.34 1.04 3.02 -0.56 -2.64 115.26 112.41 3hoa n ASN 314 Ca -0.09 0.25 0.14 0.00 -0.03 0.00 0.00 54.58 54.85 3hoa n ASN 314 Cb 0.27 -0.62 0.35 0.00 -0.61 0.00 0.00 39.78 39.16 3hoa n ASN 314 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3hoa h LEU 315 N -0.68 0.74 0.00 3.41 3.38 -1.33 0.16 115.31 120.99 3hoa h LEU 315 Ca 0.00 0.09 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 3hoa h LEU 315 Cb 0.68 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 3hoa h LEU 315 CO 0.00 0.27 -1.45 0.52 0.09 0.00 0.00 178.44 177.87 3hoa n VAL 316 N -4.72 1.48 0.02 1.22 0.31 0.07 -4.30 118.33 112.40 3hoa n VAL 316 Ca 0.23 -0.02 0.16 0.00 -0.01 0.00 0.00 64.34 64.70 3hoa n VAL 316 Cb 0.59 -2.16 0.63 0.00 -0.91 0.00 0.00 33.84 31.98 3hoa n VAL 316 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3hoa h GLY 317 N -0.95 0.15 -1.53 2.92 0.00 -0.99 -2.25 103.07 100.42 3hoa h GLY 317 Ca -0.22 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3hoa h GLY 317 CO -0.13 0.02 0.00 0.54 0.00 0.00 0.00 176.54 176.97 3hoa n ARG 318 N -4.43 2.92 -1.86 4.80 1.74 0.04 -4.83 116.66 115.04 3hoa n ARG 318 Ca 0.08 -2.27 -0.30 0.00 -0.77 0.00 0.00 57.85 54.58 3hoa n ARG 318 Cb 0.46 -1.42 0.03 0.00 -1.02 0.00 0.00 32.46 30.52 3hoa n ARG 318 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3hoa s SER 319 N -1.14 5.76 0.10 0.55 1.04 -0.85 -4.95 113.70 114.21 3hoa s SER 319 Ca 0.30 1.27 -0.17 0.00 0.48 0.00 0.00 55.95 57.83 3hoa s SER 319 Cb 0.18 -2.17 -0.06 0.00 0.10 0.00 0.00 66.02 64.07 3hoa s SER 319 CO 0.16 -1.16 1.52 0.25 0.98 0.00 0.00 173.24 175.00 3hoa h LEU 320 N -0.52 0.57 -1.02 2.42 6.46 -1.93 -2.95 115.31 118.33 3hoa h LEU 320 Ca -0.45 -0.33 -0.01 0.00 -0.12 0.00 0.00 57.88 56.98 3hoa h LEU 320 Cb 1.23 -0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 40.96 3hoa h LEU 320 CO 0.63 0.76 0.53 1.23 -0.62 0.00 0.00 178.44 180.97 3hoa h GLY 321 N 0.36 1.29 1.00 3.75 0.00 -1.92 0.18 103.07 107.73 3hoa h GLY 321 Ca 0.08 -0.54 0.01 0.00 0.00 0.00 0.00 47.33 46.88 3hoa h GLY 321 CO 0.02 0.52 0.40 -2.75 0.00 0.00 0.00 176.54 174.73 3hoa h PHE 322 N 1.22 0.76 0.00 5.60 3.57 -1.75 -2.24 116.94 124.11 3hoa h PHE 322 Ca 0.32 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.77 3hoa h PHE 322 Cb -0.04 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.43 3hoa h PHE 322 CO 0.01 0.49 -0.29 -1.49 -2.23 0.00 0.00 178.31 174.79 3hoa h TRP 323 N 0.82 0.00 -0.27 0.41 4.06 -1.27 -1.18 115.95 118.52 3hoa h TRP 323 Ca 0.22 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 61.08 3hoa h TRP 323 Cb -0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.06 3hoa h TRP 323 CO -0.03 0.29 -0.20 0.93 -3.56 0.00 0.00 178.44 175.87 3hoa h GLU 324 N 0.00 0.49 -0.05 0.49 5.08 -0.74 0.35 114.58 120.20 3hoa h GLU 324 Ca -0.00 -0.17 -0.18 0.00 -1.00 0.00 0.00 59.36 58.02 3hoa h GLU 324 Cb 1.20 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.43 3hoa h GLU 324 CO 0.04 0.67 -0.65 -0.09 -1.00 0.00 0.00 179.01 177.98 3hoa h ARG 325 N 0.44 0.53 0.00 2.33 9.65 -1.17 -3.39 114.38 122.77 3hoa h ARG 325 Ca 0.07 -0.50 0.00 0.00 -1.10 0.00 0.00 59.98 58.45 3hoa h ARG 325 Cb 0.60 0.13 0.00 0.00 -1.39 0.00 0.00 29.97 29.31 3hoa h ARG 325 CO 0.04 1.13 -0.72 1.19 2.80 0.00 0.00 179.97 184.41 3hoa n PHE 326 N -4.14 0.00 -0.29 2.20 3.01 -0.47 -4.60 117.46 113.17 3hoa n PHE 326 Ca -0.09 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.32 3hoa n PHE 326 Cb 0.69 -0.02 0.07 0.00 -0.01 0.00 0.00 39.48 40.21 3hoa n PHE 326 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 3hoa h PHE 327 N 0.00 1.04 -0.88 1.38 3.57 -0.49 -0.89 116.94 120.67 3hoa h PHE 327 Ca 0.00 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.59 3hoa h PHE 327 Cb 0.35 -0.34 -0.06 0.00 2.79 0.00 0.00 35.95 38.69 3hoa h PHE 327 CO 0.00 0.68 0.57 -1.00 -2.23 0.00 0.00 178.31 176.33 3hoa h PRO 328 N 1.09 0.86 -0.10 6.41 0.13 -1.81 0.84 132.00 139.41 3hoa h PRO 328 Ca 0.29 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.35 3hoa h PRO 328 Cb -0.06 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 30.87 3hoa h PRO 328 CO -0.06 0.57 -0.00 -0.09 -0.23 0.00 0.00 178.00 178.19 3hoa h ARG 329 N 0.89 0.18 -0.58 0.86 9.65 -1.67 -1.65 114.38 122.06 3hoa h ARG 329 Ca 0.40 -0.06 0.04 0.00 -1.10 0.00 0.00 59.98 59.26 3hoa h ARG 329 Cb 0.37 -0.02 -0.04 0.00 -1.39 0.00 0.00 29.97 28.89 3hoa h ARG 329 CO -0.16 0.43 0.33 0.00 2.80 0.00 0.00 179.97 183.37 3hoa h ALA 330 N 0.74 0.75 -0.92 2.80 0.00 -0.01 0.42 119.26 123.03 3hoa h ALA 330 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.06 3hoa h ALA 330 Cb 0.35 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.94 3hoa h ALA 330 CO 0.01 0.02 0.59 -0.09 0.00 0.00 0.00 179.25 179.78 3hoa h ARG 331 N 0.63 0.82 0.01 0.00 2.43 0.84 -0.02 114.38 119.09 3hoa h ARG 331 Ca 0.24 -0.05 -0.19 0.00 -0.81 0.00 0.00 59.98 59.17 3hoa h ARG 331 Cb 0.09 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 3hoa h ARG 331 CO -0.13 0.55 -0.90 0.93 -1.51 0.00 0.00 179.97 178.90 3hoa h GLU 332 N 0.85 0.04 0.15 0.20 5.08 -0.11 -3.34 114.58 117.45 3hoa h GLU 332 Ca 0.45 -0.05 -0.30 0.00 -1.00 0.00 0.00 59.36 58.46 3hoa h GLU 332 Cb 0.54 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.81 3hoa h GLU 332 CO -0.21 0.91 -1.39 0.28 -1.00 0.00 0.00 179.01 177.60 3hoa h VAL 333 N 0.02 1.34 -3.33 3.13 2.07 -0.04 -3.45 116.25 115.99 3hoa h VAL 333 Ca -0.02 -2.90 -0.67 0.00 0.82 0.00 0.00 66.70 63.94 3hoa h VAL 333 Cb 1.58 2.90 -0.32 0.00 -1.52 0.00 0.00 31.29 33.94 3hoa h VAL 333 CO 0.12 0.86 -0.78 -0.36 0.02 0.00 0.00 177.57 177.43 3hoa s PHE 334 N -2.63 2.94 0.36 1.57 0.40 -0.11 -4.99 117.98 115.52 3hoa s PHE 334 Ca -0.07 -1.41 0.06 0.00 -0.60 0.00 0.00 56.93 54.91 3hoa s PHE 334 Cb 0.06 -2.02 0.74 0.00 0.51 0.00 0.00 43.02 42.31 3hoa s PHE 334 CO 0.89 -0.70 1.96 0.00 0.70 0.00 0.00 175.22 178.07 3hoa h ALA 335 N 8.01 1.70 -0.06 5.36 0.00 -1.87 -1.65 119.26 130.76 3hoa h ALA 335 Ca -0.40 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.51 3hoa h ALA 335 Cb 1.13 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 3hoa h ALA 335 CO 0.60 0.19 0.23 0.77 0.00 0.00 0.00 179.25 181.04 3hoa h SER 336 N 0.76 0.00 -0.02 0.00 0.02 -1.94 0.26 113.55 112.64 3hoa h SER 336 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 3hoa h SER 336 Cb 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 3hoa h SER 336 CO -0.10 0.00 -0.05 0.18 -1.14 0.00 0.00 176.83 175.71 3hoa n LEU 337 N -3.15 2.49 -0.33 5.07 4.77 -0.62 -4.50 117.00 120.73 3hoa n LEU 337 Ca -0.01 -0.84 0.22 0.00 -0.03 0.00 0.00 56.01 55.35 3hoa n LEU 337 Cb 0.30 -0.00 0.48 0.00 -2.33 0.00 0.00 43.42 41.87 3hoa n LEU 337 CO 0.19 0.42 1.21 1.23 -1.33 0.00 0.00 177.39 179.10 3hoa h GLY 338 N 4.76 1.37 -2.72 -0.72 0.00 -0.54 -0.43 103.07 104.80 3hoa h GLY 338 Ca 0.00 -0.23 -0.26 0.00 0.00 0.00 0.00 47.33 46.85 3hoa h GLY 338 CO 0.00 -0.16 0.17 2.09 0.00 0.00 0.00 176.54 178.64 3hoa n ASP 339 N -4.68 3.28 -4.48 0.19 5.68 -1.26 -4.99 116.55 110.28 3hoa n ASP 339 Ca 0.26 -3.58 -0.33 0.00 -0.50 0.00 0.00 54.79 50.64 3hoa n ASP 339 Cb 0.85 -0.69 -0.13 0.00 -1.14 0.00 0.00 41.12 40.00 3hoa n ASP 339 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3hoa s VAL 340 N -3.18 3.18 0.27 2.12 1.01 -0.17 -5.12 120.40 118.51 3hoa s VAL 340 Ca 0.49 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.74 3hoa s VAL 340 Cb 0.42 -2.27 -0.06 0.00 0.00 0.00 0.00 36.38 34.48 3hoa s VAL 340 CO 0.06 0.58 0.55 -0.94 0.00 0.00 0.00 175.10 175.35 3hoa s SER 341 N -0.54 6.48 0.20 3.32 1.04 -1.26 -4.96 113.70 117.97 3hoa s SER 341 Ca 0.08 0.76 -0.11 0.00 0.48 0.00 0.00 55.95 57.16 3hoa s SER 341 Cb -0.12 -2.16 0.21 0.00 0.10 0.00 0.00 66.02 64.05 3hoa s SER 341 CO 0.02 -0.17 1.77 0.25 0.98 0.00 0.00 173.24 176.08 3hoa h LEU 342 N 1.89 0.30 -0.61 2.42 5.85 -1.99 -0.70 115.31 122.48 3hoa h LEU 342 Ca -0.47 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.34 3hoa h LEU 342 Cb 1.18 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.18 3hoa h LEU 342 CO 0.67 0.20 0.36 -0.33 -0.34 0.00 0.00 178.44 178.99 3hoa h GLU 343 N 0.46 0.67 -0.41 1.25 5.08 -1.98 0.86 114.58 120.51 3hoa h GLU 343 Ca 0.27 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.45 3hoa h GLU 343 Cb 0.26 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 3hoa h GLU 343 CO -0.23 0.44 -0.30 -0.44 -1.00 0.00 0.00 179.01 177.48 3hoa h ASP 344 N 0.69 0.97 -0.19 1.42 3.32 -1.82 -1.58 116.42 119.23 3hoa h ASP 344 Ca 0.25 -0.44 -0.04 0.00 0.02 0.00 0.00 57.03 56.83 3hoa h ASP 344 Cb 0.08 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 3hoa h ASP 344 CO -0.13 1.20 -0.03 0.15 -1.72 0.00 0.00 179.24 178.71 3hoa h PHE 345 N 0.75 0.39 -0.82 4.55 3.04 -0.89 -0.03 116.94 123.92 3hoa h PHE 345 Ca 0.08 -0.08 0.01 0.00 3.98 0.00 0.00 57.97 61.96 3hoa h PHE 345 Cb 0.88 -0.10 -0.04 0.00 2.56 0.00 0.00 35.95 39.25 3hoa h PHE 345 CO 0.06 0.59 0.54 1.25 -2.02 0.00 0.00 178.31 178.73 3hoa h HIS 346 N 0.08 1.04 -0.41 0.41 2.76 -0.83 -1.06 115.15 117.14 3hoa h HIS 346 Ca 0.05 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.15 3hoa h HIS 346 Cb 0.45 -0.35 -0.01 0.00 1.55 0.00 0.00 27.41 29.05 3hoa h HIS 346 CO 0.05 0.66 -0.11 0.35 -1.30 0.00 0.00 177.93 177.58 3hoa h PHE 347 N 1.12 0.90 -0.14 5.26 -0.00 -1.12 -3.20 116.94 119.77 3hoa h PHE 347 Ca 0.30 -0.20 0.01 0.00 -0.00 0.00 0.00 57.97 58.09 3hoa h PHE 347 Cb -0.12 -0.22 -0.01 0.00 -0.00 0.00 0.00 35.95 35.60 3hoa h PHE 347 CO 0.00 0.92 0.06 0.00 -0.00 0.00 0.00 178.31 179.29 3hoa h ALA 348 N 0.85 0.15 0.00 2.41 0.00 0.02 -2.06 119.26 120.62 3hoa h ALA 348 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hoa h ALA 348 Cb 0.64 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3hoa h ALA 348 CO 0.04 -0.39 0.00 1.33 0.00 0.00 0.00 179.25 180.23 3hoa n VAL 349 N -5.04 0.00 -0.59 0.00 0.24 -0.50 -2.01 118.33 110.43 3hoa n VAL 349 Ca -0.04 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.30 3hoa n VAL 349 Cb 0.05 -0.63 0.05 0.00 -1.47 0.00 0.00 33.84 31.84 3hoa n VAL 349 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3hoa n ASN 350 N -0.93 1.88 -4.71 -1.34 3.02 -0.82 -5.03 115.26 107.33 3hoa n ASN 350 Ca 0.13 -2.34 -0.43 0.00 -0.03 0.00 0.00 54.58 51.90 3hoa n ASN 350 Cb 0.06 -0.18 -0.03 0.00 -0.61 0.00 0.00 39.78 39.03 3hoa n ASN 350 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hoa n ALA 351 N -0.80 2.32 -2.77 5.41 0.00 -0.85 -4.95 120.51 118.87 3hoa n ALA 351 Ca 0.06 0.40 -0.34 0.00 0.00 0.00 0.00 53.44 53.56 3hoa n ALA 351 Cb 0.44 -2.45 -0.10 0.00 0.00 0.00 0.00 19.45 17.34 3hoa n ALA 351 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3hoa s VAL 352 N 0.59 4.22 -0.30 0.00 1.01 -1.26 -4.76 120.40 119.89 3hoa s VAL 352 Ca 0.71 -0.26 -0.13 0.00 0.00 0.00 0.00 61.98 62.30 3hoa s VAL 352 Cb -0.55 -2.81 0.16 0.00 0.00 0.00 0.00 36.38 33.19 3hoa s VAL 352 CO 0.41 0.56 0.91 -0.70 0.00 0.00 0.00 175.10 176.27 3hoa s GLU 353 N -0.38 0.34 0.20 2.72 2.12 -1.26 -5.06 118.70 117.39 3hoa s GLU 353 Ca 0.07 0.81 -0.33 0.00 0.36 0.00 0.00 54.97 55.88 3hoa s GLU 353 Cb -0.12 0.48 -0.13 0.00 0.26 0.00 0.00 34.13 34.61 3hoa s GLU 353 CO 0.02 -0.18 1.52 -0.35 -0.54 0.00 0.00 175.26 175.74 3hoa n PRO 354 N 5.16 2.17 -4.26 4.30 -0.04 -1.26 -4.75 135.00 136.32 3hoa n PRO 354 Ca -0.08 0.78 -0.19 0.00 -0.04 0.00 0.00 63.50 63.96 3hoa n PRO 354 Cb 0.52 -2.51 -0.07 0.00 -0.04 0.00 0.00 33.50 31.39 3hoa n PRO 354 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3hoa n SER 355 N 2.88 -0.80 -0.03 3.54 3.41 -1.26 -4.97 113.62 116.39 3hoa n SER 355 Ca 0.14 -3.21 -0.08 0.00 -0.26 0.00 0.00 58.87 55.46 3hoa n SER 355 Cb 0.31 1.81 -0.14 0.00 -0.26 0.00 0.00 64.21 65.92 3hoa n SER 355 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3hoa n LEU 356 N 0.00 0.70 -4.57 1.04 4.77 -1.26 -4.89 117.00 112.78 3hoa n LEU 356 Ca 0.07 0.33 -0.40 0.00 -0.03 0.00 0.00 56.01 55.98 3hoa n LEU 356 Cb 0.62 0.23 -0.09 0.00 -2.33 0.00 0.00 43.42 41.84 3hoa n LEU 356 CO 0.32 0.39 0.07 -0.63 -1.33 0.00 0.00 177.39 176.21 3hoa s ILE 357 N -2.60 5.15 0.13 -0.08 1.09 -1.26 -4.89 121.20 118.74 3hoa s ILE 357 Ca -0.06 0.32 -0.26 0.00 -1.10 0.00 0.00 60.65 59.56 3hoa s ILE 357 Cb 0.08 -3.78 -0.03 0.00 -1.06 0.00 0.00 42.46 37.67 3hoa s ILE 357 CO 0.83 0.01 1.62 -0.09 -0.10 0.00 0.00 174.94 177.21 3hoa h ARG 358 N 8.33 -0.38 0.00 2.79 2.43 -1.96 -1.57 114.38 124.02 3hoa h ARG 358 Ca -0.30 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 3hoa h ARG 358 Cb 1.15 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 3hoa h ARG 358 CO 0.68 -0.26 0.00 1.33 -1.51 0.00 0.00 179.97 180.21 3hoa n VAL 359 N -5.40 1.42 0.59 0.20 0.24 -1.26 -0.97 118.33 113.15 3hoa n VAL 359 Ca -0.04 0.36 0.06 0.00 -2.04 0.00 0.00 64.34 62.68 3hoa n VAL 359 Cb 0.31 -1.26 -0.03 0.00 -1.47 0.00 0.00 33.84 31.40 3hoa n VAL 359 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3hoa n GLU 360 N -1.44 2.26 -1.98 7.34 1.02 -0.70 -5.02 120.64 122.11 3hoa n GLU 360 Ca 0.02 -0.43 -0.39 0.00 -0.02 0.00 0.00 57.16 56.34 3hoa n GLU 360 Cb 0.06 -1.15 0.01 0.00 -0.02 0.00 0.00 31.44 30.35 3hoa n GLU 360 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hoa s ALA 361 N -1.86 3.05 0.85 0.62 0.00 -0.15 -5.02 121.76 119.24 3hoa s ALA 361 Ca 0.09 1.22 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 3hoa s ALA 361 Cb 0.10 -3.50 0.10 0.00 0.00 0.00 0.00 23.12 19.82 3hoa s ALA 361 CO 0.41 -1.01 1.15 0.16 0.00 0.00 0.00 175.76 176.47 3hoa s ASP 362 N -0.93 4.11 0.27 0.00 -4.77 -1.26 -4.66 116.67 109.44 3hoa s ASP 362 Ca 0.64 0.93 -0.00 0.00 -3.30 0.00 0.00 52.55 50.81 3hoa s ASP 362 Cb -0.37 -1.49 0.62 0.00 -1.09 0.00 0.00 42.92 40.59 3hoa s ASP 362 CO 0.46 -2.17 1.68 -0.33 0.70 0.00 0.00 175.17 175.51 3hoa h GLU 363 N -1.23 0.29 -0.02 2.11 5.08 -1.92 0.75 114.58 119.63 3hoa h GLU 363 Ca -0.48 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 57.71 3hoa h GLU 363 Cb 1.32 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.52 3hoa h GLU 363 CO 0.64 0.19 -0.59 0.28 -1.00 0.00 0.00 179.01 178.52 3hoa h VAL 364 N 0.29 1.41 0.00 3.13 2.07 -1.96 -3.36 116.25 117.83 3hoa h VAL 364 Ca 0.50 -2.03 -0.15 0.00 0.82 0.00 0.00 66.70 65.84 3hoa h VAL 364 Cb 0.94 2.51 -0.02 0.00 -1.52 0.00 0.00 31.29 33.19 3hoa h VAL 364 CO -0.56 0.60 -0.97 0.71 0.02 0.00 0.00 177.57 177.37 3hoa h THR 365 N -0.04 0.83 -0.92 2.57 1.35 -1.89 -3.40 112.91 111.40 3hoa h THR 365 Ca -0.07 -2.30 0.12 0.00 -0.55 0.00 0.00 66.41 63.61 3hoa h THR 365 Cb 1.29 2.33 -0.13 0.00 -1.73 0.00 0.00 68.15 69.90 3hoa h THR 365 CO 0.12 0.47 -0.43 0.00 -0.25 0.00 0.00 175.52 175.43 3hoa n TYR 366 N -3.10 -0.14 0.30 4.73 9.36 0.24 -0.75 117.16 127.80 3hoa n TYR 366 Ca -0.03 1.15 0.18 0.00 3.32 0.00 0.00 57.90 62.51 3hoa n TYR 366 Cb 0.81 -0.74 0.84 0.00 -0.63 0.00 0.00 39.34 39.62 3hoa n TYR 366 CO 0.00 0.00 0.00 -0.91 0.22 0.00 0.00 176.86 176.17 3hoa h ASN 367 N 0.00 0.00 0.34 2.98 2.35 -1.81 -0.29 115.58 119.16 3hoa h ASN 367 Ca 0.26 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.89 3hoa h ASN 367 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 3hoa h ASN 367 CO -0.90 0.00 -0.48 -0.07 -1.65 0.00 0.00 177.43 174.33 3hoa h LEU 368 N 0.00 0.18 -0.49 1.61 3.38 -1.21 -0.35 115.31 118.42 3hoa h LEU 368 Ca 0.00 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3hoa h LEU 368 Cb 0.23 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3hoa h LEU 368 CO 0.00 0.63 0.23 0.45 0.09 0.00 0.00 178.44 179.84 3hoa h HIS 369 N 0.13 0.71 -0.48 1.13 3.86 -1.03 -1.96 115.15 117.53 3hoa h HIS 369 Ca 0.01 -0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.10 3hoa h HIS 369 Cb 0.90 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 29.12 3hoa h HIS 369 CO 0.01 0.57 -0.01 0.82 0.86 0.00 0.00 177.93 180.18 3hoa h ILE 370 N 0.65 1.24 -0.40 2.45 1.08 -1.39 -2.77 117.51 118.39 3hoa h ILE 370 Ca 0.17 -1.03 0.02 0.00 -0.39 0.00 0.00 64.86 63.63 3hoa h ILE 370 Cb 0.13 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 3hoa h ILE 370 CO -0.02 0.36 0.23 0.25 -0.69 0.00 0.00 178.15 178.28 3hoa h LEU 371 N 0.74 0.36 -0.14 1.44 6.46 -0.54 -1.04 115.31 122.59 3hoa h LEU 371 Ca 0.14 0.01 0.04 0.00 -0.12 0.00 0.00 57.88 57.95 3hoa h LEU 371 Cb 0.47 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 40.29 3hoa h LEU 371 CO 0.02 0.26 -0.13 0.58 -0.62 0.00 0.00 178.44 178.56 3hoa h VAL 372 N 0.46 0.65 -0.73 1.05 2.07 -1.13 -1.19 116.25 117.43 3hoa h VAL 372 Ca 0.16 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.71 3hoa h VAL 372 Cb 0.02 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 3hoa h VAL 372 CO -0.08 0.00 0.45 0.03 0.02 0.00 0.00 177.57 177.99 3hoa h ARG 373 N -0.15 0.85 0.24 1.57 3.08 -1.21 -1.48 114.38 117.29 3hoa h ARG 373 Ca 0.09 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 3hoa h ARG 373 Cb 0.28 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hoa h ARG 373 CO -0.22 0.57 -0.11 1.25 -1.07 0.00 0.00 179.97 180.38 3hoa h LEU 374 N 0.88 -0.27 -0.72 3.04 5.85 -0.79 0.18 115.31 123.47 3hoa h LEU 374 Ca 0.30 -0.03 0.10 0.00 0.84 0.00 0.00 57.88 59.08 3hoa h LEU 374 Cb 0.04 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.07 3hoa h LEU 374 CO -0.12 -0.15 0.36 -0.33 -0.34 0.00 0.00 178.44 177.87 3hoa h GLU 375 N -0.37 0.59 -0.22 1.25 5.08 -1.01 0.16 114.58 120.06 3hoa h GLU 375 Ca -0.03 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 3hoa h GLU 375 Cb 0.29 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 3hoa h GLU 375 CO 0.05 0.39 0.09 -0.07 -1.00 0.00 0.00 179.01 178.48 3hoa h LEU 376 N 0.61 0.30 -1.07 1.33 3.38 -0.99 -0.62 115.31 118.25 3hoa h LEU 376 Ca 0.36 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 3hoa h LEU 376 Cb 0.38 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 3hoa h LEU 376 CO -0.27 0.37 0.31 -0.33 0.09 0.00 0.00 178.44 178.61 3hoa h GLU 377 N 0.20 0.97 -0.40 1.13 5.08 0.38 0.24 114.58 122.18 3hoa h GLU 377 Ca 0.07 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 3hoa h GLU 377 Cb 0.16 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3hoa h GLU 377 CO -0.01 0.76 -0.01 -0.07 -1.00 0.00 0.00 179.01 178.68 3hoa h LEU 378 N 0.96 0.70 -0.59 1.33 3.38 -0.56 -1.62 115.31 118.91 3hoa h LEU 378 Ca 0.23 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 3hoa h LEU 378 Cb 0.12 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3hoa h LEU 378 CO -0.03 0.84 0.35 0.00 0.09 0.00 0.00 178.44 179.69 3hoa h ALA 379 N 0.88 0.76 0.56 1.53 0.00 -0.59 0.11 119.26 122.51 3hoa h ALA 379 Ca 0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3hoa h ALA 379 Cb 0.49 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.05 3hoa h ALA 379 CO 0.02 0.25 -0.27 -0.07 0.00 0.00 0.00 179.25 179.19 3hoa h LEU 380 N 0.80 -0.64 -1.15 0.00 3.38 -0.80 0.12 115.31 117.02 3hoa h LEU 380 Ca 0.21 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 3hoa h LEU 380 Cb 0.01 0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 3hoa h LEU 380 CO -0.04 -0.45 -0.08 -0.26 0.09 0.00 0.00 178.44 177.70 3hoa h PHE 381 N -0.75 0.00 -0.00 1.13 -1.00 -1.20 -2.05 116.94 113.06 3hoa h PHE 381 Ca -0.08 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.70 3hoa h PHE 381 Cb 0.58 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.14 3hoa h PHE 381 CO -0.04 0.08 -0.05 0.54 -1.61 0.00 0.00 178.31 177.23 3hoa n ARG 382 N -3.19 0.71 -1.45 1.51 1.74 0.36 -4.85 116.66 111.48 3hoa n ARG 382 Ca 0.01 -0.16 -0.05 0.00 -0.77 0.00 0.00 57.85 56.88 3hoa n ARG 382 Cb 0.38 -1.50 -0.02 0.00 -1.02 0.00 0.00 32.46 30.31 3hoa n ARG 382 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hoa n GLY 383 N 1.23 0.59 0.26 -0.13 0.00 -0.77 -4.92 105.19 101.46 3hoa n GLY 383 Ca 0.16 -0.77 0.09 0.00 0.00 0.00 0.00 46.02 45.51 3hoa n GLY 383 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hoa n GLU 384 N -2.43 1.14 -3.81 1.61 1.02 0.34 -4.94 120.64 113.57 3hoa n GLU 384 Ca -0.06 -0.55 -0.13 0.00 -0.02 0.00 0.00 57.16 56.41 3hoa n GLU 384 Cb 0.29 -1.40 -0.14 0.00 -0.02 0.00 0.00 31.44 30.18 3hoa n GLU 384 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3hoa s LEU 385 N -2.55 1.40 -0.10 -4.62 0.20 -0.80 -4.94 118.68 107.28 3hoa s LEU 385 Ca 0.13 0.18 -0.05 0.00 0.69 0.00 0.00 54.13 55.07 3hoa s LEU 385 Cb 0.15 0.25 -0.04 0.00 -0.43 0.00 0.00 46.19 46.13 3hoa s LEU 385 CO 0.62 -0.07 0.12 -0.55 -0.29 0.00 0.00 176.35 176.18 3hoa s SER 386 N 0.43 6.18 0.61 3.68 0.15 -1.26 -4.24 113.70 119.23 3hoa s SER 386 Ca -0.03 0.39 0.28 0.00 0.70 0.00 0.00 55.95 57.29 3hoa s SER 386 Cb -0.05 -1.95 1.40 0.00 -1.71 0.00 0.00 66.02 63.71 3hoa s SER 386 CO -0.02 0.39 1.81 1.55 1.20 0.00 0.00 173.24 178.17 3hoa h PRO 387 N 4.86 0.00 0.00 5.44 0.13 -2.00 0.40 132.00 140.82 3hoa h PRO 387 Ca -0.54 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.54 3hoa h PRO 387 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 3hoa h PRO 387 CO 0.59 0.00 -0.28 1.05 -0.23 0.00 0.00 178.00 179.13 3hoa h GLU 388 N 0.00 0.00 -0.61 0.86 4.11 -1.98 -2.98 114.58 113.97 3hoa h GLU 388 Ca 0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.64 3hoa h GLU 388 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3hoa h GLU 388 CO -0.00 0.28 0.00 -0.25 0.07 0.00 0.00 179.01 179.11 3hoa n ASP 389 N -3.46 5.41 -0.13 3.06 8.00 0.14 -4.49 116.55 125.08 3hoa n ASP 389 Ca -0.00 -2.75 -0.12 0.00 0.71 0.00 0.00 54.79 52.63 3hoa n ASP 389 Cb 0.45 -0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 40.88 3hoa n ASP 389 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3hoa h LEU 390 N 4.09 0.83 -0.59 0.64 3.38 -1.50 -2.74 115.31 119.41 3hoa h LEU 390 Ca 0.00 -0.41 0.08 0.00 0.09 0.00 0.00 57.88 57.64 3hoa h LEU 390 Cb 1.79 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 42.25 3hoa h LEU 390 CO 0.40 1.06 0.26 -0.65 0.09 0.00 0.00 178.44 179.59 3hoa h PRO 391 N 0.60 0.46 -0.08 1.13 0.11 -1.83 0.42 132.00 132.81 3hoa h PRO 391 Ca 0.08 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.15 3hoa h PRO 391 Cb 0.75 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.76 3hoa h PRO 391 CO 0.06 0.30 -0.01 0.93 -0.21 0.00 0.00 178.00 179.07 3hoa h GLU 392 N 0.47 0.14 -0.59 1.05 3.07 -1.89 -1.78 114.58 115.06 3hoa h GLU 392 Ca 0.29 -0.05 -0.03 0.00 -0.50 0.00 0.00 59.36 59.06 3hoa h GLU 392 Cb 0.29 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 3hoa h GLU 392 CO -0.25 0.45 0.25 0.00 -1.40 0.00 0.00 179.01 178.05 3hoa h ALA 393 N 0.69 1.32 -0.08 3.43 0.00 -1.21 -1.41 119.26 122.00 3hoa h ALA 393 Ca 0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hoa h ALA 393 Cb 0.39 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3hoa h ALA 393 CO 0.01 0.51 0.05 2.35 0.00 0.00 0.00 179.25 182.17 3hoa h TRP 394 N 0.85 0.11 0.31 0.00 2.91 -0.02 0.19 115.95 120.29 3hoa h TRP 394 Ca 0.20 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.22 3hoa h TRP 394 Cb 0.15 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 28.76 3hoa h TRP 394 CO 0.01 0.10 -0.20 0.00 -1.03 0.00 0.00 178.44 177.32 3hoa h ALA 395 N 1.00 -0.48 -0.35 2.65 0.00 -0.90 -0.90 119.26 120.27 3hoa h ALA 395 Ca 0.03 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.90 3hoa h ALA 395 Cb 0.02 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3hoa h ALA 395 CO -0.01 -0.78 0.10 0.93 0.00 0.00 0.00 179.25 179.49 3hoa h GLU 396 N -0.49 0.22 -0.50 0.00 5.08 -1.18 -1.16 114.58 116.55 3hoa h GLU 396 Ca -0.03 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 3hoa h GLU 396 Cb 0.41 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.57 3hoa h GLU 396 CO 0.02 0.15 0.23 0.87 -1.00 0.00 0.00 179.01 179.28 3hoa h LYS 397 N 0.23 0.44 -0.14 2.33 1.79 -0.80 -2.08 116.57 118.35 3hoa h LYS 397 Ca 0.16 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.60 3hoa h LYS 397 Cb 0.16 -0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 30.71 3hoa h LYS 397 CO -0.19 0.29 0.06 1.88 -1.08 0.00 0.00 179.45 180.41 3hoa h TYR 398 N 0.46 0.20 -0.41 -1.35 -1.99 -0.69 -1.24 116.97 111.95 3hoa h TYR 398 Ca 0.23 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.99 3hoa h TYR 398 Cb 0.17 -0.06 -0.04 0.00 2.00 0.00 0.00 36.73 38.79 3hoa h TYR 398 CO -0.12 0.28 0.16 0.00 -0.00 0.00 0.00 178.16 178.48 3hoa h ARG 399 N 0.07 0.32 -0.32 4.88 3.08 -1.03 0.41 114.38 121.79 3hoa h ARG 399 Ca 0.05 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 3hoa h ARG 399 Cb 0.16 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3hoa h ARG 399 CO -0.00 0.21 -0.02 -0.44 -1.07 0.00 0.00 179.97 178.65 3hoa h ASP 400 N 0.33 0.57 0.17 7.04 3.32 -1.31 0.71 116.42 127.26 3hoa h ASP 400 Ca 0.19 -0.32 -0.26 0.00 0.02 0.00 0.00 57.03 56.65 3hoa h ASP 400 Cb 0.16 -0.15 0.02 0.00 0.22 0.00 0.00 39.33 39.57 3hoa h ASP 400 CO -0.18 0.75 -1.21 0.45 -1.72 0.00 0.00 179.24 177.33 3hoa h HIS 401 N 0.37 0.67 0.00 4.55 3.86 -1.06 -3.40 115.15 120.14 3hoa h HIS 401 Ca 0.09 -0.49 -0.03 0.00 -1.16 0.00 0.00 60.37 58.78 3hoa h HIS 401 Cb 0.47 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 28.91 3hoa h HIS 401 CO 0.04 1.47 -1.84 1.28 0.86 0.00 0.00 177.93 179.74 3hoa n LEU 402 N -3.92 0.00 0.00 2.43 4.77 0.14 -5.00 117.00 115.42 3hoa n LEU 402 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 3hoa n LEU 402 Cb 0.94 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 3hoa n LEU 402 CO 0.51 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3hoa n GLY 403 N 1.56 0.82 2.90 -0.72 0.00 0.24 -4.82 105.19 105.17 3hoa n GLY 403 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 3hoa n GLY 403 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hoa s VAL 404 N -3.28 -0.00 0.15 1.61 -7.23 -1.25 -4.91 120.40 105.49 3hoa s VAL 404 Ca 0.00 0.00 0.06 0.00 -1.81 0.00 0.00 61.98 60.23 3hoa s VAL 404 Cb 0.00 -0.05 -0.04 0.00 0.56 0.00 0.00 36.38 36.85 3hoa s VAL 404 CO 0.00 0.00 -0.14 0.00 -0.31 0.00 0.00 175.10 174.66 3hoa s ALA 405 N 0.02 1.63 0.64 1.32 0.00 -1.26 -3.78 121.76 120.33 3hoa s ALA 405 Ca -0.00 -1.43 -0.16 0.00 0.00 0.00 0.00 51.96 50.37 3hoa s ALA 405 Cb -0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 23.05 3hoa s ALA 405 CO 0.00 0.06 1.13 -2.14 0.00 0.00 0.00 175.76 174.80 3hoa s PRO 406 N -3.12 2.84 -0.00 0.00 0.02 -1.26 -4.95 135.00 128.52 3hoa s PRO 406 Ca 0.14 1.48 0.13 0.00 0.02 0.00 0.00 61.00 62.76 3hoa s PRO 406 Cb -0.02 -1.95 -0.16 0.00 0.02 0.00 0.00 34.50 32.39 3hoa s PRO 406 CO 0.03 -1.24 0.50 0.36 -0.33 0.00 0.00 177.00 176.33 3hoa n LYS 407 N -2.23 2.23 -1.83 5.54 0.00 -1.26 -4.97 118.16 115.63 3hoa n LYS 407 Ca 0.11 -0.03 0.00 0.00 -0.00 0.00 0.00 58.31 58.39 3hoa n LYS 407 Cb 0.52 -1.16 0.00 0.00 -0.00 0.00 0.00 35.03 34.39 3hoa n LYS 407 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 3hoa n ASP 408 N -1.44 0.45 -0.05 -5.58 3.85 -1.26 -5.08 116.55 107.44 3hoa n ASP 408 Ca 0.01 -0.92 -0.16 0.00 -0.71 0.00 0.00 54.79 53.02 3hoa n ASP 408 Cb 0.23 0.00 -0.14 0.00 -1.35 0.00 0.00 41.12 39.86 3hoa n ASP 408 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 3hoa n TYR 409 N 0.00 0.69 -0.21 2.11 4.02 -1.26 -3.73 117.16 118.78 3hoa n TYR 409 Ca 0.00 0.18 -0.02 0.00 -0.01 0.00 0.00 57.90 58.05 3hoa n TYR 409 Cb 0.00 -1.10 0.04 0.00 -0.02 0.00 0.00 39.34 38.26 3hoa n TYR 409 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 3hoa h LYS 410 N 0.03 -0.07 -0.60 -0.72 3.64 -1.85 0.17 116.57 117.17 3hoa h LYS 410 Ca -0.45 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 58.84 3hoa h LYS 410 Cb 2.03 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 33.82 3hoa h LYS 410 CO 0.03 -0.05 0.11 -0.25 -2.27 0.00 0.00 179.45 177.03 3hoa n ASP 411 N -5.44 5.13 0.00 4.20 10.43 -1.26 -3.43 116.55 126.17 3hoa n ASP 411 Ca 0.06 -3.08 0.00 0.00 2.57 0.00 0.00 54.79 54.34 3hoa n ASP 411 Cb 0.34 -0.70 0.00 0.00 1.84 0.00 0.00 41.12 42.61 3hoa n ASP 411 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3hoa n GLY 412 N 0.14 1.78 0.19 0.44 0.00 0.53 -4.71 105.19 103.56 3hoa n GLY 412 Ca 0.33 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.48 3hoa n GLY 412 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3hoa h VAL 413 N 0.00 0.00 -0.57 1.61 -1.51 -1.81 -2.71 116.25 111.26 3hoa h VAL 413 Ca 0.00 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 3hoa h VAL 413 Cb 0.00 0.63 0.00 0.00 -2.13 0.00 0.00 31.29 29.79 3hoa h VAL 413 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 177.57 176.57 3hoa n MET 414 N -2.40 3.31 0.09 5.19 2.81 -0.76 -4.56 117.12 120.81 3hoa n MET 414 Ca -0.01 -2.69 -0.06 0.00 -1.81 0.00 0.00 57.70 53.13 3hoa n MET 414 Cb 0.07 -1.71 0.06 0.00 -0.71 0.00 0.00 33.22 30.93 3hoa n MET 414 CO 0.00 0.00 0.00 -0.56 1.51 0.00 0.00 175.97 176.92 3hoa h GLN 415 N 3.53 0.16 -6.01 0.03 3.07 -1.50 -3.45 115.11 110.95 3hoa h GLN 415 Ca 0.00 -0.14 -0.68 0.00 0.09 0.00 0.00 58.65 57.92 3hoa h GLN 415 Cb 1.23 0.03 -0.15 0.00 0.08 0.00 0.00 27.48 28.67 3hoa h GLN 415 CO 0.14 0.83 -0.63 -0.51 0.09 0.00 0.00 178.83 178.75 3hoa s ASP 416 N -6.89 5.20 0.44 0.06 1.01 -1.26 -5.00 116.67 110.23 3hoa s ASP 416 Ca -0.03 0.12 0.26 0.00 0.71 0.00 0.00 52.55 53.62 3hoa s ASP 416 Cb 0.11 -1.44 0.72 0.00 1.01 0.00 0.00 42.92 43.32 3hoa s ASP 416 CO 0.80 0.37 1.74 1.62 0.21 0.00 0.00 175.17 179.91 3hoa h VAL 417 N 4.07 0.00 -0.85 -1.27 3.04 -1.96 -3.39 116.25 115.89 3hoa h VAL 417 Ca -0.50 -0.76 0.10 0.00 -1.01 0.00 0.00 66.70 64.52 3hoa h VAL 417 Cb 1.19 1.75 -0.12 0.00 -2.01 0.00 0.00 31.29 32.10 3hoa h VAL 417 CO 0.55 0.00 -0.43 1.41 -1.01 0.00 0.00 177.57 178.08 3hoa n HIS 418 N -2.96 -0.21 0.22 3.17 8.25 -1.26 -0.84 115.22 121.59 3hoa n HIS 418 Ca 0.03 1.06 0.05 0.00 -0.26 0.00 0.00 57.72 58.61 3hoa n HIS 418 Cb 0.44 -0.67 0.49 0.00 1.12 0.00 0.00 29.99 31.36 3hoa n HIS 418 CO 0.00 0.00 0.00 -1.49 0.64 0.00 0.00 176.34 175.49 3hoa h TRP 419 N 0.00 0.00 -0.29 4.41 6.55 -1.78 0.26 115.95 125.10 3hoa h TRP 419 Ca 0.20 0.00 -0.17 0.00 0.95 0.00 0.00 58.89 59.88 3hoa h TRP 419 Cb 0.42 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.72 3hoa h TRP 419 CO -0.82 0.23 -0.47 0.00 -1.05 0.00 0.00 178.44 176.33 3hoa h ALA 420 N 1.77 0.45 0.00 1.49 0.00 -1.27 -2.59 119.26 119.12 3hoa h ALA 420 Ca -0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3hoa h ALA 420 Cb 0.43 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hoa h ALA 420 CO 0.03 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.30 3hoa n GLY 421 N 0.31 -0.77 2.18 0.00 0.00 -0.49 -4.39 105.19 102.02 3hoa n GLY 421 Ca -0.04 -0.12 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 3hoa n GLY 421 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hoa n GLY 422 N 0.48 0.79 3.50 -0.02 0.00 -0.67 -4.92 105.19 104.35 3hoa n GLY 422 Ca 0.14 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 45.01 3hoa n GLY 422 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hoa n LEU 423 N -0.60 5.12 -4.74 0.99 4.77 0.82 -4.95 117.00 118.41 3hoa n LEU 423 Ca -0.05 -4.15 -0.35 0.00 -0.03 0.00 0.00 56.01 51.42 3hoa n LEU 423 Cb 0.19 -1.69 -0.09 0.00 -2.33 0.00 0.00 43.42 39.50 3hoa n LEU 423 CO 0.08 0.42 -0.27 -0.36 -1.33 0.00 0.00 177.39 175.93 3hoa s PHE 424 N 3.07 3.28 -0.52 -1.77 0.08 -1.26 -4.17 117.98 116.69 3hoa s PHE 424 Ca 0.49 0.29 0.00 0.00 0.12 0.00 0.00 56.93 57.83 3hoa s PHE 424 Cb 0.02 -1.83 0.00 0.00 -0.57 0.00 0.00 43.02 40.63 3hoa s PHE 424 CO 0.04 0.54 0.00 0.41 -0.10 0.00 0.00 175.22 176.11 3hoa n GLY 425 N 2.12 0.67 0.25 4.36 0.00 -1.26 -4.71 105.19 106.62 3hoa n GLY 425 Ca -0.19 -0.81 -0.24 0.00 0.00 0.00 0.00 46.02 44.78 3hoa n GLY 425 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3hoa n TYR 426 N -3.05 0.00 -0.32 1.61 9.36 -1.26 -4.31 117.16 119.19 3hoa n TYR 426 Ca -0.05 0.00 0.18 0.00 3.32 0.00 0.00 57.90 61.35 3hoa n TYR 426 Cb 0.23 -0.85 0.38 0.00 -0.63 0.00 0.00 39.34 38.47 3hoa n TYR 426 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3hoa h PHE 427 N -0.76 0.79 -0.38 2.98 0.05 -1.91 -1.14 116.94 116.57 3hoa h PHE 427 Ca -0.59 0.04 0.11 0.00 3.82 0.00 0.00 57.97 61.35 3hoa h PHE 427 Cb 1.55 -0.19 -0.02 0.00 2.00 0.00 0.00 35.95 39.29 3hoa h PHE 427 CO -0.07 -0.09 0.30 -1.35 -0.18 0.00 0.00 178.31 176.92 3hoa h PRO 428 N 0.39 0.00 0.00 1.51 0.11 -1.88 -0.98 132.00 131.15 3hoa h PRO 428 Ca 0.64 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.74 3hoa h PRO 428 Cb 1.32 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.43 3hoa h PRO 428 CO -0.56 0.00 -0.06 1.79 -0.21 0.00 0.00 178.00 178.96 3hoa h THR 429 N 0.00 0.38 -0.60 -1.15 1.35 -1.50 -1.74 112.91 109.64 3hoa h THR 429 Ca 0.18 -0.31 -0.09 0.00 -0.55 0.00 0.00 66.41 65.64 3hoa h THR 429 Cb 0.78 1.22 -0.02 0.00 -1.73 0.00 0.00 68.15 68.40 3hoa h THR 429 CO -0.00 0.06 0.03 1.88 -0.25 0.00 0.00 175.52 177.23 3hoa h TYR 430 N 0.00 1.11 -0.20 4.73 -1.99 -1.33 -1.35 116.97 117.95 3hoa h TYR 430 Ca -0.00 -0.17 -0.21 0.00 2.00 0.00 0.00 58.73 60.34 3hoa h TYR 430 Cb 0.21 -0.30 0.01 0.00 2.00 0.00 0.00 36.73 38.65 3hoa h TYR 430 CO 0.00 0.97 -0.71 1.15 -0.00 0.00 0.00 178.16 179.57 3hoa h THR 431 N 0.95 1.28 -0.80 -2.88 2.02 -1.46 -2.44 112.91 109.57 3hoa h THR 431 Ca 0.18 -1.90 0.05 0.00 0.77 0.00 0.00 66.41 65.51 3hoa h THR 431 Cb 0.51 1.87 -0.06 0.00 -1.74 0.00 0.00 68.15 68.73 3hoa h THR 431 CO 0.02 0.61 0.49 -0.07 0.37 0.00 0.00 175.52 176.95 3hoa h LEU 432 N 0.58 0.78 -0.15 2.58 3.38 -1.33 -0.81 115.31 120.35 3hoa h LEU 432 Ca -0.03 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3hoa h LEU 432 Cb 1.33 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 3hoa h LEU 432 CO 0.15 0.51 -0.15 1.23 0.09 0.00 0.00 178.44 180.27 3hoa h GLY 433 N 0.92 -0.06 1.50 0.83 0.00 -1.03 0.53 103.07 105.76 3hoa h GLY 433 Ca 0.34 0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.81 3hoa h GLY 433 CO -0.16 -0.15 0.08 3.43 0.00 0.00 0.00 176.54 179.74 3hoa h ASN 434 N -0.17 0.58 -0.05 0.19 2.35 -0.94 0.12 115.58 117.66 3hoa h ASN 434 Ca 0.10 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3hoa h ASN 434 Cb 0.32 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.54 3hoa h ASN 434 CO -0.25 0.60 -0.12 -0.07 -1.65 0.00 0.00 177.43 175.94 3hoa h LEU 435 N 0.61 0.19 -1.12 1.61 3.38 -0.30 -2.81 115.31 116.87 3hoa h LEU 435 Ca 0.14 -0.58 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 3hoa h LEU 435 Cb 0.27 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3hoa h LEU 435 CO 0.00 0.74 0.41 1.88 0.09 0.00 0.00 178.44 181.56 3hoa h TYR 436 N -0.35 1.00 -0.66 1.13 0.05 0.14 -1.91 116.97 116.38 3hoa h TYR 436 Ca -0.00 -0.02 0.02 0.00 0.05 0.00 0.00 58.73 58.79 3hoa h TYR 436 Cb 0.71 -0.32 -0.04 0.00 1.01 0.00 0.00 36.73 38.09 3hoa h TYR 436 CO 0.12 0.69 0.42 0.00 -1.05 0.00 0.00 178.16 178.34 3hoa h ALA 437 N 1.42 0.86 -0.52 3.88 0.00 -0.96 0.26 119.26 124.21 3hoa h ALA 437 Ca 0.26 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3hoa h ALA 437 Cb 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3hoa h ALA 437 CO -0.04 0.20 0.07 0.00 0.00 0.00 0.00 179.25 179.48 3hoa h ALA 438 N 1.28 0.69 -0.35 0.00 0.00 -1.14 -0.88 119.26 118.85 3hoa h ALA 438 Ca 0.26 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 3hoa h ALA 438 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3hoa h ALA 438 CO -0.09 0.43 -0.16 1.96 0.00 0.00 0.00 179.25 181.39 3hoa h GLN 439 N 0.74 0.74 -0.31 0.00 4.20 -0.89 -2.21 115.11 117.38 3hoa h GLN 439 Ca 0.16 -0.32 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 3hoa h GLN 439 Cb 0.42 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 3hoa h GLN 439 CO 0.01 0.93 0.15 0.74 -0.67 0.00 0.00 178.83 179.98 3hoa h PHE 440 N 0.52 0.44 -0.43 2.96 0.05 -0.41 -2.78 116.94 117.29 3hoa h PHE 440 Ca 0.08 -0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.85 3hoa h PHE 440 Cb 0.70 -0.14 -0.02 0.00 2.00 0.00 0.00 35.95 38.49 3hoa h PHE 440 CO 0.06 0.40 0.26 0.35 -0.18 0.00 0.00 178.31 179.19 3hoa h PHE 441 N 0.36 0.56 0.28 -0.55 3.57 -1.10 -1.45 116.94 118.61 3hoa h PHE 441 Ca 0.10 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 3hoa h PHE 441 Cb 0.12 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.68 3hoa h PHE 441 CO -0.02 0.37 -0.14 0.37 -2.23 0.00 0.00 178.31 176.67 3hoa h GLN 442 N 0.59 -0.36 -0.84 1.11 4.15 -1.19 -1.44 115.11 117.13 3hoa h GLN 442 Ca 0.16 0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.66 3hoa h GLN 442 Cb -0.02 0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.69 3hoa h GLN 442 CO -0.03 -0.11 0.52 -0.22 -1.93 0.00 0.00 178.83 177.07 3hoa h LYS 443 N -0.59 0.94 -0.10 1.69 1.63 -1.23 -1.76 116.57 117.14 3hoa h LYS 443 Ca -0.04 -0.06 0.03 0.00 -0.85 0.00 0.00 60.65 59.73 3hoa h LYS 443 Cb 0.43 -0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 31.82 3hoa h LYS 443 CO 0.06 0.62 -0.08 0.00 -3.45 0.00 0.00 179.45 176.61 3hoa h ALA 444 N 1.39 0.01 -0.12 5.00 0.00 -1.06 -1.66 119.26 122.82 3hoa h ALA 444 Ca 0.36 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 3hoa h ALA 444 Cb 0.15 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3hoa h ALA 444 CO -0.17 -0.53 -0.19 0.93 0.00 0.00 0.00 179.25 179.29 3hoa h GLU 445 N -0.08 0.20 -0.16 0.00 5.08 -0.87 0.14 114.58 118.88 3hoa h GLU 445 Ca 0.07 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3hoa h GLU 445 Cb 0.18 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 3hoa h GLU 445 CO -0.16 0.39 0.06 0.00 -1.00 0.00 0.00 179.01 178.30 3hoa h ALA 446 N 1.62 0.21 0.00 3.43 0.00 -0.79 0.43 119.26 124.16 3hoa h ALA 446 Ca 0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3hoa h ALA 446 Cb 0.45 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hoa h ALA 446 CO 0.03 -0.19 -0.24 0.93 0.00 0.00 0.00 179.25 179.78 3hoa h GLU 447 N 0.09 0.00 -0.00 0.00 5.08 -1.07 -3.35 114.58 115.33 3hoa h GLU 447 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3hoa h GLU 447 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3hoa h GLU 447 CO -0.00 0.05 -0.50 1.28 -1.00 0.00 0.00 179.01 178.83 3hoa n LEU 448 N -3.03 0.52 0.00 1.33 4.77 0.46 -5.10 117.00 115.95 3hoa n LEU 448 Ca 0.03 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.50 3hoa n LEU 448 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 3hoa n LEU 448 CO 0.36 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 3hoa n GLY 449 N 1.25 -1.08 3.66 -0.72 0.00 0.15 -4.88 105.19 103.56 3hoa n GLY 449 Ca 0.02 -1.62 -0.59 0.00 0.00 0.00 0.00 46.02 43.83 3hoa n GLY 449 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hoa n PRO 450 N -1.01 0.68 0.10 1.61 -0.04 -1.26 -4.64 135.00 130.44 3hoa n PRO 450 Ca 0.00 0.25 0.03 0.00 -0.04 0.00 0.00 63.50 63.73 3hoa n PRO 450 Cb 0.00 -1.85 -0.01 0.00 -0.04 0.00 0.00 33.50 31.61 3hoa n PRO 450 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3hoa h LEU 451 N 5.33 0.00 -0.61 1.53 3.38 -1.90 -3.37 115.31 119.67 3hoa h LEU 451 Ca -0.47 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.63 3hoa h LEU 451 Cb 1.35 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.00 3hoa h LEU 451 CO 0.87 0.47 -0.07 -0.33 0.09 0.00 0.00 178.44 179.47 3hoa h GLU 452 N 0.00 0.06 -0.73 1.13 3.07 -2.00 -0.52 114.58 115.59 3hoa h GLU 452 Ca -0.06 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 3hoa h GLU 452 Cb 1.41 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 29.27 3hoa h GLU 452 CO 0.05 0.04 0.39 -1.00 -1.40 0.00 0.00 179.01 177.09 3hoa h PRO 453 N 0.06 1.02 -0.11 2.33 0.13 -1.98 -1.47 132.00 131.99 3hoa h PRO 453 Ca 0.31 -0.12 -0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3hoa h PRO 453 Cb 0.49 -0.20 -0.00 0.00 0.13 0.00 0.00 31.00 31.41 3hoa h PRO 453 CO -0.57 0.77 0.05 0.00 -0.23 0.00 0.00 178.00 178.02 3hoa h ARG 454 N 1.01 0.15 -0.92 0.86 3.08 -1.46 -2.56 114.38 114.54 3hoa h ARG 454 Ca 0.26 -0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.38 3hoa h ARG 454 Cb 0.05 -0.03 -0.08 0.00 0.08 0.00 0.00 29.97 29.99 3hoa h ARG 454 CO -0.04 0.23 0.56 0.74 -1.07 0.00 0.00 179.97 180.39 3hoa h PHE 455 N 0.04 1.02 -0.32 3.04 0.05 -1.01 0.24 116.94 120.00 3hoa h PHE 455 Ca 0.04 0.03 0.07 0.00 3.82 0.00 0.00 57.97 61.93 3hoa h PHE 455 Cb 0.13 -0.32 -0.01 0.00 2.00 0.00 0.00 35.95 37.75 3hoa h PHE 455 CO -0.03 0.43 0.22 0.00 -0.18 0.00 0.00 178.31 178.75 3hoa h ALA 456 N 1.49 2.18 -0.01 2.45 0.00 -0.88 -0.62 119.26 123.86 3hoa h ALA 456 Ca 0.44 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3hoa h ALA 456 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hoa h ALA 456 CO -0.24 -0.26 -0.43 0.54 0.00 0.00 0.00 179.25 178.86 3hoa n ARG 457 N -4.46 0.71 -0.75 0.00 1.74 0.69 -4.04 116.66 110.54 3hoa n ARG 457 Ca 0.04 -0.49 0.00 0.00 -0.77 0.00 0.00 57.85 56.63 3hoa n ARG 457 Cb 0.33 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 3hoa n ARG 457 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hoa n GLY 458 N 1.40 0.57 3.46 -0.13 0.00 -0.24 -4.99 105.19 105.26 3hoa n GLY 458 Ca 0.10 -0.47 -0.44 0.00 0.00 0.00 0.00 46.02 45.20 3hoa n GLY 458 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hoa s GLU 459 N -0.97 3.93 -0.06 1.61 2.12 -0.31 -4.74 118.70 120.28 3hoa s GLU 459 Ca 0.00 -2.34 0.19 0.00 0.36 0.00 0.00 54.97 53.18 3hoa s GLU 459 Cb 0.00 -5.00 -0.28 0.00 0.26 0.00 0.00 34.13 29.11 3hoa s GLU 459 CO 0.00 -1.75 0.35 1.19 -0.54 0.00 0.00 175.26 174.50 3hoa n PHE 460 N 5.86 0.00 -0.32 5.30 3.01 -1.26 -4.27 117.46 125.78 3hoa n PHE 460 Ca 0.32 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.87 3hoa n PHE 460 Cb 0.45 -0.54 0.29 0.00 -0.01 0.00 0.00 39.48 39.67 3hoa n PHE 460 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 3hoa h GLN 461 N 0.00 0.86 -0.21 -1.08 5.75 -1.85 -0.60 115.11 117.98 3hoa h GLN 461 Ca -0.10 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.35 3hoa h GLN 461 Cb 1.15 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.49 3hoa h GLN 461 CO 0.01 0.57 0.13 -1.35 -2.65 0.00 0.00 178.83 175.53 3hoa h PRO 462 N 0.89 0.26 -0.61 -2.39 0.11 -1.99 0.40 132.00 128.66 3hoa h PRO 462 Ca 0.47 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.52 3hoa h PRO 462 Cb 0.55 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 3hoa h PRO 462 CO -0.23 0.17 0.20 0.35 -0.21 0.00 0.00 178.00 178.27 3hoa h PHE 463 N 0.26 0.97 -0.36 0.65 3.57 -1.66 -1.91 116.94 118.46 3hoa h PHE 463 Ca 0.08 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 3hoa h PHE 463 Cb -0.01 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 3hoa h PHE 463 CO -0.08 0.80 0.14 1.25 -2.23 0.00 0.00 178.31 178.20 3hoa h LEU 464 N 0.87 0.50 -1.76 0.59 5.85 -0.79 -2.18 115.31 118.39 3hoa h LEU 464 Ca 0.20 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3hoa h LEU 464 Cb 0.28 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3hoa h LEU 464 CO -0.01 0.54 0.20 0.44 -0.34 0.00 0.00 178.44 179.27 3hoa h ASP 465 N 0.44 0.28 -0.27 1.25 3.32 -0.03 -0.62 116.42 120.79 3hoa h ASP 465 Ca 0.12 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 3hoa h ASP 465 Cb 0.19 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3hoa h ASP 465 CO -0.01 0.20 0.05 -0.25 -1.72 0.00 0.00 179.24 177.51 3hoa h TRP 466 N 0.33 0.47 -0.15 4.55 7.01 -0.81 -1.53 115.95 125.82 3hoa h TRP 466 Ca 0.12 -0.06 -0.08 0.00 2.11 0.00 0.00 58.89 60.98 3hoa h TRP 466 Cb 0.07 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 26.99 3hoa h TRP 466 CO -0.00 0.53 -0.26 1.79 -2.79 0.00 0.00 178.44 177.72 3hoa h THR 467 N 0.26 1.24 -0.03 2.65 1.35 -0.66 0.04 112.91 117.77 3hoa h THR 467 Ca 0.08 -1.14 -0.00 0.00 -0.55 0.00 0.00 66.41 64.80 3hoa h THR 467 Cb 0.31 1.42 -0.00 0.00 -1.73 0.00 0.00 68.15 68.15 3hoa h THR 467 CO 0.00 0.35 0.01 0.03 -0.25 0.00 0.00 175.52 175.66 3hoa h ARG 468 N 0.24 0.05 -0.38 4.72 -0.00 -0.92 0.26 114.38 118.35 3hoa h ARG 468 Ca 0.04 -0.01 -0.13 0.00 -0.50 0.00 0.00 59.98 59.37 3hoa h ARG 468 Cb 0.59 -0.01 -0.01 0.00 0.00 0.00 0.00 29.97 30.54 3hoa h ARG 468 CO 0.04 0.26 -0.30 0.00 0.00 0.00 0.00 179.97 179.98 3hoa h ALA 469 N 0.78 0.76 0.00 0.04 0.00 -0.99 0.13 119.26 119.99 3hoa h ALA 469 Ca 0.01 -0.41 -0.23 0.00 0.00 0.00 0.00 54.91 54.28 3hoa h ALA 469 Cb 0.24 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3hoa h ALA 469 CO 0.00 0.65 -1.72 0.54 0.00 0.00 0.00 179.25 178.73 3hoa n ARG 470 N -4.08 0.64 0.03 0.00 5.12 -0.02 -4.65 116.66 113.70 3hoa n ARG 470 Ca -0.01 0.18 -0.01 0.00 -1.93 0.00 0.00 57.85 56.08 3hoa n ARG 470 Cb 0.48 -1.73 -0.00 0.00 -1.16 0.00 0.00 32.46 30.05 3hoa n ARG 470 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 3hoa n ILE 471 N -2.87 1.16 -0.26 0.55 5.41 0.78 -4.78 119.36 119.35 3hoa n ILE 471 Ca -0.16 0.35 -0.06 0.00 1.00 0.00 0.00 62.75 63.89 3hoa n ILE 471 Cb 0.95 -1.64 0.05 0.00 -0.71 0.00 0.00 39.64 38.29 3hoa n ILE 471 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 176.55 177.00 3hoa h HIS 472 N -0.08 1.04 0.00 1.39 3.86 -1.16 -3.03 115.15 117.17 3hoa h HIS 472 Ca -0.00 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 3hoa h HIS 472 Cb 0.16 -0.32 -0.00 0.00 1.06 0.00 0.00 27.41 28.31 3hoa h HIS 472 CO -0.03 0.76 -0.07 0.00 0.86 0.00 0.00 177.93 179.46 3hoa h ALA 473 N 1.17 1.83 0.00 2.45 0.00 -0.84 -2.62 119.26 121.25 3hoa h ALA 473 Ca 0.25 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hoa h ALA 473 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3hoa h ALA 473 CO -0.03 0.08 0.00 0.39 0.00 0.00 0.00 179.25 179.69 3hoa n GLU 474 N -4.38 0.17 0.00 0.00 -0.58 -1.14 -4.55 120.64 110.16 3hoa n GLU 474 Ca -0.03 0.34 0.00 0.00 -0.42 0.00 0.00 57.16 57.05 3hoa n GLU 474 Cb 0.15 -1.79 0.00 0.00 -0.57 0.00 0.00 31.44 29.23 3hoa n GLU 474 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hoa n GLY 475 N 0.29 3.02 1.88 0.62 0.00 -0.99 -0.18 105.19 109.84 3hoa n GLY 475 Ca 0.03 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 3hoa n GLY 475 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3hoa n SER 476 N 2.87 4.75 -0.09 1.61 7.64 -0.79 -4.01 113.62 125.60 3hoa n SER 476 Ca 0.00 -3.76 -0.01 0.00 1.01 0.00 0.00 58.87 56.11 3hoa n SER 476 Cb 0.00 -0.71 0.25 0.00 -1.01 0.00 0.00 64.21 62.74 3hoa n SER 476 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 3hoa h ARG 477 N 1.55 0.72 -6.46 1.43 2.43 -0.81 -3.44 114.38 109.80 3hoa h ARG 477 Ca 0.44 -0.13 -0.64 0.00 -0.81 0.00 0.00 59.98 58.84 3hoa h ARG 477 Cb 1.59 -0.12 -0.17 0.00 -0.42 0.00 0.00 29.97 30.86 3hoa h ARG 477 CO 0.95 0.65 -0.80 -0.06 -1.51 0.00 0.00 179.97 179.20 3hoa s PHE 478 N -5.21 2.31 0.60 2.20 0.08 -1.26 -4.99 117.98 111.71 3hoa s PHE 478 Ca -0.09 -0.34 -0.18 0.00 0.12 0.00 0.00 56.93 56.44 3hoa s PHE 478 Cb 0.16 -1.09 -0.03 0.00 -0.57 0.00 0.00 43.02 41.49 3hoa s PHE 478 CO 0.78 0.58 1.17 1.03 -0.10 0.00 0.00 175.22 178.68 3hoa s ARG 479 N -2.99 2.98 0.26 0.44 1.81 -1.26 -4.72 118.95 115.46 3hoa s ARG 479 Ca 0.24 1.69 -0.02 0.00 -1.72 0.00 0.00 55.73 55.92 3hoa s ARG 479 Cb -0.07 -1.95 0.50 0.00 -0.45 0.00 0.00 34.95 32.98 3hoa s ARG 479 CO 0.12 -1.17 1.76 -1.00 -0.68 0.00 0.00 175.30 174.33 3hoa h PRO 480 N 0.73 0.56 -0.65 3.54 0.13 -1.87 0.11 132.00 134.55 3hoa h PRO 480 Ca -0.49 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.58 3hoa h PRO 480 Cb 1.28 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 3hoa h PRO 480 CO 0.55 0.37 0.32 -0.09 -0.23 0.00 0.00 178.00 178.92 3hoa h ARG 481 N 0.58 0.92 -0.56 0.86 2.43 -1.91 -1.76 114.38 114.94 3hoa h ARG 481 Ca 0.44 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.39 3hoa h ARG 481 Cb 0.62 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 3hoa h ARG 481 CO -0.36 0.72 -0.01 0.28 -1.51 0.00 0.00 179.97 179.09 3hoa h VAL 482 N 0.89 1.26 -0.21 0.20 2.07 -1.63 -2.13 116.25 116.70 3hoa h VAL 482 Ca 0.22 -1.12 0.02 0.00 0.82 0.00 0.00 66.70 66.64 3hoa h VAL 482 Cb 0.10 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 3hoa h VAL 482 CO -0.03 0.40 0.07 0.25 0.02 0.00 0.00 177.57 178.28 3hoa h LEU 483 N 0.89 0.07 -0.53 2.57 6.46 -0.34 0.17 115.31 124.60 3hoa h LEU 483 Ca 0.16 0.02 0.02 0.00 -0.12 0.00 0.00 57.88 57.96 3hoa h LEU 483 Cb 0.54 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 3hoa h LEU 483 CO 0.03 0.07 0.33 0.58 -0.62 0.00 0.00 178.44 178.83 3hoa h VAL 484 N 0.16 1.08 -0.38 1.05 2.07 -1.15 -1.41 116.25 117.67 3hoa h VAL 484 Ca 0.09 -0.23 -0.12 0.00 0.82 0.00 0.00 66.70 67.27 3hoa h VAL 484 Cb 0.07 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 3hoa h VAL 484 CO -0.10 0.12 -0.25 -0.33 0.02 0.00 0.00 177.57 177.03 3hoa h GLU 485 N 0.66 0.78 -0.11 1.57 5.08 -0.92 0.17 114.58 121.82 3hoa h GLU 485 Ca 0.21 -0.33 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 3hoa h GLU 485 Cb -0.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 3hoa h GLU 485 CO -0.08 0.95 -0.42 0.00 -1.00 0.00 0.00 179.01 178.46 3hoa h ARG 486 N 0.68 0.24 0.10 2.33 3.08 -0.40 0.43 114.38 120.84 3hoa h ARG 486 Ca 0.09 -0.12 -0.24 0.00 0.07 0.00 0.00 59.98 59.78 3hoa h ARG 486 Cb 0.77 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 3hoa h ARG 486 CO 0.06 0.62 -1.22 0.28 -1.07 0.00 0.00 179.97 178.65 3hoa h VAL 487 N 0.20 1.13 0.00 2.04 2.07 -1.11 -3.40 116.25 117.19 3hoa h VAL 487 Ca 0.02 -2.39 -0.03 0.00 0.82 0.00 0.00 66.70 65.11 3hoa h VAL 487 Cb 0.83 2.78 -0.01 0.00 -1.52 0.00 0.00 31.29 33.37 3hoa h VAL 487 CO 0.07 0.66 -1.56 0.35 0.02 0.00 0.00 177.57 177.11 3hoa n THR 488 N -4.05 0.43 -0.83 2.57 -2.24 0.60 -4.97 114.28 105.80 3hoa n THR 488 Ca -0.23 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 3hoa n THR 488 Cb 0.84 -0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 3hoa n THR 488 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hoa n GLY 489 N 1.26 0.80 3.25 3.38 0.00 0.15 -4.94 105.19 109.10 3hoa n GLY 489 Ca -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 3hoa n GLY 489 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hoa s GLU 490 N -0.17 1.03 0.54 1.61 2.02 -1.25 -5.01 118.70 117.46 3hoa s GLU 490 Ca 0.00 -1.17 -0.11 0.00 0.02 0.00 0.00 54.97 53.70 3hoa s GLU 490 Cb 0.00 -1.05 -0.05 0.00 0.10 0.00 0.00 34.13 33.13 3hoa s GLU 490 CO 0.00 0.22 0.94 0.00 0.02 0.00 0.00 175.26 176.44 3hoa s ALA 491 N -1.70 3.18 0.14 5.21 0.00 -1.26 -3.67 121.76 123.66 3hoa s ALA 491 Ca 0.07 -0.10 -0.34 0.00 0.00 0.00 0.00 51.96 51.58 3hoa s ALA 491 Cb -0.07 -2.95 -0.16 0.00 0.00 0.00 0.00 23.12 19.93 3hoa s ALA 491 CO 0.04 -0.41 1.27 -0.35 0.00 0.00 0.00 175.76 176.31 3hoa n PRO 492 N -2.14 1.26 -3.77 0.00 -0.04 -1.26 -4.96 135.00 124.09 3hoa n PRO 492 Ca 0.05 0.45 -0.11 0.00 -0.04 0.00 0.00 63.50 63.85 3hoa n PRO 492 Cb 0.54 -2.03 -0.07 0.00 -0.04 0.00 0.00 33.50 31.90 3hoa n PRO 492 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3hoa s SER 493 N 0.26 -0.10 0.01 3.54 0.15 -1.26 -5.04 113.70 111.26 3hoa s SER 493 Ca 0.78 -0.24 0.23 0.00 0.70 0.00 0.00 55.95 57.43 3hoa s SER 493 Cb -0.87 0.35 0.22 0.00 -1.71 0.00 0.00 66.02 64.01 3hoa s SER 493 CO 0.49 -0.62 1.21 0.00 1.20 0.00 0.00 173.24 175.51 3hoa n ALA 494 N 0.54 3.89 -0.17 5.45 0.00 -1.26 -4.40 120.51 124.56 3hoa n ALA 494 Ca -0.18 -0.43 -0.09 0.00 0.00 0.00 0.00 53.44 52.73 3hoa n ALA 494 Cb 0.60 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.05 3hoa n ALA 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hoa h ARG 495 N 0.00 0.79 -0.64 0.00 3.08 -1.96 -0.83 114.38 114.82 3hoa h ARG 495 Ca 0.00 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 3hoa h ARG 495 Cb 0.53 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 3hoa h ARG 495 CO 0.00 0.79 0.33 -1.35 -1.07 0.00 0.00 179.97 178.67 3hoa h PRO 496 N 0.67 0.89 -0.23 0.04 0.11 -1.94 0.29 132.00 131.83 3hoa h PRO 496 Ca 0.15 -0.10 -0.06 0.00 0.11 0.00 0.00 66.00 66.10 3hoa h PRO 496 Cb 0.37 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 3hoa h PRO 496 CO 0.01 0.67 -0.08 0.35 -0.21 0.00 0.00 178.00 178.74 3hoa h PHE 497 N 0.89 0.52 -0.65 0.65 3.57 -1.77 -0.39 116.94 119.76 3hoa h PHE 497 Ca 0.22 -0.12 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 3hoa h PHE 497 Cb 0.06 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 3hoa h PHE 497 CO 0.01 0.71 0.18 -0.07 -2.23 0.00 0.00 178.31 176.90 3hoa h LEU 498 N 0.18 0.94 -0.41 0.59 3.38 -0.74 -0.35 115.31 118.90 3hoa h LEU 498 Ca 0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 3hoa h LEU 498 Cb 0.56 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 3hoa h LEU 498 CO 0.03 0.90 0.18 0.00 0.09 0.00 0.00 178.44 179.64 3hoa h ALA 499 N 1.22 0.53 -0.03 1.53 0.00 -0.29 0.53 119.26 122.76 3hoa h ALA 499 Ca 0.21 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3hoa h ALA 499 Cb 0.31 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3hoa h ALA 499 CO -0.00 0.11 -0.11 -0.92 0.00 0.00 0.00 179.25 178.33 3hoa h TYR 500 N 0.52 -0.27 -0.30 0.00 3.20 -0.59 -1.74 116.97 117.79 3hoa h TYR 500 Ca 0.14 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 3hoa h TYR 500 Cb 0.15 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 3hoa h TYR 500 CO -0.01 -0.16 0.12 -0.07 -1.64 0.00 0.00 178.16 176.40 3hoa h LEU 501 N -0.17 0.41 -1.16 2.82 3.38 -0.80 -1.69 115.31 118.10 3hoa h LEU 501 Ca 0.05 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3hoa h LEU 501 Cb 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 3hoa h LEU 501 CO -0.13 0.46 0.43 -0.33 0.09 0.00 0.00 178.44 178.96 3hoa h GLU 502 N 0.33 1.00 -0.11 1.13 5.08 -0.80 -0.36 114.58 120.86 3hoa h GLU 502 Ca 0.10 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 3hoa h GLU 502 Cb 0.18 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 3hoa h GLU 502 CO -0.01 0.72 -0.13 -0.22 -1.00 0.00 0.00 179.01 178.37 3hoa h LYS 503 N 1.02 0.28 -0.09 2.33 3.64 -1.19 -2.36 116.57 120.20 3hoa h LYS 503 Ca 0.26 -0.16 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3hoa h LYS 503 Cb -0.02 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 3hoa h LYS 503 CO -0.05 0.71 0.05 -0.22 -2.27 0.00 0.00 179.45 177.67 3hoa h LYS 504 N -0.14 0.13 0.00 1.90 3.64 -1.00 -3.09 116.57 118.01 3hoa h LYS 504 Ca 0.01 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hoa h LYS 504 Cb 0.67 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 3hoa h LYS 504 CO 0.03 0.19 -0.25 0.66 -2.27 0.00 0.00 179.45 177.81 3hoa n TYR 505 N -4.97 0.50 0.16 1.91 4.02 -0.17 -2.30 117.16 116.30 3hoa n TYR 505 Ca -0.06 0.14 0.02 0.00 -0.01 0.00 0.00 57.90 58.00 3hoa n TYR 505 Cb 0.08 -0.67 0.24 0.00 -0.02 0.00 0.00 39.34 38.97 3hoa n TYR 505 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3hoa h ALA 506 N 2.69 0.97 0.17 -0.72 0.00 -1.42 0.15 119.26 121.09 3hoa h ALA 506 Ca 0.00 -0.46 -0.26 0.00 0.00 0.00 0.00 54.91 54.19 3hoa h ALA 506 Cb 0.66 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 18.40 3hoa h ALA 506 CO 0.00 0.63 -1.12 0.00 0.00 0.00 0.00 179.25 178.76 3hoa h ALA 507 N 1.50 -0.09 -0.02 0.00 0.00 -1.44 -3.36 119.26 115.84 3hoa h ALA 507 Ca -0.01 -0.76 -0.10 0.00 0.00 0.00 0.00 54.91 54.04 3hoa h ALA 507 Cb 1.02 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.94 3hoa h ALA 507 CO 0.07 0.54 -0.39 -0.07 0.00 0.00 0.00 179.25 179.40 3hoa h LEU 508 N -0.05 0.37 -1.87 0.00 3.38 -1.35 -3.52 115.31 112.28 3hoa h LEU 508 Ca -0.19 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.05 3hoa h LEU 508 Cb 1.86 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.49 3hoa h LEU 508 CO 0.21 1.06 0.00 -1.22 0.09 0.00 0.00 178.44 178.58