#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 4.29 0.33 3.17 -4.23 -1.26 -4.88 115.64 113.06 3hoa s THR 2 Ca 0.00 0.81 0.02 0.00 -1.18 0.00 0.00 61.69 61.34 3hoa s THR 2 Cb 0.00 -3.59 0.20 0.00 1.34 0.00 0.00 72.50 70.45 3hoa s THR 2 CO 0.00 -0.91 1.92 1.55 -0.54 0.00 0.00 174.62 176.64 3hoa h PRO 3 N -0.31 0.74 -0.36 3.99 0.13 -1.98 -0.78 132.00 133.43 3hoa h PRO 3 Ca -0.44 -0.10 -0.08 0.00 -0.87 0.00 0.00 66.00 64.50 3hoa h PRO 3 Cb 1.20 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 32.18 3hoa h PRO 3 CO 0.59 0.60 -0.12 0.93 -0.23 0.00 0.00 178.00 179.77 3hoa h GLU 4 N 0.73 0.62 -0.17 0.86 3.07 -1.93 0.16 114.58 117.94 3hoa h GLU 4 Ca 0.18 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.75 3hoa h GLU 4 Cb 0.14 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 27.99 3hoa h GLU 4 CO -0.02 0.73 -0.25 0.00 -1.40 0.00 0.00 179.01 178.07 3hoa h ALA 5 N 1.30 0.26 -0.87 3.43 0.00 -1.79 -1.71 119.26 119.87 3hoa h ALA 5 Ca 0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 3hoa h ALA 5 Cb 0.54 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3hoa h ALA 5 CO 0.03 0.24 0.45 0.00 0.00 0.00 0.00 179.25 179.97 3hoa h ALA 6 N 0.59 1.15 -0.63 0.00 0.00 -0.93 -1.72 119.26 117.72 3hoa h ALA 6 Ca 0.02 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 3hoa h ALA 6 Cb 0.83 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3hoa h ALA 6 CO 0.06 0.66 0.05 -0.92 0.00 0.00 0.00 179.25 179.10 3hoa h TYR 7 N 1.23 1.16 -0.34 0.00 3.20 -0.60 -1.75 116.97 119.87 3hoa h TYR 7 Ca 0.30 -0.18 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 3hoa h TYR 7 Cb 0.07 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.02 3hoa h TYR 7 CO 0.01 1.00 -0.01 1.96 -1.64 0.00 0.00 178.16 179.49 3hoa h GLN 8 N 0.99 0.61 -0.60 1.82 1.08 -0.88 0.23 115.11 118.35 3hoa h GLN 8 Ca 0.19 -0.20 -0.04 0.00 -1.45 0.00 0.00 58.65 57.15 3hoa h GLN 8 Cb 0.51 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.85 3hoa h GLN 8 CO 0.02 0.73 0.22 -0.91 -0.95 0.00 0.00 178.83 177.95 3hoa h ASN 9 N 0.41 0.80 -0.37 1.46 2.35 -1.27 0.25 115.58 119.22 3hoa h ASN 9 Ca 0.10 -0.11 -0.15 0.00 -0.55 0.00 0.00 56.30 55.59 3hoa h ASN 9 Cb 0.46 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3hoa h ASN 9 CO 0.02 0.73 -0.33 0.25 -1.65 0.00 0.00 177.43 176.45 3hoa h LEU 10 N 0.86 0.95 -0.05 1.61 5.85 -1.12 -0.16 115.31 123.25 3hoa h LEU 10 Ca 0.20 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 3hoa h LEU 10 Cb 0.19 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 3hoa h LEU 10 CO -0.02 1.19 0.01 0.25 -0.34 0.00 0.00 178.44 179.54 3hoa h LEU 11 N 0.76 0.07 -0.06 2.25 5.85 0.26 -0.09 115.31 124.33 3hoa h LEU 11 Ca 0.08 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 3hoa h LEU 11 Cb 0.91 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.92 3hoa h LEU 11 CO 0.08 0.28 0.04 -0.33 -0.34 0.00 0.00 178.44 178.17 3hoa h GLU 12 N -0.14 0.09 -0.23 1.25 5.08 -0.46 -0.76 114.58 119.39 3hoa h GLU 12 Ca 0.01 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 3hoa h GLU 12 Cb 0.24 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3hoa h GLU 12 CO 0.00 0.10 0.10 0.35 -1.00 0.00 0.00 179.01 178.56 3hoa h PHE 13 N 0.05 0.19 -0.57 4.33 3.57 -0.99 -0.11 116.94 123.41 3hoa h PHE 13 Ca 0.02 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 3hoa h PHE 13 Cb 0.04 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 3hoa h PHE 13 CO -0.06 0.10 0.02 1.96 -2.23 0.00 0.00 178.31 178.10 3hoa h GLN 14 N 0.23 0.98 -0.12 1.11 1.08 -0.88 -2.16 115.11 115.33 3hoa h GLN 14 Ca 0.10 -0.29 -0.13 0.00 -1.45 0.00 0.00 58.65 56.89 3hoa h GLN 14 Cb 0.04 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 3hoa h GLN 14 CO -0.08 0.95 -0.48 0.00 -0.95 0.00 0.00 178.83 178.28 3hoa h ARG 15 N 0.90 0.32 -0.73 1.46 3.08 -0.90 -2.11 114.38 116.40 3hoa h ARG 15 Ca 0.17 -0.17 0.01 0.00 0.07 0.00 0.00 59.98 60.06 3hoa h ARG 15 Cb 0.50 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 3hoa h ARG 15 CO 0.02 0.73 0.48 1.49 -1.07 0.00 0.00 179.97 181.62 3hoa h GLU 16 N 0.25 0.93 -0.55 0.04 4.57 -0.70 0.19 114.58 119.32 3hoa h GLU 16 Ca 0.01 -0.06 -0.06 0.00 -1.18 0.00 0.00 59.36 58.08 3hoa h GLU 16 Cb 0.94 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 29.29 3hoa h GLU 16 CO 0.08 0.62 0.09 1.15 -1.18 0.00 0.00 179.01 179.77 3hoa h THR 17 N 0.96 1.24 -0.38 0.32 2.02 -1.11 -1.45 112.91 114.49 3hoa h THR 17 Ca 0.27 -0.90 -0.13 0.00 0.77 0.00 0.00 66.41 66.42 3hoa h THR 17 Cb -0.08 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 3hoa h THR 17 CO -0.07 0.33 -0.26 0.00 0.37 0.00 0.00 175.52 175.89 3hoa h ALA 18 N 1.27 0.55 -0.78 6.16 0.00 -0.65 -0.10 119.26 125.71 3hoa h ALA 18 Ca 0.17 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 3hoa h ALA 18 Cb 0.36 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3hoa h ALA 18 CO 0.01 0.56 0.47 1.88 0.00 0.00 0.00 179.25 182.16 3hoa h TYR 19 N 0.66 1.02 -0.57 0.00 -1.99 -0.42 0.40 116.97 116.08 3hoa h TYR 19 Ca 0.08 -0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.75 3hoa h TYR 19 Cb 0.84 -0.34 -0.02 0.00 2.00 0.00 0.00 36.73 39.21 3hoa h TYR 19 CO 0.06 0.69 0.13 -0.07 -0.00 0.00 0.00 178.16 178.97 3hoa h LEU 20 N 1.06 0.87 -0.98 3.88 3.38 -1.08 -2.65 115.31 119.79 3hoa h LEU 20 Ca 0.28 -0.24 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 3hoa h LEU 20 Cb -0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 3hoa h LEU 20 CO -0.05 0.88 -0.09 0.00 0.09 0.00 0.00 178.44 179.27 3hoa h ALA 21 N 1.02 1.15 0.00 1.53 0.00 -0.49 -2.56 119.26 119.92 3hoa h ALA 21 Ca 0.18 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 3hoa h ALA 21 Cb 0.36 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3hoa h ALA 21 CO 0.00 0.54 -0.12 0.66 0.00 0.00 0.00 179.25 180.33 3hoa h SER 22 N 0.58 0.00 0.43 0.00 4.64 -0.59 0.84 113.55 119.45 3hoa h SER 22 Ca 0.11 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.29 3hoa h SER 22 Cb 0.51 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3hoa h SER 22 CO 0.03 0.12 -0.59 -0.07 -0.87 0.00 0.00 176.83 175.45 3hoa h LEU 23 N 0.00 0.18 -0.60 5.97 3.38 -1.18 -1.27 115.31 121.80 3hoa h LEU 23 Ca -0.00 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 3hoa h LEU 23 Cb 0.29 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3hoa h LEU 23 CO 0.02 0.73 -0.42 1.23 0.09 0.00 0.00 178.44 180.08 3hoa h GLY 24 N 1.56 0.69 1.09 0.83 0.00 -0.85 -2.02 103.07 104.38 3hoa h GLY 24 Ca -0.00 -0.71 -0.04 0.00 0.00 0.00 0.00 47.33 46.57 3hoa h GLY 24 CO 0.09 0.64 0.32 0.00 0.00 0.00 0.00 176.54 177.59 3hoa h ALA 25 N 1.01 1.10 -0.33 3.60 0.00 -0.68 0.18 119.26 124.14 3hoa h ALA 25 Ca 0.04 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 3hoa h ALA 25 Cb 0.95 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3hoa h ALA 25 CO 0.09 0.65 0.03 1.25 0.00 0.00 0.00 179.25 181.27 3hoa h LEU 26 N 1.13 0.54 -0.97 0.00 5.85 -1.08 -0.85 115.31 119.94 3hoa h LEU 26 Ca 0.26 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3hoa h LEU 26 Cb 0.19 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3hoa h LEU 26 CO -0.02 0.69 0.44 0.00 -0.34 0.00 0.00 178.44 179.20 3hoa h ALA 27 N 0.88 1.21 -0.75 1.25 0.00 -0.82 0.57 119.26 121.59 3hoa h ALA 27 Ca 0.10 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3hoa h ALA 27 Cb 0.39 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3hoa h ALA 27 CO 0.01 0.63 0.23 0.00 0.00 0.00 0.00 179.25 180.12 3hoa h ALA 28 N 1.32 0.98 -0.11 0.00 0.00 -0.43 -0.28 119.26 120.74 3hoa h ALA 28 Ca 0.29 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3hoa h ALA 28 Cb 0.05 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 3hoa h ALA 28 CO -0.04 0.67 0.03 2.35 0.00 0.00 0.00 179.25 182.26 3hoa h TRP 29 N 1.12 0.19 -0.97 0.00 7.01 -0.43 -3.02 115.95 119.85 3hoa h TRP 29 Ca 0.24 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.25 3hoa h TRP 29 Cb 0.32 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.27 3hoa h TRP 29 CO 0.03 0.33 0.64 0.22 -2.79 0.00 0.00 178.44 176.86 3hoa h ASP 30 N -0.01 1.07 0.03 2.65 1.82 -0.68 -2.34 116.42 118.97 3hoa h ASP 30 Ca 0.04 -0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 56.66 3hoa h ASP 30 Cb 0.24 -0.25 -0.00 0.00 0.68 0.00 0.00 39.33 40.00 3hoa h ASP 30 CO -0.00 0.74 -0.02 -0.61 -1.61 0.00 0.00 179.24 177.73 3hoa h GLN 31 N 1.24 0.00 -0.03 0.28 4.15 -0.93 0.37 115.11 120.21 3hoa h GLN 31 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.80 3hoa h GLN 31 Cb -0.02 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.67 3hoa h GLN 31 CO -0.12 0.02 -0.13 0.54 -1.93 0.00 0.00 178.83 177.22 3hoa n ARG 32 N -4.29 1.98 0.00 1.69 1.74 -0.91 -4.61 116.66 112.26 3hoa n ARG 32 Ca -0.03 -1.62 0.00 0.00 -0.77 0.00 0.00 57.85 55.43 3hoa n ARG 32 Cb 0.11 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 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 0.90 0.00 -0.00 0.55 -2.24 -0.79 -4.46 114.28 108.25 3hoa n THR 33 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3hoa n THR 33 Cb 0.55 -0.92 -0.01 0.00 -2.10 0.00 0.00 70.33 67.85 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 -2.66 0.50 -1.58 -0.78 2.81 -0.05 -5.00 117.12 110.36 3hoa n MET 34 Ca 0.00 -0.01 -0.47 0.00 -1.81 0.00 0.00 57.70 55.41 3hoa n MET 34 Cb 0.27 -1.03 -0.03 0.00 -0.71 0.00 0.00 33.22 31.72 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 -1.60 1.29 -1.94 2.02 3.06 -0.19 -4.91 119.36 117.08 3hoa n ILE 35 Ca -0.00 -0.32 -0.35 0.00 -2.50 0.00 0.00 62.75 59.58 3hoa n ILE 35 Cb 0.09 -0.87 0.04 0.00 0.54 0.00 0.00 39.64 39.44 3hoa n ILE 35 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 3hoa s PRO 36 N -0.77 2.93 0.33 9.51 0.02 -1.26 -4.91 135.00 140.84 3hoa s PRO 36 Ca 0.68 1.64 0.09 0.00 0.02 0.00 0.00 61.00 63.43 3hoa s PRO 36 Cb -0.80 -1.94 0.83 0.00 0.02 0.00 0.00 34.50 32.61 3hoa s PRO 36 CO 0.55 -1.20 1.77 -0.22 -0.33 0.00 0.00 177.00 177.57 3hoa h LYS 37 N 0.60 0.64 -0.28 5.54 3.64 -2.01 0.13 116.57 124.83 3hoa h LYS 37 Ca -0.49 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 3hoa h LYS 37 Cb 1.27 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 3hoa h LYS 37 CO 0.55 0.43 0.00 1.63 -2.27 0.00 0.00 179.45 179.78 3hoa n LYS 38 N -4.75 1.78 -0.07 1.90 5.02 -1.26 -4.08 118.16 116.69 3hoa n LYS 38 Ca 0.24 -1.20 0.12 0.00 -2.02 0.00 0.00 58.31 55.45 3hoa n LYS 38 Cb 0.65 -1.32 0.26 0.00 -0.02 0.00 0.00 35.03 34.60 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 1.09 0.92 0.20 0.72 0.00 0.03 -4.54 105.19 103.60 3hoa n GLY 39 Ca 0.14 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 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 3.75 0.64 -0.42 1.61 3.86 -1.71 -1.93 115.15 120.96 3hoa h HIS 40 Ca 0.00 -0.07 0.02 0.00 -1.16 0.00 0.00 60.37 59.16 3hoa h HIS 40 Cb 0.81 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 29.07 3hoa h HIS 40 CO 0.10 0.62 0.24 0.93 0.86 0.00 0.00 177.93 180.68 3hoa h GLU 41 N 0.48 0.46 -0.74 2.45 5.08 -1.91 -0.55 114.58 119.84 3hoa h GLU 41 Ca 0.12 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 3hoa h GLU 41 Cb 0.30 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 3hoa h GLU 41 CO 0.00 0.31 0.30 1.25 -1.00 0.00 0.00 179.01 179.86 3hoa h HIS 42 N 0.48 1.13 -0.36 4.33 2.76 -1.84 -2.38 115.15 119.27 3hoa h HIS 42 Ca 0.17 -0.08 0.01 0.00 -2.20 0.00 0.00 60.37 58.26 3hoa h HIS 42 Cb 0.03 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 28.63 3hoa h HIS 42 CO -0.08 0.86 0.22 -0.09 -1.30 0.00 0.00 177.93 177.54 3hoa h ARG 43 N 1.07 0.43 -0.97 5.26 9.65 -0.67 -0.48 114.38 128.66 3hoa h ARG 43 Ca 0.25 -0.03 0.07 0.00 -1.10 0.00 0.00 59.98 59.17 3hoa h ARG 43 Cb 0.21 -0.10 -0.07 0.00 -1.39 0.00 0.00 29.97 28.63 3hoa h ARG 43 CO -0.02 0.29 0.63 0.00 2.80 0.00 0.00 179.97 183.67 3hoa h ALA 44 N 1.15 1.45 -0.30 2.80 0.00 -0.89 -0.72 119.26 122.75 3hoa h ALA 44 Ca 0.14 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.91 3hoa h ALA 44 Cb -0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3hoa h ALA 44 CO -0.05 0.40 -0.29 0.00 0.00 0.00 0.00 179.25 179.30 3hoa h ARG 45 N 1.11 0.62 -0.06 0.00 3.08 -0.81 -1.16 114.38 117.16 3hoa h ARG 45 Ca 0.42 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 60.21 3hoa h ARG 45 Cb 0.21 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 3hoa h ARG 45 CO -0.17 0.84 0.02 1.96 -1.07 0.00 0.00 179.97 181.55 3hoa h GLN 46 N 0.53 0.09 -0.97 0.04 4.20 -0.04 -1.83 115.11 117.12 3hoa h GLN 46 Ca 0.07 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.79 3hoa h GLN 46 Cb 0.77 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.48 3hoa h GLN 46 CO 0.06 0.23 0.64 0.52 -0.67 0.00 0.00 178.83 179.61 3hoa h MET 47 N -0.07 1.22 -0.33 1.46 2.86 -1.02 -0.84 114.93 118.21 3hoa h MET 47 Ca 0.02 -0.07 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 3hoa h MET 47 Cb 0.17 -0.28 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 3hoa h MET 47 CO -0.00 0.81 -0.25 0.00 1.06 0.00 0.00 176.91 178.53 3hoa h ALA 48 N 1.42 0.95 -0.31 6.32 0.00 -1.05 0.35 119.26 126.94 3hoa h ALA 48 Ca 0.38 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3hoa h ALA 48 Cb -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3hoa h ALA 48 CO -0.11 0.61 -0.13 0.00 0.00 0.00 0.00 179.25 179.62 3hoa h ALA 49 N 1.16 0.43 -0.26 0.00 0.00 -0.77 -1.97 119.26 117.85 3hoa h ALA 49 Ca 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3hoa h ALA 49 Cb 0.72 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3hoa h ALA 49 CO 0.06 0.31 0.11 1.25 0.00 0.00 0.00 179.25 180.98 3hoa h LEU 50 N 0.40 0.35 -0.83 0.00 6.46 -0.88 -2.12 115.31 118.69 3hoa h LEU 50 Ca 0.07 -0.15 0.09 0.00 -0.12 0.00 0.00 57.88 57.77 3hoa h LEU 50 Cb 0.64 -0.09 -0.07 0.00 -0.73 0.00 0.00 40.66 40.41 3hoa h LEU 50 CO 0.04 0.41 0.48 0.00 -0.62 0.00 0.00 178.44 178.75 3hoa h ALA 51 N 0.96 1.18 -0.55 1.25 0.00 -0.20 0.93 119.26 122.84 3hoa h ALA 51 Ca 0.09 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 3hoa h ALA 51 Cb 0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 3hoa h ALA 51 CO -0.01 0.11 0.04 0.00 0.00 0.00 0.00 179.25 179.39 3hoa h ARG 52 N 0.80 0.91 0.31 0.00 3.08 -1.09 -1.15 114.38 117.24 3hoa h ARG 52 Ca 0.40 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 3hoa h ARG 52 Cb 0.36 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.31 3hoa h ARG 52 CO -0.24 0.88 -0.15 1.25 -1.07 0.00 0.00 179.97 180.64 3hoa h LEU 53 N 0.85 -0.35 -0.85 3.04 5.85 -0.55 -2.12 115.31 121.18 3hoa h LEU 53 Ca 0.17 -0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.82 3hoa h LEU 53 Cb 0.45 0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.50 3hoa h LEU 53 CO 0.02 -0.02 0.50 -0.07 -0.34 0.00 0.00 178.44 178.53 3hoa h LEU 54 N -0.71 0.74 -0.87 2.25 3.38 -0.83 -0.30 115.31 118.96 3hoa h LEU 54 Ca -0.04 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3hoa h LEU 54 Cb 0.49 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3hoa h LEU 54 CO 0.07 0.43 0.44 -0.74 0.09 0.00 0.00 178.44 178.73 3hoa h HIS 55 N 0.85 1.24 -0.54 1.13 2.76 -1.17 0.22 115.15 119.65 3hoa h HIS 55 Ca 0.40 -0.05 -0.03 0.00 -2.20 0.00 0.00 60.37 58.49 3hoa h HIS 55 Cb 0.34 -0.39 -0.02 0.00 1.55 0.00 0.00 27.41 28.88 3hoa h HIS 55 CO -0.05 0.88 0.22 0.37 -1.30 0.00 0.00 177.93 178.05 3hoa h GLN 56 N 1.24 0.80 -0.54 5.26 5.75 -0.52 -2.96 115.11 124.13 3hoa h GLN 56 Ca 0.30 -0.14 -0.07 0.00 -0.15 0.00 0.00 58.65 58.59 3hoa h GLN 56 Cb 0.09 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 3hoa h GLN 56 CO -0.04 0.69 0.05 0.00 -2.65 0.00 0.00 178.83 176.88 3hoa h ARG 57 N 0.73 0.93 0.00 1.69 3.08 -0.52 -2.51 114.38 117.78 3hoa h ARG 57 Ca 0.18 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.96 3hoa h ARG 57 Cb 0.19 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3hoa h ARG 57 CO -0.02 0.92 0.00 -1.33 -1.07 0.00 0.00 179.97 178.47 3hoa n MET 58 N -4.32 0.17 -0.03 0.04 2.81 0.01 -2.38 117.12 113.42 3hoa n MET 58 Ca 0.02 0.49 0.01 0.00 -1.81 0.00 0.00 57.70 56.41 3hoa n MET 58 Cb 0.29 -1.89 0.03 0.00 -0.71 0.00 0.00 33.22 30.94 3hoa n MET 58 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3hoa n THR 59 N -2.23 0.82 -1.68 2.03 -1.04 -1.13 -4.70 114.28 106.35 3hoa n THR 59 Ca 0.01 -0.91 -0.43 0.00 -2.04 0.00 0.00 64.05 60.68 3hoa n THR 59 Cb 0.17 0.60 -0.03 0.00 -1.82 0.00 0.00 70.33 69.24 3hoa n THR 59 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3hoa n ASP 60 N -0.19 3.94 -0.16 8.00 -0.08 -0.96 -4.85 116.55 122.24 3hoa n ASP 60 Ca 0.02 0.96 0.26 0.00 -1.51 0.00 0.00 54.79 54.53 3hoa n ASP 60 Cb 0.25 -1.50 0.69 0.00 2.34 0.00 0.00 41.12 42.90 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 9.18 0.05 -0.69 -0.67 0.13 -1.91 -1.61 132.00 136.48 3hoa h PRO 61 Ca -0.48 -0.00 0.08 0.00 -0.87 0.00 0.00 66.00 64.73 3hoa h PRO 61 Cb 1.24 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 3hoa h PRO 61 CO 0.94 0.03 0.46 0.00 -0.23 0.00 0.00 178.00 179.20 3hoa h ARG 62 N 0.05 0.64 -0.62 0.86 3.08 -1.98 -1.38 114.38 115.03 3hoa h ARG 62 Ca 0.40 -0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.51 3hoa h ARG 62 Cb 1.53 -0.14 -0.07 0.00 0.08 0.00 0.00 29.97 31.36 3hoa h ARG 62 CO -0.03 0.42 0.23 0.82 -1.07 0.00 0.00 179.97 180.34 3hoa h ILE 63 N 0.65 0.75 -0.36 2.04 2.04 -1.66 0.61 117.51 121.59 3hoa h ILE 63 Ca 0.31 -0.14 -0.10 0.00 1.00 0.00 0.00 64.86 65.93 3hoa h ILE 63 Cb 0.35 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3hoa h ILE 63 CO -0.10 0.07 -0.17 1.23 0.00 0.00 0.00 178.15 179.18 3hoa h GLY 64 N 0.40 0.72 0.80 5.37 0.00 -1.43 -1.05 103.07 107.88 3hoa h GLY 64 Ca 0.32 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 3hoa h GLY 64 CO -0.32 0.52 -0.06 0.83 0.00 0.00 0.00 176.54 177.51 3hoa h GLU 65 N 0.59 -0.16 -0.43 4.80 5.08 -0.74 -2.37 114.58 121.36 3hoa h GLU 65 Ca 0.09 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3hoa h GLU 65 Cb 0.63 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 3hoa h GLU 65 CO 0.04 0.06 0.20 -1.49 -1.00 0.00 0.00 179.01 176.83 3hoa h TRP 66 N -0.37 0.61 -0.04 4.33 6.55 -0.90 -2.91 115.95 123.23 3hoa h TRP 66 Ca -0.02 -0.03 0.04 0.00 0.95 0.00 0.00 58.89 59.83 3hoa h TRP 66 Cb 0.30 -0.19 -0.05 0.00 -0.86 0.00 0.00 29.16 28.36 3hoa h TRP 66 CO -0.01 0.50 -0.25 -0.07 -1.05 0.00 0.00 178.44 177.57 3hoa h LEU 67 N 0.55 -0.74 -2.02 -4.49 3.38 -1.17 -0.77 115.31 110.04 3hoa h LEU 67 Ca 0.15 0.11 0.14 0.00 0.09 0.00 0.00 57.88 58.36 3hoa h LEU 67 Cb 0.12 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3hoa h LEU 67 CO -0.02 -0.31 0.37 -0.08 0.09 0.00 0.00 178.44 178.49 3hoa h GLU 68 N -0.36 0.00 0.00 1.13 4.81 -1.38 0.31 114.58 119.10 3hoa h GLU 68 Ca 0.07 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.21 3hoa h GLU 68 Cb 0.47 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 3hoa h GLU 68 CO -0.25 0.00 -0.47 -0.22 -0.73 0.00 0.00 179.01 177.34 3hoa h LYS 69 N 0.00 0.00 0.03 1.92 1.63 -0.96 -3.32 116.57 115.87 3hoa h LYS 69 Ca 0.22 0.00 -0.37 0.00 -0.85 0.00 0.00 60.65 59.66 3hoa h LYS 69 Cb 0.96 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.53 3hoa h LYS 69 CO -0.00 0.47 -2.24 0.28 -3.45 0.00 0.00 179.45 174.51 3hoa n VAL 70 N -3.37 1.56 -1.84 2.00 0.31 0.37 -4.42 118.33 112.95 3hoa n VAL 70 Ca 0.01 -0.68 -0.41 0.00 -0.01 0.00 0.00 64.34 63.25 3hoa n VAL 70 Cb 0.64 -1.25 -0.01 0.00 -0.91 0.00 0.00 33.84 32.30 3hoa n VAL 70 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3hoa s GLU 71 N -2.53 4.14 0.00 5.55 2.02 0.82 -1.96 118.70 126.74 3hoa s GLU 71 Ca -0.23 2.53 0.00 0.00 0.02 0.00 0.00 54.97 57.29 3hoa s GLU 71 Cb 0.08 -3.00 0.00 0.00 0.10 0.00 0.00 34.13 31.30 3hoa s GLU 71 CO 0.72 -0.53 0.00 0.41 0.02 0.00 0.00 175.26 175.88 3hoa n GLY 72 N 1.16 2.27 3.92 -1.39 0.00 -1.26 -4.92 105.19 104.97 3hoa n GLY 72 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.63 6.03 0.64 1.61 1.04 -0.83 -4.96 113.70 113.60 3hoa s SER 73 Ca 0.00 0.71 0.32 0.00 0.48 0.00 0.00 55.95 57.47 3hoa s SER 73 Cb 0.00 -1.97 1.77 0.00 0.10 0.00 0.00 66.02 65.92 3hoa s SER 73 CO 0.00 -0.69 2.05 -0.65 0.98 0.00 0.00 173.24 174.93 3hoa h PRO 74 N 0.21 0.00 -0.14 4.02 0.11 -1.95 -1.81 132.00 132.43 3hoa h PRO 74 Ca -0.47 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.68 3hoa h PRO 74 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3hoa h PRO 74 CO 0.61 0.00 0.11 -0.07 -0.21 0.00 0.00 178.00 178.43 3hoa h LEU 75 N 0.00 0.00 -3.04 2.35 3.38 -1.93 -3.02 115.31 113.04 3hoa h LEU 75 Ca 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3hoa h LEU 75 Cb 0.56 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 3hoa h LEU 75 CO -0.00 0.00 -0.07 1.33 0.09 0.00 0.00 178.44 179.79 3hoa n VAL 76 N -4.46 2.01 -0.20 1.22 0.24 -0.68 -4.47 118.33 111.99 3hoa n VAL 76 Ca 0.00 -2.37 -0.02 0.00 -2.04 0.00 0.00 64.34 59.91 3hoa n VAL 76 Cb 0.23 -0.24 0.08 0.00 -1.47 0.00 0.00 33.84 32.44 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 0.40 0.52 -6.04 7.34 4.20 -1.59 -3.37 115.11 116.58 3hoa h GLN 77 Ca 0.01 -0.03 -0.60 0.00 0.06 0.00 0.00 58.65 58.09 3hoa h GLN 77 Cb 1.08 -0.12 -0.11 0.00 0.30 0.00 0.00 27.48 28.63 3hoa h GLN 77 CO 0.04 0.35 0.65 0.34 -0.67 0.00 0.00 178.83 179.54 3hoa s ASP 78 N -5.50 6.38 0.17 1.46 3.68 -1.26 -4.90 116.67 116.70 3hoa s ASP 78 Ca -0.13 -0.21 0.10 0.00 2.13 0.00 0.00 52.55 54.45 3hoa s ASP 78 Cb 0.15 -2.46 0.55 0.00 -1.45 0.00 0.00 42.92 39.71 3hoa s ASP 78 CO 0.75 -1.26 1.26 -0.81 0.13 0.00 0.00 175.17 175.24 3hoa n PRO 79 N 7.63 0.07 0.00 4.34 -0.04 -1.26 -0.91 135.00 144.82 3hoa n PRO 79 Ca 0.04 0.53 0.11 0.00 -0.04 0.00 0.00 63.50 64.14 3hoa n PRO 79 Cb 0.48 -1.79 0.03 0.00 -0.04 0.00 0.00 33.50 32.17 3hoa n PRO 79 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3hoa n LEU 80 N -1.84 1.14 -4.76 1.53 4.77 -1.26 -4.30 117.00 112.28 3hoa n LEU 80 Ca -0.01 -0.44 -0.33 0.00 -0.03 0.00 0.00 56.01 55.21 3hoa n LEU 80 Cb 0.09 -0.06 0.06 0.00 -2.33 0.00 0.00 43.42 41.18 3hoa n LEU 80 CO 0.04 0.25 0.74 -0.94 -1.33 0.00 0.00 177.39 176.16 3hoa s SER 81 N -2.83 4.81 0.20 -1.43 1.04 -0.09 -4.84 113.70 110.55 3hoa s SER 81 Ca 0.13 2.05 -0.11 0.00 0.48 0.00 0.00 55.95 58.50 3hoa s SER 81 Cb 0.17 -2.56 0.20 0.00 0.10 0.00 0.00 66.02 63.94 3hoa s SER 81 CO 0.73 -1.83 1.78 0.44 0.98 0.00 0.00 173.24 175.34 3hoa h ASP 82 N -0.21 0.40 -0.14 7.02 3.45 -1.93 -1.40 116.42 123.61 3hoa h ASP 82 Ca -0.46 0.04 0.01 0.00 0.43 0.00 0.00 57.03 57.04 3hoa h ASP 82 Cb 1.25 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.98 3hoa h ASP 82 CO 0.53 0.26 0.07 0.00 -1.57 0.00 0.00 179.24 178.53 3hoa h ALA 83 N 1.33 0.17 -0.53 3.45 0.00 -1.92 -1.08 119.26 120.68 3hoa h ALA 83 Ca 0.27 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 3hoa h ALA 83 Cb 0.20 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3hoa h ALA 83 CO -0.19 -0.37 -0.03 0.00 0.00 0.00 0.00 179.25 178.65 3hoa h ALA 84 N 1.07 0.95 -0.36 0.00 0.00 -1.72 -0.67 119.26 118.52 3hoa h ALA 84 Ca 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 3hoa h ALA 84 Cb 0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3hoa h ALA 84 CO -0.04 0.63 0.19 0.28 0.00 0.00 0.00 179.25 180.30 3hoa h VAL 85 N 0.84 1.16 -0.08 0.00 2.07 -1.00 0.41 116.25 119.66 3hoa h VAL 85 Ca 0.15 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 3hoa h VAL 85 Cb 0.54 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.09 3hoa h VAL 85 CO 0.03 0.16 0.02 0.78 0.02 0.00 0.00 177.57 178.58 3hoa h ASN 86 N 0.45 0.12 -0.80 0.57 2.35 -1.02 -1.70 115.58 115.55 3hoa h ASN 86 Ca 0.13 -0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 3hoa h ASN 86 Cb 0.09 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 3hoa h ASN 86 CO -0.02 0.31 0.48 0.58 -1.65 0.00 0.00 177.43 177.14 3hoa h VAL 87 N -0.09 1.22 -0.38 2.81 2.07 -1.07 0.26 116.25 121.07 3hoa h VAL 87 Ca 0.02 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 3hoa h VAL 87 Cb 0.24 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 3hoa h VAL 87 CO 0.00 0.23 0.13 -0.09 0.02 0.00 0.00 177.57 177.87 3hoa h ARG 88 N 1.09 0.59 -0.18 1.57 2.43 -0.84 -0.94 114.38 118.11 3hoa h ARG 88 Ca 0.29 -0.12 -0.19 0.00 -0.81 0.00 0.00 59.98 59.14 3hoa h ARG 88 Cb -0.04 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 3hoa h ARG 88 CO -0.05 0.58 -0.66 0.93 -1.51 0.00 0.00 179.97 179.26 3hoa h GLU 89 N 0.47 0.67 -0.75 0.20 4.39 -1.08 -2.72 114.58 115.76 3hoa h GLU 89 Ca 0.13 -0.49 -0.06 0.00 0.34 0.00 0.00 59.36 59.28 3hoa h GLU 89 Cb 0.23 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 3hoa h GLU 89 CO -0.01 1.11 0.24 -1.49 -1.16 0.00 0.00 179.01 177.70 3hoa h TRP 90 N 0.49 1.21 -0.47 4.33 6.55 -0.39 -1.43 115.95 126.24 3hoa h TRP 90 Ca -0.02 -0.12 -0.03 0.00 0.95 0.00 0.00 58.89 59.67 3hoa h TRP 90 Cb 1.25 -0.35 -0.02 0.00 -0.86 0.00 0.00 29.16 29.18 3hoa h TRP 90 CO 0.06 0.95 0.19 -0.09 -1.05 0.00 0.00 178.44 178.50 3hoa h ARG 91 N 1.12 0.71 -0.32 0.49 9.65 -1.15 -0.96 114.38 123.92 3hoa h ARG 91 Ca 0.24 -0.13 -0.03 0.00 -1.10 0.00 0.00 59.98 58.96 3hoa h ARG 91 Cb 0.31 -0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 28.76 3hoa h ARG 91 CO -0.01 0.64 0.08 0.37 2.80 0.00 0.00 179.97 183.86 3hoa h GLN 92 N 0.62 0.51 -0.58 0.20 5.75 -1.25 -0.78 115.11 119.59 3hoa h GLN 92 Ca 0.16 -0.12 -0.05 0.00 -0.15 0.00 0.00 58.65 58.48 3hoa h GLN 92 Cb 0.20 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.66 3hoa h GLN 92 CO -0.01 0.57 0.14 0.00 -2.65 0.00 0.00 178.83 176.88 3hoa h ALA 93 N 0.92 1.17 -0.36 3.38 0.00 -1.18 -1.02 119.26 122.17 3hoa h ALA 93 Ca 0.10 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3hoa h ALA 93 Cb 0.28 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3hoa h ALA 93 CO -0.00 0.57 0.12 -0.92 0.00 0.00 0.00 179.25 179.01 3hoa h TYR 94 N 0.85 0.58 -0.57 0.00 3.20 -0.94 -1.71 116.97 118.39 3hoa h TYR 94 Ca 0.19 -0.06 -0.10 0.00 3.14 0.00 0.00 58.73 61.90 3hoa h TYR 94 Cb 0.30 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 3hoa h TYR 94 CO 0.02 0.56 -0.06 0.93 -1.64 0.00 0.00 178.16 177.97 3hoa h GLU 95 N 0.44 1.03 -0.62 1.82 4.39 -0.88 -1.58 114.58 119.18 3hoa h GLU 95 Ca 0.12 -0.35 -0.08 0.00 0.34 0.00 0.00 59.36 59.38 3hoa h GLU 95 Cb 0.24 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 3hoa h GLU 95 CO -0.00 1.04 0.05 0.00 -1.16 0.00 0.00 179.01 178.94 3hoa h ARG 96 N 0.93 1.04 -0.29 2.33 2.47 -1.08 -1.38 114.38 118.40 3hoa h ARG 96 Ca 0.15 -0.30 -0.11 0.00 -1.26 0.00 0.00 59.98 58.47 3hoa h ARG 96 Cb 0.61 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.82 3hoa h ARG 96 CO 0.04 0.99 -0.25 0.00 0.56 0.00 0.00 179.97 181.31 3hoa h ALA 97 N 1.08 0.42 0.00 0.04 0.00 -1.18 -3.15 119.26 116.47 3hoa h ALA 97 Ca 0.18 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3hoa h ALA 97 Cb 0.49 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3hoa h ALA 97 CO 0.02 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.67 3hoa h ARG 98 N 0.42 0.00 0.00 0.00 3.08 -1.23 -3.15 114.38 113.50 3hoa h ARG 98 Ca 0.05 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 3hoa h ARG 98 Cb 0.81 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.85 3hoa h ARG 98 CO 0.06 0.00 -0.22 0.00 -1.07 0.00 0.00 179.97 178.74 3hoa h ALA 99 N 2.16 1.01 -2.27 0.04 0.00 -1.21 -3.42 119.26 115.57 3hoa h ALA 99 Ca 0.00 -0.20 -0.66 0.00 0.00 0.00 0.00 54.91 54.05 3hoa h ALA 99 Cb 0.76 -0.04 -0.16 0.00 0.00 0.00 0.00 17.79 18.36 3hoa h ALA 99 CO 0.00 0.28 0.02 0.42 0.00 0.00 0.00 179.25 179.97 3hoa s ILE 100 N -3.62 4.92 0.51 0.00 1.01 -1.19 -4.93 121.20 117.90 3hoa s ILE 100 Ca 0.01 0.07 -0.20 0.00 0.00 0.00 0.00 60.65 60.53 3hoa s ILE 100 Cb 0.10 -4.12 -0.10 0.00 0.01 0.00 0.00 42.46 38.35 3hoa s ILE 100 CO 0.64 -0.48 0.65 -2.65 0.00 0.00 0.00 174.94 173.09 3hoa n PRO 101 N 6.02 0.69 -0.09 2.79 -0.02 -1.26 -4.70 135.00 138.44 3hoa n PRO 101 Ca -0.03 0.26 -0.14 0.00 -2.02 0.00 0.00 63.50 61.57 3hoa n PRO 101 Cb 0.48 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 32.11 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 0.61 -0.45 -0.62 -0.52 4.57 -1.95 -1.74 114.58 114.48 3hoa h GLU 102 Ca -0.44 0.03 0.03 0.00 -1.18 0.00 0.00 59.36 57.80 3hoa h GLU 102 Cb 1.39 0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 30.05 3hoa h GLU 102 CO 0.50 -0.30 0.41 0.00 -1.18 0.00 0.00 179.01 178.44 3hoa h ARG 103 N -0.47 0.72 -0.07 1.92 2.47 -1.99 -1.30 114.38 115.67 3hoa h ARG 103 Ca 0.05 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3hoa h ARG 103 Cb 0.62 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.78 3hoa h ARG 103 CO -0.53 0.48 0.03 1.25 0.56 0.00 0.00 179.97 181.76 3hoa h LEU 104 N 0.75 0.09 -0.42 3.04 5.85 -1.74 0.21 115.31 123.08 3hoa h LEU 104 Ca 0.24 -0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.85 3hoa h LEU 104 Cb 0.05 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 3hoa h LEU 104 CO -0.06 0.20 0.26 0.00 -0.34 0.00 0.00 178.44 178.49 3hoa h ALA 105 N 0.90 0.53 -0.21 1.25 0.00 -0.87 0.09 119.26 120.95 3hoa h ALA 105 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hoa h ALA 105 Cb 0.13 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3hoa h ALA 105 CO -0.00 -0.04 0.08 0.28 0.00 0.00 0.00 179.25 179.56 3hoa h VAL 106 N 0.54 1.18 -0.11 0.00 2.07 -1.06 -1.86 116.25 117.00 3hoa h VAL 106 Ca 0.16 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 3hoa h VAL 106 Cb -0.03 1.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 3hoa h VAL 106 CO -0.05 0.17 0.06 -0.33 0.02 0.00 0.00 177.57 177.44 3hoa h GLU 107 N 0.18 0.15 -0.42 1.57 5.08 -0.39 -1.97 114.58 118.78 3hoa h GLU 107 Ca 0.07 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3hoa h GLU 107 Cb 0.20 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3hoa h GLU 107 CO -0.00 0.14 0.26 1.25 -1.00 0.00 0.00 179.01 179.66 3hoa h LEU 108 N 0.10 0.44 -0.58 1.33 5.85 -0.95 0.12 115.31 121.62 3hoa h LEU 108 Ca 0.04 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3hoa h LEU 108 Cb 0.04 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 3hoa h LEU 108 CO -0.01 0.31 0.33 0.00 -0.34 0.00 0.00 178.44 178.73 3hoa h ALA 109 N 1.17 0.75 -0.57 1.25 0.00 -1.27 -0.89 119.26 119.71 3hoa h ALA 109 Ca 0.16 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 3hoa h ALA 109 Cb -0.02 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3hoa h ALA 109 CO -0.06 0.26 -0.02 0.37 0.00 0.00 0.00 179.25 179.80 3hoa h GLN 110 N 0.79 1.00 -0.44 0.00 4.15 -1.00 -2.03 115.11 117.58 3hoa h GLN 110 Ca 0.21 -0.32 -0.06 0.00 0.77 0.00 0.00 58.65 59.25 3hoa h GLN 110 Cb 0.03 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.61 3hoa h GLN 110 CO -0.03 0.99 0.03 0.00 -1.93 0.00 0.00 178.83 177.89 3hoa h ALA 111 N 1.05 0.59 0.32 3.38 0.00 -0.43 -1.64 119.26 122.53 3hoa h ALA 111 Ca 0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3hoa h ALA 111 Cb 0.56 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3hoa h ALA 111 CO 0.03 0.35 -0.15 0.93 0.00 0.00 0.00 179.25 180.40 3hoa h GLU 112 N 0.60 -0.41 -0.78 0.00 5.08 -1.09 0.13 114.58 118.11 3hoa h GLU 112 Ca 0.13 0.03 0.13 0.00 -1.00 0.00 0.00 59.36 58.64 3hoa h GLU 112 Cb 0.44 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.70 3hoa h GLU 112 CO 0.02 -0.19 0.37 1.03 -1.00 0.00 0.00 179.01 179.23 3hoa h SER 113 N -0.55 0.44 0.16 1.42 0.87 -1.35 0.16 113.55 114.71 3hoa h SER 113 Ca -0.04 0.09 -0.18 0.00 -1.23 0.00 0.00 61.79 60.42 3hoa h SER 113 Cb 0.41 0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.38 3hoa h SER 113 CO 0.07 0.21 -0.68 -0.33 -0.53 0.00 0.00 176.83 175.57 3hoa h GLU 114 N 0.57 0.47 -0.29 2.24 5.08 -1.09 -1.85 114.58 119.70 3hoa h GLU 114 Ca 0.41 -0.36 -0.06 0.00 -1.00 0.00 0.00 59.36 58.35 3hoa h GLU 114 Cb 0.54 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3hoa h GLU 114 CO -0.34 0.98 -0.05 0.00 -1.00 0.00 0.00 179.01 178.60 3hoa h ALA 115 N 0.93 0.40 -0.33 3.43 0.00 0.03 -1.40 119.26 122.32 3hoa h ALA 115 Ca -0.02 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.63 3hoa h ALA 115 Cb 1.25 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3hoa h ALA 115 CO 0.12 0.20 0.20 0.93 0.00 0.00 0.00 179.25 180.71 3hoa h GLU 116 N 0.32 0.40 -0.09 0.00 5.08 -0.67 0.16 114.58 119.79 3hoa h GLU 116 Ca 0.08 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3hoa h GLU 116 Cb 0.52 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 3hoa h GLU 116 CO 0.03 0.27 0.02 1.03 -1.00 0.00 0.00 179.01 179.35 3hoa h SER 117 N 0.42 0.01 -0.54 1.42 0.87 -1.23 -1.44 113.55 113.06 3hoa h SER 117 Ca 0.13 0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.60 3hoa h SER 117 Cb -0.02 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3hoa h SER 117 CO -0.05 0.02 -0.02 0.15 -0.53 0.00 0.00 176.83 176.40 3hoa h PHE 118 N 0.06 1.09 -1.01 2.24 3.57 -1.09 -3.01 116.94 118.79 3hoa h PHE 118 Ca 0.04 -0.19 0.02 0.00 3.53 0.00 0.00 57.97 61.37 3hoa h PHE 118 Cb 0.03 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.43 3hoa h PHE 118 CO -0.10 0.98 0.67 2.35 -2.23 0.00 0.00 178.31 179.97 3hoa h TRP 119 N 0.91 1.26 -1.01 0.41 7.01 -0.40 0.11 115.95 124.24 3hoa h TRP 119 Ca 0.16 0.03 0.23 0.00 2.11 0.00 0.00 58.89 61.43 3hoa h TRP 119 Cb 0.56 -0.42 -0.11 0.00 -2.10 0.00 0.00 29.16 27.09 3hoa h TRP 119 CO 0.04 0.77 0.62 0.93 -2.79 0.00 0.00 178.44 178.01 3hoa h GLU 120 N 1.34 0.55 0.00 2.65 4.39 -1.12 -1.65 114.58 120.74 3hoa h GLU 120 Ca 0.38 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 60.02 3hoa h GLU 120 Cb -0.11 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.41 3hoa h GLU 120 CO -0.09 0.37 -1.90 0.39 -1.16 0.00 0.00 179.01 176.61 3hoa n GLU 121 N -4.76 0.62 -0.07 2.33 1.02 -1.02 -4.52 120.64 114.24 3hoa n GLU 121 Ca 0.25 -0.16 -0.14 0.00 -0.02 0.00 0.00 57.16 57.10 3hoa n GLU 121 Cb 0.74 -1.45 -0.06 0.00 -0.02 0.00 0.00 31.44 30.65 3hoa n GLU 121 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hoa h ALA 122 N 1.65 0.30 -0.22 0.62 0.00 -0.13 -3.14 119.26 118.35 3hoa h ALA 122 Ca -0.04 -0.40 0.05 0.00 0.00 0.00 0.00 54.91 54.52 3hoa h ALA 122 Cb 0.98 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.65 3hoa h ALA 122 CO 0.00 0.31 -0.15 -0.09 0.00 0.00 0.00 179.25 179.32 3hoa h ARG 123 N 0.22 -0.14 0.00 0.00 2.43 -1.56 0.10 114.38 115.43 3hoa h ARG 123 Ca 0.02 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3hoa h ARG 123 Cb 0.86 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.44 3hoa h ARG 123 CO 0.07 -0.09 -0.01 -1.35 -1.51 0.00 0.00 179.97 177.07 3hoa h PRO 124 N -0.15 0.00 -0.01 0.20 0.11 -1.79 0.64 132.00 131.01 3hoa h PRO 124 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3hoa h PRO 124 Cb 0.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.45 3hoa h PRO 124 CO -0.31 0.01 -0.30 0.54 -0.21 0.00 0.00 178.00 177.73 3hoa n ARG 125 N -3.15 0.80 -2.48 1.05 1.74 0.14 -4.92 116.66 109.85 3hoa n ARG 125 Ca -0.02 -0.49 -0.21 0.00 -0.77 0.00 0.00 57.85 56.36 3hoa n ARG 125 Cb 0.15 -1.49 -0.00 0.00 -1.02 0.00 0.00 32.46 30.09 3hoa n ARG 125 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3hoa n ASP 126 N -0.67 -5.97 -3.98 0.55 2.03 0.22 -4.90 116.55 103.83 3hoa n ASP 126 Ca 0.11 -0.05 -0.43 0.00 0.52 0.00 0.00 54.79 54.94 3hoa n ASP 126 Cb 0.36 -4.95 0.00 0.00 -0.72 0.00 0.00 41.12 35.81 3hoa n ASP 126 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 3hoa n ASP 127 N -2.09 5.31 -0.13 1.67 4.64 -0.63 -4.76 116.55 120.56 3hoa n ASP 127 Ca -0.23 -3.14 -0.10 0.00 -1.38 0.00 0.00 54.79 49.94 3hoa n ASP 127 Cb 0.68 -1.46 0.03 0.00 -1.04 0.00 0.00 41.12 39.33 3hoa n ASP 127 CO 0.00 0.00 0.00 -0.25 -0.82 0.00 0.00 177.20 176.13 3hoa h TRP 128 N 5.91 1.06 -0.49 -0.67 2.91 -1.90 -2.56 115.95 120.21 3hoa h TRP 128 Ca 0.35 -0.26 0.08 0.00 1.13 0.00 0.00 58.89 60.19 3hoa h TRP 128 Cb 0.66 -0.25 -0.06 0.00 -0.51 0.00 0.00 29.16 29.01 3hoa h TRP 128 CO 1.19 1.06 0.13 -0.09 -1.03 0.00 0.00 178.44 179.70 3hoa h ARG 129 N 0.79 0.27 0.00 2.65 2.43 -2.00 0.31 114.38 118.83 3hoa h ARG 129 Ca 0.10 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.17 3hoa h ARG 129 Cb 0.80 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 3hoa h ARG 129 CO 0.07 0.18 -0.39 0.78 -1.51 0.00 0.00 179.97 179.10 3hoa h GLY 130 N 0.28 0.00 1.32 2.80 0.00 -1.95 -3.29 103.07 102.23 3hoa h GLY 130 Ca 0.24 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.25 3hoa h GLY 130 CO -0.28 0.00 -1.45 -2.75 0.00 0.00 0.00 176.54 172.05 3hoa h PHE 131 N 0.00 0.80 -0.93 5.60 3.57 -0.81 -3.38 116.94 121.80 3hoa h PHE 131 Ca -0.00 -0.59 0.18 0.00 3.53 0.00 0.00 57.97 61.08 3hoa h PHE 131 Cb 1.03 -0.03 -0.17 0.00 2.79 0.00 0.00 35.95 39.57 3hoa h PHE 131 CO 0.00 1.49 -0.27 1.25 -2.23 0.00 0.00 178.31 178.55 3hoa h LEU 132 N 0.12 -1.00 -0.77 0.59 5.85 -0.52 -0.40 115.31 119.18 3hoa h LEU 132 Ca -0.23 0.28 0.11 0.00 0.84 0.00 0.00 57.88 58.88 3hoa h LEU 132 Cb 2.11 0.62 -0.08 0.00 0.37 0.00 0.00 40.66 43.67 3hoa h LEU 132 CO 0.24 -0.30 0.38 -0.65 -0.34 0.00 0.00 178.44 177.77 3hoa h PRO 133 N -0.01 0.59 -0.55 5.25 0.11 -1.77 0.19 132.00 135.81 3hoa h PRO 133 Ca 0.42 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.44 3hoa h PRO 133 Cb 0.66 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.61 3hoa h PRO 133 CO -0.95 0.39 0.16 1.88 -0.21 0.00 0.00 178.00 179.26 3hoa h TYR 134 N 0.61 0.91 -0.18 0.65 -1.99 -1.33 -2.22 116.97 113.42 3hoa h TYR 134 Ca 0.39 -0.10 -0.02 0.00 2.00 0.00 0.00 58.73 61.01 3hoa h TYR 134 Cb 0.47 -0.26 -0.01 0.00 2.00 0.00 0.00 36.73 38.94 3hoa h TYR 134 CO -0.11 0.78 0.06 1.25 -0.00 0.00 0.00 178.16 180.14 3hoa h LEU 135 N 0.78 0.27 -1.01 3.88 5.85 -0.70 -2.03 115.31 122.36 3hoa h LEU 135 Ca 0.18 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.72 3hoa h LEU 135 Cb 0.31 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 3hoa h LEU 135 CO -0.00 0.41 0.66 0.11 -0.34 0.00 0.00 178.44 179.27 3hoa h LYS 136 N 0.12 1.26 -0.30 1.25 1.57 -0.61 0.21 116.57 120.07 3hoa h LYS 136 Ca 0.06 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3hoa h LYS 136 Cb 0.23 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 3hoa h LYS 136 CO -0.00 0.83 0.15 -0.09 -0.57 0.00 0.00 179.45 179.77 3hoa h ARG 137 N 1.30 0.43 -0.31 3.15 2.43 -1.22 0.53 114.38 120.68 3hoa h ARG 137 Ca 0.39 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.49 3hoa h ARG 137 Cb -0.04 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 3hoa h ARG 137 CO -0.11 0.39 0.14 0.28 -1.51 0.00 0.00 179.97 179.16 3hoa h VAL 138 N 0.36 1.17 0.23 0.20 2.07 -0.85 -2.16 116.25 117.27 3hoa h VAL 138 Ca 0.10 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3hoa h VAL 138 Cb 0.10 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3hoa h VAL 138 CO -0.01 0.17 -0.11 0.22 0.02 0.00 0.00 177.57 177.86 3hoa h TYR 139 N 0.37 -0.28 -0.63 1.57 3.20 -0.20 -0.02 116.97 120.97 3hoa h TYR 139 Ca 0.11 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.07 3hoa h TYR 139 Cb 0.14 0.09 -0.08 0.00 1.54 0.00 0.00 36.73 38.43 3hoa h TYR 139 CO -0.01 -0.17 0.23 0.00 -1.64 0.00 0.00 178.16 176.57 3hoa h ALA 140 N 0.46 0.82 -0.23 1.82 0.00 0.10 0.17 119.26 122.41 3hoa h ALA 140 Ca -0.03 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3hoa h ALA 140 Cb 0.24 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3hoa h ALA 140 CO 0.05 -0.20 -0.34 -0.07 0.00 0.00 0.00 179.25 178.68 3hoa h LEU 141 N 0.40 0.50 -0.47 0.00 3.38 -1.18 -2.14 115.31 115.81 3hoa h LEU 141 Ca 0.32 -0.20 -0.12 0.00 0.09 0.00 0.00 57.88 57.98 3hoa h LEU 141 Cb 0.42 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3hoa h LEU 141 CO -0.33 0.81 -0.16 0.74 0.09 0.00 0.00 178.44 179.59 3hoa h THR 142 N 0.41 1.27 -0.93 0.22 2.02 0.16 -0.55 112.91 115.52 3hoa h THR 142 Ca 0.05 -1.31 -0.01 0.00 0.77 0.00 0.00 66.41 65.91 3hoa h THR 142 Cb 0.80 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 68.30 3hoa h THR 142 CO 0.06 0.45 0.55 0.50 0.37 0.00 0.00 175.52 177.45 3hoa h LYS 143 N 0.78 1.26 -0.48 6.66 3.64 -0.53 0.25 116.57 128.16 3hoa h LYS 143 Ca 0.11 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 3hoa h LYS 143 Cb 0.72 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3hoa h LYS 143 CO 0.06 0.89 0.10 1.49 -2.27 0.00 0.00 179.45 179.71 3hoa h GLU 144 N 1.28 0.77 -0.72 1.90 4.81 -1.06 -0.01 114.58 121.55 3hoa h GLU 144 Ca 0.33 -0.20 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3hoa h GLU 144 Cb -0.04 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 3hoa h GLU 144 CO -0.06 0.77 0.45 -0.22 -0.73 0.00 0.00 179.01 179.22 3hoa h LYS 145 N 0.65 0.97 -0.56 1.92 3.64 -0.52 -1.91 116.57 120.77 3hoa h LYS 145 Ca 0.15 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 59.38 3hoa h LYS 145 Cb 0.35 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 3hoa h LYS 145 CO 0.01 0.68 0.07 0.00 -2.27 0.00 0.00 179.45 177.93 3hoa h ALA 146 N 1.24 1.08 -0.24 5.00 0.00 -0.54 -1.36 119.26 124.44 3hoa h ALA 146 Ca 0.26 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3hoa h ALA 146 Cb -0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3hoa h ALA 146 CO -0.05 0.59 -0.27 0.93 0.00 0.00 0.00 179.25 180.45 3hoa h GLU 147 N 0.85 0.46 -0.04 0.00 5.08 -0.56 0.23 114.58 120.60 3hoa h GLU 147 Ca 0.17 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3hoa h GLU 147 Cb 0.40 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.63 3hoa h GLU 147 CO 0.01 0.70 -0.06 0.28 -1.00 0.00 0.00 179.01 178.94 3hoa h VAL 148 N 0.41 1.42 0.00 3.13 2.07 -1.05 -2.73 116.25 119.49 3hoa h VAL 148 Ca 0.06 -1.32 -0.05 0.00 0.82 0.00 0.00 66.70 66.20 3hoa h VAL 148 Cb 0.69 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 3hoa h VAL 148 CO 0.05 0.36 -0.26 -0.07 0.02 0.00 0.00 177.57 177.67 3hoa h LEU 149 N -0.40 0.00 -0.60 2.57 -0.00 -1.15 -2.91 115.31 112.82 3hoa h LEU 149 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.76 3hoa h LEU 149 Cb 0.61 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.25 3hoa h LEU 149 CO 0.01 0.26 -0.58 0.15 -0.00 0.00 0.00 178.44 178.28 3hoa h PHE 150 N 0.00 0.00 0.00 1.13 3.57 -0.51 -3.01 116.94 118.12 3hoa h PHE 150 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3hoa h PHE 150 Cb 0.53 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.27 3hoa h PHE 150 CO 0.00 0.58 0.00 0.00 -2.23 0.00 0.00 178.31 176.66 3hoa h ALA 151 N 1.42 1.00 -2.66 2.41 0.00 -1.28 -3.45 119.26 116.70 3hoa h ALA 151 Ca -0.01 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.34 3hoa h ALA 151 Cb 1.17 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 3hoa h ALA 151 CO 0.08 0.00 -0.34 -0.51 0.00 0.00 0.00 179.25 178.47 3hoa s LEU 152 N -4.82 4.26 0.58 0.00 1.43 -1.14 -5.07 118.68 113.93 3hoa s LEU 152 Ca 0.09 0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 53.45 3hoa s LEU 152 Cb 0.11 -3.21 -0.03 0.00 0.03 0.00 0.00 46.19 43.09 3hoa s LEU 152 CO 0.58 0.02 1.34 -2.16 0.23 0.00 0.00 176.35 176.37 3hoa s PRO 153 N -2.93 2.92 0.00 1.29 0.04 -1.26 -4.98 135.00 130.08 3hoa s PRO 153 Ca 0.39 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.62 3hoa s PRO 153 Cb -0.12 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.31 3hoa s PRO 153 CO 0.27 -1.35 0.00 -0.35 0.04 0.00 0.00 177.00 175.61 3hoa n PRO 154 N -1.35 -0.87 -2.78 0.56 -0.04 -1.26 -4.96 135.00 124.30 3hoa n PRO 154 Ca 0.12 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 63.18 3hoa n PRO 154 Cb 0.46 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.86 3hoa n PRO 154 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hoa s ALA 155 N -2.80 3.35 0.07 0.55 0.00 -1.26 -4.95 121.76 116.71 3hoa s ALA 155 Ca 0.00 0.58 -0.37 0.00 0.00 0.00 0.00 51.96 52.17 3hoa s ALA 155 Cb 0.00 -3.18 -0.17 0.00 0.00 0.00 0.00 23.12 19.77 3hoa s ALA 155 CO 0.00 0.20 1.37 -2.30 0.00 0.00 0.00 175.76 175.03 3hoa n PRO 156 N 1.64 1.18 0.00 0.00 -0.02 -1.26 -0.37 135.00 136.17 3hoa n PRO 156 Ca -0.02 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3hoa n PRO 156 Cb 0.47 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 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 2.63 3.00 3.83 -1.23 0.00 -1.26 -5.05 105.19 107.11 3hoa n GLY 157 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 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 0.94 6.55 0.66 1.61 1.01 0.50 -5.05 116.67 122.89 3hoa s ASP 158 Ca 0.00 1.62 -0.14 0.00 0.71 0.00 0.00 52.55 54.74 3hoa s ASP 158 Cb 0.00 -2.52 -0.00 0.00 1.01 0.00 0.00 42.92 41.41 3hoa s ASP 158 CO 0.00 -0.64 1.08 -2.16 0.21 0.00 0.00 175.17 173.66 3hoa s PRO 159 N -3.96 2.90 0.81 8.23 0.04 -1.26 -4.79 135.00 136.98 3hoa s PRO 159 Ca 0.60 1.23 -0.12 0.00 0.04 0.00 0.00 61.00 62.74 3hoa s PRO 159 Cb -0.11 -1.97 0.09 0.00 0.04 0.00 0.00 34.50 32.54 3hoa s PRO 159 CO 0.30 -1.15 1.17 -1.25 0.04 0.00 0.00 177.00 176.11 3hoa s PRO 160 N -4.36 1.69 0.19 0.56 0.04 -1.26 -4.87 135.00 126.98 3hoa s PRO 160 Ca 0.64 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.99 3hoa s PRO 160 Cb -0.17 -1.80 -0.08 0.00 0.04 0.00 0.00 34.50 32.49 3hoa s PRO 160 CO 0.44 -2.15 1.21 0.71 0.04 0.00 0.00 177.00 177.26 3hoa s TYR 161 N -2.36 3.40 -0.15 0.56 4.12 -1.26 -4.91 117.35 116.75 3hoa s TYR 161 Ca 0.70 1.39 0.18 0.00 0.02 0.00 0.00 57.07 59.36 3hoa s TYR 161 Cb -0.25 -3.46 -0.10 0.00 -1.52 0.00 0.00 41.96 36.63 3hoa s TYR 161 CO 0.52 -1.30 0.89 0.78 0.02 0.00 0.00 175.55 176.45 3hoa h GLY 162 N 5.26 0.00 -2.81 0.71 0.00 -1.96 -3.48 103.07 100.79 3hoa h GLY 162 Ca -0.45 0.00 0.03 0.00 0.00 0.00 0.00 47.33 46.92 3hoa h GLY 162 CO 0.75 0.00 0.28 -1.83 0.00 0.00 0.00 176.54 175.73 3hoa s GLU 163 N -3.02 1.31 0.53 4.80 -1.05 -1.26 -5.04 118.70 114.97 3hoa s GLU 163 Ca -0.02 -0.56 0.28 0.00 -0.15 0.00 0.00 54.97 54.51 3hoa s GLU 163 Cb 0.09 0.55 1.43 0.00 -0.44 0.00 0.00 34.13 35.76 3hoa s GLU 163 CO 0.80 -0.58 1.96 1.37 0.95 0.00 0.00 175.26 179.76 3hoa h LEU 164 N 2.00 0.00 -1.54 1.83 8.10 -1.92 -0.19 115.31 123.59 3hoa h LEU 164 Ca -0.28 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.68 3hoa h LEU 164 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.49 3hoa h LEU 164 CO 0.33 0.00 0.05 0.22 -4.11 0.00 0.00 178.44 174.93 3hoa h TYR 165 N 0.00 0.34 0.00 0.17 3.20 -1.93 -1.98 116.97 116.77 3hoa h TYR 165 Ca 0.32 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.16 3hoa h TYR 165 Cb 1.27 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.43 3hoa h TYR 165 CO 0.00 0.32 -0.05 -0.44 -1.64 0.00 0.00 178.16 176.35 3hoa h ASP 166 N 0.34 0.00 0.25 -2.11 3.32 -1.38 -0.59 116.42 116.25 3hoa h ASP 166 Ca 0.08 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.03 3hoa h ASP 166 Cb 0.15 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3hoa h ASP 166 CO -0.00 0.05 -0.41 0.00 -1.72 0.00 0.00 179.24 177.16 3hoa h ALA 167 N 1.95 1.13 0.16 3.45 0.00 -1.48 0.26 119.26 124.73 3hoa h ALA 167 Ca -0.00 -0.41 -0.21 0.00 0.00 0.00 0.00 54.91 54.29 3hoa h ALA 167 Cb 0.17 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 17.90 3hoa h ALA 167 CO 0.01 0.58 -0.93 -0.07 0.00 0.00 0.00 179.25 178.84 3hoa h LEU 168 N 0.18 0.53 -0.25 0.00 3.38 -1.24 -3.29 115.31 114.61 3hoa h LEU 168 Ca 0.02 -0.95 0.03 0.00 0.09 0.00 0.00 57.88 57.06 3hoa h LEU 168 Cb 0.81 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 3hoa h LEU 168 CO 0.06 1.45 0.08 -0.07 0.09 0.00 0.00 178.44 180.05 3hoa h LEU 169 N -0.29 0.08 -1.49 1.67 3.38 -1.20 -2.47 115.31 114.99 3hoa h LEU 169 Ca -0.16 0.03 0.26 0.00 0.09 0.00 0.00 57.88 58.09 3hoa h LEU 169 Cb 1.73 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 42.42 3hoa h LEU 169 CO 0.17 0.08 0.67 -0.78 0.09 0.00 0.00 178.44 178.67 3hoa h ASP 170 N 0.19 0.37 0.13 -0.43 1.82 -1.05 -0.67 116.42 116.79 3hoa h ASP 170 Ca 0.11 0.06 -0.04 0.00 -0.39 0.00 0.00 57.03 56.78 3hoa h ASP 170 Cb 0.08 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.09 3hoa h ASP 170 CO -0.12 0.10 -0.15 1.23 -1.61 0.00 0.00 179.24 178.69 3hoa h GLY 171 N 0.34 0.05 0.00 -0.78 0.00 -1.50 -2.85 103.07 98.33 3hoa h GLY 171 Ca 0.55 -0.03 -0.35 0.00 0.00 0.00 0.00 47.33 47.50 3hoa h GLY 171 CO -0.22 0.03 -2.32 -1.72 0.00 0.00 0.00 176.54 172.30 3hoa n TYR 172 N -4.34 0.00 -3.71 5.60 4.02 -0.36 -4.73 117.16 113.63 3hoa n TYR 172 Ca -0.02 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.58 3hoa n TYR 172 Cb 0.23 -0.94 -0.12 0.00 -0.02 0.00 0.00 39.34 38.49 3hoa n TYR 172 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 3hoa s GLU 173 N -2.46 1.54 -0.37 -0.72 2.56 -0.57 -3.03 118.70 115.65 3hoa s GLU 173 Ca -0.14 -2.39 -0.43 0.00 0.00 0.00 0.00 54.97 52.01 3hoa s GLU 173 Cb 0.06 -2.49 -0.17 0.00 2.00 0.00 0.00 34.13 33.53 3hoa s GLU 173 CO 0.73 -1.23 1.70 -2.30 -0.56 0.00 0.00 175.26 173.60 3hoa n PRO 174 N 3.00 0.70 0.00 4.30 -0.02 -1.08 -1.21 135.00 140.69 3hoa n PRO 174 Ca 0.15 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 3hoa n PRO 174 Cb 0.37 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 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 4.16 2.48 3.77 -1.23 0.00 -1.26 -4.48 105.19 108.63 3hoa n GLY 175 Ca 0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.67 4.34 0.05 1.61 0.00 -0.35 -4.70 119.30 119.59 3hoa s MET 176 Ca 0.00 1.98 0.04 0.00 0.00 0.00 0.00 55.69 57.70 3hoa s MET 176 Cb 0.00 -2.98 -0.03 0.00 0.00 0.00 0.00 34.83 31.83 3hoa s MET 176 CO 0.00 -0.12 -0.11 1.03 0.00 0.00 0.00 175.02 175.82 3hoa s ARG 177 N -1.86 0.69 0.35 4.11 1.81 -1.26 -4.20 118.95 118.59 3hoa s ARG 177 Ca 0.50 -0.82 0.07 0.00 -1.72 0.00 0.00 55.73 53.77 3hoa s ARG 177 Cb -0.35 -0.59 0.76 0.00 -0.45 0.00 0.00 34.95 34.33 3hoa s ARG 177 CO 0.45 0.13 1.89 0.00 -0.68 0.00 0.00 175.30 177.08 3hoa h ALA 178 N 4.51 1.76 0.00 2.13 0.00 -1.94 0.13 119.26 125.86 3hoa h ALA 178 Ca -0.38 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.54 3hoa h ALA 178 Cb 1.19 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3hoa h ALA 178 CO 0.41 0.03 0.00 2.89 0.00 0.00 0.00 179.25 182.58 3hoa n ARG 179 N -4.54 0.17 -0.07 0.00 1.85 -1.26 -0.91 116.66 111.89 3hoa n ARG 179 Ca 0.16 0.46 -0.16 0.00 -1.00 0.00 0.00 57.85 57.31 3hoa n ARG 179 Cb 0.40 -1.86 -0.14 0.00 -1.05 0.00 0.00 32.46 29.81 3hoa n ARG 179 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 3hoa n GLU 180 N -2.19 0.68 0.29 2.89 2.13 0.31 -4.43 120.64 120.33 3hoa n GLU 180 Ca 0.01 0.16 -0.15 0.00 0.66 0.00 0.00 57.16 57.85 3hoa n GLU 180 Cb 0.18 -1.61 -0.08 0.00 0.27 0.00 0.00 31.44 30.21 3hoa n GLU 180 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3hoa h LEU 181 N 0.02 -0.64 -0.91 4.31 3.38 -0.55 -3.28 115.31 117.63 3hoa h LEU 181 Ca -0.49 -0.04 0.25 0.00 0.09 0.00 0.00 57.88 57.69 3hoa h LEU 181 Cb 2.03 0.17 -0.16 0.00 0.09 0.00 0.00 40.66 42.79 3hoa h LEU 181 CO 0.01 -0.31 0.12 -0.07 0.09 0.00 0.00 178.44 178.28 3hoa h LEU 182 N -0.99 -0.25 -0.91 1.67 3.38 -1.25 0.12 115.31 117.07 3hoa h LEU 182 Ca -0.08 0.24 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 3hoa h LEU 182 Cb 0.64 0.38 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 3hoa h LEU 182 CO 0.13 -0.26 -0.54 1.55 0.09 0.00 0.00 178.44 179.41 3hoa h PRO 183 N 0.09 0.01 -0.25 1.13 0.13 -1.77 -1.29 132.00 130.05 3hoa h PRO 183 Ca 0.56 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.65 3hoa h PRO 183 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 3hoa h PRO 183 CO -0.78 0.55 0.02 -0.07 -0.23 0.00 0.00 178.00 177.49 3hoa h LEU 184 N 0.01 0.42 -1.21 1.56 3.38 -0.86 -2.21 115.31 116.40 3hoa h LEU 184 Ca -0.00 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 3hoa h LEU 184 Cb 0.95 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3hoa h LEU 184 CO 0.07 0.60 -0.22 -0.26 0.09 0.00 0.00 178.44 178.72 3hoa h PHE 185 N 0.23 0.30 -0.09 1.13 -1.00 -1.15 -0.26 116.94 116.10 3hoa h PHE 185 Ca 0.08 -0.05 -0.00 0.00 2.81 0.00 0.00 57.97 60.80 3hoa h PHE 185 Cb 0.37 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 39.84 3hoa h PHE 185 CO 0.03 0.49 0.05 0.00 -1.61 0.00 0.00 178.31 177.26 3hoa h ALA 186 N 1.52 0.11 0.16 2.45 0.00 -1.01 0.65 119.26 123.15 3hoa h ALA 186 Ca 0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3hoa h ALA 186 Cb 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3hoa h ALA 186 CO 0.04 -0.35 -0.08 1.49 0.00 0.00 0.00 179.25 180.35 3hoa h GLU 187 N 0.05 -0.21 -0.15 0.00 4.81 -1.13 -2.23 114.58 115.72 3hoa h GLU 187 Ca 0.03 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3hoa h GLU 187 Cb 0.08 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 3hoa h GLU 187 CO -0.00 -0.13 -0.04 1.25 -0.73 0.00 0.00 179.01 179.36 3hoa h LEU 188 N -0.23 -0.14 -0.73 1.64 5.85 -0.80 -1.88 115.31 119.02 3hoa h LEU 188 Ca -0.02 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.81 3hoa h LEU 188 Cb 0.18 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.25 3hoa h LEU 188 CO 0.04 -0.05 0.42 0.50 -0.34 0.00 0.00 178.44 179.00 3hoa h LYS 189 N -0.00 0.74 -0.27 1.25 3.64 0.39 -0.66 116.57 121.66 3hoa h LYS 189 Ca 0.07 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.36 3hoa h LYS 189 Cb 0.11 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 3hoa h LYS 189 CO -0.15 0.49 -0.01 1.49 -2.27 0.00 0.00 179.45 179.00 3hoa h GLU 190 N 0.76 0.48 -0.70 1.90 4.57 -1.18 -1.97 114.58 118.45 3hoa h GLU 190 Ca 0.33 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 3hoa h GLU 190 Cb 0.20 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.71 3hoa h GLU 190 CO -0.19 0.65 0.39 0.78 -1.18 0.00 0.00 179.01 179.46 3hoa h GLY 191 N 0.26 1.04 1.54 1.92 0.00 -1.01 -1.59 103.07 105.22 3hoa h GLY 191 Ca 0.08 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 3hoa h GLY 191 CO 0.01 0.45 -0.10 1.41 0.00 0.00 0.00 176.54 178.31 3hoa h LEU 192 N 0.96 0.54 -0.34 3.11 3.38 -1.07 -1.61 115.31 120.27 3hoa h LEU 192 Ca 0.25 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 3hoa h LEU 192 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3hoa h LEU 192 CO -0.04 0.68 0.01 0.11 0.09 0.00 0.00 178.44 179.29 3hoa h LYS 193 N 0.52 0.59 -0.74 1.13 1.79 -0.88 0.19 116.57 119.17 3hoa h LYS 193 Ca 0.10 -0.19 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 3hoa h LYS 193 Cb 0.49 -0.06 -0.03 0.00 -1.58 0.00 0.00 32.23 31.05 3hoa h LYS 193 CO 0.03 0.71 0.41 0.78 -1.08 0.00 0.00 179.45 180.30 3hoa h GLY 194 N 0.40 1.10 1.05 3.86 0.00 -1.04 -2.32 103.07 106.13 3hoa h GLY 194 Ca 0.10 -0.50 -0.13 0.00 0.00 0.00 0.00 47.33 46.80 3hoa h GLY 194 CO 0.02 0.48 -0.27 -2.00 0.00 0.00 0.00 176.54 174.77 3hoa h LEU 195 N 1.02 0.90 -1.95 3.11 5.85 -1.13 -2.89 115.31 120.21 3hoa h LEU 195 Ca 0.26 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 3hoa h LEU 195 Cb 0.03 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.81 3hoa h LEU 195 CO -0.04 1.14 -0.11 -0.07 -0.34 0.00 0.00 178.44 179.01 3hoa h LEU 196 N 0.66 0.00 0.12 2.25 3.38 -0.81 -1.70 115.31 119.21 3hoa h LEU 196 Ca 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3hoa h LEU 196 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 3hoa h LEU 196 CO 0.07 0.11 -0.06 0.44 0.09 0.00 0.00 178.44 179.09 3hoa h ASP 197 N 0.00 -0.14 -0.52 -0.43 3.32 -1.20 -0.36 116.42 117.09 3hoa h ASP 197 Ca -0.00 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 3hoa h ASP 197 Cb 0.29 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 3hoa h ASP 197 CO 0.01 0.05 0.25 0.03 -1.72 0.00 0.00 179.24 177.86 3hoa h ARG 198 N -0.33 0.74 0.14 3.56 3.08 -1.39 -1.65 114.38 118.53 3hoa h ARG 198 Ca -0.02 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 3hoa h ARG 198 Cb 0.26 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3hoa h ARG 198 CO 0.03 0.61 -0.07 0.82 -1.07 0.00 0.00 179.97 180.29 3hoa h ILE 199 N 0.69 1.01 -0.43 2.04 2.04 -1.28 -2.28 117.51 119.30 3hoa h ILE 199 Ca 0.18 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.34 3hoa h ILE 199 Cb 0.11 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 3hoa h ILE 199 CO -0.02 0.16 0.23 -0.07 0.00 0.00 0.00 178.15 178.45 3hoa h LEU 200 N -0.52 0.51 -1.10 1.44 3.38 -1.06 -1.42 115.31 116.54 3hoa h LEU 200 Ca -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3hoa h LEU 200 Cb 0.41 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3hoa h LEU 200 CO 0.03 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.59 3hoa n GLY 201 N -1.34 0.35 3.80 0.83 0.00 -0.63 -4.91 105.19 103.30 3hoa n GLY 201 Ca 0.03 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 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 -1.27 7.15 0.26 1.61 0.15 -0.54 -4.97 113.70 116.09 3hoa s SER 202 Ca 0.27 1.71 0.17 0.00 0.70 0.00 0.00 55.95 58.80 3hoa s SER 202 Cb 0.14 -2.54 0.06 0.00 -1.71 0.00 0.00 66.02 61.97 3hoa s SER 202 CO 0.20 -0.16 1.33 1.23 1.20 0.00 0.00 173.24 177.04 3hoa h GLY 203 N 2.75 0.00 -4.02 9.45 0.00 -1.87 -3.45 103.07 105.92 3hoa h GLY 203 Ca -0.48 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.34 3hoa h GLY 203 CO 0.64 0.00 0.54 0.54 0.00 0.00 0.00 176.54 178.25 3hoa s LYS 204 N -3.02 4.53 -0.04 4.80 1.02 -1.26 -5.04 119.74 120.74 3hoa s LYS 204 Ca 0.03 1.88 -0.01 0.00 0.02 0.00 0.00 55.97 57.88 3hoa s LYS 204 Cb 0.08 -3.21 0.03 0.00 -0.52 0.00 0.00 37.83 34.21 3hoa s LYS 204 CO 0.75 0.00 0.06 1.03 -0.92 0.00 0.00 175.35 176.27 3hoa s ARG 205 N -0.75 -0.05 0.66 1.68 0.52 -1.26 -4.98 118.95 114.76 3hoa s ARG 205 Ca 0.50 0.32 -0.16 0.00 -0.52 0.00 0.00 55.73 55.86 3hoa s ARG 205 Cb -0.33 -0.38 0.00 0.00 0.52 0.00 0.00 34.95 34.76 3hoa s ARG 205 CO 0.39 -0.26 1.18 -1.25 0.02 0.00 0.00 175.30 175.38 3hoa s PRO 206 N 1.72 2.62 -1.12 3.54 0.04 -1.26 -4.96 135.00 135.58 3hoa s PRO 206 Ca -0.01 1.68 -0.08 0.00 0.04 0.00 0.00 61.00 62.63 3hoa s PRO 206 Cb -0.12 -1.90 0.28 0.00 0.04 0.00 0.00 34.50 32.79 3hoa s PRO 206 CO -0.03 -1.45 1.25 -3.47 0.04 0.00 0.00 177.00 173.34 3hoa n ASP 207 N -2.23 5.70 0.24 6.66 2.03 -1.26 -4.82 116.55 122.87 3hoa n ASP 207 Ca 0.13 -3.12 0.17 0.00 0.52 0.00 0.00 54.79 52.48 3hoa n ASP 207 Cb 0.50 -1.37 0.81 0.00 -0.72 0.00 0.00 41.12 40.35 3hoa n ASP 207 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 3hoa h THR 208 N 3.67 0.00 -0.75 5.18 1.35 -1.93 -2.62 112.91 117.81 3hoa h THR 208 Ca 0.20 -0.14 0.20 0.00 -0.55 0.00 0.00 66.41 66.12 3hoa h THR 208 Cb 0.81 0.95 -0.04 0.00 -1.73 0.00 0.00 68.15 68.13 3hoa h THR 208 CO 1.13 0.00 0.53 -1.28 -0.25 0.00 0.00 175.52 175.64 3hoa h SER 209 N 0.00 0.13 -0.13 5.36 0.87 -1.99 0.17 113.55 117.96 3hoa h SER 209 Ca 0.00 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 3hoa h SER 209 Cb 0.16 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 3hoa h SER 209 CO 0.00 0.06 -0.04 0.40 -0.53 0.00 0.00 176.83 176.72 3hoa h ILE 210 N 0.13 1.18 0.00 2.23 2.04 -1.88 -2.18 117.51 119.03 3hoa h ILE 210 Ca 0.37 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.50 3hoa h ILE 210 Cb 1.25 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 3hoa h ILE 210 CO -0.05 0.24 0.00 0.18 0.00 0.00 0.00 178.15 178.52 3hoa n LEU 211 N -4.30 0.00 -0.85 1.44 4.77 0.59 -3.20 117.00 115.45 3hoa n LEU 211 Ca 0.01 0.47 0.07 0.00 -0.03 0.00 0.00 56.01 56.53 3hoa n LEU 211 Cb 0.24 -0.47 0.21 0.00 -2.33 0.00 0.00 43.42 41.07 3hoa n LEU 211 CO 0.38 -0.07 0.68 1.41 -1.33 0.00 0.00 177.39 178.46 3hoa n HIS 212 N -1.47 0.69 -1.82 -1.77 8.25 -0.82 -1.48 115.22 116.80 3hoa n HIS 212 Ca 0.07 -0.56 -0.27 0.00 -0.26 0.00 0.00 57.72 56.69 3hoa n HIS 212 Cb 0.28 -0.08 0.19 0.00 1.12 0.00 0.00 29.99 31.50 3hoa n HIS 212 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3hoa n ARG 213 N 0.58 -1.28 -2.41 -0.41 1.74 -1.19 -4.67 116.66 109.02 3hoa n ARG 213 Ca 0.16 -1.89 -0.41 0.00 -0.77 0.00 0.00 57.85 54.93 3hoa n ARG 213 Cb 0.56 -1.28 -0.03 0.00 -1.02 0.00 0.00 32.46 30.69 3hoa n ARG 213 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3hoa s PRO 214 N -5.68 4.48 -0.37 5.56 0.02 -1.26 -4.29 135.00 133.46 3hoa s PRO 214 Ca 0.70 1.82 0.01 0.00 0.02 0.00 0.00 61.00 63.55 3hoa s PRO 214 Cb -0.02 -3.28 0.15 0.00 0.02 0.00 0.00 34.50 31.36 3hoa s PRO 214 CO 0.49 -0.13 0.25 0.71 -0.33 0.00 0.00 177.00 177.99 3hoa s TYR 215 N 0.35 0.88 -0.24 6.54 1.51 -0.20 -4.33 117.35 121.87 3hoa s TYR 215 Ca 0.55 -1.86 -0.43 0.00 -1.01 0.00 0.00 57.07 54.32 3hoa s TYR 215 Cb -0.31 -0.96 -0.20 0.00 -0.11 0.00 0.00 41.96 40.38 3hoa s TYR 215 CO 0.33 -0.83 1.30 -2.30 -1.11 0.00 0.00 175.55 172.95 3hoa n PRO 216 N 3.67 0.00 -0.26 -1.71 -0.02 -1.26 -4.59 135.00 130.82 3hoa n PRO 216 Ca 0.17 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.67 3hoa n PRO 216 Cb 0.40 -1.47 0.23 0.00 -0.02 0.00 0.00 33.50 32.64 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 3.90 1.15 0.00 -1.45 2.07 -1.91 -0.80 116.25 119.21 3hoa h VAL 217 Ca -0.47 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 66.64 3hoa h VAL 217 Cb 1.38 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 3hoa h VAL 217 CO 0.80 0.19 -0.25 1.05 0.02 0.00 0.00 177.57 179.37 3hoa h GLU 218 N 1.05 0.00 0.01 1.57 -0.00 -2.00 -1.43 114.58 113.77 3hoa h GLU 218 Ca 0.33 0.00 -0.24 0.00 -0.00 0.00 0.00 59.36 59.44 3hoa h GLU 218 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 28.77 3hoa h GLU 218 CO -0.09 0.25 -0.96 0.00 -0.00 0.00 0.00 179.01 178.21 3hoa h ALA 219 N 1.75 0.11 -0.86 1.06 0.00 -1.58 -2.63 119.26 117.10 3hoa h ALA 219 Ca -0.00 -0.67 0.01 0.00 0.00 0.00 0.00 54.91 54.25 3hoa h ALA 219 Cb 0.52 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3hoa h ALA 219 CO 0.03 0.61 0.57 1.96 0.00 0.00 0.00 179.25 182.42 3hoa h GLN 220 N 0.28 1.11 -0.52 0.00 4.20 -0.76 0.38 115.11 119.80 3hoa h GLN 220 Ca -0.12 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 3hoa h GLN 220 Cb 1.63 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 29.13 3hoa h GLN 220 CO 0.19 0.73 0.31 -0.09 -0.67 0.00 0.00 178.83 179.31 3hoa h ARG 221 N 1.14 0.71 -0.42 1.46 2.43 -1.26 0.97 114.38 119.41 3hoa h ARG 221 Ca 0.32 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.37 3hoa h ARG 221 Cb -0.11 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 3hoa h ARG 221 CO -0.08 0.52 0.06 0.00 -1.51 0.00 0.00 179.97 178.97 3hoa h ARG 222 N 0.70 0.71 -0.31 0.20 3.08 -0.98 -1.06 114.38 116.71 3hoa h ARG 222 Ca 0.19 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3hoa h ARG 222 Cb -0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 3hoa h ARG 222 CO -0.03 0.75 0.16 0.35 -1.07 0.00 0.00 179.97 180.12 3hoa h PHE 223 N 0.56 0.45 -0.44 3.04 3.57 -0.75 -2.16 116.94 121.20 3hoa h PHE 223 Ca 0.13 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.66 3hoa h PHE 223 Cb 0.38 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 3hoa h PHE 223 CO 0.03 0.39 0.18 0.00 -2.23 0.00 0.00 178.31 176.68 3hoa h ALA 224 N 1.01 0.54 -0.65 2.41 0.00 -0.64 -1.03 119.26 120.90 3hoa h ALA 224 Ca 0.11 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3hoa h ALA 224 Cb 0.11 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3hoa h ALA 224 CO -0.01 -0.20 0.43 -0.07 0.00 0.00 0.00 179.25 179.40 3hoa h LEU 225 N 0.37 0.68 -0.35 0.00 3.38 -0.93 0.13 115.31 118.59 3hoa h LEU 225 Ca 0.20 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 3hoa h LEU 225 Cb 0.17 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3hoa h LEU 225 CO -0.18 0.48 -0.22 -0.33 0.09 0.00 0.00 178.44 178.27 3hoa h GLU 226 N 0.80 0.76 -0.52 1.13 5.08 -0.65 -2.32 114.58 118.86 3hoa h GLU 226 Ca 0.26 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 3hoa h GLU 226 Cb 0.04 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3hoa h GLU 226 CO -0.07 0.98 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.83 3hoa h LEU 227 N 0.55 0.87 0.20 1.33 3.38 -0.66 -0.96 115.31 120.01 3hoa h LEU 227 Ca 0.07 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3hoa h LEU 227 Cb 0.78 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3hoa h LEU 227 CO 0.06 0.94 -0.21 -0.07 0.09 0.00 0.00 178.44 179.25 3hoa h LEU 228 N 0.83 -0.57 -0.81 1.67 3.38 -0.82 0.11 115.31 119.09 3hoa h LEU 228 Ca 0.15 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 3hoa h LEU 228 Cb 0.52 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 3hoa h LEU 228 CO 0.03 -0.31 -0.30 0.77 0.09 0.00 0.00 178.44 178.71 3hoa h SER 229 N -0.45 0.56 -0.83 -0.43 4.64 -1.34 -2.07 113.55 113.63 3hoa h SER 229 Ca 0.00 -0.21 0.01 0.00 -0.47 0.00 0.00 61.79 61.12 3hoa h SER 229 Cb 0.43 -0.15 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 3hoa h SER 229 CO -0.06 0.84 0.55 0.00 -0.87 0.00 0.00 176.83 177.28 3hoa h ALA 230 N 1.20 1.06 0.00 5.18 0.00 -0.82 -2.75 119.26 123.14 3hoa h ALA 230 Ca 0.06 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3hoa h ALA 230 Cb 0.76 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3hoa h ALA 230 CO 0.06 0.43 -0.09 0.00 0.00 0.00 0.00 179.25 179.65 3hoa n GLY 232 N 0.72 1.31 3.69 0.00 0.00 -1.04 -4.67 105.19 105.20 3hoa n GLY 232 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 3.16 -0.62 1.61 5.04 -0.81 -4.96 117.35 118.77 3hoa s TYR 233 Ca 0.00 1.19 -0.27 0.00 -2.44 0.00 0.00 57.07 55.54 3hoa s TYR 233 Cb 0.00 -3.44 0.03 0.00 0.35 0.00 0.00 41.96 38.91 3hoa s TYR 233 CO 0.00 -1.39 1.18 0.34 -1.34 0.00 0.00 175.55 174.34 3hoa s ASP 234 N 1.52 6.34 0.00 4.32 -1.08 -1.26 -4.34 116.67 122.17 3hoa s ASP 234 Ca 0.56 -0.15 0.18 0.00 -0.52 0.00 0.00 52.55 52.62 3hoa s ASP 234 Cb -0.25 -2.53 0.86 0.00 -1.46 0.00 0.00 42.92 39.53 3hoa s ASP 234 CO 0.22 -1.55 1.55 0.18 0.52 0.00 0.00 175.17 176.09 3hoa n LEU 235 N 8.55 0.00 0.11 -1.34 4.77 -1.26 -1.56 117.00 126.27 3hoa n LEU 235 Ca 0.06 0.36 0.13 0.00 -0.03 0.00 0.00 56.01 56.53 3hoa n LEU 235 Cb 0.49 -0.36 0.30 0.00 -2.33 0.00 0.00 43.42 41.51 3hoa n LEU 235 CO 0.70 -0.14 0.70 -0.33 -1.33 0.00 0.00 177.39 176.99 3hoa h GLU 236 N 0.00 0.00 0.00 3.23 4.39 -1.96 -3.29 114.58 116.95 3hoa h GLU 236 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 3hoa h GLU 236 Cb 0.22 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 28.79 3hoa h GLU 236 CO 0.00 0.00 -0.58 0.00 -1.16 0.00 0.00 179.01 177.27 3hoa n ALA 237 N -1.85 3.28 -3.30 3.43 0.00 -0.60 -4.94 120.51 116.52 3hoa n ALA 237 Ca 0.05 -3.02 0.04 0.00 0.00 0.00 0.00 53.44 50.50 3hoa n ALA 237 Cb 0.45 -0.43 0.01 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.79 0.77 3.52 0.00 0.00 -1.11 -0.89 105.19 106.69 3hoa n GLY 238 Ca 0.16 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.01 0.91 -0.11 1.61 1.70 -1.25 -4.74 118.95 115.06 3hoa s ARG 239 Ca 0.08 -0.36 0.03 0.00 -0.47 0.00 0.00 55.73 55.02 3hoa s ARG 239 Cb -0.01 0.40 0.00 0.00 -0.57 0.00 0.00 34.95 34.78 3hoa s ARG 239 CO 0.01 -0.40 -0.23 -1.17 -1.08 0.00 0.00 175.30 172.42 3hoa s LEU 240 N -2.56 2.09 0.06 -1.89 0.20 -1.26 -1.62 118.68 113.70 3hoa s LEU 240 Ca 0.05 -0.57 0.01 0.00 0.69 0.00 0.00 54.13 54.31 3hoa s LEU 240 Cb -0.01 -1.41 -0.03 0.00 -0.43 0.00 0.00 46.19 44.30 3hoa s LEU 240 CO -0.08 0.13 -0.05 -1.81 -0.29 0.00 0.00 176.35 174.25 3hoa s ASP 241 N 0.50 0.72 0.36 3.68 1.01 -1.02 -5.02 116.67 116.89 3hoa s ASP 241 Ca -0.15 -0.81 -0.21 0.00 0.71 0.00 0.00 52.55 52.09 3hoa s ASP 241 Cb -0.17 0.12 -0.10 0.00 1.01 0.00 0.00 42.92 43.77 3hoa s ASP 241 CO 0.05 -0.42 0.89 -2.16 0.21 0.00 0.00 175.17 173.74 3hoa s PRO 242 N -2.94 4.29 0.20 8.23 0.04 -1.26 -2.29 135.00 141.26 3hoa s PRO 242 Ca 0.01 1.07 -0.17 0.00 0.04 0.00 0.00 61.00 61.95 3hoa s PRO 242 Cb 0.00 -2.46 0.02 0.00 0.04 0.00 0.00 34.50 32.11 3hoa s PRO 242 CO -0.05 0.13 0.50 -0.08 0.04 0.00 0.00 177.00 177.55 3hoa s THR 243 N -1.93 0.03 0.13 1.26 -1.32 -0.41 -4.78 115.64 108.62 3hoa s THR 243 Ca 0.56 -0.88 -0.15 0.00 -1.21 0.00 0.00 61.69 60.00 3hoa s THR 243 Cb -0.12 -1.65 -0.00 0.00 -1.51 0.00 0.00 72.50 69.21 3hoa s THR 243 CO 0.17 -0.12 1.67 0.00 -2.21 0.00 0.00 174.62 174.13 3hoa h ALA 244 N 2.23 0.54 -3.32 11.08 0.00 -1.86 -3.34 119.26 124.59 3hoa h ALA 244 Ca -0.28 -0.15 -0.52 0.00 0.00 0.00 0.00 54.91 53.95 3hoa h ALA 244 Cb 1.26 -0.16 -0.39 0.00 0.00 0.00 0.00 17.79 18.50 3hoa h ALA 244 CO 0.38 0.16 -0.78 -1.01 0.00 0.00 0.00 179.25 178.00 3hoa s HIS 245 N -5.49 1.31 0.26 0.00 3.76 -1.26 -4.79 115.29 109.07 3hoa s HIS 245 Ca -0.13 -0.89 -0.30 0.00 -0.15 0.00 0.00 55.06 53.59 3hoa s HIS 245 Cb 0.10 -1.13 -0.14 0.00 1.11 0.00 0.00 32.58 32.52 3hoa s HIS 245 CO 0.76 -0.58 1.21 -0.35 -0.85 0.00 0.00 174.74 174.93 3hoa n PRO 246 N 4.98 1.64 -3.89 8.40 -0.04 -1.26 -4.90 135.00 139.92 3hoa n PRO 246 Ca -0.10 0.58 -0.09 0.00 -0.04 0.00 0.00 63.50 63.86 3hoa n PRO 246 Cb 0.48 -2.10 -0.04 0.00 -0.04 0.00 0.00 33.50 31.80 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 -0.58 0.09 -0.02 0.54 -0.12 -1.22 -4.98 117.98 111.68 3hoa s PHE 247 Ca 0.64 -0.47 0.04 0.00 -0.05 0.00 0.00 56.93 57.09 3hoa s PHE 247 Cb -0.70 0.38 -0.01 0.00 -0.63 0.00 0.00 43.02 42.06 3hoa s PHE 247 CO 0.56 -1.03 -0.15 -2.00 -0.05 0.00 0.00 175.22 172.54 3hoa s GLU 248 N -3.95 1.38 -0.04 1.99 -6.30 -1.26 -1.40 118.70 109.12 3hoa s GLU 248 Ca 0.16 -0.53 -0.01 0.00 -2.50 0.00 0.00 54.97 52.08 3hoa s GLU 248 Cb -0.02 -1.28 0.03 0.00 0.00 0.00 0.00 34.13 32.86 3hoa s GLU 248 CO 0.05 0.27 0.07 -1.50 0.02 0.00 0.00 175.26 174.18 3hoa s ILE 249 N -0.14 -0.05 -0.32 -3.70 1.10 -0.26 -5.01 121.20 112.81 3hoa s ILE 249 Ca 0.01 0.19 -0.14 0.00 -0.51 0.00 0.00 60.65 60.20 3hoa s ILE 249 Cb -0.08 -0.14 -0.03 0.00 0.15 0.00 0.00 42.46 42.36 3hoa s ILE 249 CO 0.00 0.08 0.30 0.00 -2.11 0.00 0.00 174.94 173.21 3hoa s ALA 250 N 1.03 3.52 -0.00 1.50 0.00 -1.26 -0.87 121.76 125.67 3hoa s ALA 250 Ca -0.08 -1.17 -0.08 0.00 0.00 0.00 0.00 51.96 50.63 3hoa s ALA 250 Cb -0.11 -2.70 -0.30 0.00 0.00 0.00 0.00 23.12 20.01 3hoa s ALA 250 CO -0.04 -0.88 0.85 0.82 0.00 0.00 0.00 175.76 176.52 3hoa h ILE 251 N 5.47 1.14 0.00 0.00 1.08 -0.93 -3.48 117.51 120.79 3hoa h ILE 251 Ca -0.32 -2.72 0.00 0.00 -0.39 0.00 0.00 64.86 61.44 3hoa h ILE 251 Cb 1.16 2.83 0.00 0.00 -3.07 0.00 0.00 36.82 37.74 3hoa h ILE 251 CO 0.64 0.84 0.00 0.61 -0.69 0.00 0.00 178.15 179.55 3hoa n GLY 252 N 1.72 -1.74 3.64 5.37 0.00 -0.96 -4.82 105.19 108.40 3hoa n GLY 252 Ca -0.18 -1.13 -0.50 0.00 0.00 0.00 0.00 46.02 44.21 3hoa n GLY 252 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hoa n PRO 253 N -0.28 1.67 -1.06 1.61 -0.02 -1.26 -0.79 135.00 134.87 3hoa n PRO 253 Ca 0.00 0.60 -0.02 0.00 -2.02 0.00 0.00 63.50 62.06 3hoa n PRO 253 Cb 0.00 -2.32 -0.01 0.00 -0.02 0.00 0.00 33.50 31.15 3hoa n PRO 253 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hoa n GLY 254 N 3.20 0.53 2.73 -1.23 0.00 -1.26 -4.96 105.19 104.19 3hoa n GLY 254 Ca 0.19 -0.29 -0.15 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.34 0.39 -0.16 1.61 3.68 0.03 -4.31 116.67 115.57 3hoa s ASP 255 Ca 0.00 -1.87 -0.01 0.00 2.13 0.00 0.00 52.55 52.81 3hoa s ASP 255 Cb 0.00 0.77 0.04 0.00 -1.45 0.00 0.00 42.92 42.28 3hoa s ASP 255 CO 0.00 -0.18 -0.05 -0.69 0.13 0.00 0.00 175.17 174.37 3hoa s VAL 256 N 1.05 1.09 0.09 1.11 1.01 -0.07 -0.18 120.40 124.49 3hoa s VAL 256 Ca 0.23 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.67 3hoa s VAL 256 Cb -0.07 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3hoa s VAL 256 CO -0.07 0.15 0.02 -0.13 0.00 0.00 0.00 175.10 175.07 3hoa s ARG 257 N 1.64 2.63 0.12 2.72 0.52 -0.05 -3.86 118.95 122.67 3hoa s ARG 257 Ca 0.01 -0.80 0.03 0.00 -0.52 0.00 0.00 55.73 54.45 3hoa s ARG 257 Cb -0.15 -2.59 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 3hoa s ARG 257 CO -0.08 0.54 -0.09 0.96 0.02 0.00 0.00 175.30 176.66 3hoa s ILE 258 N -1.34 0.97 0.10 1.52 -4.36 -0.64 -1.11 121.20 116.35 3hoa s ILE 258 Ca 0.27 -1.91 -0.04 0.00 -0.26 0.00 0.00 60.65 58.71 3hoa s ILE 258 Cb -0.12 -1.66 -0.03 0.00 1.25 0.00 0.00 42.46 41.90 3hoa s ILE 258 CO 0.19 -0.73 0.10 0.42 0.24 0.00 0.00 174.94 175.16 3hoa s THR 259 N -3.17 0.14 0.19 8.37 -4.23 -0.49 -2.45 115.64 114.00 3hoa s THR 259 Ca 0.12 -1.64 -0.14 0.00 -1.18 0.00 0.00 61.69 58.85 3hoa s THR 259 Cb 0.02 -1.70 0.01 0.00 1.34 0.00 0.00 72.50 72.17 3hoa s THR 259 CO -0.01 -0.64 0.43 0.28 -0.54 0.00 0.00 174.62 174.14 3hoa s THR 260 N -3.96 0.04 -0.22 3.99 -1.32 -0.97 -3.45 115.64 109.75 3hoa s THR 260 Ca 0.14 -1.07 -0.04 0.00 -1.21 0.00 0.00 61.69 59.50 3hoa s THR 260 Cb 0.06 -1.74 -0.01 0.00 -1.51 0.00 0.00 72.50 69.30 3hoa s THR 260 CO -0.05 -0.18 -0.04 -0.60 -2.21 0.00 0.00 174.62 171.55 3hoa s ARG 261 N -3.92 3.40 -0.11 7.08 6.06 -1.25 -1.29 118.95 128.90 3hoa s ARG 261 Ca 0.13 -0.62 -0.06 0.00 -2.50 0.00 0.00 55.73 52.69 3hoa s ARG 261 Cb 0.01 -3.01 -0.04 0.00 0.06 0.00 0.00 34.95 31.97 3hoa s ARG 261 CO -0.01 -0.17 0.10 0.71 -2.50 0.00 0.00 175.30 173.44 3hoa s TYR 262 N 1.41 3.47 -0.11 5.12 1.51 -1.26 -1.38 117.35 126.12 3hoa s TYR 262 Ca 0.05 0.43 0.03 0.00 -1.01 0.00 0.00 57.07 56.57 3hoa s TYR 262 Cb -0.14 -1.91 0.01 0.00 -0.11 0.00 0.00 41.96 39.80 3hoa s TYR 262 CO -0.02 0.64 -0.22 0.71 -1.11 0.00 0.00 175.55 175.55 3hoa s TYR 263 N -0.92 2.44 0.48 2.71 1.51 -1.26 -4.93 117.35 117.38 3hoa s TYR 263 Ca 0.14 -1.08 0.17 0.00 -1.01 0.00 0.00 57.07 55.29 3hoa s TYR 263 Cb -0.12 -1.66 1.18 0.00 -0.11 0.00 0.00 41.96 41.26 3hoa s TYR 263 CO 0.03 -0.47 2.05 1.49 -1.11 0.00 0.00 175.55 177.54 3hoa h GLU 264 N 6.97 0.19 -0.44 -0.62 4.22 -1.96 -2.82 114.58 120.11 3hoa h GLU 264 Ca -0.25 -0.01 -0.29 0.00 0.08 0.00 0.00 59.36 58.89 3hoa h GLU 264 Cb 1.22 -0.04 -0.20 0.00 0.50 0.00 0.00 28.75 30.23 3hoa h GLU 264 CO 0.50 0.12 -0.34 -0.40 -2.18 0.00 0.00 179.01 176.71 3hoa n ASP 265 N -4.47 3.46 -3.25 1.04 3.85 -1.26 -1.03 116.55 114.89 3hoa n ASP 265 Ca 0.05 -3.81 -0.04 0.00 -0.71 0.00 0.00 54.79 50.28 3hoa n ASP 265 Cb 0.31 -0.55 -0.03 0.00 -1.35 0.00 0.00 41.12 39.50 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 -3.41 -1.33 0.22 2.11 5.99 -1.07 -4.12 117.98 116.38 3hoa s PHE 266 Ca 0.47 0.45 -0.08 0.00 0.00 0.00 0.00 56.93 57.77 3hoa s PHE 266 Cb 0.41 0.04 0.35 0.00 0.00 0.00 0.00 43.02 43.82 3hoa s PHE 266 CO -0.01 -1.05 1.72 0.35 -0.00 0.00 0.00 175.22 176.23 3hoa h PHE 267 N 7.85 0.33 -0.41 10.12 3.57 -1.49 -3.26 116.94 133.64 3hoa h PHE 267 Ca -0.03 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.57 3hoa h PHE 267 Cb 1.14 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.79 3hoa h PHE 267 CO 0.26 0.01 0.11 -0.91 -2.23 0.00 0.00 178.31 175.55 3hoa h ASN 268 N 0.34 0.07 -0.10 0.41 4.21 -1.95 -3.11 115.58 115.46 3hoa h ASN 268 Ca 0.35 0.06 0.01 0.00 1.21 0.00 0.00 56.30 57.94 3hoa h ASN 268 Cb 0.52 0.07 -0.03 0.00 -1.12 0.00 0.00 38.32 37.76 3hoa h ASN 268 CO -0.40 0.08 -0.20 0.00 -1.29 0.00 0.00 177.43 175.61 3hoa h ALA 269 N 1.30 -0.54 -0.42 -0.83 0.00 -1.82 0.20 119.26 117.14 3hoa h ALA 269 Ca 0.20 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.11 3hoa h ALA 269 Cb 0.22 0.80 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 3hoa h ALA 269 CO -0.23 -0.63 0.26 0.78 0.00 0.00 0.00 179.25 179.43 3hoa h GLY 270 N -0.18 0.59 0.47 0.00 0.00 -1.31 -0.03 103.07 102.61 3hoa h GLY 270 Ca 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 3hoa h GLY 270 CO -0.19 0.19 -0.18 -2.22 0.00 0.00 0.00 176.54 174.14 3hoa h ILE 271 N 0.54 0.32 0.00 2.60 1.08 -1.45 -2.17 117.51 118.43 3hoa h ILE 271 Ca 0.16 -0.70 -0.05 0.00 -0.39 0.00 0.00 64.86 63.88 3hoa h ILE 271 Cb -0.03 0.52 -0.01 0.00 -3.07 0.00 0.00 36.82 34.23 3hoa h ILE 271 CO -0.06 0.07 -0.26 -0.26 -0.69 0.00 0.00 178.15 176.96 3hoa h PHE 272 N -1.03 0.00 -0.65 1.37 -1.00 -1.06 -1.76 116.94 112.82 3hoa h PHE 272 Ca -0.05 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.66 3hoa h PHE 272 Cb 0.50 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.03 3hoa h PHE 272 CO 0.03 0.26 0.13 0.78 -1.61 0.00 0.00 178.31 177.90 3hoa h GLY 273 N 1.94 1.14 0.83 -1.45 0.00 -1.03 -0.58 103.07 103.92 3hoa h GLY 273 Ca -0.00 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.58 3hoa h GLY 273 CO 0.03 0.68 0.03 -0.84 0.00 0.00 0.00 176.54 176.45 3hoa h THR 274 N 0.97 1.18 -0.62 4.70 2.02 -0.66 -2.10 112.91 118.41 3hoa h THR 274 Ca 0.20 -0.55 -0.03 0.00 0.77 0.00 0.00 66.41 66.80 3hoa h THR 274 Cb 0.40 1.34 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 3hoa h THR 274 CO 0.01 0.16 0.28 -0.07 0.37 0.00 0.00 175.52 176.27 3hoa h LEU 275 N -0.01 0.80 0.50 2.58 3.38 -1.26 0.16 115.31 121.46 3hoa h LEU 275 Ca 0.04 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3hoa h LEU 275 Cb 0.22 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3hoa h LEU 275 CO -0.00 0.69 -0.24 -0.74 0.09 0.00 0.00 178.44 178.24 3hoa h HIS 276 N 0.88 -0.63 -0.59 1.13 2.76 -0.95 -1.44 115.15 116.31 3hoa h HIS 276 Ca 0.21 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.34 3hoa h HIS 276 Cb 0.11 0.21 -0.03 0.00 1.55 0.00 0.00 27.41 29.25 3hoa h HIS 276 CO 0.01 -0.37 0.25 0.93 -1.30 0.00 0.00 177.93 177.44 3hoa h GLU 277 N -0.70 0.85 -0.98 5.26 4.39 -1.08 -2.05 114.58 120.27 3hoa h GLU 277 Ca -0.07 -0.13 0.04 0.00 0.34 0.00 0.00 59.36 59.55 3hoa h GLU 277 Cb 0.53 -0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 28.97 3hoa h GLU 277 CO 0.11 0.69 0.64 1.98 -1.16 0.00 0.00 179.01 181.27 3hoa h MET 278 N 0.85 1.18 -0.52 2.33 1.85 -0.40 -0.18 114.93 120.03 3hoa h MET 278 Ca 0.20 -0.07 0.05 0.00 -0.61 0.00 0.00 59.70 59.27 3hoa h MET 278 Cb 0.15 -0.27 -0.05 0.00 0.43 0.00 0.00 31.60 31.87 3hoa h MET 278 CO -0.02 0.78 0.26 0.78 -0.40 0.00 0.00 176.91 178.31 3hoa h GLY 279 N 1.21 0.73 0.97 1.39 0.00 -0.52 0.40 103.07 107.25 3hoa h GLY 279 Ca 0.40 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 3hoa h GLY 279 CO -0.13 0.11 0.23 0.45 0.00 0.00 0.00 176.54 177.20 3hoa h HIS 280 N 0.50 0.68 -0.76 5.60 -0.00 -1.24 -2.97 115.15 116.96 3hoa h HIS 280 Ca 0.23 -0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.58 3hoa h HIS 280 Cb 0.15 -0.21 -0.04 0.00 -0.00 0.00 0.00 27.41 27.31 3hoa h HIS 280 CO -0.10 0.53 0.51 0.00 -0.00 0.00 0.00 177.93 178.87 3hoa h ALA 281 N 1.08 0.97 -0.40 2.45 0.00 0.08 -2.24 119.26 121.19 3hoa h ALA 281 Ca 0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 3hoa h ALA 281 Cb 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3hoa h ALA 281 CO -0.02 0.38 0.10 -0.07 0.00 0.00 0.00 179.25 179.64 3hoa h LEU 282 N 1.03 0.54 0.12 0.00 3.38 -0.14 0.17 115.31 120.42 3hoa h LEU 282 Ca 0.28 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 3hoa h LEU 282 Cb -0.12 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.49 3hoa h LEU 282 CO -0.06 0.54 -0.06 0.22 0.09 0.00 0.00 178.44 179.17 3hoa h TYR 283 N 0.58 -0.15 -0.68 1.13 3.20 -1.32 -1.25 116.97 118.49 3hoa h TYR 283 Ca 0.14 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.01 3hoa h TYR 283 Cb 0.21 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 3hoa h TYR 283 CO 0.01 0.14 0.45 0.93 -1.64 0.00 0.00 178.16 178.04 3hoa h GLU 284 N -0.44 0.90 0.00 1.82 4.39 -1.04 -0.81 114.58 119.40 3hoa h GLU 284 Ca -0.02 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.63 3hoa h GLU 284 Cb 0.35 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 3hoa h GLU 284 CO 0.03 0.60 0.00 1.04 -1.16 0.00 0.00 179.01 179.52 3hoa n GLN 285 N -4.61 0.16 0.01 2.33 6.02 0.57 -2.37 117.38 119.50 3hoa n GLN 285 Ca 0.06 0.40 0.11 0.00 -0.01 0.00 0.00 57.00 57.56 3hoa n GLN 285 Cb 0.02 -1.81 0.08 0.00 1.02 0.00 0.00 30.24 29.55 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 -0.02 -1.18 3.76 1.08 0.00 -0.36 -4.95 105.19 103.54 3hoa n GLY 286 Ca 0.02 -0.43 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 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 -3.35 4.05 -0.30 0.99 1.43 -0.92 -3.83 118.68 116.74 3hoa s LEU 287 Ca 0.08 2.52 -0.28 0.00 -1.03 0.00 0.00 54.13 55.42 3hoa s LEU 287 Cb 0.16 -4.13 -0.05 0.00 0.03 0.00 0.00 46.19 42.20 3hoa s LEU 287 CO 0.78 -1.03 2.21 -2.16 0.23 0.00 0.00 176.35 176.38 3hoa s PRO 288 N -2.58 2.91 0.37 1.29 0.04 -1.26 -4.85 135.00 130.91 3hoa s PRO 288 Ca 0.63 1.79 0.08 0.00 0.04 0.00 0.00 61.00 63.54 3hoa s PRO 288 Cb -0.34 -4.40 0.80 0.00 0.04 0.00 0.00 34.50 30.60 3hoa s PRO 288 CO 0.42 -2.36 1.93 0.87 0.04 0.00 0.00 177.00 177.90 3hoa h LYS 289 N 15.86 0.67 0.00 4.56 1.57 -1.94 -0.97 116.57 136.32 3hoa h LYS 289 Ca -0.36 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.38 3hoa h LYS 289 Cb 1.24 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.39 3hoa h LYS 289 CO 1.02 0.44 -0.01 1.05 -0.57 0.00 0.00 179.45 181.38 3hoa h GLU 290 N 0.69 0.00 -0.44 3.15 9.09 -2.01 -1.77 114.58 123.29 3hoa h GLU 290 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.77 3hoa h GLU 290 Cb 0.46 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.56 3hoa h GLU 290 CO -0.13 0.01 0.00 0.72 0.05 0.00 0.00 179.01 179.65 3hoa n HIS 291 N -3.26 1.25 -1.78 2.06 8.25 -0.37 -5.02 115.22 116.36 3hoa n HIS 291 Ca -0.03 -0.72 -0.41 0.00 -0.26 0.00 0.00 57.72 56.30 3hoa n HIS 291 Cb 0.10 -0.29 -0.00 0.00 1.12 0.00 0.00 29.99 30.92 3hoa n HIS 291 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85 3hoa n TRP 292 N 0.31 3.02 -0.59 4.41 -0.00 -0.67 -2.38 117.44 121.53 3hoa n TRP 292 Ca 0.22 0.44 0.00 0.00 -0.00 0.00 0.00 57.50 58.16 3hoa n TRP 292 Cb 0.89 -2.54 0.00 0.00 -0.00 0.00 0.00 31.31 29.66 3hoa n TRP 292 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3hoa n GLY 293 N 0.47 0.77 3.21 5.87 0.00 -1.26 -5.00 105.19 109.25 3hoa n GLY 293 Ca 0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 3hoa n GLY 293 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hoa s THR 294 N -2.86 1.12 0.32 2.61 -4.23 -1.00 -4.27 115.64 107.33 3hoa s THR 294 Ca 0.00 -1.74 0.06 0.00 -1.18 0.00 0.00 61.69 58.83 3hoa s THR 294 Cb 0.00 -1.50 0.31 0.00 1.34 0.00 0.00 72.50 72.65 3hoa s THR 294 CO 0.00 -0.54 1.83 -0.65 -0.54 0.00 0.00 174.62 174.72 3hoa h PRO 295 N 3.41 0.77 -0.70 3.99 0.11 -1.88 0.40 132.00 138.11 3hoa h PRO 295 Ca -0.38 -0.05 0.13 0.00 0.11 0.00 0.00 66.00 65.81 3hoa h PRO 295 Cb 1.19 -0.17 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 3hoa h PRO 295 CO 0.54 0.51 0.47 -0.09 -0.21 0.00 0.00 178.00 179.21 3hoa h ARG 296 N 0.79 0.42 -0.71 1.05 9.65 -1.87 -1.14 114.38 122.58 3hoa h ARG 296 Ca 0.51 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.36 3hoa h ARG 296 Cb 0.73 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.22 3hoa h ARG 296 CO -0.27 0.28 0.00 0.41 2.80 0.00 0.00 179.97 183.19 3hoa n GLY 297 N -1.52 2.34 3.93 2.80 0.00 0.10 -3.46 105.19 109.38 3hoa n GLY 297 Ca 0.12 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.03 6.37 0.49 1.61 1.01 -0.44 -4.68 116.67 120.00 3hoa s ASP 298 Ca 0.48 0.36 -0.23 0.00 0.71 0.00 0.00 52.55 53.87 3hoa s ASP 298 Cb 0.25 -1.99 -0.06 0.00 1.01 0.00 0.00 42.92 42.12 3hoa s ASP 298 CO 0.33 -0.04 1.26 0.00 0.21 0.00 0.00 175.17 176.93 3hoa s ALA 299 N -1.87 2.92 0.13 5.23 0.00 -1.26 -1.62 121.76 125.30 3hoa s ALA 299 Ca 0.38 1.13 0.01 0.00 0.00 0.00 0.00 51.96 53.48 3hoa s ALA 299 Cb -0.11 -3.47 -0.11 0.00 0.00 0.00 0.00 23.12 19.43 3hoa s ALA 299 CO 0.29 -0.99 1.30 -0.24 0.00 0.00 0.00 175.76 176.12 3hoa h VAL 300 N 1.72 1.52 -2.05 0.00 3.04 -1.94 -3.43 116.25 115.11 3hoa h VAL 300 Ca -0.50 -2.83 0.21 0.00 -1.01 0.00 0.00 66.70 62.57 3hoa h VAL 300 Cb 1.27 2.63 -0.11 0.00 -2.01 0.00 0.00 31.29 33.08 3hoa h VAL 300 CO 0.59 0.82 0.59 -0.94 -1.01 0.00 0.00 177.57 177.63 3hoa s SER 301 N -6.96 -0.17 0.23 3.17 1.04 -1.26 -4.75 113.70 105.00 3hoa s SER 301 Ca -0.03 -0.26 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 3hoa s SER 301 Cb 0.09 0.37 0.24 0.00 0.10 0.00 0.00 66.02 66.83 3hoa s SER 301 CO 0.84 -0.68 1.60 -0.07 0.98 0.00 0.00 173.24 175.92 3hoa h LEU 302 N 2.00 0.55 -0.09 2.42 3.38 -1.92 -1.69 115.31 119.96 3hoa h LEU 302 Ca -0.25 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.48 3hoa h LEU 302 Cb 1.22 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 3hoa h LEU 302 CO 0.27 0.90 0.05 1.23 0.09 0.00 0.00 178.44 180.97 3hoa h GLY 303 N 1.09 0.14 1.33 0.83 0.00 -1.82 0.22 103.07 104.85 3hoa h GLY 303 Ca 0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 3hoa h GLY 303 CO 0.08 0.06 0.04 -2.08 0.00 0.00 0.00 176.54 174.64 3hoa h VAL 304 N 0.03 1.24 -0.52 4.60 2.07 -1.89 -0.48 116.25 121.31 3hoa h VAL 304 Ca 0.03 -0.96 -0.07 0.00 0.82 0.00 0.00 66.70 66.53 3hoa h VAL 304 Cb 0.10 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 3hoa h VAL 304 CO -0.00 0.34 0.07 -0.74 0.02 0.00 0.00 177.57 177.25 3hoa h HIS 305 N 0.78 0.94 0.00 1.57 6.17 -0.93 -2.17 115.15 121.51 3hoa h HIS 305 Ca 0.16 -0.14 -0.03 0.00 0.71 0.00 0.00 60.37 61.07 3hoa h HIS 305 Cb 0.41 -0.25 -0.00 0.00 2.52 0.00 0.00 27.41 30.08 3hoa h HIS 305 CO 0.02 0.85 -0.14 1.49 0.71 0.00 0.00 177.93 180.86 3hoa h GLU 306 N 0.76 0.00 0.00 5.26 4.57 -0.22 -2.36 114.58 122.59 3hoa h GLU 306 Ca 0.16 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.25 3hoa h GLU 306 Cb 0.43 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 3hoa h GLU 306 CO 0.01 0.14 -0.39 0.66 -1.18 0.00 0.00 179.01 178.26 3hoa h SER 307 N 0.00 0.00 0.36 1.04 4.64 -0.44 -1.28 113.55 117.88 3hoa h SER 307 Ca -0.00 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.00 3hoa h SER 307 Cb 0.58 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.68 3hoa h SER 307 CO 0.02 0.39 -1.51 1.56 -0.87 0.00 0.00 176.83 176.42 3hoa h GLN 308 N 0.00 0.39 -0.16 4.77 1.08 -1.22 -2.22 115.11 117.76 3hoa h GLN 308 Ca -0.00 -0.67 -0.04 0.00 -1.45 0.00 0.00 58.65 56.49 3hoa h GLN 308 Cb 0.90 0.25 -0.00 0.00 -0.05 0.00 0.00 27.48 28.58 3hoa h GLN 308 CO 0.05 1.30 -0.05 0.66 -0.95 0.00 0.00 178.83 179.84 3hoa h SER 309 N 0.11 0.32 0.01 1.46 4.64 -1.38 -2.83 113.55 115.86 3hoa h SER 309 Ca -0.25 -0.38 -0.08 0.00 -0.47 0.00 0.00 61.79 60.62 3hoa h SER 309 Cb 2.08 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 64.07 3hoa h SER 309 CO 0.22 0.62 -0.20 0.03 -0.87 0.00 0.00 176.83 176.62 3hoa h ARG 310 N 0.01 0.35 -0.05 4.77 2.47 -1.35 -0.45 114.38 120.13 3hoa h ARG 310 Ca 0.04 -0.11 0.02 0.00 -1.26 0.00 0.00 59.98 58.67 3hoa h ARG 310 Cb 0.49 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.75 3hoa h ARG 310 CO 0.02 0.55 -0.07 1.15 0.56 0.00 0.00 179.97 182.17 3hoa h THR 311 N 0.32 0.80 0.02 2.04 2.02 -1.31 0.16 112.91 116.96 3hoa h THR 311 Ca 0.06 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.03 3hoa h THR 311 Cb 0.55 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 3hoa h THR 311 CO 0.04 0.00 -0.96 -0.50 0.37 0.00 0.00 175.52 174.47 3hoa h TRP 312 N -0.10 0.11 0.07 3.16 4.06 -1.36 0.95 115.95 122.85 3hoa h TRP 312 Ca 0.05 -0.07 -0.00 0.00 2.06 0.00 0.00 58.89 60.92 3hoa h TRP 312 Cb 0.17 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.32 3hoa h TRP 312 CO -0.16 0.98 -0.04 1.49 -3.56 0.00 0.00 178.44 177.15 3hoa h GLU 313 N 0.03 -0.10 0.00 0.49 4.81 -0.95 -0.16 114.58 118.70 3hoa h GLU 313 Ca -0.03 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.13 3hoa h GLU 313 Cb 1.66 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.05 3hoa h GLU 313 CO 0.13 0.35 -1.08 0.09 -0.73 0.00 0.00 179.01 177.77 3hoa n ASN 314 N -4.91 1.70 -0.13 1.04 3.02 0.55 -2.96 115.26 113.57 3hoa n ASN 314 Ca -0.08 0.28 0.10 0.00 -0.03 0.00 0.00 54.58 54.85 3hoa n ASN 314 Cb 0.25 -0.64 0.45 0.00 -0.61 0.00 0.00 39.78 39.23 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 -0.77 0.48 0.00 3.41 3.38 -1.30 -2.02 115.31 118.49 3hoa h LEU 315 Ca -0.12 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3hoa h LEU 315 Cb 0.92 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 3hoa h LEU 315 CO -0.07 0.29 -0.98 0.52 0.09 0.00 0.00 178.44 178.29 3hoa n VAL 316 N -4.48 1.48 -0.03 1.22 0.31 0.29 -4.38 118.33 112.74 3hoa n VAL 316 Ca 0.11 0.14 0.22 0.00 -0.01 0.00 0.00 64.34 64.80 3hoa n VAL 316 Cb 0.34 -2.29 0.70 0.00 -0.91 0.00 0.00 33.84 31.68 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 -0.93 0.01 -1.24 2.92 0.00 -0.96 -2.20 103.07 100.66 3hoa h GLY 317 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 3hoa h GLY 317 CO -0.01 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.07 3hoa n ARG 318 N -4.36 2.87 -2.04 4.80 1.74 -0.76 -4.83 116.66 114.08 3hoa n ARG 318 Ca 0.11 -2.21 -0.32 0.00 -0.77 0.00 0.00 57.85 54.66 3hoa n ARG 318 Cb 0.67 -1.39 0.00 0.00 -1.02 0.00 0.00 32.46 30.72 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 -1.26 6.13 0.15 0.55 1.04 -0.83 -4.95 113.70 114.54 3hoa s SER 319 Ca 0.26 1.59 -0.12 0.00 0.48 0.00 0.00 55.95 58.16 3hoa s SER 319 Cb 0.17 -2.50 0.03 0.00 0.10 0.00 0.00 66.02 63.82 3hoa s SER 319 CO 0.13 -0.93 1.65 0.25 0.98 0.00 0.00 173.24 175.31 3hoa h LEU 320 N 0.20 0.82 -0.59 2.42 6.46 -1.93 -2.85 115.31 119.85 3hoa h LEU 320 Ca -0.46 -0.25 0.04 0.00 -0.12 0.00 0.00 57.88 57.09 3hoa h LEU 320 Cb 1.20 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.87 3hoa h LEU 320 CO 0.60 0.86 0.33 1.23 -0.62 0.00 0.00 178.44 180.84 3hoa h GLY 321 N 0.74 0.84 0.71 3.75 0.00 -1.92 -0.55 103.07 106.65 3hoa h GLY 321 Ca 0.16 -0.24 0.04 0.00 0.00 0.00 0.00 47.33 47.30 3hoa h GLY 321 CO 0.01 0.17 0.22 -2.75 0.00 0.00 0.00 176.54 174.19 3hoa h PHE 322 N 0.64 0.40 0.00 5.60 3.57 -1.73 -2.56 116.94 122.87 3hoa h PHE 322 Ca 0.25 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 3hoa h PHE 322 Cb 0.11 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 3hoa h PHE 322 CO -0.08 0.19 -0.12 -1.49 -2.23 0.00 0.00 178.31 174.59 3hoa h TRP 323 N 0.44 0.00 -0.35 0.41 4.06 -1.20 -1.71 115.95 117.60 3hoa h TRP 323 Ca 0.21 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.11 3hoa h TRP 323 Cb 0.14 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.28 3hoa h TRP 323 CO -0.11 0.12 -0.00 0.93 -3.56 0.00 0.00 178.44 175.81 3hoa h GLU 324 N 0.00 0.55 -0.02 0.49 5.08 -0.71 0.53 114.58 120.50 3hoa h GLU 324 Ca -0.00 -0.12 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 3hoa h GLU 324 Cb 0.94 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.12 3hoa h GLU 324 CO 0.02 0.58 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.33 3hoa h ARG 325 N 0.53 0.16 0.00 2.33 9.65 -1.21 -3.39 114.38 122.45 3hoa h ARG 325 Ca 0.11 -0.14 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 3hoa h ARG 325 Cb 0.34 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.96 3hoa h ARG 325 CO 0.01 0.83 -0.94 1.19 2.80 0.00 0.00 179.97 183.87 3hoa n PHE 326 N -4.57 0.00 -0.24 2.20 3.01 -0.68 -4.55 117.46 112.64 3hoa n PHE 326 Ca -0.09 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.30 3hoa n PHE 326 Cb 0.44 -0.01 0.04 0.00 -0.01 0.00 0.00 39.48 39.95 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 0.98 -0.48 1.38 3.57 -0.13 -1.12 116.94 121.13 3hoa h PHE 327 Ca 0.00 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.41 3hoa h PHE 327 Cb 0.47 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 3hoa h PHE 327 CO 0.00 0.75 0.18 -1.00 -2.23 0.00 0.00 178.31 176.01 3hoa h PRO 328 N 0.92 0.70 -0.29 6.41 0.13 -1.80 -0.34 132.00 137.73 3hoa h PRO 328 Ca 0.22 -0.10 -0.03 0.00 -0.87 0.00 0.00 66.00 65.21 3hoa h PRO 328 Cb 0.17 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.17 3hoa h PRO 328 CO -0.02 0.59 0.05 -0.09 -0.23 0.00 0.00 178.00 178.30 3hoa h ARG 329 N 0.69 0.48 0.00 0.86 9.65 -1.71 -2.00 114.38 122.34 3hoa h ARG 329 Ca 0.17 -0.13 -0.02 0.00 -1.10 0.00 0.00 59.98 58.90 3hoa h ARG 329 Cb 0.16 -0.06 -0.00 0.00 -1.39 0.00 0.00 29.97 28.68 3hoa h ARG 329 CO -0.01 0.58 -0.08 0.00 2.80 0.00 0.00 179.97 183.26 3hoa h ALA 330 N 0.88 1.75 -0.07 2.80 0.00 -0.68 0.70 119.26 124.64 3hoa h ALA 330 Ca 0.09 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 3hoa h ALA 330 Cb 0.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3hoa h ALA 330 CO 0.01 0.10 -0.48 -0.09 0.00 0.00 0.00 179.25 178.78 3hoa h ARG 331 N 0.00 0.17 0.03 0.00 9.65 -0.46 0.25 114.38 124.02 3hoa h ARG 331 Ca -0.00 -0.09 -0.22 0.00 -1.10 0.00 0.00 59.98 58.57 3hoa h ARG 331 Cb 0.16 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.72 3hoa h ARG 331 CO 0.01 0.62 -1.02 0.93 2.80 0.00 0.00 179.97 183.31 3hoa h GLU 332 N 0.14 0.09 0.20 0.20 5.08 -0.24 -3.35 114.58 116.70 3hoa h GLU 332 Ca 0.01 -0.14 -0.33 0.00 -1.00 0.00 0.00 59.36 57.90 3hoa h GLU 332 Cb 0.91 0.05 0.02 0.00 0.50 0.00 0.00 28.75 30.22 3hoa h GLU 332 CO 0.07 1.03 -1.59 0.28 -1.00 0.00 0.00 179.01 177.79 3hoa h VAL 333 N 0.03 1.08 -3.57 3.13 2.07 -0.90 -3.45 116.25 114.64 3hoa h VAL 333 Ca -0.04 -2.56 -0.67 0.00 0.82 0.00 0.00 66.70 64.24 3hoa h VAL 333 Cb 1.75 2.87 -0.27 0.00 -1.52 0.00 0.00 31.29 34.12 3hoa h VAL 333 CO 0.15 0.82 -0.66 -0.36 0.02 0.00 0.00 177.57 177.54 3hoa s PHE 334 N -2.57 3.11 0.45 1.57 0.40 0.87 -4.98 117.98 116.84 3hoa s PHE 334 Ca -0.14 -1.06 0.11 0.00 -0.60 0.00 0.00 56.93 55.24 3hoa s PHE 334 Cb 0.05 -2.20 1.03 0.00 0.51 0.00 0.00 43.02 42.41 3hoa s PHE 334 CO 0.88 -0.59 2.07 0.00 0.70 0.00 0.00 175.22 178.28 3hoa h ALA 335 N 8.18 1.87 0.00 5.36 0.00 -1.86 -1.98 119.26 130.84 3hoa h ALA 335 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3hoa h ALA 335 Cb 1.13 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3hoa h ALA 335 CO 0.60 0.09 0.00 0.43 0.00 0.00 0.00 179.25 180.37 3hoa n SER 336 N -4.49 0.26 -1.50 0.00 7.64 -1.26 -1.30 113.62 112.98 3hoa n SER 336 Ca 0.03 0.60 0.10 0.00 1.01 0.00 0.00 58.87 60.61 3hoa n SER 336 Cb 0.14 -0.64 0.34 0.00 -1.01 0.00 0.00 64.21 63.03 3hoa n SER 336 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3hoa n LEU 337 N -1.83 4.41 -0.01 -3.43 4.77 -0.74 -4.60 117.00 115.57 3hoa n LEU 337 Ca 0.01 -2.22 -0.09 0.00 -0.03 0.00 0.00 56.01 53.67 3hoa n LEU 337 Cb 0.07 -0.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.59 3hoa n LEU 337 CO 0.08 0.85 0.78 1.23 -1.33 0.00 0.00 177.39 179.00 3hoa h GLY 338 N 4.31 -0.01 -3.96 -0.72 0.00 -1.35 -2.79 103.07 98.56 3hoa h GLY 338 Ca 0.00 0.15 -0.66 0.00 0.00 0.00 0.00 47.33 46.82 3hoa h GLY 338 CO 0.15 -0.13 0.65 2.09 0.00 0.00 0.00 176.54 179.31 3hoa n ASP 339 N -5.27 7.26 -4.23 0.19 5.75 -1.26 -4.94 116.55 114.06 3hoa n ASP 339 Ca -0.03 -3.78 -0.31 0.00 -0.01 0.00 0.00 54.79 50.66 3hoa n ASP 339 Cb 0.19 -0.89 -0.17 0.00 -1.03 0.00 0.00 41.12 39.22 3hoa n ASP 339 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3hoa s VAL 340 N -4.77 1.95 0.44 2.12 1.01 -1.05 -5.13 120.40 114.97 3hoa s VAL 340 Ca 0.63 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 3hoa s VAL 340 Cb 0.50 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 3hoa s VAL 340 CO -0.00 0.54 0.69 -0.94 0.00 0.00 0.00 175.10 175.38 3hoa s SER 341 N 0.07 6.06 0.21 3.32 1.04 -1.26 -4.96 113.70 118.18 3hoa s SER 341 Ca -0.10 0.54 -0.10 0.00 0.48 0.00 0.00 55.95 56.77 3hoa s SER 341 Cb -0.15 -1.88 0.16 0.00 0.10 0.00 0.00 66.02 64.25 3hoa s SER 341 CO 0.05 -0.58 1.87 0.25 0.98 0.00 0.00 173.24 175.81 3hoa h LEU 342 N 0.40 0.81 -0.37 2.42 5.85 -1.98 -1.84 115.31 120.60 3hoa h LEU 342 Ca -0.47 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.25 3hoa h LEU 342 Cb 1.23 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.04 3hoa h LEU 342 CO 0.60 0.58 0.19 -0.08 -0.34 0.00 0.00 178.44 179.39 3hoa h GLU 343 N 0.96 0.38 -0.41 1.25 4.81 -1.99 -0.19 114.58 119.39 3hoa h GLU 343 Ca 0.27 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 3hoa h GLU 343 Cb -0.08 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 3hoa h GLU 343 CO -0.07 0.25 0.12 -0.44 -0.73 0.00 0.00 179.01 178.14 3hoa h ASP 344 N 0.40 0.61 -0.11 1.04 3.32 -1.89 -2.07 116.42 117.71 3hoa h ASP 344 Ca 0.15 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3hoa h ASP 344 Cb 0.05 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 3hoa h ASP 344 CO -0.10 0.66 0.06 0.15 -1.72 0.00 0.00 179.24 178.29 3hoa h PHE 345 N 0.52 0.17 -0.13 4.55 3.04 -1.07 -0.12 116.94 123.91 3hoa h PHE 345 Ca 0.13 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.07 3hoa h PHE 345 Cb 0.27 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.72 3hoa h PHE 345 CO 0.01 0.22 0.04 1.25 -2.02 0.00 0.00 178.31 177.81 3hoa h HIS 346 N 0.06 0.17 -0.03 0.41 2.76 -0.99 -1.36 115.15 116.17 3hoa h HIS 346 Ca 0.04 -0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.05 3hoa h HIS 346 Cb 0.12 -0.05 0.01 0.00 1.55 0.00 0.00 27.41 29.03 3hoa h HIS 346 CO -0.03 0.15 -0.59 0.35 -1.30 0.00 0.00 177.93 176.50 3hoa h PHE 347 N 0.18 0.65 -0.35 5.26 -0.00 -1.05 -3.23 116.94 118.39 3hoa h PHE 347 Ca 0.05 -0.34 -0.00 0.00 -0.00 0.00 0.00 57.97 57.68 3hoa h PHE 347 Cb 0.06 -0.08 -0.02 0.00 -0.00 0.00 0.00 35.95 35.91 3hoa h PHE 347 CO 0.00 1.14 0.21 0.00 -0.00 0.00 0.00 178.31 179.66 3hoa h ALA 348 N 0.37 0.45 0.00 2.41 0.00 -0.51 -2.04 119.26 119.94 3hoa h ALA 348 Ca -0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hoa h ALA 348 Cb 1.28 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3hoa h ALA 348 CO 0.12 -0.04 0.00 1.33 0.00 0.00 0.00 179.25 180.66 3hoa n VAL 349 N -4.79 0.37 -1.04 0.00 0.24 -0.56 -2.09 118.33 110.46 3hoa n VAL 349 Ca -0.01 0.09 0.10 0.00 -2.04 0.00 0.00 64.34 62.49 3hoa n VAL 349 Cb 0.06 -0.85 0.14 0.00 -1.47 0.00 0.00 33.84 31.73 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 -1.18 2.39 -4.76 -1.34 3.02 -0.80 -5.04 115.26 107.55 3hoa n ASN 350 Ca 0.09 -3.06 -0.41 0.00 -0.03 0.00 0.00 54.58 51.16 3hoa n ASN 350 Cb 0.10 -0.42 -0.01 0.00 -0.61 0.00 0.00 39.78 38.83 3hoa n ASN 350 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hoa s ALA 351 N -2.83 3.66 -0.06 5.41 0.00 -0.89 -4.99 121.76 122.06 3hoa s ALA 351 Ca 0.32 1.56 0.03 0.00 0.00 0.00 0.00 51.96 53.86 3hoa s ALA 351 Cb 0.28 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 3hoa s ALA 351 CO 0.03 -1.00 -0.13 0.08 0.00 0.00 0.00 175.76 174.75 3hoa s VAL 352 N -0.52 3.21 -0.29 0.00 1.01 -1.26 -4.76 120.40 117.79 3hoa s VAL 352 Ca 0.58 -0.67 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 3hoa s VAL 352 Cb -0.47 -2.27 0.14 0.00 0.00 0.00 0.00 36.38 33.78 3hoa s VAL 352 CO 0.54 0.59 0.96 -0.70 0.00 0.00 0.00 175.10 176.49 3hoa s GLU 353 N -0.72 0.39 0.13 2.72 2.12 -1.26 -5.05 118.70 117.03 3hoa s GLU 353 Ca 0.11 0.71 -0.31 0.00 0.36 0.00 0.00 54.97 55.84 3hoa s GLU 353 Cb -0.11 0.16 -0.09 0.00 0.26 0.00 0.00 34.13 34.35 3hoa s GLU 353 CO 0.01 -0.09 1.54 -1.25 -0.54 0.00 0.00 175.26 174.93 3hoa s PRO 354 N 1.57 4.24 0.32 4.30 0.04 -1.26 -4.72 135.00 139.49 3hoa s PRO 354 Ca -0.08 2.28 0.06 0.00 0.04 0.00 0.00 61.00 63.30 3hoa s PRO 354 Cb -0.04 -3.28 -0.03 0.00 0.04 0.00 0.00 34.50 31.19 3hoa s PRO 354 CO -0.16 -0.59 0.25 -1.54 0.04 0.00 0.00 177.00 175.00 3hoa s SER 355 N 1.41 1.56 -0.05 6.66 1.04 -1.26 -4.97 113.70 118.09 3hoa s SER 355 Ca 0.69 -1.71 0.09 0.00 0.48 0.00 0.00 55.95 55.51 3hoa s SER 355 Cb -0.41 0.53 -0.24 0.00 0.10 0.00 0.00 66.02 66.00 3hoa s SER 355 CO 0.31 -1.02 0.64 -0.07 0.98 0.00 0.00 173.24 174.08 3hoa h LEU 356 N 2.18 0.07 -8.81 2.42 3.38 -1.93 -3.47 115.31 109.15 3hoa h LEU 356 Ca -0.27 -0.16 -0.64 0.00 0.09 0.00 0.00 57.88 56.91 3hoa h LEU 356 Cb 1.24 -0.02 -0.14 0.00 0.09 0.00 0.00 40.66 41.82 3hoa h LEU 356 CO 0.40 1.14 -0.02 -0.63 0.09 0.00 0.00 178.44 179.42 3hoa s ILE 357 N -2.60 5.02 0.12 1.22 -1.09 -1.26 -4.92 121.20 117.69 3hoa s ILE 357 Ca -0.07 0.50 -0.27 0.00 -2.23 0.00 0.00 60.65 58.58 3hoa s ILE 357 Cb 0.08 -3.94 -0.05 0.00 -1.58 0.00 0.00 42.46 36.97 3hoa s ILE 357 CO 0.82 -0.15 1.62 -0.09 -1.23 0.00 0.00 174.94 175.90 3hoa h ARG 358 N 8.36 -0.44 -0.11 2.79 2.43 -1.96 -1.93 114.38 123.52 3hoa h ARG 358 Ca -0.28 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 58.95 3hoa h ARG 358 Cb 1.13 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.77 3hoa h ARG 358 CO 0.76 -0.29 0.23 -0.39 -1.51 0.00 0.00 179.97 178.77 3hoa h VAL 359 N -0.46 0.21 -0.01 0.20 -1.51 -1.98 -0.26 116.25 112.44 3hoa h VAL 359 Ca 0.06 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.53 3hoa h VAL 359 Cb 0.55 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 3hoa h VAL 359 CO -0.27 0.00 -0.52 -0.62 -1.23 0.00 0.00 177.57 174.93 3hoa n GLU 360 N -3.34 1.20 -2.08 5.19 1.02 -0.90 -5.00 120.64 116.73 3hoa n GLU 360 Ca 0.00 -0.79 -0.38 0.00 -0.02 0.00 0.00 57.16 55.97 3hoa n GLU 360 Cb 0.32 -1.43 0.01 0.00 -0.02 0.00 0.00 31.44 30.32 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 -2.42 2.98 0.89 0.62 0.00 -0.11 -5.02 121.76 118.70 3hoa s ALA 361 Ca 0.15 1.11 -0.12 0.00 0.00 0.00 0.00 51.96 53.11 3hoa s ALA 361 Cb 0.16 -3.46 0.12 0.00 0.00 0.00 0.00 23.12 19.95 3hoa s ALA 361 CO 0.58 -0.90 1.12 0.16 0.00 0.00 0.00 175.76 176.71 3hoa s ASP 362 N -1.12 3.69 0.28 0.00 -4.77 -1.26 -4.69 116.67 108.80 3hoa s ASP 362 Ca 0.65 1.13 0.01 0.00 -3.30 0.00 0.00 52.55 51.04 3hoa s ASP 362 Cb -0.34 -1.78 0.66 0.00 -1.09 0.00 0.00 42.92 40.37 3hoa s ASP 362 CO 0.41 -2.46 1.68 -0.33 0.70 0.00 0.00 175.17 175.17 3hoa h GLU 363 N -1.43 0.30 -0.05 2.11 5.08 -1.94 0.78 114.58 119.44 3hoa h GLU 363 Ca -0.50 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.80 3hoa h GLU 363 Cb 1.31 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.49 3hoa h GLU 363 CO 0.60 0.20 -0.14 0.28 -1.00 0.00 0.00 179.01 178.95 3hoa h VAL 364 N 0.31 1.45 0.00 3.13 2.07 -1.95 -3.34 116.25 117.93 3hoa h VAL 364 Ca 0.52 -1.54 0.00 0.00 0.82 0.00 0.00 66.70 66.50 3hoa h VAL 364 Cb 0.99 2.35 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 3hoa h VAL 364 CO -0.56 0.42 -0.56 0.71 0.02 0.00 0.00 177.57 177.60 3hoa h THR 365 N -0.37 0.00 -0.72 2.57 1.35 -1.88 -3.40 112.91 110.46 3hoa h THR 365 Ca -0.00 -0.95 0.11 0.00 -0.55 0.00 0.00 66.41 65.02 3hoa h THR 365 Cb 0.76 1.66 -0.12 0.00 -1.73 0.00 0.00 68.15 68.72 3hoa h THR 365 CO 0.03 0.00 -0.39 0.22 -0.25 0.00 0.00 175.52 175.13 3hoa h TYR 366 N 0.00 -1.13 0.00 4.73 3.20 -0.96 -0.05 116.97 122.76 3hoa h TYR 366 Ca 0.00 0.09 0.00 0.00 3.14 0.00 0.00 58.73 61.96 3hoa h TYR 366 Cb 0.97 0.60 0.00 0.00 1.54 0.00 0.00 36.73 39.84 3hoa h TYR 366 CO 0.00 -0.40 0.00 0.09 -1.64 0.00 0.00 178.16 176.21 3hoa n ASN 367 N -5.43 0.38 0.12 -2.11 3.02 -1.26 -1.13 115.26 108.85 3hoa n ASN 367 Ca 0.05 0.62 -0.03 0.00 -0.03 0.00 0.00 54.58 55.19 3hoa n ASN 367 Cb 0.36 -0.69 0.14 0.00 -0.61 0.00 0.00 39.78 38.97 3hoa n ASN 367 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3hoa h LEU 368 N 0.00 0.09 -0.63 3.41 3.38 -1.27 -1.53 115.31 118.75 3hoa h LEU 368 Ca 0.00 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3hoa h LEU 368 Cb 0.20 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3hoa h LEU 368 CO 0.00 0.71 0.15 0.45 0.09 0.00 0.00 178.44 179.83 3hoa h HIS 369 N 0.05 1.06 -0.45 1.13 3.86 -1.12 -2.10 115.15 117.58 3hoa h HIS 369 Ca -0.01 -0.13 -0.11 0.00 -1.16 0.00 0.00 60.37 58.96 3hoa h HIS 369 Cb 1.15 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 29.31 3hoa h HIS 369 CO 0.01 0.89 -0.14 0.82 0.86 0.00 0.00 177.93 180.36 3hoa h ILE 370 N 0.92 1.27 -0.91 2.45 1.08 -1.48 -2.81 117.51 118.04 3hoa h ILE 370 Ca 0.20 -1.27 0.03 0.00 -0.39 0.00 0.00 64.86 63.42 3hoa h ILE 370 Cb 0.36 1.15 -0.05 0.00 -3.07 0.00 0.00 36.82 35.21 3hoa h ILE 370 CO 0.00 0.44 0.59 0.25 -0.69 0.00 0.00 178.15 178.74 3hoa h LEU 371 N 0.73 0.99 0.32 1.44 7.12 -1.06 0.16 115.31 125.02 3hoa h LEU 371 Ca 0.11 -0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.10 3hoa h LEU 371 Cb 0.69 -0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 40.58 3hoa h LEU 371 CO 0.05 0.69 -0.24 0.58 -0.13 0.00 0.00 178.44 179.38 3hoa h VAL 372 N 1.16 0.48 -0.84 1.05 2.07 -1.26 -0.35 116.25 118.56 3hoa h VAL 372 Ca 0.35 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.92 3hoa h VAL 372 Cb -0.03 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.17 3hoa h VAL 372 CO -0.11 0.00 0.53 0.03 0.02 0.00 0.00 177.57 178.04 3hoa h ARG 373 N -0.57 0.97 -0.24 1.57 3.08 -1.18 -1.46 114.38 116.55 3hoa h ARG 373 Ca -0.02 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 3hoa h ARG 373 Cb 0.50 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 3hoa h ARG 373 CO -0.00 0.64 0.11 1.25 -1.07 0.00 0.00 179.97 180.89 3hoa h LEU 374 N 1.00 0.32 -0.91 3.04 5.85 -0.36 -0.54 115.31 123.71 3hoa h LEU 374 Ca 0.35 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 3hoa h LEU 374 Cb 0.08 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 3hoa h LEU 374 CO -0.14 0.37 0.35 -0.33 -0.34 0.00 0.00 178.44 178.35 3hoa h GLU 375 N 0.24 1.14 -0.54 1.25 5.08 -0.76 -0.38 114.58 120.62 3hoa h GLU 375 Ca 0.08 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 3hoa h GLU 375 Cb 0.14 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3hoa h GLU 375 CO -0.01 0.89 -0.02 -0.07 -1.00 0.00 0.00 179.01 178.81 3hoa h LEU 376 N 1.12 0.94 -0.28 1.33 3.38 -1.09 -1.85 115.31 118.87 3hoa h LEU 376 Ca 0.27 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3hoa h LEU 376 Cb 0.15 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3hoa h LEU 376 CO -0.03 1.03 0.04 -0.33 0.09 0.00 0.00 178.44 179.24 3hoa h GLU 377 N 0.83 0.47 -0.34 1.13 5.08 -0.71 -1.19 114.58 119.85 3hoa h GLU 377 Ca 0.15 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 3hoa h GLU 377 Cb 0.56 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 3hoa h GLU 377 CO 0.03 0.58 0.15 -0.07 -1.00 0.00 0.00 179.01 178.70 3hoa h LEU 378 N 0.28 0.20 -1.26 1.33 3.38 -1.00 -1.08 115.31 117.17 3hoa h LEU 378 Ca 0.08 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.09 3hoa h LEU 378 Cb 0.35 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 3hoa h LEU 378 CO 0.01 0.15 0.50 0.00 0.09 0.00 0.00 178.44 179.19 3hoa h ALA 379 N 1.19 1.48 0.56 1.53 0.00 -1.19 -0.18 119.26 122.65 3hoa h ALA 379 Ca 0.15 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 3hoa h ALA 379 Cb 0.09 -0.30 0.01 0.00 0.00 0.00 0.00 17.79 17.58 3hoa h ALA 379 CO -0.12 0.48 -0.27 -0.07 0.00 0.00 0.00 179.25 179.26 3hoa h LEU 380 N 1.01 -0.64 -0.14 0.00 3.38 -0.38 0.33 115.31 118.87 3hoa h LEU 380 Ca 0.28 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.21 3hoa h LEU 380 Cb -0.09 0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3hoa h LEU 380 CO -0.07 -0.31 0.00 0.49 0.09 0.00 0.00 178.44 178.64 3hoa n PHE 381 N -5.33 0.17 0.94 1.13 3.01 -0.49 -1.54 117.46 115.35 3hoa n PHE 381 Ca -0.12 0.07 0.12 0.00 1.01 0.00 0.00 57.45 58.53 3hoa n PHE 381 Cb 0.34 -0.61 0.25 0.00 -0.01 0.00 0.00 39.48 39.45 3hoa n PHE 381 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3hoa n ARG 382 N -1.65 2.17 -1.45 -1.08 1.74 -0.10 -4.83 116.66 111.46 3hoa n ARG 382 Ca 0.03 -1.73 -0.08 0.00 -0.77 0.00 0.00 57.85 55.30 3hoa n ARG 382 Cb 0.19 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 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 1.33 0.79 0.07 -0.13 0.00 -0.59 -4.91 105.19 101.75 3hoa n GLY 383 Ca 0.17 -0.63 0.06 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.54 0.64 -4.40 1.61 1.02 0.11 -4.95 120.64 112.13 3hoa n GLU 384 Ca -0.09 -0.01 -0.20 0.00 -0.02 0.00 0.00 57.16 56.84 3hoa n GLU 384 Cb 0.34 -1.66 -0.14 0.00 -0.02 0.00 0.00 31.44 29.97 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 -5.12 2.14 0.10 -4.62 2.96 -0.64 -4.96 118.68 108.54 3hoa s LEU 385 Ca -0.05 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.46 3hoa s LEU 385 Cb 0.11 -0.62 -0.04 0.00 0.50 0.00 0.00 46.19 46.14 3hoa s LEU 385 CO 0.85 0.06 0.20 -0.94 -1.32 0.00 0.00 176.35 175.20 3hoa s SER 386 N -0.98 6.15 0.41 3.68 1.04 -1.26 -4.42 113.70 118.32 3hoa s SER 386 Ca 0.02 0.17 0.07 0.00 0.48 0.00 0.00 55.95 56.69 3hoa s SER 386 Cb -0.07 -1.83 0.86 0.00 0.10 0.00 0.00 66.02 65.08 3hoa s SER 386 CO 0.01 0.13 2.04 -0.65 0.98 0.00 0.00 173.24 175.75 3hoa h PRO 387 N 2.81 0.55 0.00 4.02 0.11 -2.01 -0.87 132.00 136.62 3hoa h PRO 387 Ca -0.46 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 3hoa h PRO 387 Cb 1.17 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3hoa h PRO 387 CO 0.71 0.37 -0.05 0.93 -0.21 0.00 0.00 178.00 179.75 3hoa h GLU 388 N 0.57 0.00 -0.69 1.05 3.07 -1.98 -2.07 114.58 114.53 3hoa h GLU 388 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3hoa h GLU 388 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3hoa h GLU 388 CO -0.04 0.05 0.00 -0.25 -1.40 0.00 0.00 179.01 177.37 3hoa n ASP 389 N -4.16 3.74 -0.02 1.42 8.00 -0.34 -4.56 116.55 120.63 3hoa n ASP 389 Ca -0.03 -2.02 -0.09 0.00 0.71 0.00 0.00 54.79 53.36 3hoa n ASP 389 Cb 0.13 -0.47 -0.03 0.00 -0.02 0.00 0.00 41.12 40.73 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 4.03 -0.21 -0.56 0.64 3.38 -1.25 -2.36 115.31 118.98 3hoa h LEU 390 Ca 0.00 0.06 0.11 0.00 0.09 0.00 0.00 57.88 58.14 3hoa h LEU 390 Cb 0.95 0.12 -0.10 0.00 0.09 0.00 0.00 40.66 41.72 3hoa h LEU 390 CO 0.01 -0.09 -0.04 -0.65 0.09 0.00 0.00 178.44 177.76 3hoa h PRO 391 N -0.04 0.08 -0.22 1.13 0.11 -1.82 0.43 132.00 131.67 3hoa h PRO 391 Ca 0.08 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.17 3hoa h PRO 391 Cb 0.16 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.25 3hoa h PRO 391 CO -0.18 0.05 0.06 0.93 -0.21 0.00 0.00 178.00 178.66 3hoa h GLU 392 N 0.08 0.34 -0.58 1.05 3.07 -1.86 -1.21 114.58 115.47 3hoa h GLU 392 Ca 0.28 -0.07 -0.02 0.00 -0.50 0.00 0.00 59.36 59.05 3hoa h GLU 392 Cb 0.45 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.28 3hoa h GLU 392 CO -0.51 0.44 0.30 0.00 -1.40 0.00 0.00 179.01 177.84 3hoa h ALA 393 N 0.89 0.74 -0.17 3.43 0.00 -0.87 -1.93 119.26 121.34 3hoa h ALA 393 Ca 0.07 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3hoa h ALA 393 Cb 0.24 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3hoa h ALA 393 CO -0.00 0.28 0.02 2.35 0.00 0.00 0.00 179.25 181.90 3hoa h TRP 394 N 0.78 0.03 -0.57 0.00 2.91 0.02 0.14 115.95 119.26 3hoa h TRP 394 Ca 0.20 0.01 -0.03 0.00 1.13 0.00 0.00 58.89 60.20 3hoa h TRP 394 Cb 0.08 0.01 -0.03 0.00 -0.51 0.00 0.00 29.16 28.71 3hoa h TRP 394 CO -0.01 0.00 0.24 0.00 -1.03 0.00 0.00 178.44 177.64 3hoa h ALA 395 N 1.13 0.74 -0.37 2.65 0.00 -1.05 -1.10 119.26 121.26 3hoa h ALA 395 Ca 0.08 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 3hoa h ALA 395 Cb 0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3hoa h ALA 395 CO -0.12 0.34 -0.18 0.93 0.00 0.00 0.00 179.25 180.22 3hoa h GLU 396 N 0.78 0.68 -0.38 0.00 5.08 -1.16 -1.46 114.58 118.12 3hoa h GLU 396 Ca 0.19 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 3hoa h GLU 396 Cb 0.18 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3hoa h GLU 396 CO -0.02 0.82 -0.08 0.87 -1.00 0.00 0.00 179.01 179.60 3hoa h LYS 397 N 0.61 0.73 -0.31 2.33 1.79 -0.71 -1.09 116.57 119.92 3hoa h LYS 397 Ca 0.10 -0.27 -0.03 0.00 -2.18 0.00 0.00 60.65 58.26 3hoa h LYS 397 Cb 0.64 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.23 3hoa h LYS 397 CO 0.05 0.87 0.09 1.88 -1.08 0.00 0.00 179.45 181.26 3hoa h TYR 398 N 0.54 0.50 -0.62 -1.35 -1.99 -1.06 0.18 116.97 113.17 3hoa h TYR 398 Ca 0.10 -0.05 0.03 0.00 2.00 0.00 0.00 58.73 60.80 3hoa h TYR 398 Cb 0.59 -0.14 -0.04 0.00 2.00 0.00 0.00 36.73 39.14 3hoa h TYR 398 CO 0.05 0.52 0.38 -0.09 -0.00 0.00 0.00 178.16 179.02 3hoa h ARG 399 N 0.34 0.73 -0.29 4.88 2.43 -1.15 0.44 114.38 121.77 3hoa h ARG 399 Ca 0.10 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 3hoa h ARG 399 Cb 0.26 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3hoa h ARG 399 CO -0.00 0.48 -0.07 -0.44 -1.51 0.00 0.00 179.97 178.43 3hoa h ASP 400 N 0.75 0.56 0.16 -3.80 3.32 -0.94 -1.70 116.42 114.77 3hoa h ASP 400 Ca 0.25 -0.36 -0.36 0.00 0.02 0.00 0.00 57.03 56.58 3hoa h ASP 400 Cb 0.01 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.41 3hoa h ASP 400 CO -0.10 0.80 -1.83 0.45 -1.72 0.00 0.00 179.24 176.83 3hoa h HIS 401 N 0.32 0.63 0.00 4.55 3.86 -0.46 -3.40 115.15 120.65 3hoa h HIS 401 Ca 0.07 -0.46 0.00 0.00 -1.16 0.00 0.00 60.37 58.82 3hoa h HIS 401 Cb 0.55 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.99 3hoa h HIS 401 CO 0.05 1.72 -1.25 1.28 0.86 0.00 0.00 177.93 180.59 3hoa n LEU 402 N -3.57 0.43 0.00 2.43 4.77 0.15 -4.98 117.00 116.23 3hoa n LEU 402 Ca -0.27 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 3hoa n LEU 402 Cb 1.06 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.15 3hoa n LEU 402 CO 0.48 0.11 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 3hoa n GLY 403 N 1.45 0.72 2.93 -0.72 0.00 -0.64 -4.78 105.19 104.16 3hoa n GLY 403 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.73 0.24 0.07 1.61 -7.23 -1.24 -4.93 120.40 106.19 3hoa s VAL 404 Ca 0.00 -0.24 0.07 0.00 -1.81 0.00 0.00 61.98 60.00 3hoa s VAL 404 Cb 0.00 -0.23 -0.03 0.00 0.56 0.00 0.00 36.38 36.68 3hoa s VAL 404 CO 0.00 -0.00 -0.20 0.00 -0.31 0.00 0.00 175.10 174.59 3hoa s ALA 405 N -0.25 1.70 0.81 1.32 0.00 -1.26 -2.94 121.76 121.13 3hoa s ALA 405 Ca -0.01 -1.13 -0.13 0.00 0.00 0.00 0.00 51.96 50.70 3hoa s ALA 405 Cb -0.02 -0.27 0.08 0.00 0.00 0.00 0.00 23.12 22.91 3hoa s ALA 405 CO -0.00 0.35 1.18 -2.14 0.00 0.00 0.00 175.76 175.15 3hoa s PRO 406 N -1.57 1.70 0.00 0.00 0.02 -1.26 -4.95 135.00 128.93 3hoa s PRO 406 Ca 0.06 1.65 0.05 0.00 0.02 0.00 0.00 61.00 62.78 3hoa s PRO 406 Cb -0.09 -1.79 0.07 0.00 0.02 0.00 0.00 34.50 32.70 3hoa s PRO 406 CO 0.03 -2.15 0.79 0.36 -0.33 0.00 0.00 177.00 175.70 3hoa n LYS 407 N -3.36 0.68 -3.83 5.54 0.00 -1.26 -5.03 118.16 110.89 3hoa n LYS 407 Ca 0.13 -1.08 -0.06 0.00 -0.00 0.00 0.00 58.31 57.29 3hoa n LYS 407 Cb 0.51 -1.10 0.02 0.00 -0.00 0.00 0.00 35.03 34.46 3hoa n LYS 407 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 3hoa s ASP 408 N -0.59 -0.02 0.01 -5.58 3.84 -1.26 -5.06 116.67 108.02 3hoa s ASP 408 Ca 0.07 -0.92 -0.19 0.00 -0.00 0.00 0.00 52.55 51.51 3hoa s ASP 408 Cb 0.04 0.71 -0.27 0.00 -1.38 0.00 0.00 42.92 42.03 3hoa s ASP 408 CO 0.06 -1.40 1.06 1.88 -0.00 0.00 0.00 175.17 176.77 3hoa h TYR 409 N 2.00 0.72 -0.93 2.11 0.99 -1.96 -3.14 116.97 116.76 3hoa h TYR 409 Ca -0.30 -0.43 0.13 0.00 2.00 0.00 0.00 58.73 60.13 3hoa h TYR 409 Cb 1.24 -0.06 -0.14 0.00 1.00 0.00 0.00 36.73 38.76 3hoa h TYR 409 CO 1.28 1.28 -0.45 -0.22 -0.00 0.00 0.00 178.16 180.05 3hoa h LYS 410 N -0.05 -0.03 -0.65 4.88 3.64 -1.88 0.20 116.57 122.67 3hoa h LYS 410 Ca -0.12 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3hoa h LYS 410 Cb 1.56 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.39 3hoa h LYS 410 CO 0.16 -0.02 0.00 -0.25 -2.27 0.00 0.00 179.45 177.07 3hoa n ASP 411 N -5.40 4.67 0.00 4.20 10.43 -1.26 -3.05 116.55 126.14 3hoa n ASP 411 Ca 0.07 -2.48 0.00 0.00 2.57 0.00 0.00 54.79 54.95 3hoa n ASP 411 Cb 0.35 -0.58 0.00 0.00 1.84 0.00 0.00 41.12 42.73 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 1.04 1.45 0.27 0.44 0.00 0.60 -4.71 105.19 104.29 3hoa n GLY 412 Ca 0.25 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.45 3hoa n GLY 412 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3hoa h VAL 413 N 0.00 0.00 -0.64 1.61 3.04 -1.80 -2.24 116.25 116.23 3hoa h VAL 413 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3hoa h VAL 413 Cb 0.00 0.78 0.00 0.00 -2.01 0.00 0.00 31.29 30.06 3hoa h VAL 413 CO 0.00 0.00 0.00 0.23 -1.01 0.00 0.00 177.57 176.79 3hoa n MET 414 N -2.76 2.62 -0.15 4.17 2.81 -0.70 -4.56 117.12 118.56 3hoa n MET 414 Ca -0.02 -2.51 -0.06 0.00 -1.81 0.00 0.00 57.70 53.30 3hoa n MET 414 Cb 0.08 -1.55 0.11 0.00 -0.71 0.00 0.00 33.22 31.16 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 4.27 0.90 -6.02 0.03 3.07 -1.32 -3.44 115.11 112.60 3hoa h GLN 415 Ca 0.00 -0.26 -0.63 0.00 0.09 0.00 0.00 58.65 57.85 3hoa h GLN 415 Cb 0.97 -0.10 -0.06 0.00 0.08 0.00 0.00 27.48 28.37 3hoa h GLN 415 CO 0.00 0.89 -0.55 -0.51 0.09 0.00 0.00 178.83 178.76 3hoa s ASP 416 N -6.62 5.98 0.28 0.06 1.01 -1.26 -5.01 116.67 111.10 3hoa s ASP 416 Ca -0.10 0.16 0.23 0.00 0.71 0.00 0.00 52.55 53.54 3hoa s ASP 416 Cb 0.14 -1.75 0.17 0.00 1.01 0.00 0.00 42.92 42.50 3hoa s ASP 416 CO 0.83 0.19 1.28 1.62 0.21 0.00 0.00 175.17 179.30 3hoa h VAL 417 N 2.41 0.00 -0.48 -1.27 3.04 -1.96 -3.41 116.25 114.57 3hoa h VAL 417 Ca -0.46 -0.93 0.04 0.00 -1.01 0.00 0.00 66.70 64.34 3hoa h VAL 417 Cb 1.16 1.63 -0.06 0.00 -2.01 0.00 0.00 31.29 32.01 3hoa h VAL 417 CO 0.70 0.00 -0.29 1.41 -1.01 0.00 0.00 177.57 178.39 3hoa n HIS 418 N -2.75 -0.21 -0.19 3.17 8.25 -1.26 -0.60 115.22 121.62 3hoa n HIS 418 Ca 0.02 0.61 0.09 0.00 -0.26 0.00 0.00 57.72 58.17 3hoa n HIS 418 Cb 0.53 -0.50 0.39 0.00 1.12 0.00 0.00 29.99 31.53 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 0.72 -0.30 4.41 6.55 -1.80 0.27 115.95 125.80 3hoa h TRP 419 Ca 0.08 0.02 -0.04 0.00 0.95 0.00 0.00 58.89 59.90 3hoa h TRP 419 Cb 0.20 -0.23 -0.02 0.00 -0.86 0.00 0.00 29.16 28.25 3hoa h TRP 419 CO -0.79 0.34 0.02 0.00 -1.05 0.00 0.00 178.44 176.96 3hoa h ALA 420 N 1.62 1.49 -0.01 1.49 0.00 -1.14 -1.65 119.26 121.05 3hoa h ALA 420 Ca 0.35 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3hoa h ALA 420 Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hoa h ALA 420 CO -0.13 0.37 0.00 0.41 0.00 0.00 0.00 179.25 179.90 3hoa n GLY 421 N -1.02 -0.56 1.96 0.00 0.00 0.86 -4.08 105.19 102.34 3hoa n GLY 421 Ca 0.01 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 1.06 0.45 3.51 -0.02 0.00 -0.62 -4.87 105.19 104.70 3hoa n GLY 422 Ca 0.21 -0.59 -0.43 0.00 0.00 0.00 0.00 46.02 45.21 3hoa n GLY 422 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hoa s LEU 423 N 0.00 4.53 -0.09 0.99 1.43 -0.71 -4.96 118.68 119.88 3hoa s LEU 423 Ca 0.00 -2.68 -0.01 0.00 -1.03 0.00 0.00 54.13 50.41 3hoa s LEU 423 Cb 0.00 -2.48 -0.03 0.00 0.03 0.00 0.00 46.19 43.71 3hoa s LEU 423 CO 0.00 -0.95 -0.04 -0.36 0.23 0.00 0.00 176.35 175.23 3hoa s PHE 424 N 2.77 3.03 0.00 0.29 0.08 -1.26 -4.21 117.98 118.68 3hoa s PHE 424 Ca 0.47 0.05 0.00 0.00 0.12 0.00 0.00 56.93 57.57 3hoa s PHE 424 Cb -0.00 -1.77 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 3hoa s PHE 424 CO 0.02 0.34 0.00 0.41 -0.10 0.00 0.00 175.22 175.89 3hoa n GLY 425 N 2.36 0.45 0.13 4.36 0.00 -1.26 -4.64 105.19 106.59 3hoa n GLY 425 Ca -0.18 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 44.99 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 -2.97 0.09 -0.32 1.61 9.36 -1.26 -4.39 117.16 119.28 3hoa n TYR 426 Ca 0.00 0.04 0.21 0.00 3.32 0.00 0.00 57.90 61.47 3hoa n TYR 426 Cb 0.00 -0.94 0.41 0.00 -0.63 0.00 0.00 39.34 38.18 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 -1.00 0.50 -0.32 2.98 0.05 -1.92 -0.63 116.94 116.60 3hoa h PHE 427 Ca -0.58 0.05 0.09 0.00 3.82 0.00 0.00 57.97 61.35 3hoa h PHE 427 Cb 1.50 -0.06 -0.01 0.00 2.00 0.00 0.00 35.95 39.38 3hoa h PHE 427 CO -0.12 -0.33 0.28 -1.35 -0.18 0.00 0.00 178.31 176.61 3hoa h PRO 428 N 0.12 0.00 -0.06 1.51 0.11 -1.88 -1.62 132.00 130.17 3hoa h PRO 428 Ca 0.68 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.79 3hoa h PRO 428 Cb 1.57 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.68 3hoa h PRO 428 CO -0.74 0.00 0.03 1.79 -0.21 0.00 0.00 178.00 178.87 3hoa h THR 429 N 0.00 1.02 -0.55 -1.15 1.35 -1.41 -1.62 112.91 110.56 3hoa h THR 429 Ca 0.15 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.95 3hoa h THR 429 Cb 0.72 0.94 -0.03 0.00 -1.73 0.00 0.00 68.15 68.05 3hoa h THR 429 CO -0.00 0.03 0.35 1.88 -0.25 0.00 0.00 175.52 177.53 3hoa h TYR 430 N 0.09 0.70 -0.40 4.73 -1.99 -1.47 0.05 116.97 118.68 3hoa h TYR 430 Ca 0.02 0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.67 3hoa h TYR 430 Cb 0.01 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 38.49 3hoa h TYR 430 CO 0.00 0.45 -0.12 1.15 -0.00 0.00 0.00 178.16 179.65 3hoa h THR 431 N 0.74 1.28 -0.86 -2.88 2.02 -1.47 -2.47 112.91 109.27 3hoa h THR 431 Ca 0.20 -1.22 0.07 0.00 0.77 0.00 0.00 66.41 66.23 3hoa h THR 431 Cb -0.06 1.24 -0.06 0.00 -1.74 0.00 0.00 68.15 67.53 3hoa h THR 431 CO -0.04 0.41 0.56 -0.07 0.37 0.00 0.00 175.52 176.75 3hoa h LEU 432 N 0.59 0.84 -0.65 2.58 3.38 -0.98 -0.67 115.31 120.40 3hoa h LEU 432 Ca 0.10 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.08 3hoa h LEU 432 Cb 0.65 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 3hoa h LEU 432 CO 0.04 0.54 0.43 1.23 0.09 0.00 0.00 178.44 180.78 3hoa h GLY 433 N 0.96 0.92 1.14 0.83 0.00 -0.55 0.10 103.07 106.48 3hoa h GLY 433 Ca 0.37 -0.35 -0.13 0.00 0.00 0.00 0.00 47.33 47.23 3hoa h GLY 433 CO -0.14 0.34 -0.19 3.43 0.00 0.00 0.00 176.54 179.99 3hoa h ASN 434 N 0.89 1.00 -0.24 0.19 2.35 -0.85 -0.15 115.58 118.77 3hoa h ASN 434 Ca 0.24 -0.36 -0.07 0.00 -0.55 0.00 0.00 56.30 55.55 3hoa h ASN 434 Cb -0.10 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 37.99 3hoa h ASN 434 CO -0.05 1.15 -0.14 -0.07 -1.65 0.00 0.00 177.43 176.67 3hoa h LEU 435 N 0.85 0.54 -0.73 1.61 3.38 -0.84 -2.82 115.31 117.30 3hoa h LEU 435 Ca 0.12 -0.42 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 3hoa h LEU 435 Cb 0.76 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3hoa h LEU 435 CO 0.06 0.85 -0.06 1.88 0.09 0.00 0.00 178.44 181.26 3hoa h TYR 436 N 0.24 0.99 -0.57 1.13 0.05 -0.78 -2.13 116.97 115.90 3hoa h TYR 436 Ca 0.05 -0.18 0.08 0.00 0.05 0.00 0.00 58.73 58.74 3hoa h TYR 436 Cb 0.65 -0.26 -0.07 0.00 1.01 0.00 0.00 36.73 38.07 3hoa h TYR 436 CO 0.07 0.92 0.21 0.00 -1.05 0.00 0.00 178.16 178.31 3hoa h ALA 437 N 1.10 0.72 -0.31 3.88 0.00 -0.94 0.18 119.26 123.89 3hoa h ALA 437 Ca 0.14 0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.98 3hoa h ALA 437 Cb 0.58 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3hoa h ALA 437 CO 0.03 -0.19 -0.40 0.00 0.00 0.00 0.00 179.25 178.69 3hoa h ALA 438 N 1.39 0.72 -0.10 0.00 0.00 -1.30 -2.05 119.26 117.91 3hoa h ALA 438 Ca 0.28 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3hoa h ALA 438 Cb 0.33 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3hoa h ALA 438 CO -0.28 0.66 0.01 0.37 0.00 0.00 0.00 179.25 180.01 3hoa h GLN 439 N 0.60 0.18 -0.52 0.00 4.15 -0.70 -0.94 115.11 117.88 3hoa h GLN 439 Ca 0.05 -0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.45 3hoa h GLN 439 Cb 0.95 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.58 3hoa h GLN 439 CO 0.09 0.40 0.30 0.74 -1.93 0.00 0.00 178.83 178.42 3hoa h PHE 440 N -0.07 0.55 -0.67 3.99 0.05 -1.00 -2.39 116.94 117.40 3hoa h PHE 440 Ca 0.03 0.02 0.01 0.00 3.82 0.00 0.00 57.97 61.85 3hoa h PHE 440 Cb 0.31 -0.17 -0.03 0.00 2.00 0.00 0.00 35.95 38.05 3hoa h PHE 440 CO 0.02 0.30 0.45 0.35 -0.18 0.00 0.00 178.31 179.25 3hoa h PHE 441 N 0.59 0.85 -0.23 -0.55 3.57 -1.21 0.25 116.94 120.20 3hoa h PHE 441 Ca 0.22 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.76 3hoa h PHE 441 Cb 0.07 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.49 3hoa h PHE 441 CO -0.08 0.53 0.08 0.37 -2.23 0.00 0.00 178.31 176.98 3hoa h GLN 442 N 0.91 0.18 -0.74 1.11 4.15 -0.85 -0.87 115.11 119.00 3hoa h GLN 442 Ca 0.25 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.61 3hoa h GLN 442 Cb -0.10 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 3hoa h GLN 442 CO -0.05 0.12 0.26 -0.22 -1.93 0.00 0.00 178.83 177.00 3hoa h LYS 443 N 0.18 1.12 -0.67 1.69 1.63 -1.04 -2.28 116.57 117.20 3hoa h LYS 443 Ca 0.10 -0.22 -0.02 0.00 -0.85 0.00 0.00 60.65 59.66 3hoa h LYS 443 Cb 0.07 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.49 3hoa h LYS 443 CO -0.10 0.93 0.34 0.00 -3.45 0.00 0.00 179.45 177.17 3hoa h ALA 444 N 1.20 0.87 0.00 5.00 0.00 -0.37 -2.24 119.26 123.71 3hoa h ALA 444 Ca 0.24 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3hoa h ALA 444 Cb 0.26 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hoa h ALA 444 CO -0.01 0.42 -0.47 0.93 0.00 0.00 0.00 179.25 180.11 3hoa h GLU 445 N 0.93 0.00 -0.04 0.00 5.08 -1.00 0.20 114.58 119.74 3hoa h GLU 445 Ca 0.23 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.48 3hoa h GLU 445 Cb 0.10 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3hoa h GLU 445 CO -0.03 0.47 -0.49 0.00 -1.00 0.00 0.00 179.01 177.96 3hoa h ALA 446 N 1.53 1.10 0.06 3.43 0.00 -0.95 0.73 119.26 125.15 3hoa h ALA 446 Ca -0.00 -0.45 -0.35 0.00 0.00 0.00 0.00 54.91 54.10 3hoa h ALA 446 Cb 0.84 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.50 3hoa h ALA 446 CO 0.06 0.63 -2.06 0.39 0.00 0.00 0.00 179.25 178.27 3hoa n GLU 447 N -3.96 0.70 0.00 0.00 1.02 -0.89 -4.43 120.64 113.08 3hoa n GLU 447 Ca -0.02 0.22 0.10 0.00 -0.02 0.00 0.00 57.16 57.45 3hoa n GLU 447 Cb 0.52 -1.67 -0.11 0.00 -0.02 0.00 0.00 31.44 30.16 3hoa n GLU 447 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3hoa n LEU 448 N -3.25 0.71 0.00 -4.62 4.77 0.68 -5.10 117.00 110.19 3hoa n LEU 448 Ca -0.31 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 3hoa n LEU 448 Cb 1.05 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 42.12 3hoa n LEU 448 CO 0.40 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3hoa n GLY 449 N 1.43 -0.31 3.54 -0.72 0.00 0.25 -4.91 105.19 104.47 3hoa n GLY 449 Ca 0.02 -1.71 -0.53 0.00 0.00 0.00 0.00 46.02 43.79 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 -0.21 0.63 0.01 1.61 -0.04 -1.25 -4.52 135.00 131.24 3hoa n PRO 450 Ca 0.00 0.23 -0.04 0.00 -0.04 0.00 0.00 63.50 63.64 3hoa n PRO 450 Cb 0.00 -1.71 -0.11 0.00 -0.04 0.00 0.00 33.50 31.64 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 3.32 0.00 -0.62 1.53 3.38 -1.91 -3.40 115.31 117.61 3hoa h LEU 451 Ca -0.46 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.60 3hoa h LEU 451 Cb 1.38 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 42.02 3hoa h LEU 451 CO 0.69 0.79 -0.45 -0.33 0.09 0.00 0.00 178.44 179.23 3hoa h GLU 452 N 0.00 -0.20 -0.34 1.13 3.07 -1.98 0.88 114.58 117.13 3hoa h GLU 452 Ca -0.20 0.01 0.09 0.00 -0.50 0.00 0.00 59.36 58.76 3hoa h GLU 452 Cb 1.78 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.72 3hoa h GLU 452 CO 0.07 -0.13 0.25 -1.00 -1.40 0.00 0.00 179.01 176.79 3hoa h PRO 453 N -0.21 0.04 -0.00 2.33 0.13 -1.96 0.12 132.00 132.45 3hoa h PRO 453 Ca 0.18 -0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.10 3hoa h PRO 453 Cb 0.56 -0.01 0.02 0.00 0.13 0.00 0.00 31.00 31.69 3hoa h PRO 453 CO -0.72 0.03 -0.81 0.00 -0.23 0.00 0.00 178.00 176.27 3hoa h ARG 454 N 0.04 0.55 -0.94 0.86 3.08 -1.14 -3.02 114.38 113.81 3hoa h ARG 454 Ca 0.16 -0.59 -0.00 0.00 0.07 0.00 0.00 59.98 59.62 3hoa h ARG 454 Cb 0.59 0.17 -0.05 0.00 0.08 0.00 0.00 29.97 30.76 3hoa h ARG 454 CO -0.01 1.21 0.58 0.74 -1.07 0.00 0.00 179.97 181.42 3hoa h PHE 455 N 0.14 1.23 0.00 3.04 0.05 -0.04 0.23 116.94 121.58 3hoa h PHE 455 Ca -0.10 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.69 3hoa h PHE 455 Cb 1.49 -0.41 -0.00 0.00 2.00 0.00 0.00 35.95 39.03 3hoa h PHE 455 CO 0.13 0.81 -0.00 0.00 -0.18 0.00 0.00 178.31 179.06 3hoa h ALA 456 N 1.34 1.20 -0.28 2.45 0.00 -0.73 0.13 119.26 123.38 3hoa h ALA 456 Ca 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3hoa h ALA 456 Cb -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3hoa h ALA 456 CO -0.06 0.01 0.00 0.54 0.00 0.00 0.00 179.25 179.73 3hoa n ARG 457 N -3.38 2.22 -1.60 0.00 1.74 -0.09 -4.07 116.66 111.47 3hoa n ARG 457 Ca -0.03 -2.05 -0.04 0.00 -0.77 0.00 0.00 57.85 54.96 3hoa n ARG 457 Cb 0.09 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 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 1.23 0.45 3.34 -0.13 0.00 0.47 -4.98 105.19 105.57 3hoa n GLY 458 Ca 0.16 -0.79 -0.45 0.00 0.00 0.00 0.00 46.02 44.94 3hoa n GLY 458 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hoa s GLU 459 N -3.29 4.13 0.00 1.61 2.02 0.61 -4.78 118.70 119.00 3hoa s GLU 459 Ca 0.00 -3.15 0.22 0.00 0.02 0.00 0.00 54.97 52.06 3hoa s GLU 459 Cb 0.00 -4.54 -0.25 0.00 0.10 0.00 0.00 34.13 29.44 3hoa s GLU 459 CO 0.00 -1.25 0.65 1.19 0.02 0.00 0.00 175.26 175.88 3hoa n PHE 460 N 2.82 0.12 -0.33 1.61 3.01 -1.26 -4.22 117.46 119.20 3hoa n PHE 460 Ca 0.23 0.03 -0.02 0.00 1.01 0.00 0.00 57.45 58.71 3hoa n PHE 460 Cb 0.40 -0.46 0.14 0.00 -0.01 0.00 0.00 39.48 39.55 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 1.24 -0.43 -1.08 5.75 -1.86 -0.93 115.11 117.80 3hoa h GLN 461 Ca 0.00 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 3hoa h GLN 461 Cb 0.89 -0.27 -0.02 0.00 1.07 0.00 0.00 27.48 29.15 3hoa h GLN 461 CO 0.00 0.83 0.28 -1.35 -2.65 0.00 0.00 178.83 175.94 3hoa h PRO 462 N 1.27 0.57 -0.49 -2.39 0.11 -2.00 0.16 132.00 129.23 3hoa h PRO 462 Ca 0.34 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 66.37 3hoa h PRO 462 Cb -0.12 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 30.84 3hoa h PRO 462 CO -0.07 0.39 0.15 0.35 -0.21 0.00 0.00 178.00 178.61 3hoa h PHE 463 N 0.58 0.79 0.10 0.65 3.57 -1.77 -2.22 116.94 118.64 3hoa h PHE 463 Ca 0.16 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 3hoa h PHE 463 Cb -0.05 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.46 3hoa h PHE 463 CO -0.04 0.69 -0.05 1.25 -2.23 0.00 0.00 178.31 177.93 3hoa h LEU 464 N 0.66 -0.11 -1.02 0.59 5.85 -0.76 -1.93 115.31 118.60 3hoa h LEU 464 Ca 0.16 -0.02 0.16 0.00 0.84 0.00 0.00 57.88 59.02 3hoa h LEU 464 Cb 0.27 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 41.23 3hoa h LEU 464 CO -0.00 -0.05 0.62 0.44 -0.34 0.00 0.00 178.44 179.11 3hoa h ASP 465 N -0.16 0.84 -0.06 1.25 3.32 -0.63 -0.35 116.42 120.62 3hoa h ASP 465 Ca -0.01 0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.12 3hoa h ASP 465 Cb 0.13 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3hoa h ASP 465 CO 0.02 0.36 0.01 -0.25 -1.72 0.00 0.00 179.24 177.66 3hoa h TRP 466 N 0.85 0.02 -0.00 4.55 7.01 -0.82 -0.76 115.95 126.79 3hoa h TRP 466 Ca 0.55 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.51 3hoa h TRP 466 Cb 0.75 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.80 3hoa h TRP 466 CO -0.00 0.01 -0.20 1.79 -2.79 0.00 0.00 178.44 177.24 3hoa h THR 467 N 0.04 1.15 0.39 2.65 1.35 -0.40 -1.12 112.91 116.96 3hoa h THR 467 Ca 0.03 -0.70 -0.02 0.00 -0.55 0.00 0.00 66.41 65.17 3hoa h THR 467 Cb 0.02 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 3hoa h THR 467 CO -0.04 0.20 -0.19 0.03 -0.25 0.00 0.00 175.52 175.28 3hoa h ARG 468 N 0.01 -0.51 -0.42 4.72 -0.00 -0.39 0.44 114.38 118.23 3hoa h ARG 468 Ca -0.00 0.03 -0.07 0.00 -0.50 0.00 0.00 59.98 59.44 3hoa h ARG 468 Cb 0.36 0.11 -0.02 0.00 0.00 0.00 0.00 29.97 30.43 3hoa h ARG 468 CO 0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 179.97 179.76 3hoa h ALA 469 N -0.43 1.14 0.00 0.04 0.00 -1.02 0.43 119.26 119.42 3hoa h ALA 469 Ca -0.05 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.37 3hoa h ALA 469 Cb 0.54 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 3hoa h ALA 469 CO 0.09 0.55 -1.52 0.00 0.00 0.00 0.00 179.25 178.37 3hoa h ARG 470 N 0.66 0.00 0.00 0.00 3.08 -1.28 -3.43 114.38 113.42 3hoa h ARG 470 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 3hoa h ARG 470 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.52 3hoa h ARG 470 CO 0.02 0.40 0.00 -0.89 -1.07 0.00 0.00 179.97 178.43 3hoa n ILE 471 N -2.98 0.72 -0.02 2.04 5.41 -0.01 -4.77 119.36 119.74 3hoa n ILE 471 Ca -0.12 0.24 -0.09 0.00 1.00 0.00 0.00 62.75 63.77 3hoa n ILE 471 Cb 0.94 -1.28 -0.02 0.00 -0.71 0.00 0.00 39.64 38.56 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 0.00 -0.64 -0.13 1.39 3.86 -0.97 -2.19 115.15 116.47 3hoa h HIS 472 Ca 0.00 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.28 3hoa h HIS 472 Cb 0.00 0.31 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 3hoa h HIS 472 CO 0.00 -0.32 0.19 0.00 0.86 0.00 0.00 177.93 178.66 3hoa h ALA 473 N 0.72 1.64 0.00 2.45 0.00 -0.23 -2.22 119.26 121.62 3hoa h ALA 473 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hoa h ALA 473 Cb 0.46 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3hoa h ALA 473 CO -0.35 -0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.04 3hoa n GLU 474 N -3.60 0.24 0.00 0.00 -0.58 -0.82 -4.59 120.64 111.29 3hoa n GLU 474 Ca 0.00 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 57.01 3hoa n GLU 474 Cb 0.30 -1.82 0.00 0.00 -0.57 0.00 0.00 31.44 29.35 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 0.96 2.95 1.65 0.62 0.00 -0.84 -1.17 105.19 109.36 3hoa n GLY 475 Ca 0.05 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 2.49 3.94 -0.05 1.61 7.64 -0.64 -3.93 113.62 124.68 3hoa n SER 476 Ca 0.00 -3.38 0.05 0.00 1.01 0.00 0.00 58.87 56.54 3hoa n SER 476 Cb 0.00 -0.70 0.40 0.00 -1.01 0.00 0.00 64.21 62.90 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 1.85 0.60 -6.37 1.43 2.43 -1.39 -3.43 114.38 109.51 3hoa h ARG 477 Ca 0.27 -0.04 -0.61 0.00 -0.81 0.00 0.00 59.98 58.79 3hoa h ARG 477 Cb 2.11 -0.13 -0.24 0.00 -0.42 0.00 0.00 29.97 31.29 3hoa h ARG 477 CO 0.63 0.40 -0.85 -0.06 -1.51 0.00 0.00 179.97 178.58 3hoa s PHE 478 N -5.55 1.97 0.61 2.20 0.08 -1.26 -4.98 117.98 111.05 3hoa s PHE 478 Ca -0.09 -0.40 -0.19 0.00 0.12 0.00 0.00 56.93 56.38 3hoa s PHE 478 Cb 0.18 -1.12 -0.03 0.00 -0.57 0.00 0.00 43.02 41.48 3hoa s PHE 478 CO 0.74 0.19 1.29 1.03 -0.10 0.00 0.00 175.22 178.37 3hoa s ARG 479 N -1.61 2.82 0.27 0.44 1.81 -1.26 -4.68 118.95 116.73 3hoa s ARG 479 Ca 0.09 2.05 -0.00 0.00 -1.72 0.00 0.00 55.73 56.14 3hoa s ARG 479 Cb -0.10 -1.98 0.57 0.00 -0.45 0.00 0.00 34.95 33.00 3hoa s ARG 479 CO 0.03 -1.39 1.73 -1.00 -0.68 0.00 0.00 175.30 174.00 3hoa h PRO 480 N 0.88 0.49 -0.83 3.54 0.13 -1.87 -0.01 132.00 134.35 3hoa h PRO 480 Ca -0.51 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.56 3hoa h PRO 480 Cb 1.32 -0.11 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 3hoa h PRO 480 CO 0.55 0.33 0.38 -0.09 -0.23 0.00 0.00 178.00 178.93 3hoa h ARG 481 N 0.51 1.20 -0.21 0.86 2.43 -1.90 -1.56 114.38 115.72 3hoa h ARG 481 Ca 0.48 -0.19 -0.13 0.00 -0.81 0.00 0.00 59.98 59.33 3hoa h ARG 481 Cb 0.77 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.10 3hoa h ARG 481 CO -0.42 0.94 -0.44 0.28 -1.51 0.00 0.00 179.97 178.82 3hoa h VAL 482 N 1.18 1.31 -0.29 0.20 2.07 -1.54 -2.55 116.25 116.62 3hoa h VAL 482 Ca 0.28 -1.62 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 3hoa h VAL 482 Cb 0.15 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3hoa h VAL 482 CO -0.03 0.50 0.07 0.25 0.02 0.00 0.00 177.57 178.39 3hoa h LEU 483 N 0.41 0.44 -0.64 2.57 5.85 -0.69 -0.32 115.31 122.94 3hoa h LEU 483 Ca 0.03 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.55 3hoa h LEU 483 Cb 0.93 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 3hoa h LEU 483 CO 0.08 0.56 0.40 0.58 -0.34 0.00 0.00 178.44 179.72 3hoa h VAL 484 N 0.31 1.10 -0.23 1.05 2.07 -1.23 -1.56 116.25 117.76 3hoa h VAL 484 Ca 0.09 -0.27 -0.12 0.00 0.82 0.00 0.00 66.70 67.22 3hoa h VAL 484 Cb 0.29 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 3hoa h VAL 484 CO 0.00 0.15 -0.37 -0.33 0.02 0.00 0.00 177.57 177.04 3hoa h GLU 485 N 0.80 0.50 -0.09 1.57 5.08 -1.23 -0.63 114.58 120.58 3hoa h GLU 485 Ca 0.25 -0.24 -0.15 0.00 -1.00 0.00 0.00 59.36 58.23 3hoa h GLU 485 Cb -0.00 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 3hoa h GLU 485 CO -0.09 0.80 -0.61 0.00 -1.00 0.00 0.00 179.01 178.11 3hoa h ARG 486 N 0.42 0.30 0.06 2.33 3.08 -0.69 0.18 114.38 120.06 3hoa h ARG 486 Ca 0.04 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 59.80 3hoa h ARG 486 Cb 0.84 0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.92 3hoa h ARG 486 CO 0.07 0.82 -0.39 0.28 -1.07 0.00 0.00 179.97 179.67 3hoa h VAL 487 N 0.23 1.63 0.00 2.04 2.07 -1.21 -3.39 116.25 117.62 3hoa h VAL 487 Ca -0.01 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.10 3hoa h VAL 487 Cb 1.12 3.26 0.00 0.00 -1.52 0.00 0.00 31.29 34.15 3hoa h VAL 487 CO 0.10 0.64 -1.27 0.35 0.02 0.00 0.00 177.57 177.41 3hoa n THR 488 N -4.40 0.25 -0.84 2.57 -2.24 -0.25 -4.98 114.28 104.39 3hoa n THR 488 Ca -0.13 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 3hoa n THR 488 Cb 0.63 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 1.29 0.82 2.98 3.38 0.00 0.62 -4.97 105.19 109.31 3hoa n GLY 489 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3hoa n GLY 489 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3hoa s GLU 490 N -0.16 0.31 0.77 1.61 -1.05 -1.24 -5.00 118.70 113.93 3hoa s GLU 490 Ca 0.00 -0.54 -0.12 0.00 -0.15 0.00 0.00 54.97 54.17 3hoa s GLU 490 Cb 0.00 0.00 0.06 0.00 -0.44 0.00 0.00 34.13 33.75 3hoa s GLU 490 CO 0.00 -0.02 1.11 0.00 0.95 0.00 0.00 175.26 177.30 3hoa s ALA 491 N -1.19 2.15 0.28 -0.84 0.00 -1.26 -3.78 121.76 117.12 3hoa s ALA 491 Ca -0.12 0.43 -0.29 0.00 0.00 0.00 0.00 51.96 51.98 3hoa s ALA 491 Cb -0.08 -3.33 -0.14 0.00 0.00 0.00 0.00 23.12 19.57 3hoa s ALA 491 CO -0.01 -1.85 1.09 -0.35 0.00 0.00 0.00 175.76 174.64 3hoa n PRO 492 N -3.36 1.45 -3.88 0.00 -0.04 -1.26 -4.97 135.00 122.93 3hoa n PRO 492 Ca 0.10 0.51 -0.09 0.00 -0.04 0.00 0.00 63.50 63.98 3hoa n PRO 492 Cb 0.52 -1.94 -0.07 0.00 -0.04 0.00 0.00 33.50 31.98 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 -0.40 0.07 0.02 3.54 0.15 -1.26 -5.05 113.70 110.77 3hoa s SER 493 Ca 0.61 -0.70 0.23 0.00 0.70 0.00 0.00 55.95 56.78 3hoa s SER 493 Cb -0.70 0.38 -0.00 0.00 -1.71 0.00 0.00 66.02 63.98 3hoa s SER 493 CO 0.58 -0.79 1.00 0.00 1.20 0.00 0.00 173.24 175.23 3hoa n ALA 494 N -0.12 3.74 0.15 5.45 0.00 -1.26 -4.53 120.51 123.93 3hoa n ALA 494 Ca -0.13 -0.46 -0.13 0.00 0.00 0.00 0.00 53.44 52.72 3hoa n ALA 494 Cb 0.63 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 19.10 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 -0.48 -0.81 0.00 3.08 -1.96 -0.77 114.38 113.44 3hoa h ARG 495 Ca 0.00 0.03 0.15 0.00 0.07 0.00 0.00 59.98 60.23 3hoa h ARG 495 Cb 0.66 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.76 3hoa h ARG 495 CO 0.00 -0.32 0.53 -1.00 -1.07 0.00 0.00 179.97 178.11 3hoa h PRO 496 N -0.50 0.50 -0.07 0.04 0.13 -1.92 0.42 132.00 130.59 3hoa h PRO 496 Ca 0.01 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 3hoa h PRO 496 Cb 0.49 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 3hoa h PRO 496 CO -0.09 0.33 -0.01 0.35 -0.23 0.00 0.00 178.00 178.35 3hoa h PHE 497 N 0.52 0.15 -0.75 1.56 3.57 -1.70 -1.11 116.94 119.19 3hoa h PHE 497 Ca 0.40 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 3hoa h PHE 497 Cb 0.82 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.48 3hoa h PHE 497 CO -0.00 0.44 0.44 -0.07 -2.23 0.00 0.00 178.31 176.89 3hoa h LEU 498 N -0.18 0.90 -1.06 0.59 3.38 -0.08 -0.26 115.31 118.60 3hoa h LEU 498 Ca 0.02 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.93 3hoa h LEU 498 Cb 0.39 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 3hoa h LEU 498 CO 0.01 0.70 0.63 0.00 0.09 0.00 0.00 178.44 179.87 3hoa h ALA 499 N 1.23 1.32 -0.21 1.53 0.00 -0.08 0.12 119.26 123.18 3hoa h ALA 499 Ca 0.27 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3hoa h ALA 499 Cb -0.03 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.37 3hoa h ALA 499 CO -0.05 0.63 -0.01 -0.92 0.00 0.00 0.00 179.25 178.91 3hoa h TYR 500 N 1.30 0.40 -0.13 0.00 3.20 -0.58 -2.40 116.97 118.75 3hoa h TYR 500 Ca 0.35 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 3hoa h TYR 500 Cb -0.15 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 3hoa h TYR 500 CO -0.00 0.57 0.06 -0.07 -1.64 0.00 0.00 178.16 177.08 3hoa h LEU 501 N 0.12 0.18 -0.16 2.82 3.38 -0.55 -2.68 115.31 118.42 3hoa h LEU 501 Ca 0.06 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 57.93 3hoa h LEU 501 Cb 0.41 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 3hoa h LEU 501 CO 0.01 0.28 -0.17 -0.33 0.09 0.00 0.00 178.44 178.32 3hoa h GLU 502 N 0.07 -0.19 0.61 1.13 5.08 -0.77 -0.48 114.58 120.04 3hoa h GLU 502 Ca 0.05 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3hoa h GLU 502 Cb 0.15 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3hoa h GLU 502 CO -0.00 -0.13 -0.41 -0.22 -1.00 0.00 0.00 179.01 177.25 3hoa h LYS 503 N -0.20 -0.93 -0.57 2.33 3.64 -1.42 0.13 116.57 119.55 3hoa h LYS 503 Ca 0.11 0.06 0.07 0.00 -1.27 0.00 0.00 60.65 59.62 3hoa h LYS 503 Cb 0.35 0.21 -0.06 0.00 -0.41 0.00 0.00 32.23 32.33 3hoa h LYS 503 CO -0.27 -0.62 0.25 -0.22 -2.27 0.00 0.00 179.45 176.31 3hoa h LYS 504 N -0.97 0.45 0.00 1.90 3.64 -1.40 -2.58 116.57 117.62 3hoa h LYS 504 Ca -0.07 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.18 3hoa h LYS 504 Cb 0.80 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 3hoa h LYS 504 CO 0.05 0.30 -0.69 1.88 -2.27 0.00 0.00 179.45 178.72 3hoa h TYR 505 N 0.47 0.00 -0.46 1.91 -1.99 -1.06 -2.63 116.97 113.21 3hoa h TYR 505 Ca 0.27 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.95 3hoa h TYR 505 Cb 0.26 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.97 3hoa h TYR 505 CO -0.13 0.45 0.10 0.00 -0.00 0.00 0.00 178.16 178.57 3hoa h ALA 506 N 1.55 1.31 0.00 3.88 0.00 -0.55 0.29 119.26 125.75 3hoa h ALA 506 Ca -0.04 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 3hoa h ALA 506 Cb 1.38 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 3hoa h ALA 506 CO 0.05 0.49 -0.59 0.00 0.00 0.00 0.00 179.25 179.20 3hoa h ALA 507 N 1.43 0.71 0.06 0.00 0.00 -1.42 -3.34 119.26 116.71 3hoa h ALA 507 Ca 0.15 -0.53 -0.21 0.00 0.00 0.00 0.00 54.91 54.32 3hoa h ALA 507 Cb 0.28 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hoa h ALA 507 CO -0.00 0.73 -1.06 -0.07 0.00 0.00 0.00 179.25 178.85 3hoa h LEU 508 N 0.00 0.21 -1.88 0.00 3.38 -0.98 -3.52 115.31 112.52 3hoa h LEU 508 Ca -0.01 -0.80 0.00 0.00 0.09 0.00 0.00 57.88 57.17 3hoa h LEU 508 Cb 1.31 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3hoa h LEU 508 CO 0.08 1.45 0.00 -1.22 0.09 0.00 0.00 178.44 178.84