#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lho s HIS 2 N 0.00 3.77 -0.57 1.61 4.02 -1.26 -1.32 115.29 121.55 3lho s HIS 2 Ca 0.00 1.36 0.20 0.00 1.02 0.00 0.00 55.06 57.64 3lho s HIS 2 Cb 0.00 -2.57 -0.26 0.00 -1.02 0.00 0.00 32.58 28.72 3lho s HIS 2 CO 0.00 0.50 0.69 0.25 1.02 0.00 0.00 174.74 177.20 3lho n THR 3 N 1.35 0.00 -4.64 1.30 -2.24 -1.26 -4.84 114.28 103.95 3lho n THR 3 Ca -0.07 -0.21 -0.32 0.00 -2.27 0.00 0.00 64.05 61.18 3lho n THR 3 Cb 0.50 0.59 -0.17 0.00 -2.10 0.00 0.00 70.33 69.16 3lho n THR 3 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3lho s ASP 4 N -3.54 3.02 0.25 3.42 -1.08 -1.26 -4.95 116.67 112.54 3lho s ASP 4 Ca 0.01 -0.58 -0.05 0.00 -0.52 0.00 0.00 52.55 51.41 3lho s ASP 4 Cb 0.14 -1.40 0.28 0.00 -1.46 0.00 0.00 42.92 40.48 3lho s ASP 4 CO 0.85 0.07 1.87 1.62 0.52 0.00 0.00 175.17 180.10 3lho h VAL 5 N 5.84 1.25 -0.48 1.11 3.04 -1.92 -1.93 116.25 123.16 3lho h VAL 5 Ca -0.32 -0.62 -0.06 0.00 -1.01 0.00 0.00 66.70 64.68 3lho h VAL 5 Cb 1.19 0.11 -0.02 0.00 -2.01 0.00 0.00 31.29 30.56 3lho h VAL 5 CO 0.55 0.28 0.05 0.78 -1.01 0.00 0.00 177.57 178.22 3lho h ASN 6 N 1.18 0.79 -0.81 3.17 2.35 -2.00 -2.40 115.58 117.86 3lho h ASN 6 Ca 0.30 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3lho h ASN 6 Cb 0.04 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.16 3lho h ASN 6 CO -0.05 0.87 0.49 0.00 -1.65 0.00 0.00 177.43 177.10 3lho h ALA 7 N 0.95 1.33 0.12 -0.83 0.00 -1.89 -0.72 119.26 118.22 3lho h ALA 7 Ca 0.14 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3lho h ALA 7 Cb 0.43 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3lho h ALA 7 CO 0.01 0.58 -0.06 1.25 0.00 0.00 0.00 179.25 181.04 3lho h LEU 8 N 1.13 -0.13 -1.05 0.00 5.85 -0.99 -1.81 115.31 118.30 3lho h LEU 8 Ca 0.29 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 3lho h LEU 8 Cb -0.05 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3lho h LEU 8 CO -0.06 0.09 0.01 -0.26 -0.34 0.00 0.00 178.44 177.88 3lho h PHE 9 N -0.35 0.71 -0.38 1.25 0.04 -1.38 -0.32 116.94 116.51 3lho h PHE 9 Ca -0.02 -0.09 0.06 0.00 2.80 0.00 0.00 57.97 60.73 3lho h PHE 9 Cb 0.29 -0.20 -0.05 0.00 2.20 0.00 0.00 35.95 38.19 3lho h PHE 9 CO -0.01 0.67 0.08 0.00 -0.60 0.00 0.00 178.31 178.45 3lho h ALA 10 N 1.37 0.41 -0.29 2.45 0.00 -1.03 0.51 119.26 122.68 3lho h ALA 10 Ca 0.13 0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.95 3lho h ALA 10 Cb 0.39 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3lho h ALA 10 CO 0.01 -0.32 -0.46 0.00 0.00 0.00 0.00 179.25 178.49 3lho h ALA 11 N 1.28 0.64 -0.48 0.00 0.00 -0.95 -1.08 119.26 118.68 3lho h ALA 11 Ca 0.18 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3lho h ALA 11 Cb 0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3lho h ALA 11 CO -0.23 0.67 0.12 1.25 0.00 0.00 0.00 179.25 181.06 3lho h LEU 12 N 0.61 0.72 -0.49 0.00 5.85 -0.82 -2.46 115.31 118.73 3lho h LEU 12 Ca 0.04 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 3lho h LEU 12 Cb 1.02 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.84 3lho h LEU 12 CO 0.10 0.76 0.17 -0.25 -0.34 0.00 0.00 178.44 178.88 3lho h TRP 13 N 0.64 0.77 -1.00 1.25 2.91 -0.78 -0.54 115.95 119.20 3lho h TRP 13 Ca 0.15 -0.07 0.05 0.00 1.13 0.00 0.00 58.89 60.15 3lho h TRP 13 Cb 0.32 -0.22 -0.06 0.00 -0.51 0.00 0.00 29.16 28.69 3lho h TRP 13 CO 0.02 0.66 0.65 1.96 -1.03 0.00 0.00 178.44 180.71 3lho h GLN 14 N 0.65 1.18 -0.18 2.65 1.08 -1.07 -1.03 115.11 118.39 3lho h GLN 14 Ca 0.16 -0.07 -0.06 0.00 -1.45 0.00 0.00 58.65 57.23 3lho h GLN 14 Cb 0.25 -0.27 -0.00 0.00 -0.05 0.00 0.00 27.48 27.40 3lho h GLN 14 CO -0.01 0.78 -0.12 0.22 -0.95 0.00 0.00 178.83 178.76 3lho h ASP 15 N 1.22 0.42 -0.70 1.46 3.58 -1.32 -3.25 116.42 117.82 3lho h ASP 15 Ca 0.42 -0.44 0.05 0.00 0.42 0.00 0.00 57.03 57.48 3lho h ASP 15 Cb 0.09 -0.12 -0.05 0.00 1.72 0.00 0.00 39.33 40.97 3lho h ASP 15 CO -0.15 0.76 0.42 0.22 -2.88 0.00 0.00 179.24 177.61 3lho h TYR 16 N 0.07 0.77 0.00 0.28 3.20 -0.64 -2.79 116.97 117.86 3lho h TYR 16 Ca 0.04 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 3lho h TYR 16 Cb 0.62 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 3lho h TYR 16 CO 0.07 0.41 -0.05 -0.84 -1.64 0.00 0.00 178.16 176.10 3lho h ILE 17 N 0.79 0.16 0.00 1.81 3.07 -1.28 -0.35 117.51 121.72 3lho h ILE 17 Ca 0.30 -0.57 0.00 0.00 1.55 0.00 0.00 64.86 66.14 3lho h ILE 17 Cb 0.10 1.48 0.00 0.00 -0.27 0.00 0.00 36.82 38.14 3lho h ILE 17 CO -0.14 0.05 0.00 0.29 -1.05 0.00 0.00 178.15 177.30 3lho n LYS 18 N -3.20 0.08 0.00 0.16 5.02 -1.06 -2.51 118.16 116.66 3lho n LYS 18 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3lho n LYS 18 Cb 0.29 -1.04 0.00 0.00 -0.02 0.00 0.00 35.03 34.27 3lho n LYS 18 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3lho n THR 20 N 0.37 0.00 0.07 -0.18 -1.04 -0.14 -5.07 114.28 108.28 3lho n THR 20 Ca 0.00 0.00 0.16 0.00 -2.04 0.00 0.00 64.05 62.17 3lho n THR 20 Cb 0.02 0.00 0.66 0.00 -1.82 0.00 0.00 70.33 69.19 3lho n THR 20 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 3lho h PRO 21 N 0.00 0.04 -0.94 -2.82 0.13 -1.78 -0.81 132.00 125.83 3lho h PRO 21 Ca 0.00 -0.00 0.07 0.00 -0.87 0.00 0.00 66.00 65.20 3lho h PRO 21 Cb 0.00 -0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.06 3lho h PRO 21 CO 0.00 0.03 0.61 0.77 -0.23 0.00 0.00 178.00 179.18 3lho h SER 22 N 0.04 0.94 -0.68 1.44 0.02 -1.96 -1.29 113.55 112.06 3lho h SER 22 Ca 0.18 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 3lho h SER 22 Cb 0.67 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.99 3lho h SER 22 CO -0.01 0.59 0.31 0.00 -1.14 0.00 0.00 176.83 176.58 3lho h ALA 23 N 1.50 0.88 -0.77 3.77 0.00 -1.51 0.65 119.26 123.77 3lho h ALA 23 Ca 0.41 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3lho h ALA 23 Cb 0.22 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3lho h ALA 23 CO -0.16 0.46 0.38 0.00 0.00 0.00 0.00 179.25 179.93 3lho h ALA 24 N 1.14 0.99 -0.13 0.00 0.00 -1.22 -0.48 119.26 119.56 3lho h ALA 24 Ca 0.23 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 3lho h ALA 24 Cb 0.15 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3lho h ALA 24 CO -0.03 0.54 -0.17 0.87 0.00 0.00 0.00 179.25 180.47 3lho h LYS 25 N 1.08 0.35 -0.41 0.00 1.57 -0.95 -2.46 116.57 115.74 3lho h LYS 25 Ca 0.27 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 3lho h LYS 25 Cb 0.09 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3lho h LYS 25 CO -0.04 0.76 -0.07 0.82 -0.57 0.00 0.00 179.45 180.35 3lho h ILE 26 N -0.04 1.24 -0.14 1.86 2.04 -0.80 -0.35 117.51 121.33 3lho h ILE 26 Ca 0.02 -1.07 0.03 0.00 1.00 0.00 0.00 64.86 64.84 3lho h ILE 26 Cb 0.72 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 3lho h ILE 26 CO 0.04 0.36 -0.05 -0.74 0.00 0.00 0.00 178.15 177.76 3lho h HIS 27 N 0.65 -0.12 -0.38 1.37 2.76 -1.02 -0.77 115.15 117.64 3lho h HIS 27 Ca 0.12 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.32 3lho h HIS 27 Cb 0.51 0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.52 3lho h HIS 27 CO 0.02 -0.09 0.23 0.37 -1.30 0.00 0.00 177.93 177.16 3lho h GLN 28 N -0.03 0.45 -0.28 5.26 5.75 -1.15 -1.63 115.11 123.48 3lho h GLN 28 Ca 0.07 -0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.60 3lho h GLN 28 Cb 0.14 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.55 3lho h GLN 28 CO -0.16 0.29 -0.02 1.25 -2.65 0.00 0.00 178.83 177.54 3lho h LEU 29 N 0.46 -0.16 -0.08 -2.39 5.85 -0.61 0.14 115.31 118.52 3lho h LEU 29 Ca 0.15 0.07 -0.22 0.00 0.84 0.00 0.00 57.88 58.72 3lho h LEU 29 Cb -0.00 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3lho h LEU 29 CO -0.06 -0.05 -1.02 -0.07 -0.34 0.00 0.00 178.44 176.90 3lho h LEU 30 N 0.05 0.19 0.00 2.25 3.38 -1.10 -3.36 115.31 116.72 3lho h LEU 30 Ca 0.13 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3lho h LEU 30 Cb 0.19 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.88 3lho h LEU 30 CO -0.25 1.09 -0.82 0.61 0.09 0.00 0.00 178.44 179.16 3lho n GLY 31 N 1.22 -0.48 2.60 0.83 0.00 -0.62 -4.99 105.19 103.76 3lho n GLY 31 Ca -0.03 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 3lho n GLY 31 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3lho n HIS 32 N -1.43 -1.37 0.00 1.61 8.25 0.47 -0.77 115.22 121.98 3lho n HIS 32 Ca 0.02 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 3lho n HIS 32 Cb 0.26 -3.64 0.00 0.00 1.12 0.00 0.00 29.99 27.73 3lho n HIS 32 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3lho n GLY 33 N -1.06 2.37 3.80 -1.41 0.00 -1.25 -5.08 105.19 102.56 3lho n GLY 33 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 3lho n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lho s ALA 34 N -2.62 2.96 0.61 4.61 0.00 0.05 -5.03 121.76 122.34 3lho s ALA 34 Ca 0.00 0.56 -0.18 0.00 0.00 0.00 0.00 51.96 52.34 3lho s ALA 34 Cb 0.00 -3.22 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 3lho s ALA 34 CO 0.00 -0.15 1.21 -1.25 0.00 0.00 0.00 175.76 175.57 3lho s PRO 35 N -3.06 2.84 -0.08 0.00 0.04 -1.26 -4.60 135.00 128.88 3lho s PRO 35 Ca 0.64 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.51 3lho s PRO 35 Cb -0.15 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.45 3lho s PRO 35 CO 0.19 -1.31 -0.06 0.42 0.04 0.00 0.00 177.00 176.28 3lho s ILE 36 N -1.64 3.73 -0.00 0.56 -1.09 -1.26 -4.98 121.20 116.51 3lho s ILE 36 Ca 0.77 -0.46 -0.30 0.00 -2.23 0.00 0.00 60.65 58.43 3lho s ILE 36 Cb -0.31 -2.54 -0.04 0.00 -1.58 0.00 0.00 42.46 38.00 3lho s ILE 36 CO 0.35 0.58 1.12 -0.63 -1.23 0.00 0.00 174.94 175.14 3lho s ILE 37 N -0.64 4.39 -0.01 2.92 -1.09 -1.26 -5.01 121.20 120.50 3lho s ILE 37 Ca 0.10 1.71 -0.16 0.00 -2.23 0.00 0.00 60.65 60.06 3lho s ILE 37 Cb -0.12 -4.10 -0.06 0.00 -1.58 0.00 0.00 42.46 36.61 3lho s ILE 37 CO 0.02 0.08 0.45 0.20 -1.23 0.00 0.00 174.94 174.46 3lho s ASN 38 N 1.17 6.83 0.08 3.58 0.02 -1.26 -1.31 114.94 124.04 3lho s ASN 38 Ca 0.55 0.99 -0.18 0.00 -1.02 0.00 0.00 52.86 53.20 3lho s ASN 38 Cb -0.25 -2.28 -0.10 0.00 0.02 0.00 0.00 41.25 38.65 3lho s ASN 38 CO 0.26 0.25 1.44 -0.78 0.02 0.00 0.00 177.10 178.29 3lho h ASP 39 N 5.07 0.54 -4.94 -1.22 3.58 0.34 -3.35 116.42 116.44 3lho h ASP 39 Ca -0.49 -0.42 0.08 0.00 0.42 0.00 0.00 57.03 56.62 3lho h ASP 39 Cb 1.21 -0.15 -0.11 0.00 1.72 0.00 0.00 39.33 42.00 3lho h ASP 39 CO 0.65 0.84 0.37 -1.38 -2.88 0.00 0.00 179.24 176.84 3lho s HIS 40 N -4.56 -0.33 0.25 0.28 -3.43 -1.15 -1.23 115.29 105.12 3lho s HIS 40 Ca -0.13 0.09 0.10 0.00 -0.80 0.00 0.00 55.06 54.32 3lho s HIS 40 Cb 0.07 0.59 -0.05 0.00 -1.43 0.00 0.00 32.58 31.77 3lho s HIS 40 CO 0.78 -0.79 -0.10 0.96 -2.00 0.00 0.00 174.74 173.59 3lho s ILE 41 N -3.45 3.04 -0.06 -5.38 -4.36 -0.62 -0.46 121.20 109.91 3lho s ILE 41 Ca 0.06 -2.03 0.03 0.00 -0.26 0.00 0.00 60.65 58.45 3lho s ILE 41 Cb -0.02 -2.59 0.01 0.00 1.25 0.00 0.00 42.46 41.12 3lho s ILE 41 CO -0.06 -0.32 -0.13 0.00 0.24 0.00 0.00 174.94 174.67 3lho s ALA 42 N -2.23 1.33 0.20 2.27 0.00 -0.76 -1.28 121.76 121.29 3lho s ALA 42 Ca 0.29 -0.47 0.09 0.00 0.00 0.00 0.00 51.96 51.87 3lho s ALA 42 Cb -0.06 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.45 3lho s ALA 42 CO 0.17 0.14 -0.19 -0.51 0.00 0.00 0.00 175.76 175.38 3lho s LEU 43 N 0.55 2.50 0.08 0.00 1.43 -0.03 -1.15 118.68 122.06 3lho s LEU 43 Ca -0.13 -0.93 0.04 0.00 -1.03 0.00 0.00 54.13 52.07 3lho s LEU 43 Cb -0.15 -0.90 -0.03 0.00 0.03 0.00 0.00 46.19 45.14 3lho s LEU 43 CO 0.04 -0.03 -0.11 -0.13 0.23 0.00 0.00 176.35 176.35 3lho s ARG 44 N -3.12 0.78 0.10 1.70 0.52 -1.26 -1.88 118.95 115.78 3lho s ARG 44 Ca 0.21 -1.01 -0.05 0.00 -0.52 0.00 0.00 55.73 54.36 3lho s ARG 44 Cb -0.05 -0.60 0.02 0.00 0.52 0.00 0.00 34.95 34.84 3lho s ARG 44 CO 0.09 0.11 0.27 -2.37 0.02 0.00 0.00 175.30 173.42 3lho n THR 45 N 0.99 0.00 -4.23 0.02 5.66 -0.82 -4.95 114.28 110.95 3lho n THR 45 Ca -0.19 -0.25 -0.24 0.00 -3.05 0.00 0.00 64.05 60.31 3lho n THR 45 Cb 0.56 0.28 -0.07 0.00 -1.55 0.00 0.00 70.33 69.54 3lho n THR 45 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 3lho s PHE 46 N -6.11 2.82 0.00 1.09 0.08 -1.26 -1.03 117.98 113.57 3lho s PHE 46 Ca 0.06 -0.17 -0.05 0.00 0.12 0.00 0.00 56.93 56.89 3lho s PHE 46 Cb -0.01 -1.31 -0.20 0.00 -0.57 0.00 0.00 43.02 40.93 3lho s PHE 46 CO 0.03 0.56 3.16 0.27 -0.10 0.00 0.00 175.22 179.14 3lho n ASN 47 N -0.60 5.02 -4.53 1.36 6.94 -0.65 -3.93 115.26 118.88 3lho n ASN 47 Ca -0.08 -2.42 -0.35 0.00 -0.02 0.00 0.00 54.58 51.72 3lho n ASN 47 Cb 0.57 -1.30 -0.11 0.00 -2.36 0.00 0.00 39.78 36.58 3lho n ASN 47 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3lho s ILE 48 N 0.88 4.31 0.25 1.53 1.01 -1.26 -4.90 121.20 123.03 3lho s ILE 48 Ca 0.51 -0.20 -0.06 0.00 0.00 0.00 0.00 60.65 60.90 3lho s ILE 48 Cb 0.24 -2.94 0.29 0.00 0.01 0.00 0.00 42.46 40.06 3lho s ILE 48 CO 0.00 0.44 1.63 0.00 0.00 0.00 0.00 174.94 177.01 3lho h ALA 49 N 7.08 0.81 -0.77 9.38 0.00 -1.98 0.12 119.26 133.90 3lho h ALA 49 Ca -0.35 0.25 0.21 0.00 0.00 0.00 0.00 54.91 55.02 3lho h ALA 49 Cb 1.18 0.43 -0.04 0.00 0.00 0.00 0.00 17.79 19.36 3lho h ALA 49 CO 0.64 -0.43 0.55 -0.22 0.00 0.00 0.00 179.25 179.79 3lho h LYS 50 N 0.10 0.07 0.00 0.00 3.64 -1.95 -3.08 116.57 115.35 3lho h LYS 50 Ca 0.43 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.76 3lho h LYS 50 Cb 0.76 -0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 32.47 3lho h LYS 50 CO -0.68 0.04 -0.56 1.33 -2.27 0.00 0.00 179.45 177.31 3lho n VAL 51 N -4.34 0.40 -1.31 2.00 0.24 0.28 -4.96 118.33 110.64 3lho n VAL 51 Ca 0.16 -0.76 -0.30 0.00 -2.04 0.00 0.00 64.34 61.40 3lho n VAL 51 Cb 0.79 0.48 0.21 0.00 -1.47 0.00 0.00 33.84 33.85 3lho n VAL 51 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3lho s ASN 52 N -1.65 1.93 0.29 -1.34 2.20 -0.33 -4.43 114.94 111.60 3lho s ASN 52 Ca 0.15 0.70 0.02 0.00 -0.94 0.00 0.00 52.86 52.79 3lho s ASN 52 Cb 0.16 -1.03 0.71 0.00 -2.00 0.00 0.00 41.25 39.09 3lho s ASN 52 CO -0.04 -3.51 1.65 0.25 -2.94 0.00 0.00 177.10 172.51 3lho h LEU 53 N -2.16 0.02 -0.88 3.54 6.46 -1.89 -0.94 115.31 119.46 3lho h LEU 53 Ca -0.47 0.19 -0.11 0.00 -0.12 0.00 0.00 57.88 57.37 3lho h LEU 53 Cb 1.30 0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 41.47 3lho h LEU 53 CO 0.43 -0.15 -0.33 0.28 -0.62 0.00 0.00 178.44 178.05 3lho h SER 54 N 0.22 0.44 -0.35 1.25 0.02 -1.96 0.29 113.55 113.46 3lho h SER 54 Ca 0.55 -0.17 -0.05 0.00 -0.84 0.00 0.00 61.79 61.28 3lho h SER 54 Cb 1.10 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.51 3lho h SER 54 CO -0.64 0.75 0.02 0.58 -1.14 0.00 0.00 176.83 176.39 3lho h VAL 55 N 0.37 1.25 -0.42 2.27 2.07 -1.48 -2.46 116.25 117.85 3lho h VAL 55 Ca 0.04 -0.93 -0.08 0.00 0.82 0.00 0.00 66.70 66.56 3lho h VAL 55 Cb 0.76 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.68 3lho h VAL 55 CO 0.06 0.31 -0.03 -0.07 0.02 0.00 0.00 177.57 177.86 3lho h LEU 56 N 0.43 0.76 -1.98 2.57 4.07 -1.22 -3.18 115.31 116.76 3lho h LEU 56 Ca 0.10 -0.33 0.02 0.00 0.08 0.00 0.00 57.88 57.75 3lho h LEU 56 Cb 0.42 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 3lho h LEU 56 CO 0.01 0.90 0.05 0.00 -1.08 0.00 0.00 178.44 178.33 3lho h ALA 57 N 0.88 2.03 0.00 1.53 0.00 -0.77 -2.36 119.26 120.58 3lho h ALA 57 Ca 0.12 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3lho h ALA 57 Cb 0.53 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3lho h ALA 57 CO 0.03 -0.05 -0.07 0.87 0.00 0.00 0.00 179.25 180.03 3lho h LYS 58 N 0.03 0.00 0.00 0.00 1.79 -1.42 0.23 116.57 117.20 3lho h LYS 58 Ca 0.03 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.50 3lho h LYS 58 Cb 0.09 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.74 3lho h LYS 58 CO -0.00 0.07 -0.00 0.45 -1.08 0.00 0.00 179.45 178.88 3lho h HIS 59 N 0.00 0.00 0.00 -1.35 3.86 -1.57 -2.37 115.15 113.72 3lho h HIS 59 Ca -0.00 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.94 3lho h HIS 59 Cb 0.14 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.57 3lho h HIS 59 CO 0.00 0.00 -1.98 1.19 0.86 0.00 0.00 177.93 178.00 3lho n PHE 60 N -3.10 0.00 0.25 2.45 3.01 0.60 -4.53 117.46 116.14 3lho n PHE 60 Ca -0.01 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.57 3lho n PHE 60 Cb 0.18 -0.66 0.66 0.00 -0.01 0.00 0.00 39.48 39.65 3lho n PHE 60 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 3lho h THR 61 N -0.13 0.56 0.00 4.37 1.35 -1.06 -1.79 112.91 116.22 3lho h THR 61 Ca -0.40 -0.70 0.00 0.00 -0.55 0.00 0.00 66.41 64.76 3lho h THR 61 Cb 1.56 1.46 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 3lho h THR 61 CO -0.10 0.15 0.00 0.77 -0.25 0.00 0.00 175.52 176.08 3lho h SER 62 N 0.00 0.00 0.00 5.36 4.64 -1.66 -3.03 113.55 118.86 3lho h SER 62 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3lho h SER 62 Cb 0.45 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3lho h SER 62 CO 0.02 0.00 -0.26 2.30 -0.87 0.00 0.00 176.83 178.01 3lho n ILE 63 N -2.65 2.01 0.00 0.95 -5.35 -0.74 -4.99 119.36 108.59 3lho n ILE 63 Ca 0.02 -2.72 0.00 0.00 -0.27 0.00 0.00 62.75 59.78 3lho n ILE 63 Cb 0.28 -0.22 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 3lho n ILE 63 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3lho n GLY 64 N -1.24 0.80 3.77 3.28 0.00 -1.13 -4.85 105.19 105.81 3lho n GLY 64 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 3lho n GLY 64 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lho s TYR 65 N -2.00 2.74 -0.02 1.61 1.51 -0.81 -4.42 117.35 115.97 3lho s TYR 65 Ca 0.00 1.53 0.05 0.00 -1.01 0.00 0.00 57.07 57.63 3lho s TYR 65 Cb 0.00 -3.39 -0.01 0.00 -0.11 0.00 0.00 41.96 38.45 3lho s TYR 65 CO 0.00 -1.67 -0.16 0.14 -1.11 0.00 0.00 175.55 172.75 3lho s VAL 66 N -1.59 1.28 -0.05 0.71 -7.23 0.67 -4.31 120.40 109.87 3lho s VAL 66 Ca 0.68 -0.69 -0.34 0.00 -1.81 0.00 0.00 61.98 59.82 3lho s VAL 66 Cb -0.28 -1.07 -0.12 0.00 0.56 0.00 0.00 36.38 35.47 3lho s VAL 66 CO 0.33 0.36 1.85 -0.67 -0.31 0.00 0.00 175.10 176.67 3lho n ASP 67 N 2.74 3.46 0.00 4.85 -0.08 -1.26 -1.41 116.55 124.84 3lho n ASP 67 Ca -0.15 0.98 0.00 0.00 -1.51 0.00 0.00 54.79 54.11 3lho n ASP 67 Cb 0.54 -1.39 0.00 0.00 2.34 0.00 0.00 41.12 42.62 3lho n ASP 67 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 3lho n SER 68 N 6.34 0.36 -3.65 1.67 7.64 -0.21 -4.92 113.62 120.85 3lho n SER 68 Ca 0.22 -0.89 -0.01 0.00 1.01 0.00 0.00 58.87 59.20 3lho n SER 68 Cb 0.30 0.06 -0.07 0.00 -1.01 0.00 0.00 64.21 63.49 3lho n SER 68 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3lho s GLY 69 N -0.06 0.46 -0.06 0.23 0.00 -1.07 -4.90 107.32 101.92 3lho s GLY 69 Ca 0.00 3.67 0.04 0.00 0.00 0.00 0.00 44.72 48.43 3lho s GLY 69 CO 0.00 2.11 -0.18 0.99 0.00 0.00 0.00 173.10 176.02 3lho s ASP 70 N 0.20 3.65 0.02 1.64 1.11 -1.26 -1.50 116.67 120.52 3lho s ASP 70 Ca 0.05 -0.34 0.01 0.00 0.18 0.00 0.00 52.55 52.45 3lho s ASP 70 Cb -0.04 -0.91 -0.01 0.00 1.07 0.00 0.00 42.92 43.02 3lho s ASP 70 CO -0.15 0.29 -0.05 -0.31 1.18 0.00 0.00 175.17 176.13 3lho s TYR 71 N -0.39 0.41 -0.07 4.23 2.02 0.10 -4.97 117.35 118.68 3lho s TYR 71 Ca 0.04 -0.34 0.04 0.00 -0.37 0.00 0.00 57.07 56.43 3lho s TYR 71 Cb -0.12 -0.26 0.00 0.00 -0.40 0.00 0.00 41.96 41.18 3lho s TYR 71 CO 0.02 -0.08 -0.19 0.21 -1.57 0.00 0.00 175.55 173.94 3lho s LYS 72 N -1.00 2.29 -0.37 -0.62 2.20 -1.26 -0.59 119.74 120.40 3lho s LYS 72 Ca -0.08 -0.67 -0.02 0.00 -0.36 0.00 0.00 55.97 54.85 3lho s LYS 72 Cb -0.07 -1.83 0.09 0.00 -1.51 0.00 0.00 37.83 34.51 3lho s LYS 72 CO -0.00 0.16 0.12 -0.06 -0.36 0.00 0.00 175.35 175.21 3lho s PHE 73 N 0.34 3.52 0.03 4.03 0.08 0.80 -5.00 117.98 121.77 3lho s PHE 73 Ca -0.13 -2.33 -0.22 0.00 0.12 0.00 0.00 56.93 54.37 3lho s PHE 73 Cb -0.16 -2.84 -0.16 0.00 -0.57 0.00 0.00 43.02 39.30 3lho s PHE 73 CO 0.05 -0.92 1.36 1.49 -0.10 0.00 0.00 175.22 177.10 3lho h GLU 74 N 7.97 0.23 -0.78 0.44 4.57 -1.97 -1.03 114.58 124.01 3lho h GLU 74 Ca -0.14 -0.11 -0.03 0.00 -1.18 0.00 0.00 59.36 57.90 3lho h GLU 74 Cb 1.05 -0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.60 3lho h GLU 74 CO 0.62 0.61 0.36 0.37 -1.18 0.00 0.00 179.01 179.78 3lho h GLN 75 N -0.15 1.13 -0.01 1.92 4.15 -1.96 -2.33 115.11 117.87 3lho h GLN 75 Ca 0.02 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.27 3lho h GLN 75 Cb 0.55 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.04 3lho h GLN 75 CO 0.02 0.88 -0.20 1.63 -1.93 0.00 0.00 178.83 179.23 3lho n LYS 76 N -4.30 0.76 -3.16 1.69 5.02 -1.20 -4.96 118.16 112.01 3lho n LYS 76 Ca 0.07 -0.38 -0.14 0.00 -2.02 0.00 0.00 58.31 55.84 3lho n LYS 76 Cb 0.15 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 33.74 3lho n LYS 76 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3lho n LYS 77 N -0.78 -5.40 -4.47 1.97 4.76 -0.64 -4.87 118.16 108.72 3lho n LYS 77 Ca 0.13 0.68 -0.23 0.00 -2.87 0.00 0.00 58.31 56.03 3lho n LYS 77 Cb 0.32 -5.22 -0.14 0.00 -1.84 0.00 0.00 35.03 28.16 3lho n LYS 77 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3lho s LEU 78 N -5.54 2.17 0.06 -0.35 1.43 -0.48 -0.67 118.68 115.29 3lho s LEU 78 Ca 0.02 -0.49 0.05 0.00 -1.03 0.00 0.00 54.13 52.68 3lho s LEU 78 Cb -0.01 -0.77 -0.04 0.00 0.03 0.00 0.00 46.19 45.40 3lho s LEU 78 CO 0.59 0.09 -0.05 -0.63 0.23 0.00 0.00 176.35 176.58 3lho s ILE 79 N -0.84 3.75 0.21 -0.59 1.01 -0.93 -0.14 121.20 123.66 3lho s ILE 79 Ca 0.04 -0.95 -0.12 0.00 0.00 0.00 0.00 60.65 59.62 3lho s ILE 79 Cb -0.08 -2.72 -0.00 0.00 0.01 0.00 0.00 42.46 39.67 3lho s ILE 79 CO 0.02 0.23 0.42 0.00 0.00 0.00 0.00 174.94 175.61 3lho s ALA 80 N -1.16 -0.27 0.04 9.38 0.00 0.24 -0.86 121.76 129.14 3lho s ALA 80 Ca 0.21 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.36 3lho s ALA 80 Cb -0.11 0.97 -0.02 0.00 0.00 0.00 0.00 23.12 23.95 3lho s ALA 80 CO 0.13 -0.77 0.06 0.15 0.00 0.00 0.00 175.76 175.33 3lho s LYS 81 N -3.98 0.58 0.14 0.00 1.02 -0.42 0.01 119.74 117.10 3lho s LYS 81 Ca 0.18 -0.87 0.10 0.00 0.02 0.00 0.00 55.97 55.41 3lho s LYS 81 Cb 0.01 0.22 -0.04 0.00 -0.52 0.00 0.00 37.83 37.50 3lho s LYS 81 CO 0.04 -0.14 -0.25 -3.38 -0.92 0.00 0.00 175.35 170.70 3lho s HIS 82 N -2.90 2.19 0.03 3.18 -3.43 -0.57 -0.92 115.29 112.88 3lho s HIS 82 Ca -0.02 -0.39 0.07 0.00 -0.80 0.00 0.00 55.06 53.92 3lho s HIS 82 Cb 0.01 -1.16 -0.02 0.00 -1.43 0.00 0.00 32.58 29.97 3lho s HIS 82 CO -0.06 0.35 -0.20 -0.06 -2.00 0.00 0.00 174.74 172.77 3lho s PHE 83 N -1.27 1.80 0.02 0.38 0.40 0.16 -1.05 117.98 118.43 3lho s PHE 83 Ca 0.14 -0.37 0.07 0.00 -0.60 0.00 0.00 56.93 56.17 3lho s PHE 83 Cb -0.09 -1.09 -0.02 0.00 0.51 0.00 0.00 43.02 42.33 3lho s PHE 83 CO 0.07 0.07 -0.21 -1.21 0.70 0.00 0.00 175.22 174.63 3lho s GLU 84 N -1.04 1.49 0.05 0.44 2.02 -0.50 -1.48 118.70 119.68 3lho s GLU 84 Ca 0.07 -0.88 0.01 0.00 0.02 0.00 0.00 54.97 54.20 3lho s GLU 84 Cb -0.09 -1.55 -0.04 0.00 0.10 0.00 0.00 34.13 32.56 3lho s GLU 84 CO 0.01 0.40 0.11 -1.58 0.02 0.00 0.00 175.26 174.23 3lho s HIS 85 N -0.70 3.29 0.52 1.61 5.65 -1.26 -0.24 115.29 124.16 3lho s HIS 85 Ca 0.08 0.15 0.26 0.00 0.25 0.00 0.00 55.06 55.80 3lho s HIS 85 Cb -0.09 -1.68 1.58 0.00 -1.18 0.00 0.00 32.58 31.21 3lho s HIS 85 CO 0.01 0.55 2.16 -1.00 -0.65 0.00 0.00 174.74 175.81 3lho h PRO 86 N 3.44 0.00 -6.11 2.88 0.13 -1.97 -3.39 132.00 126.99 3lho h PRO 86 Ca -0.47 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.07 3lho h PRO 86 Cb 1.17 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.20 3lho h PRO 86 CO 0.67 0.06 0.60 0.34 -0.23 0.00 0.00 178.00 179.44 3lho s ASP 87 N -6.33 6.63 0.36 1.44 -1.08 -1.26 -4.95 116.67 111.48 3lho s ASP 87 Ca -0.04 0.47 0.26 0.00 -0.52 0.00 0.00 52.55 52.72 3lho s ASP 87 Cb 0.15 -2.46 1.25 0.00 -1.46 0.00 0.00 42.92 40.40 3lho s ASP 87 CO 0.58 -0.91 1.79 1.55 0.52 0.00 0.00 175.17 178.71 3lho h PRO 88 N 8.63 0.00 0.00 4.34 0.13 -2.02 -1.30 132.00 141.78 3lho h PRO 88 Ca -0.23 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.88 3lho h PRO 88 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3lho h PRO 88 CO 0.99 0.00 -0.07 0.87 -0.23 0.00 0.00 178.00 179.56 3lho h LYS 89 N 0.00 0.00 -6.77 0.86 1.57 -1.94 -3.45 116.57 106.84 3lho h LYS 89 Ca 0.00 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.29 3lho h LYS 89 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 3lho h LYS 89 CO 0.00 0.07 0.25 -0.65 -0.57 0.00 0.00 179.45 178.55 3lho s GLN 90 N -3.83 4.43 0.59 3.15 -1.52 -0.49 -4.52 119.66 117.47 3lho s GLN 90 Ca -0.01 1.13 -0.18 0.00 -1.95 0.00 0.00 55.36 54.35 3lho s GLN 90 Cb 0.11 -2.79 -0.03 0.00 -0.22 0.00 0.00 33.01 30.08 3lho s GLN 90 CO 0.55 0.30 1.16 -1.25 -0.25 0.00 0.00 175.29 175.81 3lho s PRO 91 N -2.11 3.04 0.67 2.91 0.04 -1.26 -4.84 135.00 133.45 3lho s PRO 91 Ca 0.48 1.67 -0.16 0.00 0.04 0.00 0.00 61.00 63.04 3lho s PRO 91 Cb -0.17 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.42 3lho s PRO 91 CO 0.22 -1.11 1.16 0.15 0.04 0.00 0.00 177.00 177.46 3lho s LYS 92 N -3.46 2.61 -0.22 4.56 1.02 -0.36 -4.68 119.74 119.21 3lho s LYS 92 Ca 0.74 1.62 0.02 0.00 0.02 0.00 0.00 55.97 58.37 3lho s LYS 92 Cb -0.26 -1.91 0.04 0.00 -0.52 0.00 0.00 37.83 35.18 3lho s LYS 92 CO 0.33 -1.44 -0.15 0.08 -0.92 0.00 0.00 175.35 173.25 3lho s VAL 93 N -2.03 2.18 -0.23 3.17 1.01 -0.55 -1.58 120.40 122.36 3lho s VAL 93 Ca 0.72 -1.23 -0.07 0.00 0.00 0.00 0.00 61.98 61.40 3lho s VAL 93 Cb -0.26 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.01 3lho s VAL 93 CO 0.40 0.28 0.06 0.12 0.00 0.00 0.00 175.10 175.96 3lho s PHE 94 N 1.22 3.10 -0.12 5.22 5.36 -0.40 -0.66 117.98 131.70 3lho s PHE 94 Ca -0.01 -0.33 0.00 0.00 -0.96 0.00 0.00 56.93 55.63 3lho s PHE 94 Cb -0.16 -2.19 0.02 0.00 -0.34 0.00 0.00 43.02 40.35 3lho s PHE 94 CO -0.09 -0.26 -0.11 0.42 -1.46 0.00 0.00 175.22 173.73 3lho s ILE 95 N 1.33 1.25 0.29 3.12 1.01 -0.09 -0.85 121.20 127.25 3lho s ILE 95 Ca 0.05 -0.45 0.10 0.00 0.00 0.00 0.00 60.65 60.36 3lho s ILE 95 Cb -0.15 -1.21 -0.05 0.00 0.01 0.00 0.00 42.46 41.06 3lho s ILE 95 CO 0.03 0.40 -0.08 -0.94 0.00 0.00 0.00 174.94 174.35 3lho s SER 96 N 1.47 4.06 -0.01 3.58 1.04 -0.79 -1.30 113.70 121.76 3lho s SER 96 Ca 0.02 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.55 3lho s SER 96 Cb -0.13 -0.54 0.01 0.00 0.10 0.00 0.00 66.02 65.46 3lho s SER 96 CO -0.07 -0.05 0.00 -1.83 0.98 0.00 0.00 173.24 172.27 3lho s GLU 97 N -3.62 0.02 0.22 4.02 -1.05 -0.03 -1.95 118.70 116.31 3lho s GLU 97 Ca 0.32 0.04 -0.30 0.00 -0.15 0.00 0.00 54.97 54.88 3lho s GLU 97 Cb -0.04 -0.10 -0.08 0.00 -0.44 0.00 0.00 34.13 33.47 3lho s GLU 97 CO 0.18 -0.04 1.05 -1.17 0.95 0.00 0.00 175.26 176.22 3lho s LEU 98 N 0.29 4.55 -0.72 1.83 2.96 -0.20 -2.20 118.68 125.20 3lho s LEU 98 Ca -0.02 2.09 -0.22 0.00 -0.22 0.00 0.00 54.13 55.75 3lho s LEU 98 Cb -0.04 -3.61 0.08 0.00 0.50 0.00 0.00 46.19 43.12 3lho s LEU 98 CO -0.01 -0.09 1.03 -0.76 -1.32 0.00 0.00 176.35 175.20 3lho s LEU 99 N -0.89 4.37 0.52 -0.68 1.43 0.15 -1.63 118.68 121.96 3lho s LEU 99 Ca 0.45 -1.14 0.21 0.00 -1.03 0.00 0.00 54.13 52.62 3lho s LEU 99 Cb -0.29 -2.43 1.39 0.00 0.03 0.00 0.00 46.19 44.89 3lho s LEU 99 CO 0.36 -1.41 2.13 0.58 0.23 0.00 0.00 176.35 178.24 3lho h VAL 100 N 5.99 0.84 0.00 -1.59 2.07 -1.90 -1.73 116.25 119.93 3lho h VAL 100 Ca -0.20 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.10 3lho h VAL 100 Cb 1.06 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 3lho h VAL 100 CO 1.19 0.06 0.00 -0.62 0.02 0.00 0.00 177.57 178.22 3lho n GLU 101 N -4.17 0.11 0.00 1.57 4.71 -1.26 -2.40 120.64 119.19 3lho n GLU 101 Ca -0.03 0.41 0.15 0.00 -0.01 0.00 0.00 57.16 57.68 3lho n GLU 101 Cb 0.14 -1.73 0.71 0.00 -1.01 0.00 0.00 31.44 29.56 3lho n GLU 101 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3lho n GLU 102 N -1.94 1.09 -3.87 3.49 -0.58 -0.65 -4.91 120.64 113.28 3lho n GLU 102 Ca 0.02 -0.36 -0.22 0.00 -0.42 0.00 0.00 57.16 56.17 3lho n GLU 102 Cb 0.16 -1.49 -0.05 0.00 -0.57 0.00 0.00 31.44 29.48 3lho n GLU 102 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 3lho s PHE 103 N -2.16 2.71 0.52 -0.32 0.08 -1.01 -5.09 117.98 112.72 3lho s PHE 103 Ca 0.39 -0.46 -0.21 0.00 0.12 0.00 0.00 56.93 56.77 3lho s PHE 103 Cb 0.21 -1.94 -0.08 0.00 -0.57 0.00 0.00 43.02 40.64 3lho s PHE 103 CO 0.39 0.11 0.89 -1.13 -0.10 0.00 0.00 175.22 175.38 3lho n SER 104 N -1.35 0.58 -0.34 1.36 3.41 -1.26 -4.72 113.62 111.31 3lho n SER 104 Ca 0.00 0.89 0.23 0.00 -0.26 0.00 0.00 58.87 59.72 3lho n SER 104 Cb 0.62 -1.33 0.49 0.00 -0.26 0.00 0.00 64.21 63.73 3lho n SER 104 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3lho h PRO 105 N 0.87 0.40 -0.34 4.33 0.11 -1.96 -0.79 132.00 134.61 3lho h PRO 105 Ca -0.46 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.54 3lho h PRO 105 Cb 1.36 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 3lho h PRO 105 CO 0.52 0.27 -0.12 0.93 -0.21 0.00 0.00 178.00 179.39 3lho h GLU 106 N 0.41 0.69 -0.62 1.05 3.07 -1.99 -0.92 114.58 116.27 3lho h GLU 106 Ca 0.62 -0.28 -0.09 0.00 -0.50 0.00 0.00 59.36 59.11 3lho h GLU 106 Cb 1.52 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.37 3lho h GLU 106 CO -0.35 0.87 0.03 0.28 -1.40 0.00 0.00 179.01 178.45 3lho h VAL 107 N 0.47 1.26 -0.40 3.13 2.07 -1.63 -1.86 116.25 119.30 3lho h VAL 107 Ca 0.08 -1.11 0.01 0.00 0.82 0.00 0.00 66.70 66.50 3lho h VAL 107 Cb 0.64 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 3lho h VAL 107 CO 0.04 0.41 0.26 1.56 0.02 0.00 0.00 177.57 179.86 3lho h GLN 108 N 0.98 0.51 -0.71 1.57 4.20 -1.02 0.12 115.11 120.76 3lho h GLN 108 Ca 0.18 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.83 3lho h GLN 108 Cb 0.52 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 3lho h GLN 108 CO 0.02 0.34 0.33 -0.22 -0.67 0.00 0.00 178.83 178.64 3lho h LYS 109 N 0.52 1.03 -0.52 1.46 3.64 -1.07 -0.76 116.57 120.87 3lho h LYS 109 Ca 0.15 -0.16 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 3lho h LYS 109 Cb -0.04 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 3lho h LYS 109 CO -0.04 0.81 0.10 0.77 -2.27 0.00 0.00 179.45 178.82 3lho h SER 110 N 0.99 0.81 -0.19 4.20 0.02 -0.72 -0.63 113.55 118.03 3lho h SER 110 Ca 0.24 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 60.91 3lho h SER 110 Cb 0.13 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 3lho h SER 110 CO -0.03 0.86 0.01 0.40 -1.14 0.00 0.00 176.83 176.93 3lho h ILE 111 N 0.73 1.25 -0.73 3.27 2.04 -0.75 -2.27 117.51 121.04 3lho h ILE 111 Ca 0.16 -0.83 0.07 0.00 1.00 0.00 0.00 64.86 65.26 3lho h ILE 111 Cb 0.38 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 37.84 3lho h ILE 111 CO 0.01 0.25 0.48 0.45 0.00 0.00 0.00 178.15 179.34 3lho h HIS 112 N 0.09 0.75 -0.28 1.37 3.86 -1.02 -1.22 115.15 118.69 3lho h HIS 112 Ca 0.05 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.24 3lho h HIS 112 Cb 0.37 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.58 3lho h HIS 112 CO 0.03 0.38 -0.02 0.78 0.86 0.00 0.00 177.93 179.96 3lho h GLY 113 N 0.73 0.47 0.70 2.45 0.00 -0.61 0.24 103.07 107.05 3lho h GLY 113 Ca 0.32 -0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.28 3lho h GLY 113 CO -0.11 0.25 -0.38 1.41 0.00 0.00 0.00 176.54 177.71 3lho h LEU 114 N 0.42 0.43 -1.05 3.11 3.38 -0.71 -3.31 115.31 117.59 3lho h LEU 114 Ca 0.09 -0.68 -0.07 0.00 0.09 0.00 0.00 57.88 57.32 3lho h LEU 114 Cb 0.31 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3lho h LEU 114 CO 0.01 1.04 -0.33 0.40 0.09 0.00 0.00 178.44 179.65 3lho h ILE 115 N -0.14 0.84 -0.00 1.22 1.08 -1.13 -1.48 117.51 117.89 3lho h ILE 115 Ca -0.03 -1.38 0.00 0.00 -0.39 0.00 0.00 64.86 63.06 3lho h ILE 115 Cb 1.05 1.85 -0.00 0.00 -3.07 0.00 0.00 36.82 36.65 3lho h ILE 115 CO 0.08 0.33 0.00 0.44 -0.69 0.00 0.00 178.15 178.31 3lho h ASP 116 N 0.00 0.00 1.08 1.72 3.32 -1.03 -1.51 116.42 119.99 3lho h ASP 116 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3lho h ASP 116 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 3lho h ASP 116 CO 0.04 0.00 -0.14 0.00 -1.72 0.00 0.00 179.24 177.42 3lho n GLN 117 N -3.89 0.12 -2.23 3.56 6.02 -0.56 -4.77 117.38 115.64 3lho n GLN 117 Ca -0.03 0.08 -0.43 0.00 -0.01 0.00 0.00 57.00 56.62 3lho n GLN 117 Cb 0.09 -1.63 -0.02 0.00 1.02 0.00 0.00 30.24 29.70 3lho n GLN 117 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3lho s VAL 118 N -3.05 3.92 0.00 5.09 1.01 -0.57 -4.81 120.40 121.99 3lho s VAL 118 Ca 0.12 1.10 -0.30 0.00 0.00 0.00 0.00 61.98 62.89 3lho s VAL 118 Cb 0.16 -3.78 -0.07 0.00 0.00 0.00 0.00 36.38 32.69 3lho s VAL 118 CO 0.60 -0.18 1.78 -0.62 0.00 0.00 0.00 175.10 176.68 3lho s ASP 119 N 2.96 6.57 0.45 3.32 2.15 -1.26 -4.89 116.67 125.96 3lho s ASP 119 Ca 0.64 2.46 0.14 0.00 0.43 0.00 0.00 52.55 56.22 3lho s ASP 119 Cb -0.26 -2.54 1.06 0.00 -0.30 0.00 0.00 42.92 40.89 3lho s ASP 119 CO 0.23 -0.97 2.00 -0.29 -0.17 0.00 0.00 175.17 175.96 3lho h ILE 120 N 5.47 0.90 0.00 4.11 2.10 -1.95 0.80 117.51 128.94 3lho h ILE 120 Ca -0.44 -0.12 -0.03 0.00 1.08 0.00 0.00 64.86 65.35 3lho h ILE 120 Cb 1.21 0.51 -0.00 0.00 -1.09 0.00 0.00 36.82 37.44 3lho h ILE 120 CO 0.95 0.07 -0.12 0.00 -1.08 0.00 0.00 178.15 177.96 3lho h ALA 121 N 1.72 1.46 0.00 0.18 0.00 -2.00 -1.86 119.26 118.76 3lho h ALA 121 Ca 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3lho h ALA 121 Cb 0.51 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3lho h ALA 121 CO -0.06 0.15 -0.16 0.00 0.00 0.00 0.00 179.25 179.18 3lho h ALA 122 N 1.88 1.19 0.00 0.00 0.00 -1.22 -3.09 119.26 118.03 3lho h ALA 122 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3lho h ALA 122 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3lho h ALA 122 CO 0.02 0.20 0.00 0.25 0.00 0.00 0.00 179.25 179.72 3lho n THR 123 N -3.56 0.63 0.17 0.00 -2.24 -0.70 -2.22 114.28 106.35 3lho n THR 123 Ca -0.01 -0.02 0.07 0.00 -2.27 0.00 0.00 64.05 61.82 3lho n THR 123 Cb 0.30 -0.80 0.13 0.00 -2.10 0.00 0.00 70.33 67.86 3lho n THR 123 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 3lho n THR 124 N -2.07 0.51 -2.28 4.28 5.66 -1.17 -4.90 114.28 114.32 3lho n THR 124 Ca 0.04 -0.75 -0.31 0.00 -3.05 0.00 0.00 64.05 59.98 3lho n THR 124 Cb 0.33 0.89 -0.01 0.00 -1.55 0.00 0.00 70.33 69.98 3lho n THR 124 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3lho s ALA 125 N -1.08 3.17 0.43 1.79 0.00 -0.94 -4.13 121.76 120.99 3lho s ALA 125 Ca 0.23 -0.09 0.29 0.00 0.00 0.00 0.00 51.96 52.39 3lho s ALA 125 Cb 0.13 -2.97 1.56 0.00 0.00 0.00 0.00 23.12 21.84 3lho s ALA 125 CO 0.19 -0.41 2.11 0.38 0.00 0.00 0.00 175.76 178.02 3lho h ASP 126 N 0.34 0.00 -0.43 0.00 2.03 -1.52 -2.41 116.42 114.43 3lho h ASP 126 Ca -0.46 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.84 3lho h ASP 126 Cb 1.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.69 3lho h ASP 126 CO 0.62 0.09 0.00 -0.46 -1.03 0.00 0.00 179.24 178.46 3lho n ASN 127 N -3.59 2.78 -0.26 4.15 6.94 -1.26 -4.56 115.26 119.46 3lho n ASN 127 Ca -0.02 -1.94 -0.02 0.00 -0.02 0.00 0.00 54.58 52.59 3lho n ASN 127 Cb 0.21 -0.28 0.10 0.00 -2.36 0.00 0.00 39.78 37.45 3lho n ASN 127 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 3lho h PHE 128 N 3.29 0.83 0.00 -2.53 3.57 -1.65 -0.08 116.94 120.36 3lho h PHE 128 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3lho h PHE 128 Cb 0.74 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.21 3lho h PHE 128 CO 0.28 0.43 0.00 0.44 -2.23 0.00 0.00 178.31 177.24 3lho n ILE 129 N -4.69 0.62 -1.91 1.41 -5.35 -1.26 -2.32 119.36 105.85 3lho n ILE 129 Ca 0.09 0.15 0.03 0.00 -0.27 0.00 0.00 62.75 62.75 3lho n ILE 129 Cb 0.14 -0.81 0.14 0.00 -1.74 0.00 0.00 39.64 37.37 3lho n ILE 129 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3lho n TYR 130 N -1.50 0.26 0.49 4.28 4.11 -0.62 -2.74 117.16 121.45 3lho n TYR 130 Ca 0.05 -1.32 0.12 0.00 -0.00 0.00 0.00 57.90 56.75 3lho n TYR 130 Cb 0.23 -0.23 0.22 0.00 -0.00 0.00 0.00 39.34 39.57 3lho n TYR 130 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 3lho h SER 131 N 1.15 0.00 0.00 9.48 4.64 0.30 -3.46 113.55 125.66 3lho h SER 131 Ca -0.03 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 3lho h SER 131 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3lho h SER 131 CO 0.09 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 3lho n GLY 132 N 1.28 -0.16 3.74 -0.77 0.00 0.10 -4.83 105.19 104.56 3lho n GLY 132 Ca 0.04 -1.06 -0.40 0.00 0.00 0.00 0.00 46.02 44.60 3lho n GLY 132 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lho s ARG 133 N 0.00 4.54 0.00 1.61 0.52 -1.24 -1.32 118.95 123.06 3lho s ARG 133 Ca 0.00 1.17 0.12 0.00 -0.52 0.00 0.00 55.73 56.50 3lho s ARG 133 Cb 0.00 -3.38 0.18 0.00 0.52 0.00 0.00 34.95 32.28 3lho s ARG 133 CO 0.00 0.24 1.03 0.72 0.02 0.00 0.00 175.30 177.31 3lho n HIS 134 N 2.90 0.18 -4.18 -0.53 8.25 -1.26 -5.01 115.22 115.56 3lho n HIS 134 Ca -0.01 -0.17 -0.17 0.00 -0.26 0.00 0.00 57.72 57.12 3lho n HIS 134 Cb 0.50 -0.01 -0.12 0.00 1.12 0.00 0.00 29.99 31.48 3lho n HIS 134 CO 0.00 0.00 0.00 1.67 0.64 0.00 0.00 176.34 178.65 3lho s TRP 135 N -1.04 0.93 0.29 4.41 -2.14 -1.26 -4.46 118.94 115.68 3lho s TRP 135 Ca 0.19 -0.40 -0.29 0.00 2.66 0.00 0.00 56.10 58.25 3lho s TRP 135 Cb 0.12 -0.55 -0.10 0.00 -3.10 0.00 0.00 33.47 29.84 3lho s TRP 135 CO 0.17 -0.01 1.16 -0.51 -2.66 0.00 0.00 176.95 175.10 3lho s ASP 136 N -1.33 7.13 -0.09 -2.66 1.01 -1.26 -5.08 116.67 114.39 3lho s ASP 136 Ca -0.03 2.39 -0.10 0.00 0.71 0.00 0.00 52.55 55.51 3lho s ASP 136 Cb -0.08 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.24 3lho s ASP 136 CO 0.01 -0.26 0.28 0.54 0.21 0.00 0.00 175.17 175.96 3lho s VAL 137 N -1.13 0.01 0.44 -1.27 0.11 -1.26 -4.93 120.40 112.37 3lho s VAL 137 Ca 0.46 -0.09 0.08 0.00 -2.93 0.00 0.00 61.98 59.49 3lho s VAL 137 Cb -0.34 -0.43 0.00 0.00 -1.53 0.00 0.00 36.38 34.08 3lho s VAL 137 CO 0.44 -0.05 0.47 1.51 -3.33 0.00 0.00 175.10 174.14 3lho s ASP 138 N -0.10 5.23 0.20 3.54 1.47 -1.26 -0.97 116.67 124.78 3lho s ASP 138 Ca -0.02 -0.68 -0.07 0.00 1.18 0.00 0.00 52.55 52.96 3lho s ASP 138 Cb -0.03 -0.48 0.14 0.00 -0.34 0.00 0.00 42.92 42.22 3lho s ASP 138 CO 0.01 -0.76 1.66 0.11 0.68 0.00 0.00 175.17 176.86 3lho h LYS 139 N 0.82 0.95 -0.39 2.11 1.57 -1.95 -2.02 116.57 117.66 3lho h LYS 139 Ca -0.40 -0.32 -0.08 0.00 -1.87 0.00 0.00 60.65 57.98 3lho h LYS 139 Cb 1.27 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 3lho h LYS 139 CO 0.52 0.98 -0.10 0.00 -0.57 0.00 0.00 179.45 180.28 3lho h ALA 140 N 1.06 1.11 -0.08 3.86 0.00 -1.99 -0.20 119.26 123.01 3lho h ALA 140 Ca 0.15 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3lho h ALA 140 Cb 0.60 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3lho h ALA 140 CO 0.04 0.56 0.01 1.15 0.00 0.00 0.00 179.25 181.00 3lho h THR 141 N 0.62 1.23 -0.55 0.00 2.02 -1.90 -1.12 112.91 113.22 3lho h THR 141 Ca 0.11 -0.72 0.10 0.00 0.77 0.00 0.00 66.41 66.68 3lho h THR 141 Cb 0.53 1.55 -0.08 0.00 -1.74 0.00 0.00 68.15 68.41 3lho h THR 141 CO 0.03 0.20 0.07 0.22 0.37 0.00 0.00 175.52 176.41 3lho h TYR 142 N -0.12 0.09 -0.68 3.16 3.20 -1.07 -1.70 116.97 119.86 3lho h TYR 142 Ca 0.02 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.86 3lho h TYR 142 Cb 0.31 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 3lho h TYR 142 CO 0.02 -0.07 0.14 1.96 -1.64 0.00 0.00 178.16 178.58 3lho h GLN 143 N 0.19 1.09 -0.57 1.82 1.08 -0.89 -0.68 115.11 117.15 3lho h GLN 143 Ca 0.28 -0.27 -0.02 0.00 -1.45 0.00 0.00 58.65 57.20 3lho h GLN 143 Cb 0.42 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.68 3lho h GLN 143 CO -0.41 0.98 0.28 0.00 -0.95 0.00 0.00 178.83 178.73 3lho h ALA 144 N 1.12 0.73 -0.11 3.87 0.00 -0.85 -0.67 119.26 123.34 3lho h ALA 144 Ca 0.21 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3lho h ALA 144 Cb 0.39 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3lho h ALA 144 CO 0.01 0.28 0.05 -0.07 0.00 0.00 0.00 179.25 179.52 3lho h LEU 145 N 0.77 0.15 -1.84 0.00 3.38 -1.15 -3.01 115.31 113.61 3lho h LEU 145 Ca 0.20 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 58.05 3lho h LEU 145 Cb 0.10 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 3lho h LEU 145 CO -0.03 0.23 0.13 0.25 0.09 0.00 0.00 178.44 179.12 3lho h LEU 146 N 0.06 0.19 -1.59 1.67 5.85 -0.84 0.41 115.31 121.05 3lho h LEU 146 Ca 0.04 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3lho h LEU 146 Cb 0.12 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3lho h LEU 146 CO -0.00 0.13 -0.21 0.00 -0.34 0.00 0.00 178.44 178.02 3lho h ALA 147 N 1.88 1.29 0.00 1.25 0.00 -0.98 -3.23 119.26 119.47 3lho h ALA 147 Ca 0.08 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3lho h ALA 147 Cb 0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3lho h ALA 147 CO -0.02 0.26 -1.50 0.39 0.00 0.00 0.00 179.25 178.38 3lho n GLU 148 N -3.75 1.94 -3.28 0.00 1.02 -0.48 -5.00 120.64 111.09 3lho n GLU 148 Ca -0.02 -0.03 -0.04 0.00 -0.02 0.00 0.00 57.16 57.06 3lho n GLU 148 Cb 0.31 -1.21 -0.05 0.00 -0.02 0.00 0.00 31.44 30.47 3lho n GLU 148 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3lho s SER 149 N -3.69 -0.43 0.27 1.62 0.15 0.13 -5.00 113.70 106.76 3lho s SER 149 Ca -0.04 0.52 -0.03 0.00 0.70 0.00 0.00 55.95 57.10 3lho s SER 149 Cb 0.03 1.55 0.39 0.00 -1.71 0.00 0.00 66.02 66.29 3lho s SER 149 CO 0.34 -0.28 1.92 -0.33 1.20 0.00 0.00 173.24 176.09 3lho h GLU 150 N 8.11 1.16 0.16 5.44 5.08 -1.79 -1.54 114.58 131.20 3lho h GLU 150 Ca -0.21 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.09 3lho h GLU 150 Cb 1.16 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 3lho h GLU 150 CO 0.26 0.77 -0.24 -0.92 -1.00 0.00 0.00 179.01 177.88 3lho h TYR 151 N 1.20 -0.64 -0.71 4.33 5.03 -1.94 -0.55 116.97 123.68 3lho h TYR 151 Ca 0.38 0.01 0.07 0.00 2.58 0.00 0.00 58.73 61.77 3lho h TYR 151 Cb 0.01 0.26 -0.06 0.00 1.55 0.00 0.00 36.73 38.50 3lho h TYR 151 CO -0.00 -0.35 0.40 0.00 -1.32 0.00 0.00 178.16 176.89 3lho h ALA 152 N 0.26 0.97 -0.72 1.82 0.00 -1.84 -1.69 119.26 118.05 3lho h ALA 152 Ca 0.02 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3lho h ALA 152 Cb 0.47 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3lho h ALA 152 CO -0.11 0.07 0.23 0.00 0.00 0.00 0.00 179.25 179.44 3lho h ALA 153 N 1.38 0.94 -0.05 0.00 0.00 -0.98 0.70 119.26 121.25 3lho h ALA 153 Ca 0.32 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 55.02 3lho h ALA 153 Cb 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3lho h ALA 153 CO -0.20 0.62 0.01 2.35 0.00 0.00 0.00 179.25 182.03 3lho h TRP 154 N 1.06 0.01 -0.70 0.00 7.01 -0.77 0.32 115.95 122.89 3lho h TRP 154 Ca 0.23 0.00 -0.05 0.00 2.11 0.00 0.00 58.89 61.19 3lho h TRP 154 Cb 0.30 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.33 3lho h TRP 154 CO 0.02 0.01 0.24 0.28 -2.79 0.00 0.00 178.44 176.20 3lho h VAL 155 N 0.03 1.25 -0.98 2.65 2.07 -1.04 -0.87 116.25 119.37 3lho h VAL 155 Ca 0.02 -0.84 0.01 0.00 0.82 0.00 0.00 66.70 66.71 3lho h VAL 155 Cb 0.02 0.48 -0.05 0.00 -1.52 0.00 0.00 31.29 30.22 3lho h VAL 155 CO -0.03 0.33 0.63 0.00 0.02 0.00 0.00 177.57 178.52 3lho h ALA 156 N 1.11 1.24 -0.00 1.67 0.00 -0.33 0.56 119.26 123.52 3lho h ALA 156 Ca 0.23 -0.08 -0.25 0.00 0.00 0.00 0.00 54.91 54.80 3lho h ALA 156 Cb 0.27 -0.40 0.02 0.00 0.00 0.00 0.00 17.79 17.68 3lho h ALA 156 CO -0.01 0.65 -1.01 0.00 0.00 0.00 0.00 179.25 178.88 3lho h ALA 157 N 1.35 0.21 0.00 0.00 0.00 0.05 -3.40 119.26 117.46 3lho h ALA 157 Ca 0.36 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3lho h ALA 157 Cb -0.13 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3lho h ALA 157 CO -0.07 0.73 -1.02 1.28 0.00 0.00 0.00 179.25 180.17 3lho n LEU 158 N -3.82 0.06 0.00 0.00 4.77 -0.37 -4.92 117.00 112.72 3lho n LEU 158 Ca -0.10 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 3lho n LEU 158 Cb 0.87 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.96 3lho n LEU 158 CO 0.54 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3lho n GLY 159 N 1.93 1.05 3.39 -0.72 0.00 0.18 -3.63 105.19 107.40 3lho n GLY 159 Ca -0.01 -0.77 -0.45 0.00 0.00 0.00 0.00 46.02 44.80 3lho n GLY 159 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lho s TYR 160 N 0.00 3.15 0.11 1.61 2.02 -0.44 -4.82 117.35 118.98 3lho s TYR 160 Ca 0.00 -1.23 -0.19 0.00 -0.37 0.00 0.00 57.07 55.28 3lho s TYR 160 Cb 0.00 -4.06 0.05 0.00 -0.40 0.00 0.00 41.96 37.55 3lho s TYR 160 CO 0.00 -1.31 0.47 1.03 -1.57 0.00 0.00 175.55 174.17 3lho s ARG 161 N 2.30 1.09 0.28 -0.62 0.52 -1.11 -0.72 118.95 120.69 3lho s ARG 161 Ca 0.18 -0.52 -0.30 0.00 -0.52 0.00 0.00 55.73 54.57 3lho s ARG 161 Cb -0.17 0.49 -0.11 0.00 0.52 0.00 0.00 34.95 35.68 3lho s ARG 161 CO -0.00 -0.43 1.58 0.00 0.02 0.00 0.00 175.30 176.47 3lho s ALA 162 N -3.38 3.75 0.06 2.13 0.00 -1.26 -4.76 121.76 118.30 3lho s ALA 162 Ca 0.00 1.54 -0.15 0.00 0.00 0.00 0.00 51.96 53.35 3lho s ALA 162 Cb 0.00 -3.64 -0.25 0.00 0.00 0.00 0.00 23.12 19.24 3lho s ALA 162 CO -0.09 -0.94 1.16 -0.97 0.00 0.00 0.00 175.76 174.92 3lho h ASN 163 N 5.05 0.89 -4.90 0.00 -0.73 -1.52 -3.48 115.58 110.90 3lho h ASN 163 Ca -0.46 -0.76 -0.01 0.00 1.87 0.00 0.00 56.30 56.93 3lho h ASN 163 Cb 1.22 -0.27 -0.16 0.00 0.27 0.00 0.00 38.32 39.38 3lho h ASN 163 CO 0.81 1.54 0.26 -1.38 -0.37 0.00 0.00 177.43 178.28 3lho s HIS 164 N -3.23 -0.55 0.04 0.67 -3.43 -1.23 -4.46 115.29 103.10 3lho s HIS 164 Ca -0.10 0.65 -0.01 0.00 -0.80 0.00 0.00 55.06 54.81 3lho s HIS 164 Cb 0.06 0.49 -0.04 0.00 -1.43 0.00 0.00 32.58 31.66 3lho s HIS 164 CO 0.92 -0.69 0.19 -0.06 -2.00 0.00 0.00 174.74 173.10 3lho s PHE 165 N -2.49 3.50 -0.14 0.38 0.40 -1.26 -1.83 117.98 116.55 3lho s PHE 165 Ca -0.03 0.27 0.00 0.00 -0.60 0.00 0.00 56.93 56.56 3lho s PHE 165 Cb -0.01 -1.77 0.02 0.00 0.51 0.00 0.00 43.02 41.78 3lho s PHE 165 CO -0.03 0.60 -0.11 0.99 0.70 0.00 0.00 175.22 177.37 3lho s THR 166 N -1.44 1.35 0.25 0.64 2.01 0.39 -2.15 115.64 116.68 3lho s THR 166 Ca 0.32 -0.50 -0.30 0.00 0.31 0.00 0.00 61.69 61.53 3lho s THR 166 Cb -0.13 -1.30 -0.09 0.00 0.01 0.00 0.00 72.50 70.98 3lho s THR 166 CO 0.25 0.41 1.31 -0.69 -0.69 0.00 0.00 174.62 175.21 3lho s VAL 167 N 1.58 3.02 -0.46 3.82 1.01 -0.25 0.92 120.40 130.05 3lho s VAL 167 Ca 0.05 0.90 -0.25 0.00 0.00 0.00 0.00 61.98 62.68 3lho s VAL 167 Cb -0.13 -3.57 0.03 0.00 0.00 0.00 0.00 36.38 32.71 3lho s VAL 167 CO -0.10 0.16 0.90 -0.55 0.00 0.00 0.00 175.10 175.51 3lho s SER 168 N 0.05 6.49 0.15 3.32 0.15 -0.43 -1.27 113.70 122.16 3lho s SER 168 Ca 0.54 0.08 -0.13 0.00 0.70 0.00 0.00 55.95 57.15 3lho s SER 168 Cb -0.38 -2.44 0.03 0.00 -1.71 0.00 0.00 66.02 61.52 3lho s SER 168 CO 0.43 -1.02 1.65 0.40 1.20 0.00 0.00 173.24 175.90 3lho h ILE 169 N 6.05 1.24 -0.90 6.45 1.08 -1.37 -2.70 117.51 127.37 3lho h ILE 169 Ca -0.24 -0.86 0.23 0.00 -0.39 0.00 0.00 64.86 63.60 3lho h ILE 169 Cb 1.08 0.84 -0.16 0.00 -3.07 0.00 0.00 36.82 35.51 3lho h ILE 169 CO 1.01 0.31 0.02 0.78 -0.69 0.00 0.00 178.15 179.58 3lho h ASN 170 N 0.69 -0.43 0.62 1.72 4.21 -1.90 -1.53 115.58 118.96 3lho h ASN 170 Ca 0.16 0.25 0.00 0.00 1.21 0.00 0.00 56.30 57.91 3lho h ASN 170 Cb 0.34 0.43 0.00 0.00 -1.12 0.00 0.00 38.32 37.97 3lho h ASN 170 CO 0.00 -0.27 -0.27 0.47 -1.29 0.00 0.00 177.43 176.06 3lho n ASP 171 N -5.43 0.37 -4.65 5.81 8.00 -1.04 -4.84 116.55 114.77 3lho n ASP 171 Ca 0.19 -0.09 -0.43 0.00 0.71 0.00 0.00 54.79 55.17 3lho n ASP 171 Cb 0.63 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.67 3lho n ASP 171 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3lho s LEU 172 N -2.90 4.18 0.50 0.64 1.43 -0.58 -4.91 118.68 117.04 3lho s LEU 172 Ca 0.15 1.87 0.25 0.00 -1.03 0.00 0.00 54.13 55.37 3lho s LEU 172 Cb 0.18 -3.54 1.31 0.00 0.03 0.00 0.00 46.19 44.18 3lho s LEU 172 CO 0.60 -0.91 2.02 1.55 0.23 0.00 0.00 176.35 179.85 3lho h PRO 173 N 9.13 0.00 -0.02 1.29 0.13 -1.88 -3.19 132.00 137.46 3lho h PRO 173 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3lho h PRO 173 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3lho h PRO 173 CO 0.97 0.15 -0.24 0.39 -0.23 0.00 0.00 178.00 179.05 3lho n GLU 174 N -3.69 1.51 -4.51 0.86 1.02 -1.26 -4.93 120.64 109.64 3lho n GLU 174 Ca -0.02 -1.15 -0.21 0.00 -0.02 0.00 0.00 57.16 55.76 3lho n GLU 174 Cb 0.27 -1.48 -0.14 0.00 -0.02 0.00 0.00 31.44 30.07 3lho n GLU 174 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 3lho s PHE 175 N -2.28 1.26 -0.22 -0.32 0.08 -1.21 -5.04 117.98 110.25 3lho s PHE 175 Ca 0.25 -0.29 -0.05 0.00 0.12 0.00 0.00 56.93 56.96 3lho s PHE 175 Cb 0.19 -0.78 -0.12 0.00 -0.57 0.00 0.00 43.02 41.75 3lho s PHE 175 CO 0.45 0.01 -0.24 -1.91 -0.10 0.00 0.00 175.22 173.43 3lho n GLU 176 N 2.33 0.51 -4.59 0.44 2.13 -1.26 -4.73 120.64 115.46 3lho n GLU 176 Ca -0.16 0.17 -0.32 0.00 0.66 0.00 0.00 57.16 57.50 3lho n GLU 176 Cb 0.55 -1.37 -0.11 0.00 0.27 0.00 0.00 31.44 30.78 3lho n GLU 176 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 3lho s ARG 177 N -2.42 2.47 0.29 5.31 0.52 -1.26 -4.89 118.95 118.96 3lho s ARG 177 Ca -0.30 -0.75 0.01 0.00 -0.52 0.00 0.00 55.73 54.17 3lho s ARG 177 Cb 0.10 -2.43 0.55 0.00 0.52 0.00 0.00 34.95 33.69 3lho s ARG 177 CO 0.45 0.60 1.85 0.97 0.02 0.00 0.00 175.30 179.18 3lho h ILE 178 N 3.94 0.94 -0.81 1.52 2.10 -1.97 -0.75 117.51 122.48 3lho h ILE 178 Ca -0.48 -0.35 0.10 0.00 1.08 0.00 0.00 64.86 65.21 3lho h ILE 178 Cb 1.16 -0.15 -0.06 0.00 -1.09 0.00 0.00 36.82 36.68 3lho h ILE 178 CO 0.52 0.18 0.53 -0.33 -1.08 0.00 0.00 178.15 177.97 3lho h GLU 179 N 1.01 0.73 -0.02 2.19 3.07 -1.99 1.00 114.58 120.57 3lho h GLU 179 Ca 0.49 -0.04 -0.23 0.00 -0.50 0.00 0.00 59.36 59.08 3lho h GLU 179 Cb 0.45 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3lho h GLU 179 CO -0.25 0.48 -0.92 -0.44 -1.40 0.00 0.00 179.01 176.48 3lho h ASP 180 N 0.75 0.60 -0.35 1.42 3.32 -1.56 -1.73 116.42 118.87 3lho h ASP 180 Ca 0.38 -0.46 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 3lho h ASP 180 Cb 0.45 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 3lho h ASP 180 CO -0.15 1.26 0.14 0.58 -1.72 0.00 0.00 179.24 179.35 3lho h VAL 181 N 0.27 1.18 -0.97 -1.35 2.07 -0.80 -2.26 116.25 114.39 3lho h VAL 181 Ca -0.08 -0.55 0.05 0.00 0.82 0.00 0.00 66.70 66.94 3lho h VAL 181 Cb 1.55 0.91 -0.06 0.00 -1.52 0.00 0.00 31.29 32.17 3lho h VAL 181 CO 0.16 0.20 0.63 0.78 0.02 0.00 0.00 177.57 179.36 3lho h ASN 182 N 0.41 1.02 -0.40 0.57 2.35 -0.77 -1.29 115.58 117.48 3lho h ASN 182 Ca 0.12 -0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.78 3lho h ASN 182 Cb 0.17 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 3lho h ASN 182 CO -0.01 0.68 -0.07 -0.61 -1.65 0.00 0.00 177.43 175.78 3lho h GLN 183 N 1.18 0.75 -0.69 0.81 5.75 -1.11 -1.45 115.11 120.35 3lho h GLN 183 Ca 0.40 -0.27 -0.01 0.00 -0.15 0.00 0.00 58.65 58.61 3lho h GLN 183 Cb 0.08 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.55 3lho h GLN 183 CO -0.14 0.87 0.37 0.00 -2.65 0.00 0.00 178.83 177.28 3lho h ALA 184 N 0.85 1.36 -0.14 3.38 0.00 -0.91 -0.25 119.26 123.56 3lho h ALA 184 Ca 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3lho h ALA 184 Cb 0.58 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3lho h ALA 184 CO 0.03 0.52 -0.01 -0.07 0.00 0.00 0.00 179.25 179.72 3lho h LEU 185 N 0.96 0.25 -0.52 0.00 3.38 -1.00 -1.66 115.31 116.72 3lho h LEU 185 Ca 0.24 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 3lho h LEU 185 Cb 0.03 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3lho h LEU 185 CO -0.04 0.52 0.24 0.11 0.09 0.00 0.00 178.44 179.36 3lho h LYS 186 N -0.03 0.75 -0.42 1.13 1.57 -0.95 -1.75 116.57 116.87 3lho h LYS 186 Ca 0.04 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 58.72 3lho h LYS 186 Cb 0.40 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 3lho h LYS 186 CO 0.01 0.63 0.28 1.96 -0.57 0.00 0.00 179.45 181.76 3lho h GLN 187 N 0.70 0.48 -0.00 3.15 4.20 -1.04 -1.00 115.11 121.60 3lho h GLN 187 Ca 0.18 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.86 3lho h GLN 187 Cb 0.13 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3lho h GLN 187 CO -0.02 0.32 -0.01 0.00 -0.67 0.00 0.00 178.83 178.45 3lho n ALA 188 N -2.49 2.65 -0.29 3.87 0.00 -0.63 -4.91 120.51 118.72 3lho n ALA 188 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.26 3lho n ALA 188 Cb 0.12 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.11 3lho n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3lho n GLY 189 N 1.08 0.83 3.88 0.00 0.00 -0.38 -5.07 105.19 105.52 3lho n GLY 189 Ca 0.21 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 3lho n GLY 189 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3lho s PHE 190 N -2.00 3.49 -0.16 1.61 0.08 -0.69 -5.02 117.98 115.29 3lho s PHE 190 Ca 0.00 0.77 -0.07 0.00 0.12 0.00 0.00 56.93 57.75 3lho s PHE 190 Cb 0.00 -2.16 -0.04 0.00 -0.57 0.00 0.00 43.02 40.24 3lho s PHE 190 CO 0.00 0.39 0.07 0.08 -0.10 0.00 0.00 175.22 175.66 3lho s VAL 191 N -1.65 4.92 0.11 -0.44 1.01 -1.26 -4.03 120.40 119.06 3lho s VAL 191 Ca 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 61.98 62.39 3lho s VAL 191 Cb -0.12 -3.18 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 3lho s VAL 191 CO 0.21 0.51 0.28 -0.76 0.00 0.00 0.00 175.10 175.35 3lho s LEU 192 N -0.11 4.32 -0.01 3.92 1.43 -1.26 -4.54 118.68 122.43 3lho s LEU 192 Ca 0.07 0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 53.21 3lho s LEU 192 Cb -0.12 -3.05 -0.07 0.00 0.03 0.00 0.00 46.19 42.98 3lho s LEU 192 CO 0.01 0.10 1.68 0.20 0.23 0.00 0.00 176.35 178.56 3lho s ASN 193 N -2.71 6.63 -0.09 2.29 0.01 0.15 -4.89 114.94 116.34 3lho s ASN 193 Ca 0.37 2.35 0.12 0.00 -0.71 0.00 0.00 52.86 54.99 3lho s ASN 193 Cb -0.12 -2.54 0.26 0.00 0.41 0.00 0.00 41.25 39.25 3lho s ASN 193 CO 0.28 -0.92 1.18 -1.54 -1.51 0.00 0.00 177.10 174.58 3lho n SER 194 N 6.67 2.63 0.00 -1.22 3.41 -1.26 -4.35 113.62 119.49 3lho n SER 194 Ca 0.17 -2.64 0.00 0.00 -0.26 0.00 0.00 58.87 56.14 3lho n SER 194 Cb 0.42 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 3lho n SER 194 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3lho n SER 195 N -0.75 0.00 -0.44 4.04 7.64 -1.26 -2.31 113.62 120.54 3lho n SER 195 Ca 0.12 0.65 0.00 0.00 1.01 0.00 0.00 58.87 60.66 3lho n SER 195 Cb 0.55 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 3lho n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3lho n GLY 196 N -0.73 0.19 0.00 0.23 0.00 -1.26 -4.86 105.19 98.77 3lho n GLY 196 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3lho n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lho n GLY 197 N 0.32 -0.64 0.23 -0.02 0.00 -0.98 -4.74 105.19 99.37 3lho n GLY 197 Ca 0.00 -1.58 0.10 0.00 0.00 0.00 0.00 46.02 44.53 3lho n GLY 197 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3lho h GLU 198 N 0.00 0.00 -5.21 1.61 5.08 -1.76 -3.41 114.58 110.89 3lho h GLU 198 Ca 0.00 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.69 3lho h GLU 198 Cb 0.00 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 28.92 3lho h GLU 198 CO 0.00 0.23 -0.85 0.08 -1.00 0.00 0.00 179.01 177.47 3lho s VAL 199 N -3.88 2.25 -0.19 3.13 1.01 -1.26 -4.48 120.40 116.98 3lho s VAL 199 Ca -0.01 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 3lho s VAL 199 Cb 0.12 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 3lho s VAL 199 CO 0.63 0.54 0.12 -0.54 0.00 0.00 0.00 175.10 175.85 3lho s LYS 200 N 0.76 4.13 0.90 2.72 3.01 0.23 -4.94 119.74 126.54 3lho s LYS 200 Ca -0.08 -0.24 0.00 0.00 -1.01 0.00 0.00 55.97 54.64 3lho s LYS 200 Cb -0.16 -3.37 0.00 0.00 -1.01 0.00 0.00 37.83 33.29 3lho s LYS 200 CO -0.00 0.31 0.00 0.41 0.51 0.00 0.00 175.35 176.57 3lho n GLY 201 N 3.49 -1.82 3.63 -3.33 0.00 -1.26 -1.09 105.19 104.81 3lho n GLY 201 Ca -0.16 -1.63 -0.04 0.00 0.00 0.00 0.00 46.02 44.19 3lho n GLY 201 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3lho s SER 202 N -4.00 -0.21 0.46 1.61 1.04 -0.81 -4.87 113.70 106.92 3lho s SER 202 Ca 0.00 -0.17 0.14 0.00 0.48 0.00 0.00 55.95 56.40 3lho s SER 202 Cb 0.00 0.35 1.10 0.00 0.10 0.00 0.00 66.02 67.57 3lho s SER 202 CO 0.00 -0.62 2.04 -0.65 0.98 0.00 0.00 173.24 174.99 3lho h PRO 203 N 2.00 0.28 0.00 4.02 0.11 -1.96 -2.40 132.00 134.06 3lho h PRO 203 Ca -0.23 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.83 3lho h PRO 203 Cb 1.22 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.26 3lho h PRO 203 CO 0.27 0.19 -0.19 0.93 -0.21 0.00 0.00 178.00 178.99 3lho h GLU 204 N 0.29 0.00 -0.61 1.05 3.07 -1.95 -1.73 114.58 114.71 3lho h GLU 204 Ca 0.18 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3lho h GLU 204 Cb 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 3lho h GLU 204 CO -0.04 0.19 0.00 1.33 -1.40 0.00 0.00 179.01 179.09 3lho n VAL 205 N -3.45 1.22 -1.07 3.13 0.24 -0.93 -4.98 118.33 112.49 3lho n VAL 205 Ca -0.01 -1.07 -0.02 0.00 -2.04 0.00 0.00 64.34 61.20 3lho n VAL 205 Cb 0.36 0.40 -0.01 0.00 -1.47 0.00 0.00 33.84 33.12 3lho n VAL 205 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3lho n LEU 206 N 1.19 0.24 -3.66 1.34 4.77 -0.65 -1.59 117.00 118.63 3lho n LEU 206 Ca 0.22 0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 56.17 3lho n LEU 206 Cb 0.64 -1.59 -0.09 0.00 -2.33 0.00 0.00 43.42 40.06 3lho n LEU 206 CO 0.16 -0.53 0.23 -0.22 -1.33 0.00 0.00 177.39 175.70 3lho s LEU 207 N -0.54 -0.58 -0.04 2.23 2.96 -1.17 -1.65 118.68 119.90 3lho s LEU 207 Ca 0.00 1.25 0.04 0.00 -0.22 0.00 0.00 54.13 55.20 3lho s LEU 207 Cb 0.00 1.96 -0.00 0.00 0.50 0.00 0.00 46.19 48.65 3lho s LEU 207 CO 0.00 -0.22 -0.15 -1.61 -1.32 0.00 0.00 176.35 173.05 3lho s GLU 208 N 1.48 1.50 0.04 1.98 2.02 -0.48 -1.93 118.70 123.32 3lho s GLU 208 Ca -0.09 -0.51 0.02 0.00 0.02 0.00 0.00 54.97 54.40 3lho s GLU 208 Cb -0.06 -1.33 -0.03 0.00 0.10 0.00 0.00 34.13 32.81 3lho s GLU 208 CO -0.16 0.21 -0.07 -0.65 0.02 0.00 0.00 175.26 174.61 3lho s GLN 209 N 0.06 0.53 0.16 1.61 -0.21 -0.25 -1.02 119.66 120.54 3lho s GLN 209 Ca -0.03 -0.80 -0.07 0.00 0.02 0.00 0.00 55.36 54.48 3lho s GLN 209 Cb -0.10 -0.24 -0.01 0.00 1.00 0.00 0.00 33.01 33.66 3lho s GLN 209 CO 0.01 0.03 0.24 -1.54 -2.12 0.00 0.00 175.29 171.92 3lho s SER 210 N -1.71 0.09 0.05 5.90 1.04 -0.66 -0.60 113.70 117.81 3lho s SER 210 Ca -0.09 -0.95 -0.18 0.00 0.48 0.00 0.00 55.95 55.22 3lho s SER 210 Cb -0.08 0.41 0.04 0.00 0.10 0.00 0.00 66.02 66.48 3lho s SER 210 CO -0.00 -0.87 0.42 -0.94 0.98 0.00 0.00 173.24 172.83 3lho s SER 211 N -2.99 -0.29 0.00 7.02 1.04 -1.26 -0.78 113.70 116.44 3lho s SER 211 Ca 0.19 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.60 3lho s SER 211 Cb 0.04 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.60 3lho s SER 211 CO 0.01 -0.69 0.00 0.35 0.98 0.00 0.00 173.24 173.89 3lho n THR 212 N 0.42 0.00 -4.18 2.02 -2.24 -0.36 -0.67 114.28 109.27 3lho n THR 212 Ca -0.18 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.25 3lho n THR 212 Cb 0.60 -0.01 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 3lho n THR 212 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3lho s ALA 214 N -2.75 3.50 1.11 6.98 0.00 -1.26 -4.11 121.76 125.22 3lho s ALA 214 Ca 0.00 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 51.04 3lho s ALA 214 Cb 0.00 -1.59 0.16 0.00 0.00 0.00 0.00 23.12 21.69 3lho s ALA 214 CO 0.00 0.64 0.66 -0.25 0.00 0.00 0.00 175.76 176.81 3lho n ASP 215 N 1.70 -1.19 -4.24 0.00 8.00 -0.67 -4.80 116.55 115.33 3lho n ASP 215 Ca -0.16 -0.98 -0.24 0.00 0.71 0.00 0.00 54.79 54.11 3lho n ASP 215 Cb 0.53 -0.58 -0.14 0.00 -0.02 0.00 0.00 41.12 40.92 3lho n ASP 215 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3lho s LYS 216 N -4.49 1.27 0.06 -1.24 1.02 -1.26 -0.55 119.74 114.55 3lho s LYS 216 Ca 0.41 -0.96 -0.01 0.00 0.02 0.00 0.00 55.97 55.44 3lho s LYS 216 Cb -0.03 -1.39 -0.04 0.00 -0.52 0.00 0.00 37.83 35.84 3lho s LYS 216 CO 0.31 0.35 -0.03 0.14 -0.92 0.00 0.00 175.35 175.20 3lho s VAL 217 N -0.88 0.28 -0.17 3.17 -7.23 -0.12 -4.80 120.40 110.64 3lho s VAL 217 Ca 0.06 -1.84 -0.16 0.00 -1.81 0.00 0.00 61.98 58.23 3lho s VAL 217 Cb -0.09 -1.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.22 3lho s VAL 217 CO 0.02 -0.94 0.41 -0.69 -0.31 0.00 0.00 175.10 173.59 3lho s VAL 218 N -3.89 5.21 -0.16 1.32 1.01 -1.26 -1.02 120.40 121.62 3lho s VAL 218 Ca 0.09 0.76 -0.06 0.00 0.00 0.00 0.00 61.98 62.78 3lho s VAL 218 Cb 0.08 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 3lho s VAL 218 CO -0.08 0.29 0.03 -0.69 0.00 0.00 0.00 175.10 174.65 3lho s VAL 219 N 0.98 4.52 -1.08 2.92 1.01 0.62 -4.93 120.40 124.43 3lho s VAL 219 Ca 0.21 -0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.91 3lho s VAL 219 Cb -0.15 -3.00 0.20 0.00 0.00 0.00 0.00 36.38 33.44 3lho s VAL 219 CO 0.08 0.50 1.20 0.20 0.00 0.00 0.00 175.10 177.08 3lho s ASN 220 N 0.11 7.02 0.82 3.32 -0.87 -1.26 -1.38 114.94 122.70 3lho s ASN 220 Ca 0.03 -2.94 -0.11 0.00 -1.57 0.00 0.00 52.86 48.27 3lho s ASN 220 Cb -0.13 -2.32 0.09 0.00 -0.02 0.00 0.00 41.25 38.87 3lho s ASN 220 CO 0.01 -0.66 1.10 -0.36 -2.57 0.00 0.00 177.10 174.62 3lho s PHE 221 N 0.83 2.36 0.39 2.20 0.08 0.74 -4.88 117.98 119.70 3lho s PHE 221 Ca 0.34 1.53 0.07 0.00 0.12 0.00 0.00 56.93 59.00 3lho s PHE 221 Cb -0.06 -3.11 0.82 0.00 -0.57 0.00 0.00 43.02 40.10 3lho s PHE 221 CO -0.05 -2.10 2.00 1.79 -0.10 0.00 0.00 175.22 176.77 3lho h THR 222 N -1.35 1.04 -0.13 0.64 1.35 -1.41 -3.04 112.91 110.02 3lho h THR 222 Ca -0.45 -0.22 -0.04 0.00 -0.55 0.00 0.00 66.41 65.15 3lho h THR 222 Cb 1.25 0.35 -0.03 0.00 -1.73 0.00 0.00 68.15 67.99 3lho h THR 222 CO 0.50 0.12 -0.16 -0.90 -0.25 0.00 0.00 175.52 174.83 3lho n ASP 223 N -4.47 2.48 0.00 5.36 5.75 -1.26 -5.05 116.55 119.36 3lho n ASP 223 Ca 0.07 -3.47 0.00 0.00 -0.01 0.00 0.00 54.79 51.38 3lho n ASP 223 Cb 0.17 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.74 3lho n ASP 223 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3lho n GLY 224 N -1.11 1.77 3.22 6.12 0.00 -1.15 -4.95 105.19 109.10 3lho n GLY 224 Ca 0.22 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 3lho n GLY 224 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3lho s ASP 225 N 0.00 5.26 -0.11 1.61 1.01 -1.26 -0.19 116.67 122.99 3lho s ASP 225 Ca 0.00 -1.39 0.02 0.00 0.71 0.00 0.00 52.55 51.88 3lho s ASP 225 Cb 0.00 -1.84 -0.01 0.00 1.01 0.00 0.00 42.92 42.07 3lho s ASP 225 CO 0.00 -0.38 -0.17 -0.69 0.21 0.00 0.00 175.17 174.14 3lho s VAL 226 N 1.32 2.73 -0.17 -1.27 1.01 -0.48 -4.91 120.40 118.63 3lho s VAL 226 Ca 0.00 -0.79 -0.27 0.00 0.00 0.00 0.00 61.98 60.92 3lho s VAL 226 Cb -0.21 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 3lho s VAL 226 CO 0.00 0.54 0.92 -0.70 0.00 0.00 0.00 175.10 175.87 3lho s GLU 227 N 0.19 4.31 0.14 2.72 2.12 -1.26 -0.28 118.70 126.64 3lho s GLU 227 Ca -0.10 1.17 0.03 0.00 0.36 0.00 0.00 54.97 56.43 3lho s GLU 227 Cb -0.16 -3.59 -0.04 0.00 0.26 0.00 0.00 34.13 30.60 3lho s GLU 227 CO 0.06 -0.40 -0.07 0.96 -0.54 0.00 0.00 175.26 175.26 3lho s ILE 228 N 2.40 0.96 0.38 -3.70 -4.36 -0.19 -4.96 121.20 111.73 3lho s ILE 228 Ca 0.42 -2.01 -0.28 0.00 -0.26 0.00 0.00 60.65 58.51 3lho s ILE 228 Cb -0.17 -1.85 -0.11 0.00 1.25 0.00 0.00 42.46 41.58 3lho s ILE 228 CO 0.12 -0.73 1.50 -2.84 0.24 0.00 0.00 174.94 173.22 3lho s PRO 229 N -3.80 4.10 0.00 0.37 0.02 -1.26 -0.95 135.00 133.48 3lho s PRO 229 Ca 0.17 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.77 3lho s PRO 229 Cb 0.04 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.59 3lho s PRO 229 CO -0.00 -0.55 0.00 -1.13 -0.33 0.00 0.00 177.00 174.99 3lho n SER 230 N 0.49 0.00 -4.13 2.53 3.41 0.29 -4.78 113.62 111.43 3lho n SER 230 Ca 0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.48 3lho n SER 230 Cb 0.39 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.23 3lho n SER 230 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3lho s PHE 232 N -1.98 3.07 -0.12 0.00 -0.12 -1.26 -1.68 117.98 115.89 3lho s PHE 232 Ca -0.01 0.06 -0.02 0.00 -0.05 0.00 0.00 56.93 56.91 3lho s PHE 232 Cb -0.06 -2.42 -0.03 0.00 -0.63 0.00 0.00 43.02 39.89 3lho s PHE 232 CO -0.00 -0.48 -0.04 -0.47 -0.05 0.00 0.00 175.22 174.17 3lho s TYR 233 N -2.56 3.02 0.28 3.49 5.04 -1.26 -4.53 117.35 120.83 3lho s TYR 233 Ca 0.51 -0.14 0.10 0.00 -2.44 0.00 0.00 57.07 55.11 3lho s TYR 233 Cb -0.10 -1.86 -0.05 0.00 0.35 0.00 0.00 41.96 40.30 3lho s TYR 233 CO 0.37 0.14 -0.08 -2.00 -1.34 0.00 0.00 175.55 172.65 3lho s GLU 234 N -0.16 2.03 -0.02 4.97 2.12 -0.91 -1.23 118.70 125.49 3lho s GLU 234 Ca 0.03 -1.60 0.01 0.00 0.36 0.00 0.00 54.97 53.76 3lho s GLU 234 Cb -0.13 -1.98 0.02 0.00 0.26 0.00 0.00 34.13 32.30 3lho s GLU 234 CO 0.02 0.32 -0.01 -0.06 -0.54 0.00 0.00 175.26 174.99 3lho s PHE 235 N -2.43 0.32 -0.02 5.30 0.08 0.04 -1.09 117.98 120.18 3lho s PHE 235 Ca 0.31 -0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.35 3lho s PHE 235 Cb -0.05 -0.35 0.01 0.00 -0.57 0.00 0.00 43.02 42.07 3lho s PHE 235 CO 0.18 -0.09 -0.03 0.00 -0.10 0.00 0.00 175.22 175.18 3lho s ALA 236 N 0.68 0.42 -0.19 5.36 0.00 -0.39 -1.66 121.76 125.98 3lho s ALA 236 Ca -0.07 -0.02 -0.04 0.00 0.00 0.00 0.00 51.96 51.84 3lho s ALA 236 Cb -0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 3lho s ALA 236 CO -0.01 0.01 -0.04 0.50 0.00 0.00 0.00 175.76 176.22 3lho s ARG 237 N 0.55 3.52 0.07 0.00 3.52 -0.19 -0.96 118.95 125.46 3lho s ARG 237 Ca -0.06 -0.58 0.02 0.00 -0.13 0.00 0.00 55.73 54.99 3lho s ARG 237 Cb -0.09 -2.95 -0.04 0.00 -1.56 0.00 0.00 34.95 30.31 3lho s ARG 237 CO -0.01 0.03 0.10 1.03 -0.81 0.00 0.00 175.30 175.64 3lho s ARG 238 N 0.90 2.97 0.20 5.12 0.52 -1.26 -1.38 118.95 126.02 3lho s ARG 238 Ca -0.00 -0.64 0.10 0.00 -0.52 0.00 0.00 55.73 54.66 3lho s ARG 238 Cb -0.15 -2.78 -0.04 0.00 0.52 0.00 0.00 34.95 32.50 3lho s ARG 238 CO 0.01 0.58 -0.15 0.71 0.02 0.00 0.00 175.30 176.47 3lho s TYR 239 N -1.39 2.50 0.00 -0.53 1.51 -0.66 -4.93 117.35 113.85 3lho s TYR 239 Ca 0.30 -0.28 0.00 0.00 -1.01 0.00 0.00 57.07 56.08 3lho s TYR 239 Cb -0.12 -1.21 0.00 0.00 -0.11 0.00 0.00 41.96 40.52 3lho s TYR 239 CO 0.22 0.53 0.00 -2.30 -1.11 0.00 0.00 175.55 172.89 3lho n PRO 240 N 0.01 0.49 -0.10 -1.71 -0.02 -1.26 -1.24 135.00 131.17 3lho n PRO 240 Ca -0.11 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.26 3lho n PRO 240 Cb 0.56 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.06 3lho n PRO 240 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3lho h ALA 242 N -2.00 0.66 -0.04 3.55 0.00 -2.02 -3.46 119.26 115.96 3lho h ALA 242 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3lho h ALA 242 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3lho h ALA 242 CO 0.00 0.67 0.00 0.27 0.00 0.00 0.00 179.25 180.19 3lho n ASN 243 N -4.06 0.64 0.00 0.00 6.94 -1.26 -4.92 115.26 112.60 3lho n ASN 243 Ca -0.02 -1.37 0.00 0.00 -0.02 0.00 0.00 54.58 53.17 3lho n ASN 243 Cb 0.52 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.92 3lho n ASN 243 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3lho n GLY 244 N 1.00 3.21 3.81 4.83 0.00 -1.26 -5.05 105.19 111.73 3lho n GLY 244 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 3lho n GLY 244 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3lho s GLN 245 N -0.75 3.92 0.34 1.61 -0.21 -1.26 -4.78 119.66 118.53 3lho s GLN 245 Ca 0.00 1.19 -0.28 0.00 0.02 0.00 0.00 55.36 56.29 3lho s GLN 245 Cb 0.00 -2.12 -0.10 0.00 1.00 0.00 0.00 33.01 31.79 3lho s GLN 245 CO 0.00 -0.30 1.27 -0.51 -2.12 0.00 0.00 175.29 173.62 3lho s LEU 246 N -3.59 4.40 0.18 2.90 1.43 -1.26 -4.43 118.68 118.31 3lho s LEU 246 Ca 0.64 2.60 -0.32 0.00 -1.03 0.00 0.00 54.13 56.02 3lho s LEU 246 Cb -0.13 -3.70 -0.12 0.00 0.03 0.00 0.00 46.19 42.28 3lho s LEU 246 CO 0.21 -0.52 1.77 0.00 0.23 0.00 0.00 176.35 178.04 3lho n TYR 247 N 0.73 2.72 0.13 0.29 9.36 -0.37 -4.92 117.16 125.09 3lho n TYR 247 Ca 0.01 -0.04 0.08 0.00 3.32 0.00 0.00 57.90 61.27 3lho n TYR 247 Cb 0.43 -2.70 0.16 0.00 -0.63 0.00 0.00 39.34 36.60 3lho n TYR 247 CO 0.00 0.00 0.00 0.25 0.22 0.00 0.00 176.86 177.33 3lho n THR 248 N 4.25 0.58 -1.91 2.97 -2.24 -1.26 -4.75 114.28 111.93 3lho n THR 248 Ca 0.17 -0.79 -0.30 0.00 -2.27 0.00 0.00 64.05 60.86 3lho n THR 248 Cb 0.36 0.85 0.18 0.00 -2.10 0.00 0.00 70.33 69.62 3lho n THR 248 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3lho s GLY 249 N -1.15 1.77 0.00 3.38 0.00 -1.26 -5.04 107.32 105.02 3lho s GLY 249 Ca 0.28 -1.17 0.00 0.00 0.00 0.00 0.00 44.72 43.83 3lho s GLY 249 CO 0.22 -0.41 0.27 0.69 0.00 0.00 0.00 173.10 173.87 3lho n PHE 250 N -3.78 0.00 -4.55 1.90 3.01 -1.26 -5.00 117.46 107.78 3lho n PHE 250 Ca 0.15 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.35 3lho n PHE 250 Cb 0.59 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.97 3lho n PHE 250 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 3lho s VAL 251 N -0.32 1.21 -0.03 -4.37 -7.23 -1.26 -5.10 120.40 103.30 3lho s VAL 251 Ca 0.00 -2.00 -0.37 0.00 -1.81 0.00 0.00 61.98 57.80 3lho s VAL 251 Cb 0.00 -2.63 -0.16 0.00 0.56 0.00 0.00 36.38 34.15 3lho s VAL 251 CO 0.00 0.00 1.53 0.00 -0.31 0.00 0.00 175.10 176.32 3lho n ALA 252 N -0.89 -0.38 0.00 1.32 0.00 -1.26 -4.95 120.51 114.35 3lho n ALA 252 Ca -0.06 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.83 3lho n ALA 252 Cb 0.66 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.94 3lho n ALA 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50