#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iho s LEU 2 N 0.00 4.54 -0.26 -0.89 1.43 -0.94 -4.93 118.68 117.62 1iho s LEU 2 Ca 0.00 1.64 -0.04 0.00 -1.03 0.00 0.00 54.13 54.70 1iho s LEU 2 Cb 0.00 -3.35 0.02 0.00 0.03 0.00 0.00 46.19 42.88 1iho s LEU 2 CO 0.00 0.10 -0.01 -0.63 0.23 0.00 0.00 176.35 176.05 1iho s ILE 3 N -0.65 3.33 -0.10 -0.59 1.01 -1.26 -0.41 121.20 122.54 1iho s ILE 3 Ca 0.39 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 60.21 1iho s ILE 3 Cb -0.23 -2.68 -0.02 0.00 0.01 0.00 0.00 42.46 39.54 1iho s ILE 3 CO 0.26 0.18 -0.12 -0.63 0.00 0.00 0.00 174.94 174.63 1iho s ILE 4 N 1.41 3.15 -0.05 2.92 -1.09 0.11 -4.97 121.20 122.69 1iho s ILE 4 Ca 0.02 -0.65 0.02 0.00 -2.23 0.00 0.00 60.65 57.80 1iho s ILE 4 Cb -0.17 -2.29 -0.02 0.00 -1.58 0.00 0.00 42.46 38.40 1iho s ILE 4 CO -0.02 0.55 0.05 -0.62 -1.23 0.00 0.00 174.94 173.68 1iho n GLU 5 N 3.02 4.34 -4.41 2.79 1.02 -1.26 -0.81 120.64 125.32 1iho n GLU 5 Ca -0.18 -0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.69 1iho n GLU 5 Cb 0.53 -0.73 -0.12 0.00 -0.02 0.00 0.00 31.44 31.10 1iho n GLU 5 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1iho s THR 6 N -1.47 2.40 0.13 2.62 -4.23 -1.26 -4.20 115.64 109.63 1iho s THR 6 Ca 0.00 -2.00 -0.18 0.00 -1.18 0.00 0.00 61.69 58.34 1iho s THR 6 Cb 0.01 -2.15 -0.03 0.00 1.34 0.00 0.00 72.50 71.67 1iho s THR 6 CO 0.06 -0.11 1.72 -0.07 -0.54 0.00 0.00 174.62 175.68 1iho h LEU 7 N 3.21 0.40 -0.64 4.79 3.38 -1.96 -1.63 115.31 122.87 1iho h LEU 7 Ca -0.47 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 57.44 1iho h LEU 7 Cb 1.21 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 1iho h LEU 7 CO 0.48 0.39 0.38 -0.65 0.09 0.00 0.00 178.44 179.13 1iho h PRO 8 N 0.39 0.72 -0.06 1.13 0.11 -1.99 -0.12 132.00 132.17 1iho h PRO 8 Ca 0.11 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.07 1iho h PRO 8 Cb 0.08 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.02 1iho h PRO 8 CO -0.02 0.48 -0.46 -0.07 -0.21 0.00 0.00 178.00 177.72 1iho h LEU 9 N 0.74 0.16 -0.25 2.35 3.38 -1.98 -1.67 115.31 118.04 1iho h LEU 9 Ca 0.27 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.09 1iho h LEU 9 Cb 0.07 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1iho h LEU 9 CO -0.13 0.61 -0.14 0.25 0.09 0.00 0.00 178.44 179.12 1iho h LEU 10 N 0.13 0.56 -1.21 1.67 5.85 -0.72 -2.54 115.31 119.05 1iho h LEU 10 Ca 0.01 -0.42 -0.03 0.00 0.84 0.00 0.00 57.88 58.28 1iho h LEU 10 Cb 0.87 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 1iho h LEU 10 CO 0.07 0.86 0.18 -0.09 -0.34 0.00 0.00 178.44 179.11 1iho h ARG 11 N 0.26 0.73 -0.42 1.25 2.43 -0.83 0.82 114.38 118.63 1iho h ARG 11 Ca 0.05 -0.11 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1iho h ARG 11 Cb 0.65 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1iho h ARG 11 CO 0.04 0.62 0.21 0.37 -1.51 0.00 0.00 179.97 179.70 1iho h GLN 12 N 0.72 0.60 -0.41 0.20 4.15 -1.25 0.07 115.11 119.19 1iho h GLN 12 Ca 0.17 -0.08 -0.06 0.00 0.77 0.00 0.00 58.65 59.45 1iho h GLN 12 Cb 0.18 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.74 1iho h GLN 12 CO -0.01 0.51 0.04 1.96 -1.93 0.00 0.00 178.83 179.40 1iho h GLN 13 N 0.54 0.70 -0.16 1.69 1.08 -0.93 -1.85 115.11 116.18 1iho h GLN 13 Ca 0.15 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 57.12 1iho h GLN 13 Cb 0.10 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 1iho h GLN 13 CO -0.02 0.76 0.03 0.82 -0.95 0.00 0.00 178.83 179.47 1iho h ILE 14 N 0.55 1.21 -0.69 2.54 1.08 -0.79 -0.20 117.51 121.22 1iho h ILE 14 Ca 0.12 -0.68 0.08 0.00 -0.39 0.00 0.00 64.86 63.99 1iho h ILE 14 Cb 0.42 1.37 -0.07 0.00 -3.07 0.00 0.00 36.82 35.47 1iho h ILE 14 CO 0.01 0.21 0.35 0.03 -0.69 0.00 0.00 178.15 178.05 1iho h ARG 15 N 0.05 0.58 -0.22 2.37 3.08 -0.94 -1.34 114.38 117.96 1iho h ARG 15 Ca 0.05 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.93 1iho h ARG 15 Cb 0.29 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 1iho h ARG 15 CO 0.00 0.39 -0.42 0.00 -1.07 0.00 0.00 179.97 178.87 1iho h ARG 16 N 0.60 0.52 -0.39 0.04 3.08 -1.10 0.74 114.38 117.87 1iho h ARG 16 Ca 0.33 -0.27 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 1iho h ARG 16 Cb 0.32 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.36 1iho h ARG 16 CO -0.25 0.85 0.19 -0.07 -1.07 0.00 0.00 179.97 179.62 1iho h LEU 17 N 0.43 0.52 -0.95 3.04 3.38 -0.61 -2.42 115.31 118.70 1iho h LEU 17 Ca 0.03 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 1iho h LEU 17 Cb 0.91 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1iho h LEU 17 CO 0.08 0.50 -0.46 0.03 0.09 0.00 0.00 178.44 178.68 1iho h ARG 18 N 0.49 0.14 -0.52 1.13 3.08 -1.06 -2.07 114.38 115.56 1iho h ARG 18 Ca 0.13 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1iho h ARG 18 Cb 0.13 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 1iho h ARG 18 CO -0.02 0.57 0.27 1.98 -1.07 0.00 0.00 179.97 181.71 1iho h MET 19 N 0.11 0.72 0.00 0.04 4.05 -0.55 0.05 114.93 119.36 1iho h MET 19 Ca 0.01 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1iho h MET 19 Cb 0.86 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.52 1iho h MET 19 CO 0.07 0.54 0.00 0.39 0.23 0.00 0.00 176.91 178.14 1iho n GLU 20 N -4.39 0.97 -1.82 0.39 -0.58 -0.94 -4.88 120.64 109.38 1iho n GLU 20 Ca 0.05 0.00 -0.07 0.00 -0.42 0.00 0.00 57.16 56.72 1iho n GLU 20 Cb 0.11 -1.37 -0.01 0.00 -0.57 0.00 0.00 31.44 29.60 1iho n GLU 20 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1iho n GLY 21 N 0.81 0.36 3.74 0.62 0.00 0.00 -5.02 105.19 105.70 1iho n GLY 21 Ca 0.17 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 1iho n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iho s LYS 22 N -3.76 4.74 -0.03 1.61 -0.14 -0.81 -5.02 119.74 116.34 1iho s LYS 22 Ca 0.00 1.51 -0.29 0.00 -1.36 0.00 0.00 55.97 55.83 1iho s LYS 22 Cb 0.00 -3.32 -0.03 0.00 -1.68 0.00 0.00 37.83 32.80 1iho s LYS 22 CO 0.00 0.31 0.96 0.50 -0.76 0.00 0.00 175.35 176.36 1iho s ARG 23 N -0.53 4.52 -0.13 1.68 3.52 -1.26 -4.57 118.95 122.17 1iho s ARG 23 Ca 0.45 1.37 -0.03 0.00 -0.13 0.00 0.00 55.73 57.39 1iho s ARG 23 Cb -0.25 -3.48 -0.03 0.00 -1.56 0.00 0.00 34.95 29.63 1iho s ARG 23 CO 0.32 -0.10 -0.02 0.08 -0.81 0.00 0.00 175.30 174.77 1iho s VAL 24 N 1.21 4.07 -0.03 7.11 1.01 -1.26 -1.24 120.40 131.27 1iho s VAL 24 Ca 0.50 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 62.20 1iho s VAL 24 Cb -0.20 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1iho s VAL 24 CO 0.25 0.53 -0.10 0.00 0.00 0.00 0.00 175.10 175.78 1iho s ALA 25 N -0.09 2.86 -0.09 5.51 0.00 -0.52 0.02 121.76 129.45 1iho s ALA 25 Ca 0.03 -0.99 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1iho s ALA 25 Cb -0.13 -1.07 -0.00 0.00 0.00 0.00 0.00 23.12 21.92 1iho s ALA 25 CO 0.02 0.58 -0.24 -1.17 0.00 0.00 0.00 175.76 174.96 1iho s LEU 26 N -1.06 2.06 -0.38 0.00 2.96 -0.15 -0.78 118.68 121.34 1iho s LEU 26 Ca 0.14 -0.54 -0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1iho s LEU 26 Cb -0.11 -1.37 0.10 0.00 0.50 0.00 0.00 46.19 45.32 1iho s LEU 26 CO 0.04 0.17 0.14 -0.69 -1.32 0.00 0.00 176.35 174.69 1iho s VAL 27 N 0.25 2.93 0.09 1.68 1.01 -0.24 -1.81 120.40 124.31 1iho s VAL 27 Ca -0.16 -2.13 -0.30 0.00 0.00 0.00 0.00 61.98 59.39 1iho s VAL 27 Cb -0.17 -3.04 -0.06 0.00 0.00 0.00 0.00 36.38 33.12 1iho s VAL 27 CO 0.08 -0.64 1.07 -2.16 0.00 0.00 0.00 175.10 173.45 1iho s PRO 28 N 1.06 4.57 0.14 2.72 0.05 -1.26 -2.03 135.00 140.25 1iho s PRO 28 Ca 0.09 1.60 -0.05 0.00 0.05 0.00 0.00 61.00 62.69 1iho s PRO 28 Cb -0.21 -3.36 -0.02 0.00 0.05 0.00 0.00 34.50 30.96 1iho s PRO 28 CO -0.05 -0.00 0.17 0.95 0.05 0.00 0.00 177.00 178.12 1iho s THR 29 N 0.41 0.09 -0.24 1.26 -4.23 -0.37 -4.93 115.64 107.63 1iho s THR 29 Ca 0.52 -1.62 0.13 0.00 -1.18 0.00 0.00 61.69 59.54 1iho s THR 29 Cb -0.26 -1.90 0.51 0.00 1.34 0.00 0.00 72.50 72.19 1iho s THR 29 CO 0.31 -0.40 1.44 0.23 -0.54 0.00 0.00 174.62 175.66 1iho n MET 30 N -0.15 2.28 0.00 3.99 2.81 -1.26 -2.10 117.12 122.70 1iho n MET 30 Ca -0.07 -3.01 0.00 0.00 -1.81 0.00 0.00 57.70 52.81 1iho n MET 30 Cb 0.63 -1.83 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 1iho n MET 30 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iho n GLY 31 N -0.88 -2.01 3.43 3.03 0.00 -1.26 -4.49 105.19 103.00 1iho n GLY 31 Ca 0.28 -1.41 -0.17 0.00 0.00 0.00 0.00 46.02 44.72 1iho n GLY 31 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1iho n ASN 32 N 0.82 -2.51 -4.79 1.61 5.15 -1.26 -4.92 115.26 109.36 1iho n ASN 32 Ca 0.00 -0.65 -0.35 0.00 -0.60 0.00 0.00 54.58 52.98 1iho n ASN 32 Cb 0.00 -5.04 -0.05 0.00 -0.53 0.00 0.00 39.78 34.17 1iho n ASN 32 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1iho s LEU 33 N -6.28 4.06 0.32 1.20 1.43 -1.26 -5.06 118.68 113.09 1iho s LEU 33 Ca 0.05 1.94 0.02 0.00 -1.03 0.00 0.00 54.13 55.11 1iho s LEU 33 Cb -0.01 -4.31 -0.02 0.00 0.03 0.00 0.00 46.19 41.88 1iho s LEU 33 CO 0.74 -0.50 0.35 -1.38 0.23 0.00 0.00 176.35 175.79 1iho s HIS 34 N -1.81 1.35 0.44 0.29 -3.43 -1.26 -4.96 115.29 105.92 1iho s HIS 34 Ca 0.60 -1.45 0.10 0.00 -0.80 0.00 0.00 55.06 53.52 1iho s HIS 34 Cb -0.18 -0.40 0.97 0.00 -1.43 0.00 0.00 32.58 31.54 1iho s HIS 34 CO 0.23 -0.96 2.06 -0.44 -2.00 0.00 0.00 174.74 173.62 1iho h ASP 35 N 2.18 0.37 -0.52 7.38 3.32 -1.99 -0.20 116.42 126.96 1iho h ASP 35 Ca -0.28 -0.01 0.10 0.00 0.02 0.00 0.00 57.03 56.87 1iho h ASP 35 Cb 1.24 -0.09 -0.11 0.00 0.22 0.00 0.00 39.33 40.59 1iho h ASP 35 CO 0.39 0.26 -0.30 1.23 -1.72 0.00 0.00 179.24 179.10 1iho h GLY 36 N 0.43 -0.07 1.40 2.75 0.00 -1.98 -1.88 103.07 103.73 1iho h GLY 36 Ca 0.15 0.39 -0.12 0.00 0.00 0.00 0.00 47.33 47.75 1iho h GLY 36 CO -0.04 -0.21 -0.31 0.45 0.00 0.00 0.00 176.54 176.43 1iho h HIS 37 N -0.17 0.78 -0.19 5.60 3.86 -1.46 -2.67 115.15 120.91 1iho h HIS 37 Ca 0.22 -0.20 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1iho h HIS 37 Cb 0.53 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 1iho h HIS 37 CO -0.58 0.90 0.04 0.52 0.86 0.00 0.00 177.93 179.68 1iho h MET 38 N 0.57 0.26 -0.28 2.45 2.07 -0.97 -1.76 114.93 117.27 1iho h MET 38 Ca 0.07 -0.03 -0.14 0.00 -2.07 0.00 0.00 59.70 57.52 1iho h MET 38 Cb 0.82 -0.05 -0.01 0.00 -1.87 0.00 0.00 31.60 30.49 1iho h MET 38 CO 0.07 0.25 -0.41 -0.22 1.07 0.00 0.00 176.91 177.67 1iho h LYS 39 N 0.26 0.69 -0.36 1.72 1.63 -1.01 -1.16 116.57 118.34 1iho h LYS 39 Ca 0.07 -0.36 0.02 0.00 -0.85 0.00 0.00 60.65 59.53 1iho h LYS 39 Cb 0.11 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.73 1iho h LYS 39 CO -0.00 0.97 0.19 -0.07 -3.45 0.00 0.00 179.45 177.09 1iho h LEU 40 N 0.56 0.30 -0.60 5.20 3.38 -1.15 -0.83 115.31 122.17 1iho h LEU 40 Ca 0.04 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1iho h LEU 40 Cb 0.95 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 1iho h LEU 40 CO 0.09 0.22 0.39 0.58 0.09 0.00 0.00 178.44 179.80 1iho h VAL 41 N 0.39 1.13 -0.75 1.22 2.07 -1.20 -0.80 116.25 118.30 1iho h VAL 41 Ca 0.15 -0.27 -0.04 0.00 0.82 0.00 0.00 66.70 67.36 1iho h VAL 41 Cb 0.03 0.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 1iho h VAL 41 CO -0.09 0.14 0.32 0.44 0.02 0.00 0.00 177.57 178.41 1iho h ASP 42 N 0.78 1.00 -0.49 0.57 3.32 -0.83 0.17 116.42 120.95 1iho h ASP 42 Ca 0.23 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 57.04 1iho h ASP 42 Cb -0.05 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 1iho h ASP 42 CO -0.07 0.88 -0.05 -0.33 -1.72 0.00 0.00 179.24 177.95 1iho h GLU 43 N 1.08 0.94 -0.53 3.56 4.39 -0.83 -2.10 114.58 121.10 1iho h GLU 43 Ca 0.25 -0.30 -0.08 0.00 0.34 0.00 0.00 59.36 59.57 1iho h GLU 43 Cb 0.17 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 1iho h GLU 43 CO -0.03 0.96 0.00 0.00 -1.16 0.00 0.00 179.01 178.79 1iho h ALA 44 N 1.08 0.71 -0.53 3.43 0.00 -0.57 -2.46 119.26 120.93 1iho h ALA 44 Ca 0.15 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1iho h ALA 44 Cb 0.57 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1iho h ALA 44 CO 0.03 0.52 0.10 0.87 0.00 0.00 0.00 179.25 180.78 1iho h LYS 45 N 0.80 0.82 0.00 0.00 1.79 -0.51 -1.71 116.57 117.76 1iho h LYS 45 Ca 0.15 -0.18 -0.06 0.00 -2.18 0.00 0.00 60.65 58.38 1iho h LYS 45 Cb 0.53 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.05 1iho h LYS 45 CO 0.03 0.76 -0.30 0.00 -1.08 0.00 0.00 179.45 178.85 1iho h ALA 46 N 1.32 1.02 0.00 3.86 0.00 -1.21 -3.31 119.26 120.94 1iho h ALA 46 Ca 0.17 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1iho h ALA 46 Cb 0.33 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1iho h ALA 46 CO 0.00 0.38 -1.27 0.54 0.00 0.00 0.00 179.25 178.90 1iho n ARG 47 N -3.48 0.18 -4.21 0.00 1.74 -0.94 -4.99 116.66 104.96 1iho n ARG 47 Ca -0.00 -0.05 -0.12 0.00 -0.77 0.00 0.00 57.85 56.90 1iho n ARG 47 Cb 0.47 -1.51 -0.10 0.00 -1.02 0.00 0.00 32.46 30.30 1iho n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1iho s ALA 48 N -3.14 1.20 0.15 7.54 0.00 -0.68 -5.01 121.76 121.83 1iho s ALA 48 Ca 0.04 -1.55 -0.05 0.00 0.00 0.00 0.00 51.96 50.39 1iho s ALA 48 Cb 0.15 0.62 -0.00 0.00 0.00 0.00 0.00 23.12 23.89 1iho s ALA 48 CO 0.88 -0.36 1.40 -0.44 0.00 0.00 0.00 175.76 177.24 1iho h ASP 49 N 2.75 0.67 -3.88 0.00 3.45 -1.48 -3.44 116.42 114.49 1iho h ASP 49 Ca -0.36 -0.42 -0.44 0.00 0.43 0.00 0.00 57.03 56.23 1iho h ASP 49 Cb 1.20 -0.20 -0.31 0.00 -0.56 0.00 0.00 39.33 39.47 1iho h ASP 49 CO 0.62 1.18 -0.79 -0.69 -1.57 0.00 0.00 179.24 177.98 1iho s VAL 50 N -3.73 0.88 -0.13 -1.35 1.01 -0.64 -4.97 120.40 111.48 1iho s VAL 50 Ca -0.08 -0.43 0.01 0.00 0.00 0.00 0.00 61.98 61.49 1iho s VAL 50 Cb 0.10 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.70 1iho s VAL 50 CO 0.86 0.27 -0.17 -0.69 0.00 0.00 0.00 175.10 175.37 1iho s VAL 51 N 0.09 2.59 -0.18 2.92 1.01 -1.26 -1.43 120.40 124.13 1iho s VAL 51 Ca -0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.12 1iho s VAL 51 Cb -0.08 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 1iho s VAL 51 CO 0.00 0.53 -0.06 -0.69 0.00 0.00 0.00 175.10 174.88 1iho s VAL 52 N 0.52 3.41 -0.14 2.92 1.01 0.04 -2.03 120.40 126.13 1iho s VAL 52 Ca -0.11 -0.50 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1iho s VAL 52 Cb -0.16 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 1iho s VAL 52 CO 0.04 0.47 -0.12 -0.69 0.00 0.00 0.00 175.10 174.80 1iho s VAL 53 N 0.91 3.09 -0.08 2.92 1.01 -0.33 -1.08 120.40 126.84 1iho s VAL 53 Ca -0.01 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.21 1iho s VAL 53 Cb -0.15 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 33.88 1iho s VAL 53 CO 0.01 0.51 0.29 -0.94 0.00 0.00 0.00 175.10 174.97 1iho s SER 54 N 0.47 6.57 -0.28 3.32 1.04 -0.86 -1.18 113.70 122.79 1iho s SER 54 Ca -0.09 0.68 0.02 0.00 0.48 0.00 0.00 55.95 57.05 1iho s SER 54 Cb -0.16 -2.17 0.07 0.00 0.10 0.00 0.00 66.02 63.87 1iho s SER 54 CO 0.04 0.31 -0.03 -0.63 0.98 0.00 0.00 173.24 173.91 1iho s ILE 55 N -0.71 1.86 -0.24 -1.02 1.01 0.02 -1.24 121.20 120.88 1iho s ILE 55 Ca 0.19 -1.67 -0.04 0.00 0.00 0.00 0.00 60.65 59.13 1iho s ILE 55 Cb -0.14 -2.17 0.12 0.00 0.01 0.00 0.00 42.46 40.28 1iho s ILE 55 CO 0.08 -0.27 0.42 0.12 0.00 0.00 0.00 174.94 175.29 1iho s PHE 56 N 1.19 -0.92 -0.64 3.97 5.36 -0.89 -4.11 117.98 121.94 1iho s PHE 56 Ca -0.01 1.22 -0.27 0.00 -0.96 0.00 0.00 56.93 56.91 1iho s PHE 56 Cb -0.19 0.21 0.02 0.00 -0.34 0.00 0.00 43.02 42.72 1iho s PHE 56 CO -0.08 -0.65 1.34 0.08 -1.46 0.00 0.00 175.22 174.45 1iho s VAL 57 N 2.62 3.78 -0.55 3.12 1.01 -1.26 -4.36 120.40 124.75 1iho s VAL 57 Ca 0.08 0.58 -0.24 0.00 0.00 0.00 0.00 61.98 62.40 1iho s VAL 57 Cb -0.14 -4.67 0.04 0.00 0.00 0.00 0.00 36.38 31.62 1iho s VAL 57 CO -0.15 -1.48 0.94 0.21 0.00 0.00 0.00 175.10 174.62 1iho s ASN 58 N 4.09 6.34 0.51 3.32 2.47 -1.26 -4.94 114.94 125.47 1iho s ASN 58 Ca 0.44 -0.37 0.23 0.00 0.42 0.00 0.00 52.86 53.59 1iho s ASN 58 Cb -0.09 -2.43 1.33 0.00 -1.45 0.00 0.00 41.25 38.60 1iho s ASN 58 CO 0.21 -1.22 1.98 -0.65 -3.72 0.00 0.00 177.10 173.69 1iho h PRO 59 N 9.31 0.08 0.00 0.43 0.11 -1.97 -1.74 132.00 138.22 1iho h PRO 59 Ca -0.26 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1iho h PRO 59 Cb 1.07 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1iho h PRO 59 CO 1.09 0.06 -0.04 0.52 -0.21 0.00 0.00 178.00 179.42 1iho h MET 60 N 0.09 0.00 -0.65 1.05 2.86 -1.92 -2.32 114.93 114.04 1iho h MET 60 Ca 0.28 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.72 1iho h MET 60 Cb 0.98 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.52 1iho h MET 60 CO -0.03 0.04 0.22 0.00 1.06 0.00 0.00 176.91 178.20 1iho n GLN 61 N -3.31 3.33 -4.69 1.72 10.64 -0.65 -4.20 117.38 120.21 1iho n GLN 61 Ca -0.02 -3.07 -0.32 0.00 -1.83 0.00 0.00 57.00 51.76 1iho n GLN 61 Cb 0.18 -2.12 -0.12 0.00 -0.86 0.00 0.00 30.24 27.31 1iho n GLN 61 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 1iho s PHE 62 N -3.02 2.71 0.17 2.61 0.40 -0.88 -4.79 117.98 115.18 1iho s PHE 62 Ca 0.52 -0.15 0.03 0.00 -0.60 0.00 0.00 56.93 56.74 1iho s PHE 62 Cb 0.43 -1.57 0.01 0.00 0.51 0.00 0.00 43.02 42.39 1iho s PHE 62 CO 0.11 0.26 1.39 -0.44 0.70 0.00 0.00 175.22 177.24 1iho h ASP 63 N 4.86 0.22 -5.08 1.36 3.32 -1.91 -3.46 116.42 115.71 1iho h ASP 63 Ca -0.47 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.33 1iho h ASP 63 Cb 1.16 -0.07 -0.15 0.00 0.22 0.00 0.00 39.33 40.49 1iho h ASP 63 CO 0.50 0.98 -0.20 0.00 -1.72 0.00 0.00 179.24 178.81 1iho s ARG 64 N -3.20 0.93 0.58 3.56 1.70 -1.26 -5.02 118.95 116.24 1iho s ARG 64 Ca -0.02 -0.67 0.34 0.00 -0.47 0.00 0.00 55.73 54.91 1iho s ARG 64 Cb 0.10 0.40 1.81 0.00 -0.57 0.00 0.00 34.95 36.69 1iho s ARG 64 CO 0.82 -0.33 2.18 -1.35 -1.08 0.00 0.00 175.30 175.55 1iho h PRO 65 N 2.77 0.00 0.01 3.89 0.11 -1.97 -2.06 132.00 134.75 1iho h PRO 65 Ca -0.33 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.59 1iho h PRO 65 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1iho h PRO 65 CO 0.48 0.04 -0.91 1.05 -0.21 0.00 0.00 178.00 178.46 1iho h GLU 66 N 0.00 0.06 -0.44 1.05 9.09 -1.99 -1.78 114.58 120.56 1iho h GLU 66 Ca -0.00 -0.08 -0.06 0.00 0.05 0.00 0.00 59.36 59.27 1iho h GLU 66 Cb 0.21 0.02 -0.02 0.00 -1.65 0.00 0.00 28.75 27.32 1iho h GLU 66 CO 0.01 0.92 0.03 -0.44 0.05 0.00 0.00 179.01 179.58 1iho h ASP 67 N 0.03 0.74 -0.94 3.06 3.32 -1.80 -2.31 116.42 118.52 1iho h ASP 67 Ca -0.02 -0.29 0.09 0.00 0.02 0.00 0.00 57.03 56.83 1iho h ASP 67 Cb 1.58 -0.20 -0.07 0.00 0.22 0.00 0.00 39.33 40.86 1iho h ASP 67 CO 0.13 0.85 0.58 0.25 -1.72 0.00 0.00 179.24 179.32 1iho h LEU 68 N 0.61 0.88 -1.11 1.55 5.85 -1.27 -1.97 115.31 119.85 1iho h LEU 68 Ca 0.13 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1iho h LEU 68 Cb 0.45 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1iho h LEU 68 CO 0.02 0.51 -0.36 0.00 -0.34 0.00 0.00 178.44 178.27 1iho h ALA 69 N 1.48 1.25 0.00 1.25 0.00 -1.04 -2.79 119.26 119.42 1iho h ALA 69 Ca 0.44 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1iho h ALA 69 Cb 0.33 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1iho h ALA 69 CO -0.22 0.52 -0.23 0.54 0.00 0.00 0.00 179.25 179.86 1iho n ARG 70 N -4.08 0.19 -1.71 0.00 1.74 -0.79 -4.89 116.66 107.13 1iho n ARG 70 Ca -0.01 0.11 -0.43 0.00 -0.77 0.00 0.00 57.85 56.75 1iho n ARG 70 Cb 0.43 -1.68 -0.02 0.00 -1.02 0.00 0.00 32.46 30.16 1iho n ARG 70 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1iho n TYR 71 N -1.99 2.57 -2.04 -1.55 9.36 -0.93 -4.88 117.16 117.70 1iho n TYR 71 Ca 0.05 0.26 -0.41 0.00 3.32 0.00 0.00 57.90 61.13 1iho n TYR 71 Cb 0.41 -2.57 -0.02 0.00 -0.63 0.00 0.00 39.34 36.53 1iho n TYR 71 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 1iho s PRO 72 N 0.02 4.29 -0.12 2.98 0.04 -1.26 -5.01 135.00 135.94 1iho s PRO 72 Ca 0.69 2.29 0.01 0.00 0.04 0.00 0.00 61.00 64.03 1iho s PRO 72 Cb -0.56 -3.09 0.02 0.00 0.04 0.00 0.00 34.50 30.91 1iho s PRO 72 CO 0.44 -0.35 -0.14 1.03 0.04 0.00 0.00 177.00 178.03 1iho s ARG 73 N -0.95 2.14 -0.31 4.56 0.52 -1.26 -4.60 118.95 119.05 1iho s ARG 73 Ca 0.55 -0.51 0.19 0.00 -0.52 0.00 0.00 55.73 55.44 1iho s ARG 73 Cb -0.41 -1.92 0.47 0.00 0.52 0.00 0.00 34.95 33.61 1iho s ARG 73 CO 0.48 -0.16 0.99 0.25 0.02 0.00 0.00 175.30 176.88 1iho n THR 74 N 4.51 1.06 -0.32 0.02 -2.24 -1.26 -4.97 114.28 111.09 1iho n THR 74 Ca -0.17 -3.03 0.04 0.00 -2.27 0.00 0.00 64.05 58.62 1iho n THR 74 Cb 0.51 0.79 0.23 0.00 -2.10 0.00 0.00 70.33 69.76 1iho n THR 74 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1iho h LEU 75 N 2.91 0.92 -0.25 3.22 5.85 -1.99 0.70 115.31 126.68 1iho h LEU 75 Ca -0.11 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 1iho h LEU 75 Cb 1.20 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1iho h LEU 75 CO 0.43 0.58 0.03 -0.61 -0.34 0.00 0.00 178.44 178.53 1iho h GLN 76 N 1.04 0.42 -0.68 1.25 4.15 -1.99 -1.01 115.11 118.29 1iho h GLN 76 Ca 0.41 -0.12 -0.04 0.00 0.77 0.00 0.00 58.65 59.68 1iho h GLN 76 Cb 0.25 -0.05 -0.03 0.00 0.21 0.00 0.00 27.48 27.86 1iho h GLN 76 CO -0.17 0.56 0.28 1.49 -1.93 0.00 0.00 178.83 179.06 1iho h GLU 77 N 0.23 1.01 -0.44 1.69 4.57 -1.87 -1.35 114.58 118.41 1iho h GLU 77 Ca 0.08 -0.18 0.04 0.00 -1.18 0.00 0.00 59.36 58.12 1iho h GLU 77 Cb 0.34 -0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.72 1iho h GLU 77 CO 0.01 0.83 0.20 -0.44 -1.18 0.00 0.00 179.01 178.42 1iho h ASP 78 N 0.96 0.26 -0.23 1.04 3.32 -0.63 -0.85 116.42 120.28 1iho h ASP 78 Ca 0.23 0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.21 1iho h ASP 78 Cb 0.19 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 1iho h ASP 78 CO -0.02 0.19 -0.20 0.00 -1.72 0.00 0.00 179.24 177.49 1iho h GLU 80 N 0.61 0.75 -0.38 0.00 4.81 -0.96 0.51 114.58 119.92 1iho h GLU 80 Ca 0.09 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1iho h GLU 80 Cb 0.68 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 1iho h GLU 80 CO 0.05 0.50 0.08 0.87 -0.73 0.00 0.00 179.01 179.78 1iho h LYS 81 N 0.78 0.61 -0.20 1.92 1.57 -0.46 -1.79 116.57 119.00 1iho h LYS 81 Ca 0.22 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.74 1iho h LYS 81 Cb -0.06 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1iho h LYS 81 CO -0.06 0.66 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.05 1iho h LEU 82 N 0.47 0.45 -0.79 2.94 3.38 -1.05 -2.51 115.31 118.20 1iho h LEU 82 Ca 0.12 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1iho h LEU 82 Cb 0.32 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1iho h LEU 82 CO 0.00 0.77 0.20 -1.13 0.09 0.00 0.00 178.44 178.37 1iho h ASN 83 N 0.37 1.04 0.43 -0.43 -0.00 -0.76 -1.34 115.58 114.88 1iho h ASN 83 Ca 0.04 -0.20 -0.01 0.00 -0.00 0.00 0.00 56.30 56.13 1iho h ASN 83 Cb 0.80 -0.27 -0.00 0.00 -0.00 0.00 0.00 38.32 38.84 1iho h ASN 83 CO 0.06 0.98 -0.05 0.11 -0.00 0.00 0.00 177.43 178.54 1iho h LYS 84 N 1.06 0.00 -0.16 6.67 1.57 -1.05 -2.08 116.57 122.58 1iho h LYS 84 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1iho h LYS 84 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1iho h LYS 84 CO -0.00 0.05 0.00 -2.13 -0.57 0.00 0.00 179.45 176.79 1iho n ARG 85 N -3.31 2.03 -2.25 3.15 3.00 -0.58 -4.94 116.66 113.76 1iho n ARG 85 Ca -0.02 -1.53 -0.09 0.00 -0.00 0.00 0.00 57.85 56.22 1iho n ARG 85 Cb 0.20 -1.46 0.00 0.00 0.00 0.00 0.00 32.46 31.20 1iho n ARG 85 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1iho n LYS 86 N 0.79 -0.98 -2.08 -0.14 4.76 -0.72 -4.98 118.16 114.82 1iho n LYS 86 Ca 0.17 0.41 -0.40 0.00 -2.87 0.00 0.00 58.31 55.62 1iho n LYS 86 Cb 0.46 -4.34 -0.01 0.00 -1.84 0.00 0.00 35.03 29.30 1iho n LYS 86 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1iho s VAL 87 N -2.51 2.67 -0.00 -0.18 1.01 -0.83 -4.90 120.40 115.65 1iho s VAL 87 Ca 0.03 0.61 -0.09 0.00 0.00 0.00 0.00 61.98 62.52 1iho s VAL 87 Cb -0.01 -3.36 -0.31 0.00 0.00 0.00 0.00 36.38 32.70 1iho s VAL 87 CO 0.03 0.10 0.85 0.44 0.00 0.00 0.00 175.10 176.52 1iho h ASP 88 N 2.79 0.59 -3.66 3.32 3.32 -1.76 -3.41 116.42 117.60 1iho h ASP 88 Ca -0.49 -0.76 -0.17 0.00 0.02 0.00 0.00 57.03 55.62 1iho h ASP 88 Cb 1.24 -0.19 -0.27 0.00 0.22 0.00 0.00 39.33 40.33 1iho h ASP 88 CO 0.63 1.63 -0.43 -0.22 -1.72 0.00 0.00 179.24 179.13 1iho s LEU 89 N -7.25 0.79 -0.16 1.55 0.20 -0.96 -2.22 118.68 110.62 1iho s LEU 89 Ca -0.11 0.54 -0.01 0.00 0.69 0.00 0.00 54.13 55.24 1iho s LEU 89 Cb 0.06 0.87 -0.01 0.00 -0.43 0.00 0.00 46.19 46.68 1iho s LEU 89 CO 0.88 -0.12 -0.13 -0.69 -0.29 0.00 0.00 176.35 176.01 1iho s VAL 90 N 0.52 2.92 -0.37 1.68 1.01 0.45 -1.18 120.40 125.43 1iho s VAL 90 Ca -0.03 -0.69 -0.12 0.00 0.00 0.00 0.00 61.98 61.14 1iho s VAL 90 Cb -0.05 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 34.11 1iho s VAL 90 CO -0.03 0.50 0.22 0.12 0.00 0.00 0.00 175.10 175.92 1iho s PHE 91 N 0.74 3.23 -0.55 5.22 5.36 -0.33 0.08 117.98 131.74 1iho s PHE 91 Ca -0.05 -0.76 0.06 0.00 -0.96 0.00 0.00 56.93 55.22 1iho s PHE 91 Cb -0.15 -2.47 0.22 0.00 -0.34 0.00 0.00 43.02 40.28 1iho s PHE 91 CO 0.01 -0.58 0.57 0.00 -1.46 0.00 0.00 175.22 173.76 1iho n ALA 92 N 5.04 3.29 -1.98 11.12 0.00 0.01 -0.80 120.51 137.19 1iho n ALA 92 Ca -0.12 -4.07 -0.30 0.00 0.00 0.00 0.00 53.44 48.95 1iho n ALA 92 Cb 0.47 -0.88 0.01 0.00 0.00 0.00 0.00 19.45 19.05 1iho n ALA 92 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1iho s PRO 93 N -1.50 3.52 0.61 0.00 0.04 -1.26 -4.54 135.00 131.87 1iho s PRO 93 Ca 0.34 0.57 -0.09 0.00 0.04 0.00 0.00 61.00 61.86 1iho s PRO 93 Cb 0.10 -2.16 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 1iho s PRO 93 CO -0.10 -0.51 0.98 -1.54 0.04 0.00 0.00 177.00 175.87 1iho s SER 94 N -4.18 5.87 0.32 6.66 1.04 -1.26 -4.88 113.70 117.27 1iho s SER 94 Ca 0.53 1.09 0.01 0.00 0.48 0.00 0.00 55.95 58.06 1iho s SER 94 Cb -0.11 -2.11 0.54 0.00 0.10 0.00 0.00 66.02 64.45 1iho s SER 94 CO 0.51 -1.00 1.97 0.58 0.98 0.00 0.00 173.24 176.28 1iho h VAL 95 N -0.29 1.19 -0.06 5.02 2.07 -1.97 -1.74 116.25 120.47 1iho h VAL 95 Ca -0.45 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 66.54 1iho h VAL 95 Cb 1.23 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1iho h VAL 95 CO 0.62 0.20 -0.45 0.11 0.02 0.00 0.00 177.57 178.07 1iho h LYS 96 N 0.91 0.15 -0.43 1.57 6.56 -1.93 0.19 116.57 123.59 1iho h LYS 96 Ca 0.24 -0.08 -0.09 0.00 -1.06 0.00 0.00 60.65 59.66 1iho h LYS 96 Cb -0.03 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.61 1iho h LYS 96 CO -0.04 0.58 -0.09 1.49 -2.06 0.00 0.00 179.45 179.32 1iho h GLU 97 N 0.12 0.76 0.10 3.15 4.57 -1.71 -2.53 114.58 119.05 1iho h GLU 97 Ca 0.01 -0.24 -0.32 0.00 -1.18 0.00 0.00 59.36 57.62 1iho h GLU 97 Cb 0.85 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.35 1iho h GLU 97 CO 0.07 0.83 -1.71 0.82 -1.18 0.00 0.00 179.01 177.84 1iho h ILE 98 N 0.70 0.93 -2.15 2.32 1.08 -1.06 -3.41 117.51 115.91 1iho h ILE 98 Ca 0.12 -2.63 -0.56 0.00 -0.39 0.00 0.00 64.86 61.40 1iho h ILE 98 Cb 0.56 2.62 -0.41 0.00 -3.07 0.00 0.00 36.82 36.52 1iho h ILE 98 CO 0.03 0.78 -0.83 -1.22 -0.69 0.00 0.00 178.15 176.22 1iho n TYR 99 N -3.39 2.35 0.29 1.37 4.02 0.65 -4.94 117.16 117.52 1iho n TYR 99 Ca -0.21 -3.93 0.14 0.00 -0.01 0.00 0.00 57.90 53.89 1iho n TYR 99 Cb 1.05 -0.47 0.89 0.00 -0.02 0.00 0.00 39.34 40.78 1iho n TYR 99 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1iho h PRO 100 N 3.45 0.00 -0.31 -0.72 0.13 -1.63 -0.03 132.00 132.88 1iho h PRO 100 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1iho h PRO 100 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1iho h PRO 100 CO 0.69 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.55 1iho n ASN 101 N -3.93 3.69 0.00 1.44 4.13 -1.26 -5.05 115.26 114.28 1iho n ASN 101 Ca -0.03 -2.68 0.00 0.00 1.68 0.00 0.00 54.58 53.56 1iho n ASN 101 Cb 0.09 -0.45 0.00 0.00 -1.54 0.00 0.00 39.78 37.87 1iho n ASN 101 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1iho n GLY 102 N -0.08 -2.85 0.05 7.41 0.00 -0.03 -4.66 105.19 105.03 1iho n GLY 102 Ca 0.19 -1.73 0.02 0.00 0.00 0.00 0.00 46.02 44.49 1iho n GLY 102 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iho n THR 103 N -0.52 0.65 0.19 2.61 -2.24 -1.26 -4.23 114.28 109.48 1iho n THR 103 Ca 0.00 -0.66 0.04 0.00 -2.27 0.00 0.00 64.05 61.17 1iho n THR 103 Cb 0.00 -0.25 0.38 0.00 -2.10 0.00 0.00 70.33 68.36 1iho n THR 103 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1iho h GLU 104 N 0.00 0.00 -0.40 -0.78 3.07 -2.00 -2.71 114.58 111.76 1iho h GLU 104 Ca -0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1iho h GLU 104 Cb 1.53 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.44 1iho h GLU 104 CO 0.02 0.37 0.00 0.25 -1.40 0.00 0.00 179.01 178.24 1iho n THR 105 N -3.84 1.23 -2.92 1.13 -2.24 -1.26 -4.97 114.28 101.41 1iho n THR 105 Ca -0.01 -1.13 -0.36 0.00 -2.27 0.00 0.00 64.05 60.28 1iho n THR 105 Cb 0.44 0.37 -0.06 0.00 -2.10 0.00 0.00 70.33 68.98 1iho n THR 105 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1iho s HIS 106 N -1.30 3.60 0.33 4.78 5.04 -1.02 -5.00 115.29 121.71 1iho s HIS 106 Ca 0.31 1.58 -0.28 0.00 -1.54 0.00 0.00 55.06 55.13 1iho s HIS 106 Cb 0.18 -2.78 -0.12 0.00 0.04 0.00 0.00 32.58 29.90 1iho s HIS 106 CO 0.18 0.20 1.30 2.41 -2.34 0.00 0.00 174.74 176.49 1iho n THR 107 N 0.37 1.87 -4.31 0.89 -1.04 -1.26 -5.01 114.28 105.79 1iho n THR 107 Ca 0.01 -0.47 -0.17 0.00 -2.04 0.00 0.00 64.05 61.39 1iho n THR 107 Cb 0.51 -1.56 -0.10 0.00 -1.82 0.00 0.00 70.33 67.36 1iho n THR 107 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1iho s TYR 108 N -0.96 1.53 -0.12 -1.42 -0.85 -1.26 -5.03 117.35 109.24 1iho s TYR 108 Ca 0.57 -0.72 0.03 0.00 -0.52 0.00 0.00 57.07 56.43 1iho s TYR 108 Cb -0.58 -0.78 0.00 0.00 0.38 0.00 0.00 41.96 40.98 1iho s TYR 108 CO 0.61 0.18 -0.22 0.08 -1.52 0.00 0.00 175.55 174.67 1iho s VAL 109 N -3.19 2.17 -0.08 -3.49 1.01 -1.26 -5.02 120.40 110.55 1iho s VAL 109 Ca 0.22 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.25 1iho s VAL 109 Cb 0.02 -1.85 0.01 0.00 0.00 0.00 0.00 36.38 34.56 1iho s VAL 109 CO 0.05 0.55 -0.13 -0.62 0.00 0.00 0.00 175.10 174.95 1iho s ASP 110 N 0.50 1.98 -0.50 3.32 2.15 -1.26 -3.84 116.67 119.02 1iho s ASP 110 Ca -0.14 -0.33 -0.15 0.00 0.43 0.00 0.00 52.55 52.36 1iho s ASP 110 Cb -0.17 -0.90 0.10 0.00 -0.30 0.00 0.00 42.92 41.65 1iho s ASP 110 CO 0.05 0.02 0.43 -0.69 -0.17 0.00 0.00 175.17 174.81 1iho s VAL 111 N 0.78 5.08 0.43 1.11 1.01 -1.26 -5.07 120.40 122.48 1iho s VAL 111 Ca -0.12 -1.32 -0.25 0.00 0.00 0.00 0.00 61.98 60.29 1iho s VAL 111 Cb -0.16 -4.15 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 1iho s VAL 111 CO 0.02 -0.71 1.18 -2.65 0.00 0.00 0.00 175.10 172.94 1iho n PRO 112 N 5.18 1.68 0.00 2.72 -0.02 -1.26 -2.41 135.00 140.89 1iho n PRO 112 Ca -0.13 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 1iho n PRO 112 Cb 0.42 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 1iho n PRO 112 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iho n GLY 113 N 0.95 2.10 0.31 -1.23 0.00 -1.26 -4.44 105.19 101.61 1iho n GLY 113 Ca 0.08 -0.22 0.09 0.00 0.00 0.00 0.00 46.02 45.97 1iho n GLY 113 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iho h LEU 114 N 0.00 0.20 -0.07 0.99 3.38 -1.85 -1.80 115.31 116.16 1iho h LEU 114 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1iho h LEU 114 Cb 0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1iho h LEU 114 CO 0.00 0.14 0.00 0.77 0.09 0.00 0.00 178.44 179.44 1iho h SER 115 N 0.23 0.00 0.00 -0.43 4.64 -1.69 -3.23 113.55 113.07 1iho h SER 115 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1iho h SER 115 Cb 0.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1iho h SER 115 CO -0.02 0.00 -0.03 0.35 -0.87 0.00 0.00 176.83 176.26 1iho n THR 116 N -2.46 1.77 -4.28 2.95 -2.24 -0.70 -4.38 114.28 104.95 1iho n THR 116 Ca 0.05 -2.12 -0.24 0.00 -2.27 0.00 0.00 64.05 59.46 1iho n THR 116 Cb 0.44 -0.18 -0.08 0.00 -2.10 0.00 0.00 70.33 68.40 1iho n THR 116 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iho s MET 117 N -2.69 2.15 4.00 -0.78 0.23 -1.09 -3.73 119.30 117.39 1iho s MET 117 Ca 0.30 -1.69 0.00 0.00 -1.03 0.00 0.00 55.69 53.26 1iho s MET 117 Cb 0.26 -1.99 0.00 0.00 -1.53 0.00 0.00 34.83 31.57 1iho s MET 117 CO 0.03 0.13 0.00 1.28 -2.03 0.00 0.00 175.02 174.43 1iho n LEU 118 N -1.00 0.00 -0.32 0.18 4.77 -1.26 -1.04 117.00 118.32 1iho n LEU 118 Ca -0.04 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 56.04 1iho n LEU 118 Cb 0.62 0.00 0.30 0.00 -2.33 0.00 0.00 43.42 42.01 1iho n LEU 118 CO 0.43 0.00 1.23 -0.08 -1.33 0.00 0.00 177.39 177.64 1iho h GLU 119 N 0.00 0.83 0.00 3.23 4.81 -1.94 -1.55 114.58 119.95 1iho h GLU 119 Ca 0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1iho h GLU 119 Cb 0.00 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 1iho h GLU 119 CO 0.00 0.55 -0.15 0.78 -0.73 0.00 0.00 179.01 179.46 1iho h GLY 120 N 0.86 0.00 1.58 1.92 0.00 -1.29 -2.44 103.07 103.70 1iho h GLY 120 Ca 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.78 1iho h GLY 120 CO -0.25 0.00 0.09 0.00 0.00 0.00 0.00 176.54 176.37 1iho h ALA 121 N 1.85 1.47 -0.01 3.60 0.00 -1.35 -2.87 119.26 121.96 1iho h ALA 121 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1iho h ALA 121 Cb 0.34 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1iho h ALA 121 CO 0.02 0.39 -0.42 -1.13 0.00 0.00 0.00 179.25 178.11 1iho n SER 122 N -4.34 1.24 -3.42 0.00 3.41 -1.02 -4.51 113.62 104.99 1iho n SER 122 Ca 0.02 -0.99 -0.26 0.00 -0.26 0.00 0.00 58.87 57.37 1iho n SER 122 Cb 0.19 0.33 -0.09 0.00 -0.26 0.00 0.00 64.21 64.37 1iho n SER 122 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1iho n ARG 123 N -0.66 0.94 -1.81 4.33 1.74 -0.95 -5.11 116.66 115.14 1iho n ARG 123 Ca 0.10 -3.61 -0.41 0.00 -0.77 0.00 0.00 57.85 53.16 1iho n ARG 123 Cb 0.38 -1.71 -0.01 0.00 -1.02 0.00 0.00 32.46 30.10 1iho n ARG 123 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 1iho s PRO 124 N -0.93 4.13 0.00 5.56 0.02 -1.22 -1.87 135.00 140.68 1iho s PRO 124 Ca 0.33 2.55 0.00 0.00 0.02 0.00 0.00 61.00 63.91 1iho s PRO 124 Cb 0.08 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.61 1iho s PRO 124 CO -0.14 -0.56 0.00 0.41 -0.33 0.00 0.00 177.00 176.38 1iho n GLY 125 N 1.18 3.04 0.35 0.52 0.00 -1.26 -4.89 105.19 104.13 1iho n GLY 125 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 1iho n GLY 125 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1iho h HIS 126 N 0.00 -0.85 -0.06 1.61 6.17 -1.61 -1.70 115.15 118.70 1iho h HIS 126 Ca 0.00 -0.00 -0.12 0.00 0.71 0.00 0.00 60.37 60.96 1iho h HIS 126 Cb 0.00 0.32 -0.01 0.00 2.52 0.00 0.00 27.41 30.24 1iho h HIS 126 CO 0.00 -0.47 -0.51 0.74 0.71 0.00 0.00 177.93 178.39 1iho h PHE 127 N -0.73 0.21 -0.96 5.26 -1.00 -1.82 -0.21 116.94 117.69 1iho h PHE 127 Ca -0.04 -0.07 0.12 0.00 2.81 0.00 0.00 57.97 60.79 1iho h PHE 127 Cb 0.63 -0.04 -0.08 0.00 3.61 0.00 0.00 35.95 40.06 1iho h PHE 127 CO -0.15 0.65 0.59 -0.09 -1.61 0.00 0.00 178.31 177.70 1iho h ARG 128 N 0.14 0.89 -0.69 1.51 2.43 -1.80 0.44 114.38 117.30 1iho h ARG 128 Ca 0.00 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1iho h ARG 128 Cb 0.96 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.27 1iho h ARG 128 CO 0.08 0.59 0.27 0.78 -1.51 0.00 0.00 179.97 180.18 1iho h GLY 129 N 0.92 1.12 0.81 2.80 0.00 -0.10 -1.03 103.07 107.58 1iho h GLY 129 Ca 0.48 -0.61 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1iho h GLY 129 CO -0.27 0.57 -0.21 -2.08 0.00 0.00 0.00 176.54 174.55 1iho h VAL 130 N 0.99 0.53 -0.77 4.60 2.07 -0.37 -1.90 116.25 121.40 1iho h VAL 130 Ca 0.23 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.43 1iho h VAL 130 Cb 0.21 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 1iho h VAL 130 CO -0.02 0.06 0.51 0.77 0.02 0.00 0.00 177.57 178.91 1iho h SER 131 N -0.80 0.87 -0.15 0.57 4.64 -0.95 -1.02 113.55 116.71 1iho h SER 131 Ca -0.06 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.22 1iho h SER 131 Cb 0.55 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1iho h SER 131 CO 0.10 0.62 0.01 0.74 -0.87 0.00 0.00 176.83 177.43 1iho h THR 132 N 1.02 1.24 -0.04 2.95 2.02 -1.17 -1.57 112.91 117.37 1iho h THR 132 Ca 0.29 -0.80 -0.16 0.00 0.77 0.00 0.00 66.41 66.51 1iho h THR 132 Cb -0.09 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1iho h THR 132 CO -0.07 0.24 -0.69 -0.29 0.37 0.00 0.00 175.52 175.09 1iho h ILE 133 N 0.02 1.43 -0.33 3.11 6.09 -1.08 -1.84 117.51 124.91 1iho h ILE 133 Ca 0.04 -2.20 -0.18 0.00 -1.37 0.00 0.00 64.86 61.16 1iho h ILE 133 Cb 0.35 2.16 -0.00 0.00 0.47 0.00 0.00 36.82 39.80 1iho h ILE 133 CO 0.01 0.64 -0.48 0.58 -3.07 0.00 0.00 178.15 175.83 1iho h VAL 134 N 0.13 1.27 -0.39 2.19 2.07 -1.18 0.02 116.25 120.36 1iho h VAL 134 Ca -0.02 -1.66 0.01 0.00 0.82 0.00 0.00 66.70 65.85 1iho h VAL 134 Cb 1.22 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 1iho h VAL 134 CO 0.10 0.55 0.24 0.28 0.02 0.00 0.00 177.57 178.76 1iho h SER 135 N 0.72 0.41 -0.42 0.57 0.02 -1.19 0.19 113.55 113.85 1iho h SER 135 Ca 0.03 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.99 1iho h SER 135 Cb 1.09 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.51 1iho h SER 135 CO 0.11 0.29 0.26 0.50 -1.14 0.00 0.00 176.83 176.85 1iho h LYS 136 N 0.49 0.50 -0.55 3.45 3.64 -1.11 -1.54 116.57 121.45 1iho h LYS 136 Ca 0.15 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 1iho h LYS 136 Cb -0.03 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1iho h LYS 136 CO -0.05 0.33 0.16 -0.07 -2.27 0.00 0.00 179.45 177.56 1iho h LEU 137 N 0.52 0.77 -1.00 5.20 3.38 -0.65 -0.75 115.31 122.78 1iho h LEU 137 Ca 0.16 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1iho h LEU 137 Cb -0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1iho h LEU 137 CO -0.06 0.74 0.24 -0.26 0.09 0.00 0.00 178.44 179.18 1iho h PHE 138 N 0.81 0.97 -0.07 1.13 0.05 -0.08 0.13 116.94 119.88 1iho h PHE 138 Ca 0.18 -0.07 -0.13 0.00 3.82 0.00 0.00 57.97 61.77 1iho h PHE 138 Cb 0.25 -0.29 -0.01 0.00 2.00 0.00 0.00 35.95 37.90 1iho h PHE 138 CO 0.02 0.76 -0.55 -0.91 -0.18 0.00 0.00 178.31 177.44 1iho h ASN 139 N 0.94 0.22 0.07 2.17 2.35 -0.72 -0.62 115.58 119.99 1iho h ASN 139 Ca 0.22 -0.12 -0.18 0.00 -0.55 0.00 0.00 56.30 55.67 1iho h ASN 139 Cb 0.21 -0.06 0.02 0.00 0.05 0.00 0.00 38.32 38.53 1iho h ASN 139 CO -0.02 0.73 -0.75 -0.07 -1.65 0.00 0.00 177.43 175.67 1iho h LEU 140 N 0.16 0.53 0.00 1.61 3.38 -0.88 -3.36 115.31 116.75 1iho h LEU 140 Ca -0.00 -0.85 -0.17 0.00 0.09 0.00 0.00 57.88 56.95 1iho h LEU 140 Cb 1.02 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 1iho h LEU 140 CO 0.08 1.33 -1.23 0.58 0.09 0.00 0.00 178.44 179.29 1iho h VAL 141 N -0.19 0.69 -6.68 1.22 2.07 -1.05 -3.44 116.25 108.87 1iho h VAL 141 Ca -0.12 -2.21 -0.54 0.00 0.82 0.00 0.00 66.70 64.66 1iho h VAL 141 Cb 1.51 2.21 -0.00 0.00 -1.52 0.00 0.00 31.29 33.49 1iho h VAL 141 CO 0.14 0.39 -0.98 0.00 0.02 0.00 0.00 177.57 177.15 1iho n GLN 142 N -3.01 -0.88 -1.96 1.57 6.02 -0.24 -4.94 117.38 113.94 1iho n GLN 142 Ca -0.07 0.23 -0.32 0.00 -0.01 0.00 0.00 57.00 56.82 1iho n GLN 142 Cb 0.85 -3.31 0.02 0.00 1.02 0.00 0.00 30.24 28.82 1iho n GLN 142 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1iho s PRO 143 N -6.88 3.22 0.07 -1.09 0.04 -1.26 -4.85 135.00 124.25 1iho s PRO 143 Ca 0.41 1.19 0.04 0.00 0.04 0.00 0.00 61.00 62.68 1iho s PRO 143 Cb -0.19 -2.02 -0.24 0.00 0.04 0.00 0.00 34.50 32.09 1iho s PRO 143 CO 0.93 -0.89 1.11 -0.44 0.04 0.00 0.00 177.00 177.75 1iho h ASP 144 N 0.25 0.13 -4.77 6.66 5.19 -0.72 -3.44 116.42 119.74 1iho h ASP 144 Ca -0.46 -0.16 -0.19 0.00 -0.62 0.00 0.00 57.03 55.59 1iho h ASP 144 Cb 1.22 -0.04 -0.22 0.00 0.18 0.00 0.00 39.33 40.47 1iho h ASP 144 CO 0.57 1.13 -0.71 0.27 -3.12 0.00 0.00 179.24 177.38 1iho s ILE 145 N -2.67 0.15 -0.00 0.35 -4.36 -0.97 -1.11 121.20 112.59 1iho s ILE 145 Ca -0.02 -0.79 0.00 0.00 -0.26 0.00 0.00 60.65 59.58 1iho s ILE 145 Cb 0.09 -0.27 0.00 0.00 1.25 0.00 0.00 42.46 43.53 1iho s ILE 145 CO 0.84 -0.41 -0.01 0.00 0.24 0.00 0.00 174.94 175.60 1iho s ALA 146 N -1.23 0.14 -0.12 2.27 0.00 -0.47 -0.97 121.76 121.38 1iho s ALA 146 Ca -0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 51.96 51.77 1iho s ALA 146 Cb -0.09 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.97 1iho s ALA 146 CO -0.01 0.03 -0.08 0.00 0.00 0.00 0.00 175.76 175.70 1iho s PHE 148 N -0.03 0.59 0.25 0.00 0.40 -0.35 -4.48 117.98 114.36 1iho s PHE 148 Ca -0.01 -0.46 -0.21 0.00 -0.60 0.00 0.00 56.93 55.65 1iho s PHE 148 Cb -0.14 -0.36 -0.09 0.00 0.51 0.00 0.00 43.02 42.95 1iho s PHE 148 CO 0.03 -0.09 0.77 0.20 0.70 0.00 0.00 175.22 176.84 1iho s GLY 149 N -1.41 2.65 0.39 4.36 0.00 -1.26 0.09 107.32 112.14 1iho s GLY 149 Ca -0.10 0.24 0.28 0.00 0.00 0.00 0.00 44.72 45.14 1iho s GLY 149 CO 0.00 0.61 1.82 0.83 0.00 0.00 0.00 173.10 176.36 1iho h GLU 150 N 3.33 0.00 -0.84 2.90 5.08 -1.49 -3.17 114.58 120.38 1iho h GLU 150 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1iho h GLU 150 Cb 1.19 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 1iho h GLU 150 CO 0.65 0.00 0.54 -0.22 -1.00 0.00 0.00 179.01 178.98 1iho h LYS 151 N 0.00 1.13 -3.66 2.33 3.64 -1.93 -2.89 116.57 115.18 1iho h LYS 151 Ca 0.00 -0.08 -0.76 0.00 -1.27 0.00 0.00 60.65 58.54 1iho h LYS 151 Cb 0.53 -0.25 -0.16 0.00 -0.41 0.00 0.00 32.23 31.94 1iho h LYS 151 CO 0.00 0.76 1.86 -0.25 -2.27 0.00 0.00 179.45 179.55 1iho n ASP 152 N -4.47 5.17 -0.09 4.20 10.43 -1.20 -4.79 116.55 125.81 1iho n ASP 152 Ca 0.09 -3.11 -0.00 0.00 2.57 0.00 0.00 54.79 54.34 1iho n ASP 152 Cb 0.03 -1.48 0.27 0.00 1.84 0.00 0.00 41.12 41.78 1iho n ASP 152 CO 0.00 0.00 0.00 2.19 -1.07 0.00 0.00 177.20 178.32 1iho h PHE 153 N 5.94 0.74 -0.26 1.24 -5.15 -1.73 -1.93 116.94 115.79 1iho h PHE 153 Ca 0.37 -0.03 -0.07 0.00 -0.20 0.00 0.00 57.97 58.04 1iho h PHE 153 Cb 0.67 -0.23 -0.01 0.00 0.22 0.00 0.00 35.95 36.60 1iho h PHE 153 CO 1.21 0.57 -0.11 0.37 -2.00 0.00 0.00 178.31 178.36 1iho h GLN 154 N 0.73 0.53 -0.78 6.09 4.15 -1.90 -1.23 115.11 122.70 1iho h GLN 154 Ca 0.18 -0.23 0.02 0.00 0.77 0.00 0.00 58.65 59.39 1iho h GLN 154 Cb 0.14 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.77 1iho h GLN 154 CO -0.02 0.78 0.51 1.96 -1.93 0.00 0.00 178.83 180.13 1iho h GLN 155 N 0.26 1.00 -0.25 1.69 4.20 -1.91 -0.11 115.11 119.99 1iho h GLN 155 Ca 0.06 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1iho h GLN 155 Cb 0.61 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1iho h GLN 155 CO 0.03 0.66 0.15 1.25 -0.67 0.00 0.00 178.83 180.25 1iho h LEU 156 N 1.03 0.30 -0.94 1.46 5.85 -1.16 0.11 115.31 121.96 1iho h LEU 156 Ca 0.30 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1iho h LEU 156 Cb -0.07 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.84 1iho h LEU 156 CO -0.08 0.26 0.59 0.00 -0.34 0.00 0.00 178.44 178.87 1iho h ALA 157 N 1.05 1.19 -0.24 1.25 0.00 -0.98 -0.13 119.26 121.40 1iho h ALA 157 Ca 0.09 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1iho h ALA 157 Cb 0.02 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1iho h ALA 157 CO -0.02 0.62 0.13 1.25 0.00 0.00 0.00 179.25 181.23 1iho h LEU 158 N 1.28 0.21 -0.35 0.00 5.85 -0.53 -1.94 115.31 119.84 1iho h LEU 158 Ca 0.34 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.88 1iho h LEU 158 Cb -0.10 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1iho h LEU 158 CO -0.07 0.16 -0.54 0.40 -0.34 0.00 0.00 178.44 178.05 1iho h ILE 159 N 0.28 1.28 -0.48 4.05 1.08 -0.54 -0.11 117.51 123.08 1iho h ILE 159 Ca 0.10 -1.73 0.07 0.00 -0.39 0.00 0.00 64.86 62.91 1iho h ILE 159 Cb 0.00 1.64 -0.06 0.00 -3.07 0.00 0.00 36.82 35.33 1iho h ILE 159 CO -0.05 0.56 0.14 0.03 -0.69 0.00 0.00 178.15 178.14 1iho h ARG 160 N 0.63 0.29 -0.42 2.37 3.08 -0.94 0.44 114.38 119.84 1iho h ARG 160 Ca 0.02 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1iho h ARG 160 Cb 1.13 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 1iho h ARG 160 CO 0.12 0.19 0.08 -0.22 -1.07 0.00 0.00 179.97 179.07 1iho h LYS 161 N 0.30 0.69 -0.76 0.04 1.63 -1.20 -1.61 116.57 115.66 1iho h LYS 161 Ca 0.23 -0.18 0.04 0.00 -0.85 0.00 0.00 60.65 59.89 1iho h LYS 161 Cb 0.26 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 31.76 1iho h LYS 161 CO -0.26 0.72 0.47 1.98 -3.45 0.00 0.00 179.45 178.91 1iho h MET 162 N 0.55 0.89 -0.29 1.90 4.05 -0.65 -0.51 114.93 120.88 1iho h MET 162 Ca 0.13 -0.05 -0.03 0.00 -0.28 0.00 0.00 59.70 59.46 1iho h MET 162 Cb 0.35 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 30.94 1iho h MET 162 CO 0.01 0.59 0.05 0.28 0.23 0.00 0.00 176.91 178.07 1iho h VAL 163 N 0.92 1.23 -0.08 -5.77 2.07 -0.76 0.89 116.25 114.75 1iho h VAL 163 Ca 0.31 -0.77 0.02 0.00 0.82 0.00 0.00 66.70 67.07 1iho h VAL 163 Cb 0.04 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1iho h VAL 163 CO -0.12 0.25 -0.03 0.00 0.02 0.00 0.00 177.57 177.69 1iho h ALA 164 N 0.88 0.04 -0.29 1.67 0.00 -1.02 -2.02 119.26 118.53 1iho h ALA 164 Ca 0.09 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1iho h ALA 164 Cb 0.32 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1iho h ALA 164 CO 0.00 -0.50 0.08 -0.44 0.00 0.00 0.00 179.25 178.40 1iho h ASP 165 N -0.02 0.42 -0.03 0.00 3.32 -1.02 -3.19 116.42 115.90 1iho h ASP 165 Ca 0.04 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1iho h ASP 165 Cb 0.08 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1iho h ASP 165 CO -0.09 0.52 0.00 0.23 -1.72 0.00 0.00 179.24 178.18 1iho n MET 166 N -4.70 1.51 -1.00 3.56 2.81 0.30 -4.93 117.12 114.67 1iho n MET 166 Ca -0.02 -0.75 -0.00 0.00 -1.81 0.00 0.00 57.70 55.12 1iho n MET 166 Cb 0.17 -1.46 -0.00 0.00 -0.71 0.00 0.00 33.22 31.22 1iho n MET 166 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1iho n GLY 167 N 1.12 0.41 3.72 3.03 0.00 -0.77 -5.00 105.19 107.69 1iho n GLY 167 Ca 0.19 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 1iho n GLY 167 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iho s PHE 168 N -2.00 3.18 -1.31 1.61 0.40 -1.13 -4.92 117.98 113.81 1iho s PHE 168 Ca 0.00 0.89 -0.08 0.00 -0.60 0.00 0.00 56.93 57.14 1iho s PHE 168 Cb 0.00 -3.75 0.14 0.00 0.51 0.00 0.00 43.02 39.92 1iho s PHE 168 CO 0.00 -2.64 2.10 -3.47 0.70 0.00 0.00 175.22 171.91 1iho n ASP 169 N 3.73 6.17 -4.02 1.36 2.03 -1.26 -4.84 116.55 119.72 1iho n ASP 169 Ca 0.11 -3.09 -0.24 0.00 0.52 0.00 0.00 54.79 52.09 1iho n ASP 169 Cb 0.41 -1.45 -0.16 0.00 -0.72 0.00 0.00 41.12 39.20 1iho n ASP 169 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1iho s ILE 170 N 0.02 1.09 -0.17 5.18 1.01 -1.26 -4.79 121.20 122.27 1iho s ILE 170 Ca 0.46 -0.46 -0.29 0.00 0.00 0.00 0.00 60.65 60.35 1iho s ILE 170 Cb 0.13 -0.99 -0.01 0.00 0.01 0.00 0.00 42.46 41.60 1iho s ILE 170 CO -0.03 0.34 1.10 -0.70 0.00 0.00 0.00 174.94 175.65 1iho s GLU 171 N 0.60 4.30 -0.29 2.79 2.12 -0.27 -4.95 118.70 122.99 1iho s GLU 171 Ca -0.13 1.47 -0.16 0.00 0.36 0.00 0.00 54.97 56.51 1iho s GLU 171 Cb -0.15 -3.64 -0.02 0.00 0.26 0.00 0.00 34.13 30.58 1iho s GLU 171 CO 0.03 -0.56 0.44 0.42 -0.54 0.00 0.00 175.26 175.05 1iho s ILE 172 N 2.91 5.11 -0.36 -3.70 -1.09 -1.26 -1.37 121.20 121.44 1iho s ILE 172 Ca 0.49 0.53 -0.14 0.00 -2.23 0.00 0.00 60.65 59.30 1iho s ILE 172 Cb -0.18 -3.80 -0.01 0.00 -1.58 0.00 0.00 42.46 36.89 1iho s ILE 172 CO 0.12 0.03 0.27 -0.69 -1.23 0.00 0.00 174.94 173.44 1iho s VAL 173 N 2.20 5.27 -0.28 2.92 1.01 -0.19 -4.97 120.40 126.35 1iho s VAL 173 Ca 0.17 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.59 1iho s VAL 173 Cb -0.16 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1iho s VAL 173 CO 0.11 -0.11 0.68 -0.83 0.00 0.00 0.00 175.10 174.95 1iho s GLY 174 N 1.71 1.77 -0.23 4.51 0.00 -1.26 -1.21 107.32 112.61 1iho s GLY 174 Ca 0.06 -0.46 -0.14 0.00 0.00 0.00 0.00 44.72 44.18 1iho s GLY 174 CO 0.10 1.55 0.31 0.14 0.00 0.00 0.00 173.10 175.21 1iho s VAL 175 N 2.66 5.24 0.71 1.40 1.01 0.11 -4.83 120.40 126.71 1iho s VAL 175 Ca 0.28 0.50 -0.15 0.00 0.00 0.00 0.00 61.98 62.61 1iho s VAL 175 Cb -0.15 -3.65 0.03 0.00 0.00 0.00 0.00 36.38 32.61 1iho s VAL 175 CO 0.10 0.25 1.16 -2.84 0.00 0.00 0.00 175.10 173.78 1iho s PRO 176 N 1.45 2.38 0.15 2.72 0.02 -1.26 -1.24 135.00 139.22 1iho s PRO 176 Ca 0.14 1.59 -0.34 0.00 0.02 0.00 0.00 61.00 62.41 1iho s PRO 176 Cb -0.15 -1.88 -0.15 0.00 0.02 0.00 0.00 34.50 32.34 1iho s PRO 176 CO 0.08 -1.62 1.41 -0.89 -0.33 0.00 0.00 177.00 175.65 1iho n ILE 177 N -2.66 0.30 -2.59 2.83 5.41 -1.26 -4.83 119.36 116.56 1iho n ILE 177 Ca 0.12 -0.07 -0.38 0.00 1.00 0.00 0.00 62.75 63.41 1iho n ILE 177 Cb 0.51 -1.21 -0.05 0.00 -0.71 0.00 0.00 39.64 38.19 1iho n ILE 177 CO 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 176.55 176.51 1iho s MET 178 N 0.35 4.48 0.08 0.38 -1.94 -1.26 -5.00 119.30 116.39 1iho s MET 178 Ca 0.78 1.56 0.04 0.00 -1.71 0.00 0.00 55.69 56.36 1iho s MET 178 Cb -0.78 -2.88 -0.03 0.00 2.01 0.00 0.00 34.83 33.14 1iho s MET 178 CO 0.45 0.13 -0.11 1.03 -0.01 0.00 0.00 175.02 176.51 1iho s ARG 179 N -1.93 0.79 1.07 2.03 0.52 -1.26 -1.34 118.95 118.83 1iho s ARG 179 Ca 0.50 -1.04 -0.14 0.00 -0.52 0.00 0.00 55.73 54.53 1iho s ARG 179 Cb -0.25 -0.56 0.23 0.00 0.52 0.00 0.00 34.95 34.89 1iho s ARG 179 CO 0.31 0.10 1.08 0.00 0.02 0.00 0.00 175.30 176.81 1iho s ALA 180 N -1.98 0.57 0.29 2.13 0.00 0.30 -4.83 121.76 118.23 1iho s ALA 180 Ca 0.01 -0.44 0.32 0.00 0.00 0.00 0.00 51.96 51.85 1iho s ALA 180 Cb -0.06 -3.10 1.47 0.00 0.00 0.00 0.00 23.12 21.44 1iho s ALA 180 CO 0.01 -3.19 2.04 0.87 0.00 0.00 0.00 175.76 175.48 1iho h LYS 181 N -2.17 0.00 -0.10 0.00 1.57 -2.01 -0.90 116.57 112.96 1iho h LYS 181 Ca -0.55 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 1iho h LYS 181 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 1iho h LYS 181 CO 0.53 0.08 0.00 -0.40 -0.57 0.00 0.00 179.45 179.09 1iho n ASP 182 N -3.30 1.52 0.00 0.86 5.68 -1.26 -4.95 116.55 115.09 1iho n ASP 182 Ca -0.01 -1.60 0.00 0.00 -0.50 0.00 0.00 54.79 52.68 1iho n ASP 182 Cb 0.27 -0.06 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 1iho n ASP 182 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1iho n GLY 183 N 1.14 2.50 3.73 6.12 0.00 -0.34 -4.83 105.19 113.50 1iho n GLY 183 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1iho n GLY 183 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iho s LEU 184 N 0.00 4.37 0.13 0.99 2.96 -1.26 -4.66 118.68 121.22 1iho s LEU 184 Ca 0.00 2.67 -0.31 0.00 -0.22 0.00 0.00 54.13 56.27 1iho s LEU 184 Cb 0.00 -3.61 -0.10 0.00 0.50 0.00 0.00 46.19 42.98 1iho s LEU 184 CO 0.00 -0.79 1.70 0.00 -1.32 0.00 0.00 176.35 175.94 1iho s ALA 185 N 0.61 3.77 0.24 5.97 0.00 -1.26 -0.54 121.76 130.55 1iho s ALA 185 Ca 0.65 1.38 -0.30 0.00 0.00 0.00 0.00 51.96 53.70 1iho s ALA 185 Cb -0.44 -3.70 -0.09 0.00 0.00 0.00 0.00 23.12 18.89 1iho s ALA 185 CO 0.37 -1.04 1.34 -0.51 0.00 0.00 0.00 175.76 175.93 1iho s LEU 186 N 2.09 4.41 -0.16 0.00 1.43 -0.45 -4.85 118.68 121.16 1iho s LEU 186 Ca 0.75 2.54 -0.29 0.00 -1.03 0.00 0.00 54.13 56.10 1iho s LEU 186 Cb -0.44 -3.62 0.10 0.00 0.03 0.00 0.00 46.19 42.26 1iho s LEU 186 CO 0.33 -0.57 0.89 -0.55 0.23 0.00 0.00 176.35 176.68 1iho s SER 187 N 0.14 -0.50 0.57 2.29 0.15 -1.26 -4.90 113.70 110.19 1iho s SER 187 Ca 0.56 0.66 0.27 0.00 0.70 0.00 0.00 55.95 58.13 1iho s SER 187 Cb -0.39 0.57 1.52 0.00 -1.71 0.00 0.00 66.02 66.01 1iho s SER 187 CO 0.43 -0.38 2.05 0.77 1.20 0.00 0.00 173.24 177.31 1iho h SER 188 N 3.16 0.00 0.26 5.45 4.64 -2.04 -2.10 113.55 122.93 1iho h SER 188 Ca -0.23 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.03 1iho h SER 188 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1iho h SER 188 CO 0.28 0.00 -0.27 0.03 -0.87 0.00 0.00 176.83 176.00 1iho h ARG 189 N 0.00 0.02 0.00 4.77 3.08 -1.97 -1.89 114.38 118.39 1iho h ARG 189 Ca 0.14 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 1iho h ARG 189 Cb 0.67 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.72 1iho h ARG 189 CO -0.00 0.28 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.26 1iho h ASN 190 N 0.02 0.00 0.16 7.04 2.35 -1.73 -2.41 115.58 121.00 1iho h ASN 190 Ca 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1iho h ASN 190 Cb 0.48 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1iho h ASN 190 CO 0.03 0.01 -0.02 1.23 -1.65 0.00 0.00 177.43 177.04 1iho h GLY 191 N 0.16 0.00 -0.84 2.83 0.00 -1.51 -2.71 103.07 101.01 1iho h GLY 191 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1iho h GLY 191 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 1iho n TYR 192 N -3.34 0.00 -3.19 5.60 4.02 -0.91 -4.92 117.16 114.43 1iho n TYR 192 Ca -0.02 -0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.48 1iho n TYR 192 Cb 0.12 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.38 1iho n TYR 192 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1iho s LEU 193 N -2.00 4.49 1.08 7.72 1.43 -1.02 -4.37 118.68 126.01 1iho s LEU 193 Ca 0.35 1.29 -0.15 0.00 -1.03 0.00 0.00 54.13 54.59 1iho s LEU 193 Cb 0.21 -2.98 0.23 0.00 0.03 0.00 0.00 46.19 43.67 1iho s LEU 193 CO 0.33 0.18 1.12 0.42 0.23 0.00 0.00 176.35 178.63 1iho s THR 194 N -0.69 1.83 0.30 5.49 -4.23 -1.26 -4.69 115.64 112.39 1iho s THR 194 Ca 0.31 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.84 1iho s THR 194 Cb -0.20 -2.55 0.16 0.00 1.34 0.00 0.00 72.50 71.25 1iho s THR 194 CO 0.20 0.00 1.85 0.00 -0.54 0.00 0.00 174.62 176.12 1iho h ALA 195 N -2.14 1.28 -0.18 3.99 0.00 -1.99 0.14 119.26 120.36 1iho h ALA 195 Ca -0.50 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.09 1iho h ALA 195 Cb 1.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1iho h ALA 195 CO 0.47 0.49 -0.39 0.93 0.00 0.00 0.00 179.25 180.76 1iho h GLU 196 N 0.67 0.40 -0.41 0.00 3.07 -2.00 -2.17 114.58 114.15 1iho h GLU 196 Ca 0.15 -0.19 -0.13 0.00 -0.50 0.00 0.00 59.36 58.68 1iho h GLU 196 Cb 0.31 -0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.20 1iho h GLU 196 CO 0.00 0.73 -0.28 1.96 -1.40 0.00 0.00 179.01 180.03 1iho h GLN 197 N 0.34 0.88 -0.28 2.33 4.20 -1.78 -2.67 115.11 118.12 1iho h GLN 197 Ca 0.03 -0.40 -0.01 0.00 0.06 0.00 0.00 58.65 58.34 1iho h GLN 197 Cb 0.84 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.58 1iho h GLN 197 CO 0.07 1.04 0.13 -0.09 -0.67 0.00 0.00 178.83 179.31 1iho h ARG 198 N 0.74 0.39 -0.02 1.46 9.65 -0.36 -0.41 114.38 125.83 1iho h ARG 198 Ca 0.09 -0.04 -0.10 0.00 -1.10 0.00 0.00 59.98 58.82 1iho h ARG 198 Cb 0.84 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.32 1iho h ARG 198 CO 0.07 0.31 -0.47 -0.22 2.80 0.00 0.00 179.97 182.46 1iho h LYS 199 N 0.39 0.06 0.03 0.20 3.64 -1.07 -3.08 116.57 116.74 1iho h LYS 199 Ca 0.10 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.24 1iho h LYS 199 Cb 0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.86 1iho h LYS 199 CO -0.01 0.52 -0.98 0.82 -2.27 0.00 0.00 179.45 177.52 1iho h ILE 200 N 0.05 1.59 -0.92 2.00 2.04 -1.01 -3.39 117.51 117.87 1iho h ILE 200 Ca -0.00 -3.01 0.19 0.00 1.00 0.00 0.00 64.86 63.04 1iho h ILE 200 Cb 0.86 2.70 -0.07 0.00 -0.74 0.00 0.00 36.82 39.56 1iho h ILE 200 CO 0.06 0.87 0.60 0.00 0.00 0.00 0.00 178.15 179.68 1iho h ALA 201 N 0.94 2.06 0.00 1.87 0.00 -1.02 -0.89 119.26 122.21 1iho h ALA 201 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1iho h ALA 201 Cb 1.68 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1iho h ALA 201 CO 0.14 -0.35 0.00 -2.30 0.00 0.00 0.00 179.25 176.74 1iho n PRO 202 N -4.56 0.03 0.26 0.00 -0.02 -1.26 -2.13 135.00 127.31 1iho n PRO 202 Ca 0.20 0.51 0.11 0.00 -2.02 0.00 0.00 63.50 62.30 1iho n PRO 202 Cb 0.64 -1.59 0.70 0.00 -0.02 0.00 0.00 33.50 33.22 1iho n PRO 202 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1iho h GLY 203 N 0.15 0.00 0.86 -1.23 0.00 -1.47 -2.57 103.07 98.81 1iho h GLY 203 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1iho h GLY 203 CO 0.00 0.00 0.03 -2.00 0.00 0.00 0.00 176.54 174.57 1iho h LEU 204 N 0.00 0.10 -1.50 3.11 5.85 -1.65 -0.23 115.31 120.99 1iho h LEU 204 Ca -0.00 -0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.52 1iho h LEU 204 Cb 0.27 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1iho h LEU 204 CO 0.02 0.23 -0.10 0.22 -0.34 0.00 0.00 178.44 178.46 1iho h TYR 205 N -0.04 0.20 -0.35 1.25 3.20 -1.70 -0.29 116.97 119.24 1iho h TYR 205 Ca 0.02 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 1iho h TYR 205 Cb 0.16 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 1iho h TYR 205 CO -0.02 0.30 0.09 0.87 -1.64 0.00 0.00 178.16 177.76 1iho h LYS 206 N 0.19 0.56 -0.30 1.82 1.57 -1.04 0.12 116.57 119.50 1iho h LYS 206 Ca 0.04 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1iho h LYS 206 Cb 0.31 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1iho h LYS 206 CO 0.02 0.61 0.10 0.28 -0.57 0.00 0.00 179.45 179.89 1iho h VAL 207 N 0.42 1.20 -0.81 0.50 2.07 -0.53 0.08 116.25 119.17 1iho h VAL 207 Ca 0.11 -0.62 0.14 0.00 0.82 0.00 0.00 66.70 67.15 1iho h VAL 207 Cb 0.29 1.05 -0.09 0.00 -1.52 0.00 0.00 31.29 31.02 1iho h VAL 207 CO 0.00 0.21 0.40 0.25 0.02 0.00 0.00 177.57 178.45 1iho h LEU 208 N 0.32 0.48 -0.89 2.57 5.85 -0.85 -0.03 115.31 122.75 1iho h LEU 208 Ca 0.10 0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 1iho h LEU 208 Cb 0.23 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1iho h LEU 208 CO -0.00 0.21 -0.42 0.28 -0.34 0.00 0.00 178.44 178.17 1iho h SER 209 N 0.59 0.29 -0.25 1.25 0.02 -0.47 -2.20 113.55 112.78 1iho h SER 209 Ca 0.43 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 61.24 1iho h SER 209 Cb 0.59 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.04 1iho h SER 209 CO -0.35 0.68 0.07 -1.28 -1.14 0.00 0.00 176.83 174.81 1iho h SER 210 N 0.23 0.37 -0.73 3.07 0.87 0.36 -0.74 113.55 116.98 1iho h SER 210 Ca 0.02 -0.21 0.07 0.00 -1.23 0.00 0.00 61.79 60.44 1iho h SER 210 Cb 0.84 -0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 62.64 1iho h SER 210 CO 0.07 0.48 0.40 0.40 -0.53 0.00 0.00 176.83 177.65 1iho h ILE 211 N 0.23 0.94 -0.64 2.23 2.04 -0.86 -2.18 117.51 119.26 1iho h ILE 211 Ca 0.08 -0.25 -0.07 0.00 1.00 0.00 0.00 64.86 65.62 1iho h ILE 211 Cb 0.25 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 1iho h ILE 211 CO -0.00 0.13 0.11 0.00 0.00 0.00 0.00 178.15 178.39 1iho h ALA 212 N 1.39 0.97 -0.24 1.87 0.00 -0.99 -1.33 119.26 120.93 1iho h ALA 212 Ca 0.34 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1iho h ALA 212 Cb 0.26 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1iho h ALA 212 CO -0.21 0.65 0.11 -0.44 0.00 0.00 0.00 179.25 179.35 1iho h ASP 213 N 0.99 0.15 -0.36 0.00 3.32 -0.55 0.34 116.42 120.30 1iho h ASP 213 Ca 0.20 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.31 1iho h ASP 213 Cb 0.42 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.92 1iho h ASP 213 CO 0.01 0.12 0.13 0.11 -1.72 0.00 0.00 179.24 177.88 1iho h LYS 214 N 0.23 0.27 -0.46 3.56 1.57 -1.13 -1.03 116.57 119.58 1iho h LYS 214 Ca 0.10 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 1iho h LYS 214 Cb 0.04 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1iho h LYS 214 CO -0.08 0.18 0.10 -0.07 -0.57 0.00 0.00 179.45 179.01 1iho h LEU 215 N 0.28 0.71 -2.29 2.94 3.38 -0.80 -0.86 115.31 118.66 1iho h LEU 215 Ca 0.17 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1iho h LEU 215 Cb 0.14 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1iho h LEU 215 CO -0.17 0.77 0.00 -0.61 0.09 0.00 0.00 178.44 178.52 1iho h GLN 216 N 0.62 0.00 -0.61 1.13 4.15 0.03 -2.49 115.11 117.94 1iho h GLN 216 Ca 0.14 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.56 1iho h GLN 216 Cb 0.34 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.03 1iho h GLN 216 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 178.83 176.90 1iho n ALA 217 N -2.06 2.40 -0.28 3.38 0.00 -0.42 -4.94 120.51 118.58 1iho n ALA 217 Ca -0.01 -1.14 0.00 0.00 0.00 0.00 0.00 53.44 52.29 1iho n ALA 217 Cb 0.16 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1iho n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iho n GLY 218 N 1.56 0.69 3.72 0.00 0.00 -0.94 -5.04 105.19 105.19 1iho n GLY 218 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1iho n GLY 218 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1iho n GLU 219 N -2.00 2.72 0.00 1.61 1.02 -0.52 -4.86 120.64 118.61 1iho n GLU 219 Ca 0.00 0.98 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 1iho n GLU 219 Cb 0.00 -2.81 0.00 0.00 -0.02 0.00 0.00 31.44 28.61 1iho n GLU 219 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1iho n ARG 220 N 3.80 1.47 -2.52 3.49 5.12 -1.26 -4.52 116.66 122.24 1iho n ARG 220 Ca 0.16 -1.01 -0.43 0.00 -1.93 0.00 0.00 57.85 54.64 1iho n ARG 220 Cb 0.34 -0.84 0.00 0.00 -1.16 0.00 0.00 32.46 30.80 1iho n ARG 220 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1iho n ASP 221 N -0.27 4.90 -0.35 0.55 -0.08 -1.26 -4.79 116.55 115.25 1iho n ASP 221 Ca 0.00 -2.96 0.02 0.00 -1.51 0.00 0.00 54.79 50.33 1iho n ASP 221 Cb 0.28 -1.62 0.18 0.00 2.34 0.00 0.00 41.12 42.29 1iho n ASP 221 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1iho h LEU 222 N 10.27 1.03 -0.83 -2.67 3.38 -1.99 -1.85 115.31 122.65 1iho h LEU 222 Ca 0.41 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.37 1iho h LEU 222 Cb 0.79 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1iho h LEU 222 CO 1.49 0.68 0.46 0.44 0.09 0.00 0.00 178.44 181.60 1iho h ASP 223 N 1.18 1.03 -0.22 -0.43 3.32 -1.99 0.13 116.42 119.44 1iho h ASP 223 Ca 0.40 -0.10 -0.16 0.00 0.02 0.00 0.00 57.03 57.19 1iho h ASP 223 Cb 0.08 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1iho h ASP 223 CO -0.14 0.83 -0.51 -0.08 -1.72 0.00 0.00 179.24 177.63 1iho h GLU 224 N 1.15 0.72 -0.66 3.56 4.57 -1.87 0.12 114.58 122.17 1iho h GLU 224 Ca 0.29 -0.49 0.08 0.00 -1.18 0.00 0.00 59.36 58.06 1iho h GLU 224 Cb 0.02 0.07 -0.07 0.00 -0.16 0.00 0.00 28.75 28.62 1iho h GLU 224 CO -0.05 1.11 0.31 0.82 -1.18 0.00 0.00 179.01 180.03 1iho h ILE 225 N 0.44 0.86 -0.06 2.32 2.04 -1.10 0.20 117.51 122.21 1iho h ILE 225 Ca -0.00 -0.19 -0.20 0.00 1.00 0.00 0.00 64.86 65.46 1iho h ILE 225 Cb 1.12 0.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1iho h ILE 225 CO 0.11 0.10 -0.81 0.40 0.00 0.00 0.00 178.15 177.95 1iho h ILE 226 N 0.55 1.37 -0.41 -0.67 2.04 -0.69 -1.78 117.51 117.92 1iho h ILE 226 Ca 0.32 -2.23 -0.02 0.00 1.00 0.00 0.00 64.86 63.93 1iho h ILE 226 Cb 0.32 2.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.59 1iho h ILE 226 CO -0.25 0.67 0.17 0.74 0.00 0.00 0.00 178.15 179.48 1iho h THR 227 N 0.29 1.19 -0.47 -0.27 2.02 -0.36 -1.86 112.91 113.46 1iho h THR 227 Ca -0.05 -0.59 -0.08 0.00 0.77 0.00 0.00 66.41 66.45 1iho h THR 227 Cb 1.42 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 1iho h THR 227 CO 0.14 0.22 -0.05 0.40 0.37 0.00 0.00 175.52 176.60 1iho h ILE 228 N 0.52 1.25 -0.37 3.11 2.04 -0.59 -2.33 117.51 121.15 1iho h ILE 228 Ca 0.14 -1.10 0.01 0.00 1.00 0.00 0.00 64.86 64.91 1iho h ILE 228 Cb 0.18 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1iho h ILE 228 CO -0.01 0.38 0.23 0.00 0.00 0.00 0.00 178.15 178.75 1iho h ALA 229 N 1.19 0.46 -0.44 1.87 0.00 -1.14 0.53 119.26 121.74 1iho h ALA 229 Ca 0.14 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1iho h ALA 229 Cb 0.53 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1iho h ALA 229 CO 0.03 -0.11 0.25 0.78 0.00 0.00 0.00 179.25 180.20 1iho h GLY 230 N 0.46 0.61 0.81 0.00 0.00 -1.18 -1.01 103.07 102.77 1iho h GLY 230 Ca 0.14 -0.19 0.03 0.00 0.00 0.00 0.00 47.33 47.31 1iho h GLY 230 CO -0.05 0.16 0.16 1.46 0.00 0.00 0.00 176.54 178.26 1iho h GLN 231 N 0.51 0.33 -0.64 4.80 4.20 -1.07 0.23 115.11 123.46 1iho h GLN 231 Ca 0.18 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.88 1iho h GLN 231 Cb 0.02 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.69 1iho h GLN 231 CO -0.09 0.22 0.41 0.93 -0.67 0.00 0.00 178.83 179.63 1iho h GLU 232 N 0.33 0.80 -0.27 1.46 5.08 -0.68 0.26 114.58 121.56 1iho h GLU 232 Ca 0.15 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1iho h GLU 232 Cb 0.07 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 1iho h GLU 232 CO -0.11 0.53 0.14 -0.07 -1.00 0.00 0.00 179.01 178.49 1iho h LEU 233 N 0.82 0.35 -0.93 1.33 3.38 -0.68 -1.31 115.31 118.27 1iho h LEU 233 Ca 0.24 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1iho h LEU 233 Cb -0.04 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1iho h LEU 233 CO -0.08 0.36 0.30 0.78 0.09 0.00 0.00 178.44 179.90 1iho h ASN 234 N 0.31 0.99 0.56 -0.43 2.35 -0.15 -1.26 115.58 117.94 1iho h ASN 234 Ca 0.09 -0.14 -0.07 0.00 -0.55 0.00 0.00 56.30 55.64 1iho h ASN 234 Cb 0.10 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1iho h ASN 234 CO -0.01 0.87 -0.32 -0.08 -1.65 0.00 0.00 177.43 176.23 1iho h GLU 235 N 1.06 0.00 0.00 0.81 4.22 -0.25 -2.31 114.58 118.11 1iho h GLU 235 Ca 0.25 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.66 1iho h GLU 235 Cb 0.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1iho h GLU 235 CO -0.02 0.32 -0.12 0.87 -2.18 0.00 0.00 179.01 177.88 1iho h LYS 236 N 0.00 0.00 0.00 1.92 1.57 -0.11 -3.46 116.57 116.49 1iho h LYS 236 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1iho h LYS 236 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1iho h LYS 236 CO 0.04 0.12 0.00 0.41 -0.57 0.00 0.00 179.45 179.45 1iho n GLY 237 N 0.11 1.10 3.88 3.86 0.00 -0.87 -5.02 105.19 108.25 1iho n GLY 237 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1iho n GLY 237 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iho s PHE 238 N -1.61 2.68 -0.37 1.61 0.40 -0.78 -4.83 117.98 115.09 1iho s PHE 238 Ca 0.00 0.71 0.02 0.00 -0.60 0.00 0.00 56.93 57.07 1iho s PHE 238 Cb 0.00 -3.56 0.11 0.00 0.51 0.00 0.00 43.02 40.08 1iho s PHE 238 CO 0.00 -2.02 0.11 1.03 0.70 0.00 0.00 175.22 175.05 1iho s ARG 239 N -5.56 1.28 0.40 0.44 1.81 0.51 -4.12 118.95 113.71 1iho s ARG 239 Ca 0.64 -1.74 -0.25 0.00 -1.72 0.00 0.00 55.73 52.65 1iho s ARG 239 Cb -0.11 -2.75 -0.11 0.00 -0.45 0.00 0.00 34.95 31.54 1iho s ARG 239 CO 0.50 -1.00 1.11 0.00 -0.68 0.00 0.00 175.30 175.23 1iho n ALA 240 N 4.21 0.54 0.00 2.13 0.00 -1.26 -0.97 120.51 125.16 1iho n ALA 240 Ca 0.03 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1iho n ALA 240 Cb 0.40 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.71 1iho n ALA 240 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1iho n ASP 241 N 0.55 2.45 -3.64 0.00 2.03 -0.49 -4.81 116.55 112.64 1iho n ASP 241 Ca 0.08 0.00 -0.06 0.00 0.52 0.00 0.00 54.79 55.33 1iho n ASP 241 Cb 0.38 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.71 1iho n ASP 241 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1iho s ASP 242 N -3.69 -0.79 -0.03 1.67 3.68 -0.83 -4.97 116.67 111.72 1iho s ASP 242 Ca 0.00 1.27 0.01 0.00 2.13 0.00 0.00 52.55 55.96 1iho s ASP 242 Cb 0.00 1.32 0.02 0.00 -1.45 0.00 0.00 42.92 42.81 1iho s ASP 242 CO 0.00 -0.20 -0.02 -0.63 0.13 0.00 0.00 175.17 174.45 1iho s ILE 243 N 1.44 0.33 -0.04 4.11 1.01 -1.26 -0.53 121.20 126.26 1iho s ILE 243 Ca -0.09 -0.01 -0.06 0.00 0.00 0.00 0.00 60.65 60.50 1iho s ILE 243 Cb -0.05 -0.39 0.01 0.00 0.01 0.00 0.00 42.46 42.04 1iho s ILE 243 CO -0.17 0.18 0.14 -1.10 0.00 0.00 0.00 174.94 173.99 1iho s GLN 244 N 0.94 0.29 -0.08 2.79 -0.21 -0.42 -5.02 119.66 117.95 1iho s GLN 244 Ca -0.11 -0.02 0.02 0.00 0.02 0.00 0.00 55.36 55.27 1iho s GLN 244 Cb -0.14 0.13 0.02 0.00 1.00 0.00 0.00 33.01 34.01 1iho s GLN 244 CO -0.01 -0.05 -0.12 0.42 -2.12 0.00 0.00 175.29 173.41 1iho s ILE 245 N -0.46 1.17 0.13 1.08 1.01 -1.26 -1.25 121.20 121.61 1iho s ILE 245 Ca -0.05 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 1iho s ILE 245 Cb -0.04 -1.09 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 1iho s ILE 245 CO 0.01 0.37 0.06 -0.13 0.00 0.00 0.00 174.94 175.24 1iho s ARG 246 N 0.90 0.91 0.19 2.79 1.81 -0.19 -4.56 118.95 120.80 1iho s ARG 246 Ca -0.10 -1.42 -0.31 0.00 -1.72 0.00 0.00 55.73 52.18 1iho s ARG 246 Cb -0.15 0.24 -0.11 0.00 -0.45 0.00 0.00 34.95 34.49 1iho s ARG 246 CO 0.01 -0.25 1.59 0.34 -0.68 0.00 0.00 175.30 176.30 1iho s ASP 247 N -3.04 6.54 0.47 0.23 -1.08 0.10 -0.16 116.67 119.73 1iho s ASP 247 Ca 0.23 2.69 0.27 0.00 -0.52 0.00 0.00 52.55 55.22 1iho s ASP 247 Cb 0.07 -2.60 0.70 0.00 -1.46 0.00 0.00 42.92 39.63 1iho s ASP 247 CO 0.01 -0.85 1.74 0.00 0.52 0.00 0.00 175.17 176.59 1iho h ALA 248 N 6.53 1.00 0.01 3.66 0.00 -1.36 0.29 119.26 129.40 1iho h ALA 248 Ca -0.43 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.11 1iho h ALA 248 Cb 1.21 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 1iho h ALA 248 CO 0.90 0.00 -2.34 -0.25 0.00 0.00 0.00 179.25 177.57 1iho n ASP 249 N -3.08 0.84 -0.00 0.00 8.00 -1.26 -4.58 116.55 116.46 1iho n ASP 249 Ca 0.03 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.57 1iho n ASP 249 Cb 0.45 0.34 -0.05 0.00 -0.02 0.00 0.00 41.12 41.85 1iho n ASP 249 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1iho n THR 250 N -2.98 0.00 -1.02 -3.53 -2.24 -1.25 -4.90 114.28 98.36 1iho n THR 250 Ca -0.36 -0.23 -0.01 0.00 -2.27 0.00 0.00 64.05 61.18 1iho n THR 250 Cb 1.09 0.61 -0.00 0.00 -2.10 0.00 0.00 70.33 69.93 1iho n THR 250 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1iho n LEU 251 N -1.50 0.39 -4.95 3.22 4.77 0.09 -4.74 117.00 114.29 1iho n LEU 251 Ca -0.00 0.02 -0.26 0.00 -0.03 0.00 0.00 56.01 55.73 1iho n LEU 251 Cb 0.15 -1.46 0.10 0.00 -2.33 0.00 0.00 43.42 39.88 1iho n LEU 251 CO 0.14 -0.48 0.65 -0.76 -1.33 0.00 0.00 177.39 175.62 1iho s LEU 252 N -0.15 2.84 0.43 2.23 1.43 -1.26 -4.67 118.68 119.53 1iho s LEU 252 Ca 0.00 0.21 -0.26 0.00 -1.03 0.00 0.00 54.13 53.05 1iho s LEU 252 Cb 0.00 -2.66 -0.09 0.00 0.03 0.00 0.00 46.19 43.47 1iho s LEU 252 CO 0.00 -1.90 1.36 -0.62 0.23 0.00 0.00 176.35 175.42 1iho n GLU 253 N -3.07 2.14 -1.71 1.70 4.71 -1.26 0.00 120.64 123.15 1iho n GLU 253 Ca 0.11 0.76 -0.43 0.00 -0.01 0.00 0.00 57.16 57.59 1iho n GLU 253 Cb 0.60 -2.51 -0.03 0.00 -1.01 0.00 0.00 31.44 28.49 1iho n GLU 253 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1iho n VAL 254 N -0.13 0.39 -3.74 2.62 0.31 -1.26 -4.48 118.33 112.03 1iho n VAL 254 Ca 0.05 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1iho n VAL 254 Cb 0.40 -1.86 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 1iho n VAL 254 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1iho n SER 255 N 3.18 0.43 0.10 4.52 3.41 -1.26 -4.97 113.62 119.03 1iho n SER 255 Ca 0.14 -0.74 0.10 0.00 -0.26 0.00 0.00 58.87 58.11 1iho n SER 255 Cb 0.34 0.00 0.44 0.00 -0.26 0.00 0.00 64.21 64.73 1iho n SER 255 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1iho n GLU 256 N 0.00 0.13 0.04 4.33 2.13 -1.26 -1.63 120.64 124.38 1iho n GLU 256 Ca 0.00 0.40 0.11 0.00 0.66 0.00 0.00 57.16 58.33 1iho n GLU 256 Cb 0.00 -1.77 -0.07 0.00 0.27 0.00 0.00 31.44 29.86 1iho n GLU 256 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1iho n THR 257 N -2.03 0.25 -1.77 6.31 -2.24 -1.26 -4.94 114.28 108.60 1iho n THR 257 Ca 0.02 -0.46 -0.41 0.00 -2.27 0.00 0.00 64.05 60.93 1iho n THR 257 Cb 0.19 -0.05 -0.01 0.00 -2.10 0.00 0.00 70.33 68.36 1iho n THR 257 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1iho s SER 258 N -4.66 6.34 -0.01 3.42 0.01 -0.65 -4.89 113.70 113.27 1iho s SER 258 Ca -0.03 3.00 0.06 0.00 1.31 0.00 0.00 55.95 60.30 1iho s SER 258 Cb 0.13 -2.65 -0.09 0.00 0.21 0.00 0.00 66.02 63.62 1iho s SER 258 CO 0.85 -0.92 0.18 0.29 0.41 0.00 0.00 173.24 174.05 1iho n LYS 259 N 1.64 1.49 -3.88 12.44 5.02 -1.26 -4.89 118.16 128.72 1iho n LYS 259 Ca 0.06 -0.04 -0.11 0.00 -2.02 0.00 0.00 58.31 56.19 1iho n LYS 259 Cb 0.38 -1.06 -0.12 0.00 -0.02 0.00 0.00 35.03 34.21 1iho n LYS 259 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1iho s ARG 260 N -2.22 0.21 0.17 1.97 0.52 -1.26 0.09 118.95 118.44 1iho s ARG 260 Ca -0.01 -0.16 0.11 0.00 -0.52 0.00 0.00 55.73 55.15 1iho s ARG 260 Cb 0.04 0.09 -0.04 0.00 0.52 0.00 0.00 34.95 35.56 1iho s ARG 260 CO 0.27 -0.04 -0.24 0.00 0.02 0.00 0.00 175.30 175.30 1iho s ALA 261 N -0.58 2.50 -0.09 2.13 0.00 0.47 -1.03 121.76 125.15 1iho s ALA 261 Ca -0.07 -1.58 0.03 0.00 0.00 0.00 0.00 51.96 50.35 1iho s ALA 261 Cb -0.04 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 1iho s ALA 261 CO 0.00 0.47 -0.18 0.54 0.00 0.00 0.00 175.76 176.59 1iho s VAL 262 N -1.46 2.63 -0.13 0.00 0.11 0.77 -0.04 120.40 122.28 1iho s VAL 262 Ca 0.19 -0.84 -0.01 0.00 -2.93 0.00 0.00 61.98 58.39 1iho s VAL 262 Cb -0.09 -2.04 -0.02 0.00 -1.53 0.00 0.00 36.38 32.71 1iho s VAL 262 CO 0.09 0.55 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.66 1iho s ILE 263 N 0.01 3.15 -0.11 7.04 1.01 0.13 -1.02 121.20 131.41 1iho s ILE 263 Ca -0.06 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 59.99 1iho s ILE 263 Cb -0.15 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 39.99 1iho s ILE 263 CO 0.05 0.52 -0.22 -0.76 0.00 0.00 0.00 174.94 174.53 1iho s LEU 264 N 0.35 2.17 -0.01 2.97 1.43 -0.38 -1.22 118.68 123.99 1iho s LEU 264 Ca -0.10 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 1iho s LEU 264 Cb -0.16 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.61 1iho s LEU 264 CO 0.05 0.14 -0.13 0.68 0.23 0.00 0.00 176.35 177.32 1iho s VAL 265 N 0.46 1.04 -0.02 -1.59 -7.23 -0.52 -1.30 120.40 111.24 1iho s VAL 265 Ca -0.15 -0.60 0.03 0.00 -1.81 0.00 0.00 61.98 59.44 1iho s VAL 265 Cb -0.17 -0.88 0.00 0.00 0.56 0.00 0.00 36.38 35.89 1iho s VAL 265 CO 0.06 0.27 -0.09 0.00 -0.31 0.00 0.00 175.10 175.03 1iho s ALA 266 N -0.36 0.82 -0.19 1.32 0.00 0.31 -1.52 121.76 122.15 1iho s ALA 266 Ca 0.05 -0.34 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 1iho s ALA 266 Cb -0.05 -0.28 0.05 0.00 0.00 0.00 0.00 23.12 22.84 1iho s ALA 266 CO -0.00 0.15 0.49 0.00 0.00 0.00 0.00 175.76 176.39 1iho s ALA 267 N 0.08 -1.23 0.26 0.00 0.00 -0.36 -1.40 121.76 119.11 1iho s ALA 267 Ca -0.01 1.51 -0.29 0.00 0.00 0.00 0.00 51.96 53.17 1iho s ALA 267 Cb -0.07 -0.89 -0.09 0.00 0.00 0.00 0.00 23.12 22.07 1iho s ALA 267 CO 0.00 -0.25 0.95 -1.58 0.00 0.00 0.00 175.76 174.88 1iho s TRP 268 N 0.68 3.92 -0.21 0.00 0.52 -0.14 -1.32 118.94 122.40 1iho s TRP 268 Ca -0.03 1.89 -0.04 0.00 0.02 0.00 0.00 56.10 57.93 1iho s TRP 268 Cb -0.05 -2.99 0.08 0.00 -1.15 0.00 0.00 33.47 29.37 1iho s TRP 268 CO -0.05 0.37 0.16 -1.17 0.02 0.00 0.00 176.95 176.29 1iho s LEU 269 N -1.33 0.17 0.00 2.99 2.96 -0.35 -0.36 118.68 122.75 1iho s LEU 269 Ca 0.43 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.74 1iho s LEU 269 Cb -0.25 0.02 0.00 0.00 0.50 0.00 0.00 46.19 46.46 1iho s LEU 269 CO 0.31 -0.36 0.00 0.61 -1.32 0.00 0.00 176.35 175.59 1iho n GLY 270 N 5.29 2.70 1.20 7.98 0.00 -1.26 -1.48 105.19 119.63 1iho n GLY 270 Ca -0.06 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 45.76 1iho n GLY 270 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1iho n ASP 271 N 5.00 3.51 -4.77 1.61 8.00 -1.26 -4.88 116.55 123.77 1iho n ASP 271 Ca 0.00 -2.13 -0.36 0.00 0.71 0.00 0.00 54.79 53.01 1iho n ASP 271 Cb 0.00 -0.45 -0.07 0.00 -0.02 0.00 0.00 41.12 40.58 1iho n ASP 271 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iho s ALA 272 N -1.41 3.73 -0.72 2.24 0.00 -0.55 -5.01 121.76 120.04 1iho s ALA 272 Ca 0.41 -0.65 -0.13 0.00 0.00 0.00 0.00 51.96 51.59 1iho s ALA 272 Cb 0.23 -2.14 0.19 0.00 0.00 0.00 0.00 23.12 21.40 1iho s ALA 272 CO 0.25 0.27 0.65 0.50 0.00 0.00 0.00 175.76 177.42 1iho s ARG 273 N 0.01 3.28 0.33 0.00 3.52 -1.26 -1.21 118.95 123.61 1iho s ARG 273 Ca 0.11 -2.28 -0.26 0.00 -0.13 0.00 0.00 55.73 53.17 1iho s ARG 273 Cb -0.11 -4.28 -0.10 0.00 -1.56 0.00 0.00 34.95 28.90 1iho s ARG 273 CO 0.00 -1.28 0.99 -0.51 -0.81 0.00 0.00 175.30 173.69 1iho s LEU 274 N 0.50 4.34 0.02 -0.88 1.43 -0.43 -4.84 118.68 118.81 1iho s LEU 274 Ca 0.14 1.94 0.03 0.00 -1.03 0.00 0.00 54.13 55.21 1iho s LEU 274 Cb -0.16 -3.99 -0.01 0.00 0.03 0.00 0.00 46.19 42.05 1iho s LEU 274 CO -0.05 -0.16 -0.09 -0.63 0.23 0.00 0.00 176.35 175.64 1iho s ILE 275 N -1.55 0.73 0.14 -0.59 1.01 -1.26 -1.22 121.20 118.46 1iho s ILE 275 Ca 0.51 -0.70 -0.20 0.00 0.00 0.00 0.00 60.65 60.26 1iho s ILE 275 Cb -0.21 -0.67 0.05 0.00 0.01 0.00 0.00 42.46 41.64 1iho s ILE 275 CO 0.27 -0.01 0.51 -0.62 0.00 0.00 0.00 174.94 175.08 1iho s ASP 276 N -0.79 -0.41 0.11 3.58 -1.08 -0.58 -4.89 116.67 112.60 1iho s ASP 276 Ca -0.01 -0.14 -0.11 0.00 -0.52 0.00 0.00 52.55 51.77 1iho s ASP 276 Cb -0.06 0.54 0.01 0.00 -1.46 0.00 0.00 42.92 41.95 1iho s ASP 276 CO 0.00 -0.91 0.26 0.54 0.52 0.00 0.00 175.17 175.59 1iho s ASN 277 N -2.75 0.01 -0.18 -0.34 2.20 -1.26 -1.44 114.94 111.17 1iho s ASN 277 Ca 0.02 -0.56 -0.16 0.00 -0.94 0.00 0.00 52.86 51.22 1iho s ASN 277 Cb 0.00 0.39 0.05 0.00 -2.00 0.00 0.00 41.25 39.69 1iho s ASN 277 CO -0.12 -0.78 0.47 -0.75 -2.94 0.00 0.00 177.10 172.97 1iho s LYS 278 N -3.85 0.53 -0.08 3.55 2.20 -0.36 -4.98 119.74 116.75 1iho s LYS 278 Ca 0.05 0.68 -0.05 0.00 -0.36 0.00 0.00 55.97 56.29 1iho s LYS 278 Cb 0.04 0.23 -0.04 0.00 -1.51 0.00 0.00 37.83 36.55 1iho s LYS 278 CO -0.11 -0.08 0.12 -1.64 -0.36 0.00 0.00 175.35 173.29 1iho s MET 279 N 0.39 3.32 -0.04 4.03 -1.94 -1.26 -0.69 119.30 123.11 1iho s MET 279 Ca -0.01 -0.25 0.04 0.00 -1.71 0.00 0.00 55.69 53.76 1iho s MET 279 Cb -0.04 -3.07 -0.00 0.00 2.01 0.00 0.00 34.83 33.73 1iho s MET 279 CO -0.01 0.73 -0.15 0.54 -0.01 0.00 0.00 175.02 176.13 1iho s VAL 280 N -1.07 1.24 0.18 -6.03 0.11 0.94 -4.97 120.40 110.80 1iho s VAL 280 Ca 0.18 -0.61 -0.30 0.00 -2.93 0.00 0.00 61.98 58.32 1iho s VAL 280 Cb -0.12 -1.07 -0.08 0.00 -1.53 0.00 0.00 36.38 33.58 1iho s VAL 280 CO 0.07 0.36 0.98 -1.61 -3.33 0.00 0.00 175.10 171.57 1iho s GLU 281 N 0.10 4.75 0.00 1.54 0.41 -1.26 -0.40 118.70 123.84 1iho s GLU 281 Ca -0.04 1.52 0.22 0.00 -0.41 0.00 0.00 54.97 56.26 1iho s GLU 281 Cb -0.11 -3.31 0.17 0.00 -1.78 0.00 0.00 34.13 29.10 1iho s GLU 281 CO 0.02 0.33 1.20 1.28 -0.49 0.00 0.00 175.26 177.60