#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ixr s LEU 6 N 0.00 3.01 -0.00 0.00 1.43 -1.26 -5.06 118.68 116.79 1ixr s LEU 6 Ca 0.00 1.97 0.05 0.00 -1.03 0.00 0.00 54.13 55.11 1ixr s LEU 6 Cb 0.00 -4.54 -0.01 0.00 0.03 0.00 0.00 46.19 41.67 1ixr s LEU 6 CO 0.00 -2.34 -0.14 0.00 0.23 0.00 0.00 176.35 174.09 1ixr s ARG 7 N -4.74 1.14 -0.58 1.70 1.70 -1.26 -5.07 118.95 111.85 1ixr s ARG 7 Ca 0.64 -0.55 -0.26 0.00 -0.47 0.00 0.00 55.73 55.08 1ixr s ARG 7 Cb -0.19 -1.11 -0.08 0.00 -0.57 0.00 0.00 34.95 32.99 1ixr s ARG 7 CO 0.55 0.30 2.34 -1.25 -1.08 0.00 0.00 175.30 176.16 1ixr s PRO 8 N -0.45 2.06 0.05 3.89 0.04 -1.26 -4.87 135.00 134.45 1ixr s PRO 8 Ca 0.05 1.07 -0.31 0.00 0.04 0.00 0.00 61.00 61.85 1ixr s PRO 8 Cb -0.06 -4.62 -0.10 0.00 0.04 0.00 0.00 34.50 29.76 1ixr s PRO 8 CO -0.00 -3.48 1.89 1.63 0.04 0.00 0.00 177.00 177.08 1ixr n LYS 9 N 8.99 2.68 -0.86 4.56 5.02 -1.26 -4.88 118.16 132.40 1ixr n LYS 9 Ca 0.37 0.98 0.00 0.00 -2.02 0.00 0.00 58.31 57.64 1ixr n LYS 9 Cb 0.52 -2.89 0.00 0.00 -0.02 0.00 0.00 35.03 32.64 1ixr n LYS 9 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ixr n THR 10 N 5.07 0.00 -0.00 -0.18 -2.24 -1.26 -4.74 114.28 110.93 1ixr n THR 10 Ca 0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1ixr n THR 10 Cb 0.37 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.59 1ixr n THR 10 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1ixr n LEU 11 N 0.00 0.00 0.17 3.22 7.94 -1.26 -4.43 117.00 122.64 1ixr n LEU 11 Ca 0.00 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.03 1ixr n LEU 11 Cb 0.00 0.01 0.37 0.00 0.53 0.00 0.00 43.42 44.33 1ixr n LEU 11 CO 0.00 0.01 0.87 -0.78 -1.11 0.00 0.00 177.39 176.38 1ixr h ASP 12 N 0.00 0.00 -0.45 1.96 1.82 -1.97 -2.83 116.42 114.95 1ixr h ASP 12 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1ixr h ASP 12 Cb 0.28 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.29 1ixr h ASP 12 CO 0.00 0.00 0.00 -0.62 -1.61 0.00 0.00 179.24 177.01 1ixr n GLU 13 N -2.66 3.73 -3.51 0.28 1.02 -1.26 -4.89 120.64 113.35 1ixr n GLU 13 Ca 0.04 -2.89 -0.42 0.00 -0.02 0.00 0.00 57.16 53.87 1ixr n GLU 13 Cb 0.42 -1.94 -0.09 0.00 -0.02 0.00 0.00 31.44 29.81 1ixr n GLU 13 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1ixr s TYR 14 N -2.45 3.31 -0.13 -0.32 5.04 -1.07 -4.90 117.35 116.83 1ixr s TYR 14 Ca 0.46 -1.37 -0.29 0.00 -2.44 0.00 0.00 57.07 53.43 1ixr s TYR 14 Cb 0.34 -3.14 -0.04 0.00 0.35 0.00 0.00 41.96 39.47 1ixr s TYR 14 CO 0.15 -0.86 1.68 0.42 -1.34 0.00 0.00 175.55 175.59 1ixr s ILE 15 N 1.49 3.59 0.00 3.14 1.09 -1.26 -4.89 121.20 124.36 1ixr s ILE 15 Ca 0.04 0.69 0.00 0.00 -1.10 0.00 0.00 60.65 60.27 1ixr s ILE 15 Cb -0.24 -3.53 0.00 0.00 -1.06 0.00 0.00 42.46 37.63 1ixr s ILE 15 CO 0.03 -0.16 0.00 0.61 -0.10 0.00 0.00 174.94 175.32 1ixr n GLY 16 N 4.47 2.36 2.17 6.18 0.00 -1.26 -5.06 105.19 114.04 1ixr n GLY 16 Ca 0.19 -1.21 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 1ixr n GLY 16 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1ixr n GLN 17 N -1.20 0.00 -0.29 1.61 7.27 -1.26 -4.96 117.38 118.55 1ixr n GLN 17 Ca 0.00 0.00 0.07 0.00 0.07 0.00 0.00 57.00 57.14 1ixr n GLN 17 Cb 0.00 -0.72 0.12 0.00 2.41 0.00 0.00 30.24 32.06 1ixr n GLN 17 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1ixr n GLU 18 N 1.73 1.05 -0.07 3.69 -0.58 -1.26 -4.79 120.64 120.41 1ixr n GLU 18 Ca -0.01 -2.40 -0.06 0.00 -0.42 0.00 0.00 57.16 54.27 1ixr n GLU 18 Cb 0.40 -1.28 -0.02 0.00 -0.57 0.00 0.00 31.44 29.96 1ixr n GLU 18 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 1ixr n ARG 19 N -1.05 0.44 -0.30 3.49 0.63 -1.26 -3.32 116.66 115.29 1ixr n ARG 19 Ca 0.13 0.37 0.25 0.00 -0.92 0.00 0.00 57.85 57.68 1ixr n ARG 19 Cb 0.68 -1.50 0.57 0.00 0.45 0.00 0.00 32.46 32.66 1ixr n ARG 19 CO 0.00 0.00 0.00 1.37 -2.51 0.00 0.00 177.63 176.49 1ixr h LEU 20 N -0.91 0.33 -0.21 6.15 8.10 -1.88 0.33 115.31 127.21 1ixr h LEU 20 Ca 0.00 0.06 -0.01 0.00 0.11 0.00 0.00 57.88 58.03 1ixr h LEU 20 Cb 0.66 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.87 1ixr h LEU 20 CO 0.00 0.08 0.09 0.11 -4.11 0.00 0.00 178.44 174.61 1ixr h LYS 21 N 0.30 0.31 0.00 0.17 1.57 -1.87 0.69 116.57 117.75 1ixr h LYS 21 Ca 0.55 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1ixr h LYS 21 Cb 1.59 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.85 1ixr h LYS 21 CO -0.21 0.37 0.30 0.37 -0.57 0.00 0.00 179.45 179.71 1ixr h GLN 22 N 0.19 0.00 0.00 3.15 4.15 -0.34 2.08 115.11 124.35 1ixr h GLN 22 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1ixr h GLN 22 Cb 0.17 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1ixr h GLN 22 CO -0.01 0.00 -0.04 0.36 -1.93 0.00 0.00 178.83 177.22 1ixr n LYS 23 N -2.50 1.78 0.00 1.69 2.85 -0.70 -4.62 118.16 116.65 1ixr n LYS 23 Ca -0.01 -1.38 0.00 0.00 -1.05 0.00 0.00 58.31 55.86 1ixr n LYS 23 Cb 0.33 -0.92 0.00 0.00 -0.65 0.00 0.00 35.03 33.79 1ixr n LYS 23 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1ixr n LEU 24 N -0.49 1.08 0.06 -5.58 7.94 0.23 -4.54 117.00 115.70 1ixr n LEU 24 Ca 0.02 0.00 0.08 0.00 -1.11 0.00 0.00 56.01 55.01 1ixr n LEU 24 Cb 0.40 0.00 0.52 0.00 0.53 0.00 0.00 43.42 44.88 1ixr n LEU 24 CO 0.00 0.16 1.14 0.08 -1.11 0.00 0.00 177.39 177.67 1ixr h ARG 25 N 0.00 0.31 -0.32 1.96 0.11 0.29 0.74 114.38 117.47 1ixr h ARG 25 Ca 0.00 -0.02 -0.05 0.00 0.10 0.00 0.00 59.98 60.01 1ixr h ARG 25 Cb 0.39 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.39 1ixr h ARG 25 CO 0.00 0.21 0.00 0.28 0.10 0.00 0.00 179.97 180.56 1ixr h VAL 26 N 0.32 1.26 0.00 0.08 2.07 -1.81 -1.68 116.25 116.49 1ixr h VAL 26 Ca 0.14 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1ixr h VAL 26 Cb 0.18 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1ixr h VAL 26 CO -0.03 0.31 0.00 1.88 0.02 0.00 0.00 177.57 179.75 1ixr h TYR 27 N 0.36 0.00 0.00 1.57 -1.99 -1.43 -1.70 116.97 113.78 1ixr h TYR 27 Ca 0.09 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.82 1ixr h TYR 27 Cb 0.44 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.17 1ixr h TYR 27 CO 0.04 0.00 0.00 1.28 -0.00 0.00 0.00 178.16 179.48 1ixr n LEU 28 N -2.52 0.53 0.00 3.88 4.77 0.25 -2.02 117.00 121.89 1ixr n LEU 28 Ca 0.04 0.56 0.11 0.00 -0.03 0.00 0.00 56.01 56.69 1ixr n LEU 28 Cb 0.42 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 1ixr n LEU 28 CO 0.30 -0.16 -0.10 -0.62 -1.33 0.00 0.00 177.39 175.47 1ixr n GLU 29 N -2.01 0.18 0.09 3.23 1.02 -0.67 -4.08 120.64 118.40 1ixr n GLU 29 Ca 0.06 -0.03 -0.04 0.00 -0.02 0.00 0.00 57.16 57.13 1ixr n GLU 29 Cb 0.38 -1.53 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 1ixr n GLU 29 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ixr h ALA 30 N 2.73 0.48 0.00 0.62 0.00 -1.04 -3.02 119.26 119.03 1ixr h ALA 30 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.17 1ixr h ALA 30 Cb 0.64 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ixr h ALA 30 CO 0.00 1.02 0.00 0.00 0.00 0.00 0.00 179.25 180.27 1ixr n ALA 31 N -2.31 1.88 -1.32 0.00 0.00 -1.19 0.03 120.51 117.60 1ixr n ALA 31 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1ixr n ALA 31 Cb 0.86 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.31 1ixr n ALA 31 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ixr n LYS 32 N -0.30 0.00 0.00 0.00 4.76 -1.15 -4.45 118.16 117.02 1ixr n LYS 32 Ca 0.00 -0.39 0.00 0.00 -2.87 0.00 0.00 58.31 55.05 1ixr n LYS 32 Cb 0.03 -0.37 0.00 0.00 -1.84 0.00 0.00 35.03 32.85 1ixr n LYS 32 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ixr n ALA 33 N 0.00 1.80 -0.20 7.82 0.00 0.10 -4.96 120.51 125.08 1ixr n ALA 33 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1ixr n ALA 33 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1ixr n ALA 33 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ixr n ARG 34 N -0.69 0.00 0.00 0.00 1.85 -0.04 -5.04 116.66 112.74 1ixr n ARG 34 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1ixr n ARG 34 Cb 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.42 1ixr n ARG 34 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1ixr n LYS 35 N -2.20 0.00 -0.01 2.89 5.02 -1.24 -5.05 118.16 117.56 1ixr n LYS 35 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 1ixr n LYS 35 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 34.88 1ixr n LYS 35 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ixr n GLU 36 N 0.00 0.65 -2.43 1.97 4.71 -1.26 -3.76 120.64 120.52 1ixr n GLU 36 Ca 0.00 -0.03 -0.40 0.00 -0.01 0.00 0.00 57.16 56.72 1ixr n GLU 36 Cb 0.00 -1.61 -0.03 0.00 -1.01 0.00 0.00 31.44 28.79 1ixr n GLU 36 CO 0.00 0.00 0.00 -2.14 0.09 0.00 0.00 177.13 175.08 1ixr s PRO 37 N -3.11 3.09 -0.43 3.49 0.02 -1.26 -4.82 135.00 131.97 1ixr s PRO 37 Ca -0.07 -0.14 -0.19 0.00 0.02 0.00 0.00 61.00 60.62 1ixr s PRO 37 Cb 0.10 -4.35 0.02 0.00 0.02 0.00 0.00 34.50 30.30 1ixr s PRO 37 CO 0.86 -2.31 0.56 -0.48 -0.33 0.00 0.00 177.00 175.30 1ixr s LEU 38 N 6.48 4.65 0.00 -5.54 2.34 -1.26 -4.96 118.68 120.39 1ixr s LEU 38 Ca 0.44 -0.48 0.00 0.00 0.06 0.00 0.00 54.13 54.15 1ixr s LEU 38 Cb -0.08 -2.59 0.00 0.00 -0.56 0.00 0.00 46.19 42.96 1ixr s LEU 38 CO 0.14 -0.70 0.00 -0.62 -1.06 0.00 0.00 176.35 174.10 1ixr n GLU 39 N 6.00 0.00 -1.68 1.48 1.02 -1.26 -4.61 120.64 121.59 1ixr n GLU 39 Ca -0.04 0.00 -0.57 0.00 -0.02 0.00 0.00 57.16 56.53 1ixr n GLU 39 Cb 0.48 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.82 1ixr n GLU 39 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1ixr n HIS 40 N 0.00 2.03 -3.60 -0.32 8.25 -1.26 -4.57 115.22 115.74 1ixr n HIS 40 Ca 0.00 0.49 -0.40 0.00 -0.26 0.00 0.00 57.72 57.55 1ixr n HIS 40 Cb 0.00 -2.47 -0.11 0.00 1.12 0.00 0.00 29.99 28.53 1ixr n HIS 40 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1ixr s LEU 41 N 3.93 4.85 0.39 2.41 2.96 0.15 0.63 118.68 134.00 1ixr s LEU 41 Ca 1.00 -1.16 -0.04 0.00 -0.22 0.00 0.00 54.13 53.70 1ixr s LEU 41 Cb -1.05 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 43.59 1ixr s LEU 41 CO 0.64 -0.44 0.66 -0.22 -1.32 0.00 0.00 176.35 175.68 1ixr s LEU 42 N 1.51 3.85 -0.01 -0.68 2.96 -1.16 -2.00 118.68 123.15 1ixr s LEU 42 Ca 0.02 0.75 0.02 0.00 -0.22 0.00 0.00 54.13 54.70 1ixr s LEU 42 Cb -0.20 -3.64 0.00 0.00 0.50 0.00 0.00 46.19 42.84 1ixr s LEU 42 CO 0.05 -0.40 -0.05 -0.76 -1.32 0.00 0.00 176.35 173.87 1ixr s LEU 43 N -4.29 1.88 0.00 -0.68 1.43 -1.14 -4.10 118.68 111.77 1ixr s LEU 43 Ca 0.45 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.45 1ixr s LEU 43 Cb -0.10 -0.30 0.00 0.00 0.03 0.00 0.00 46.19 45.82 1ixr s LEU 43 CO 0.38 0.04 0.00 0.49 0.23 0.00 0.00 176.35 177.49 1ixr n PHE 44 N 3.15 -0.39 0.00 0.29 3.01 -1.23 -0.76 117.46 121.53 1ixr n PHE 44 Ca -0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.31 1ixr n PHE 44 Cb 0.57 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.04 1ixr n PHE 44 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ixr n GLY 45 N 5.00 -2.01 3.75 1.37 0.00 -1.21 -3.68 105.19 108.41 1ixr n GLY 45 Ca 0.00 -1.50 -0.34 0.00 0.00 0.00 0.00 46.02 44.19 1ixr n GLY 45 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ixr s PRO 46 N -2.15 2.53 0.60 1.61 0.04 -1.26 -4.66 135.00 131.71 1ixr s PRO 46 Ca 0.00 1.56 -0.08 0.00 0.04 0.00 0.00 61.00 62.52 1ixr s PRO 46 Cb 0.00 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.76 1ixr s PRO 46 CO 0.00 -1.49 0.27 -2.30 0.04 0.00 0.00 177.00 173.52 1ixr n PRO 47 N -2.51 -1.11 0.00 0.56 -0.02 -1.26 -3.63 135.00 127.03 1ixr n PRO 47 Ca 0.12 -0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.14 1ixr n PRO 47 Cb 0.51 -0.86 0.00 0.00 -0.02 0.00 0.00 33.50 33.13 1ixr n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ixr n GLY 48 N -1.06 0.07 0.00 -1.23 0.00 -1.26 -4.62 105.19 97.09 1ixr n GLY 48 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1ixr n GLY 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ixr n LEU 49 N 0.00 0.00 0.00 0.99 4.32 -1.24 -4.27 117.00 116.80 1ixr n LEU 49 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1ixr n LEU 49 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1ixr n LEU 49 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1ixr n GLY 50 N -0.86 0.79 1.05 -0.72 0.00 -1.26 -4.82 105.19 99.37 1ixr n GLY 50 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1ixr n GLY 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ixr n LYS 51 N 0.35 0.00 0.00 1.61 4.76 -1.26 -4.71 118.16 118.91 1ixr n LYS 51 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1ixr n LYS 51 Cb 0.00 -0.09 0.00 0.00 -1.84 0.00 0.00 35.03 33.10 1ixr n LYS 51 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1ixr n THR 52 N -2.69 0.00 0.33 -0.18 -1.04 -1.26 -1.80 114.28 107.63 1ixr n THR 52 Ca 0.00 1.45 0.04 0.00 -2.04 0.00 0.00 64.05 63.50 1ixr n THR 52 Cb 0.00 -2.22 0.23 0.00 -1.82 0.00 0.00 70.33 66.52 1ixr n THR 52 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1ixr h THR 53 N 0.00 0.00 0.19 12.58 2.02 -1.95 0.30 112.91 126.05 1ixr h THR 53 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1ixr h THR 53 Cb 0.00 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.60 1ixr h THR 53 CO 0.00 0.00 -0.09 0.25 0.37 0.00 0.00 175.52 176.05 1ixr h LEU 54 N 0.00 -0.22 -0.39 2.58 5.85 -1.64 -2.99 115.31 118.50 1ixr h LEU 54 Ca 0.00 0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.58 1ixr h LEU 54 Cb 1.62 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.68 1ixr h LEU 54 CO 0.00 -0.12 -0.72 0.00 -0.34 0.00 0.00 178.44 177.26 1ixr h ALA 55 N -1.80 0.69 -0.79 1.25 0.00 -1.34 0.24 119.26 117.52 1ixr h ALA 55 Ca -0.03 -0.66 0.23 0.00 0.00 0.00 0.00 54.91 54.45 1ixr h ALA 55 Cb 0.20 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1ixr h ALA 55 CO 0.04 0.90 0.67 1.25 0.00 0.00 0.00 179.25 182.12 1ixr h HIS 56 N 0.00 0.00 0.01 0.00 6.17 -0.57 0.43 115.15 121.19 1ixr h HIS 56 Ca -0.01 0.00 -0.39 0.00 0.71 0.00 0.00 60.37 60.68 1ixr h HIS 56 Cb 1.37 0.00 -0.07 0.00 2.52 0.00 0.00 27.41 31.23 1ixr h HIS 56 CO 0.00 0.00 -2.45 0.28 0.71 0.00 0.00 177.93 176.47 1ixr n VAL 57 N -3.94 1.50 -0.29 5.26 0.31 -0.94 -4.39 118.33 115.84 1ixr n VAL 57 Ca 0.16 -0.58 0.10 0.00 -0.01 0.00 0.00 64.34 64.01 1ixr n VAL 57 Cb 0.95 -1.41 0.24 0.00 -0.91 0.00 0.00 33.84 32.71 1ixr n VAL 57 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1ixr h ILE 58 N 0.00 0.28 -0.36 2.52 2.04 0.32 -2.30 117.51 120.02 1ixr h ILE 58 Ca -0.57 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.27 1ixr h ILE 58 Cb 1.92 0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 38.08 1ixr h ILE 58 CO -0.08 0.03 -0.23 0.00 0.00 0.00 0.00 178.15 177.87 1ixr h ALA 59 N 1.78 -0.26 -1.01 1.87 0.00 -0.88 -1.17 119.26 119.59 1ixr h ALA 59 Ca 0.51 0.04 0.25 0.00 0.00 0.00 0.00 54.91 55.71 1ixr h ALA 59 Cb 0.99 1.11 -0.09 0.00 0.00 0.00 0.00 17.79 19.80 1ixr h ALA 59 CO -0.70 -0.41 0.65 1.25 0.00 0.00 0.00 179.25 180.05 1ixr h HIS 60 N -0.02 0.65 -0.47 0.00 -0.00 -1.58 0.58 115.15 114.31 1ixr h HIS 60 Ca 0.06 0.02 -0.31 0.00 -0.00 0.00 0.00 60.37 60.14 1ixr h HIS 60 Cb 0.17 -0.19 -0.14 0.00 -0.00 0.00 0.00 27.41 27.25 1ixr h HIS 60 CO -0.93 0.09 0.40 0.39 -0.00 0.00 0.00 177.93 177.88 1ixr n GLU 61 N -4.61 1.77 0.00 5.26 -0.58 -0.45 -3.33 120.64 118.70 1ixr n GLU 61 Ca 0.24 -1.52 0.00 0.00 -0.42 0.00 0.00 57.16 55.46 1ixr n GLU 61 Cb 0.82 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 30.10 1ixr n GLU 61 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1ixr n LEU 62 N 0.31 0.00 0.00 -4.62 4.77 0.18 -5.02 117.00 112.62 1ixr n LEU 62 Ca 0.29 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1ixr n LEU 62 Cb 0.62 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 1ixr n LEU 62 CO 0.36 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1ixr n GLY 63 N 0.17 1.40 3.10 -0.72 0.00 0.03 -5.10 105.19 104.08 1ixr n GLY 63 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1ixr n GLY 63 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ixr s VAL 64 N -2.00 0.05 0.82 1.61 -7.23 -1.22 -4.92 120.40 107.51 1ixr s VAL 64 Ca 0.00 -0.45 -0.14 0.00 -1.81 0.00 0.00 61.98 59.58 1ixr s VAL 64 Cb 0.00 -0.39 0.21 0.00 0.56 0.00 0.00 36.38 36.76 1ixr s VAL 64 CO 0.00 -0.25 0.52 0.59 -0.31 0.00 0.00 175.10 175.65 1ixr n ASN 65 N 1.92 -2.98 -3.79 4.85 3.02 -1.26 -4.20 115.26 112.83 1ixr n ASN 65 Ca -0.19 -0.57 -0.14 0.00 -0.03 0.00 0.00 54.58 53.65 1ixr n ASN 65 Cb 0.57 -0.57 -0.15 0.00 -0.61 0.00 0.00 39.78 39.01 1ixr n ASN 65 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1ixr s LEU 66 N 0.00 1.21 -0.15 3.41 2.96 -1.26 -1.53 118.68 123.32 1ixr s LEU 66 Ca 0.39 0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.44 1ixr s LEU 66 Cb -0.06 0.13 -0.01 0.00 0.50 0.00 0.00 46.19 46.76 1ixr s LEU 66 CO 0.32 -0.10 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.51 1ixr s ARG 67 N 0.76 3.27 -0.05 1.98 6.06 0.27 -4.92 118.95 126.33 1ixr s ARG 67 Ca -0.06 -0.73 0.03 0.00 -2.50 0.00 0.00 55.73 52.47 1ixr s ARG 67 Cb -0.08 -2.63 0.00 0.00 0.06 0.00 0.00 34.95 32.30 1ixr s ARG 67 CO -0.03 0.09 -0.14 0.14 -2.50 0.00 0.00 175.30 172.85 1ixr s VAL 68 N 0.65 1.23 -0.06 7.11 -7.23 -1.26 0.67 120.40 121.51 1ixr s VAL 68 Ca -0.08 -0.58 -0.05 0.00 -1.81 0.00 0.00 61.98 59.46 1ixr s VAL 68 Cb -0.16 -1.08 0.02 0.00 0.56 0.00 0.00 36.38 35.73 1ixr s VAL 68 CO 0.02 0.36 0.16 -0.89 -0.31 0.00 0.00 175.10 174.45 1ixr s THR 69 N 0.24 -0.01 0.62 5.32 2.01 0.41 -4.90 115.64 119.32 1ixr s THR 69 Ca -0.07 0.04 -0.17 0.00 0.31 0.00 0.00 61.69 61.80 1ixr s THR 69 Cb -0.12 -0.23 -0.02 0.00 0.01 0.00 0.00 72.50 72.14 1ixr s THR 69 CO 0.02 0.01 1.15 -0.44 -0.69 0.00 0.00 174.62 174.68 1ixr s SER 70 N 0.31 5.15 0.00 3.53 0.01 -1.26 -1.97 113.70 119.48 1ixr s SER 70 Ca -0.02 2.20 0.00 0.00 1.31 0.00 0.00 55.95 59.44 1ixr s SER 70 Cb -0.03 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1ixr s SER 70 CO -0.01 -1.61 0.24 0.61 0.41 0.00 0.00 173.24 172.88 1ixr n GLY 71 N 0.07 -2.43 0.23 3.44 0.00 0.73 -3.27 105.19 103.96 1ixr n GLY 71 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1ixr n GLY 71 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ixr n PRO 72 N -0.26 0.02 -0.19 1.61 -0.02 -0.81 -1.85 135.00 133.50 1ixr n PRO 72 Ca 0.00 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1ixr n PRO 72 Cb 0.00 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1ixr n PRO 72 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ixr n ALA 73 N -1.24 2.87 -3.71 3.55 0.00 -1.20 -4.58 120.51 116.20 1ixr n ALA 73 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 1ixr n ALA 73 Cb 0.75 -1.09 -0.15 0.00 0.00 0.00 0.00 19.45 18.97 1ixr n ALA 73 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ixr s ILE 74 N 0.28 0.86 0.00 0.00 1.01 -0.77 -4.92 121.20 117.66 1ixr s ILE 74 Ca 0.00 -1.49 0.00 0.00 0.00 0.00 0.00 60.65 59.16 1ixr s ILE 74 Cb 0.00 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.82 1ixr s ILE 74 CO 0.00 -0.71 0.00 1.21 0.00 0.00 0.00 174.94 175.44 1ixr n GLU 75 N 4.72 0.00 -1.55 2.79 2.13 -1.26 -4.74 120.64 122.72 1ixr n GLU 75 Ca -0.01 0.06 -0.50 0.00 0.66 0.00 0.00 57.16 57.38 1ixr n GLU 75 Cb 0.41 -0.37 -0.06 0.00 0.27 0.00 0.00 31.44 31.69 1ixr n GLU 75 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1ixr n LYS 76 N -1.38 1.49 0.00 5.31 5.02 -1.26 -4.73 118.16 122.61 1ixr n LYS 76 Ca 0.00 0.47 0.00 0.00 -2.02 0.00 0.00 58.31 56.76 1ixr n LYS 76 Cb 0.00 -2.58 0.00 0.00 -0.02 0.00 0.00 35.03 32.43 1ixr n LYS 76 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1ixr n PRO 77 N 7.60 0.00 -0.22 1.97 -0.02 -1.26 0.12 135.00 143.19 1ixr n PRO 77 Ca 0.33 0.19 0.09 0.00 -2.02 0.00 0.00 63.50 62.09 1ixr n PRO 77 Cb 0.27 -1.64 0.18 0.00 -0.02 0.00 0.00 33.50 32.28 1ixr n PRO 77 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ixr n GLY 78 N -1.11 4.31 0.16 -1.23 0.00 -1.26 -4.58 105.19 101.48 1ixr n GLY 78 Ca 0.00 -0.99 -0.08 0.00 0.00 0.00 0.00 46.02 44.96 1ixr n GLY 78 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ixr h ASP 79 N 0.84 0.33 0.06 1.61 3.45 0.53 -2.11 116.42 121.14 1ixr h ASP 79 Ca 0.00 -0.22 -0.28 0.00 0.43 0.00 0.00 57.03 56.95 1ixr h ASP 79 Cb 1.14 -0.10 0.03 0.00 -0.56 0.00 0.00 39.33 39.83 1ixr h ASP 79 CO 0.09 0.95 -1.14 0.17 -1.57 0.00 0.00 179.24 177.74 1ixr h LEU 80 N 0.18 0.90 -0.55 1.55 -0.00 -1.81 -1.48 115.31 114.11 1ixr h LEU 80 Ca -0.03 -0.77 0.11 0.00 -0.00 0.00 0.00 57.88 57.19 1ixr h LEU 80 Cb 1.30 -0.28 -0.10 0.00 -0.00 0.00 0.00 40.66 41.58 1ixr h LEU 80 CO 0.12 1.57 -0.08 0.00 -0.00 0.00 0.00 178.44 180.05 1ixr h ALA 81 N 0.35 0.44 -0.25 0.17 0.00 -1.81 1.43 119.26 119.60 1ixr h ALA 81 Ca -0.16 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1ixr h ALA 81 Cb 1.80 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.94 1ixr h ALA 81 CO 0.22 -0.42 0.02 0.00 0.00 0.00 0.00 179.25 179.07 1ixr h ALA 82 N 1.53 1.57 0.00 0.00 0.00 -1.27 2.75 119.26 123.83 1ixr h ALA 82 Ca 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ixr h ALA 82 Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1ixr h ALA 82 CO -0.52 0.32 0.00 -0.89 0.00 0.00 0.00 179.25 178.15 1ixr n ILE 83 N -4.35 0.37 -0.05 0.00 5.41 0.42 -3.45 119.36 117.70 1ixr n ILE 83 Ca 0.01 0.09 -0.07 0.00 1.00 0.00 0.00 62.75 63.78 1ixr n ILE 83 Cb 0.19 -0.70 -0.04 0.00 -0.71 0.00 0.00 39.64 38.38 1ixr n ILE 83 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 1ixr n LEU 84 N -1.42 2.89 -4.56 1.39 4.77 0.27 -4.90 117.00 115.45 1ixr n LEU 84 Ca 0.08 -0.04 -0.36 0.00 -0.03 0.00 0.00 56.01 55.65 1ixr n LEU 84 Cb 0.24 -0.33 -0.04 0.00 -2.33 0.00 0.00 43.42 40.96 1ixr n LEU 84 CO 0.20 0.64 1.41 0.00 -1.33 0.00 0.00 177.39 178.31 1ixr s ALA 85 N -2.19 2.27 -0.16 -1.18 0.00 0.89 -4.43 121.76 116.95 1ixr s ALA 85 Ca -0.13 -1.45 -0.11 0.00 0.00 0.00 0.00 51.96 50.27 1ixr s ALA 85 Cb 0.03 -4.43 0.04 0.00 0.00 0.00 0.00 23.12 18.77 1ixr s ALA 85 CO 0.22 -3.98 0.22 -1.71 0.00 0.00 0.00 175.76 170.51 1ixr n ASN 86 N 11.48 -1.38 0.00 0.00 4.05 -1.26 -4.82 115.26 123.33 1ixr n ASN 86 Ca 0.26 1.40 0.00 0.00 0.45 0.00 0.00 54.58 56.68 1ixr n ASN 86 Cb 0.50 -5.16 0.00 0.00 1.23 0.00 0.00 39.78 36.35 1ixr n ASN 86 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1ixr n SER 87 N 1.77 0.00 -1.36 1.20 3.41 -1.26 -4.99 113.62 112.40 1ixr n SER 87 Ca -0.38 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.23 1ixr n SER 87 Cb 0.59 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1ixr n SER 87 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ixr n LEU 88 N 0.00 0.00 -2.71 1.04 4.77 -1.26 -5.06 117.00 113.78 1ixr n LEU 88 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 1ixr n LEU 88 Cb 0.00 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.19 1ixr n LEU 88 CO 0.00 -0.24 0.37 -0.62 -1.33 0.00 0.00 177.39 175.57 1ixr n GLU 89 N -0.48 1.37 -3.38 3.23 -0.58 -1.26 -5.00 120.64 114.53 1ixr n GLU 89 Ca 0.00 -2.13 -0.18 0.00 -0.42 0.00 0.00 57.16 54.43 1ixr n GLU 89 Cb 0.00 -0.35 0.08 0.00 -0.57 0.00 0.00 31.44 30.60 1ixr n GLU 89 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1ixr n GLU 90 N -0.90 -6.55 0.00 3.49 -0.58 -1.26 -4.61 120.64 110.23 1ixr n GLU 90 Ca -0.05 0.74 0.00 0.00 -0.42 0.00 0.00 57.16 57.43 1ixr n GLU 90 Cb 0.85 -5.50 0.00 0.00 -0.57 0.00 0.00 31.44 26.22 1ixr n GLU 90 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ixr n GLY 91 N -1.51 0.64 2.65 0.62 0.00 -0.76 -4.86 105.19 101.97 1ixr n GLY 91 Ca -0.11 -0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 1ixr n GLY 91 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ixr n ASP 92 N 0.00 -3.61 -4.76 1.61 9.92 -1.26 -4.12 116.55 114.32 1ixr n ASP 92 Ca 0.00 0.44 -0.33 0.00 -0.53 0.00 0.00 54.79 54.37 1ixr n ASP 92 Cb 0.00 -0.69 -0.07 0.00 -0.64 0.00 0.00 41.12 39.72 1ixr n ASP 92 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1ixr s ILE 93 N -1.67 4.61 -0.26 0.53 1.09 -0.58 -3.33 121.20 121.58 1ixr s ILE 93 Ca 0.44 -0.47 0.01 0.00 -1.10 0.00 0.00 60.65 59.53 1ixr s ILE 93 Cb -0.34 -3.10 0.05 0.00 -1.06 0.00 0.00 42.46 38.01 1ixr s ILE 93 CO 0.59 0.34 -0.08 -0.22 -0.10 0.00 0.00 174.94 175.47 1ixr s LEU 94 N -1.74 3.42 -0.15 2.97 1.98 -0.27 0.98 118.68 125.88 1ixr s LEU 94 Ca 0.23 -1.24 -0.10 0.00 -2.89 0.00 0.00 54.13 50.12 1ixr s LEU 94 Cb -0.12 -1.60 -0.05 0.00 0.66 0.00 0.00 46.19 45.09 1ixr s LEU 94 CO 0.14 -0.18 0.19 0.12 -1.89 0.00 0.00 176.35 174.72 1ixr s PHE 95 N 1.18 3.51 -0.36 5.38 2.19 0.21 -0.81 117.98 129.29 1ixr s PHE 95 Ca -0.06 0.51 0.03 0.00 0.33 0.00 0.00 56.93 57.74 1ixr s PHE 95 Cb -0.19 -2.13 0.11 0.00 -1.31 0.00 0.00 43.02 39.50 1ixr s PHE 95 CO -0.05 0.47 0.09 0.42 1.83 0.00 0.00 175.22 177.99 1ixr s ILE 96 N -0.22 1.92 0.52 3.12 1.01 0.54 0.15 121.20 128.24 1ixr s ILE 96 Ca 0.13 -2.24 -0.17 0.00 0.00 0.00 0.00 60.65 58.38 1ixr s ILE 96 Cb -0.12 -2.41 -0.07 0.00 0.01 0.00 0.00 42.46 39.86 1ixr s ILE 96 CO 0.03 -0.66 1.00 -0.62 0.00 0.00 0.00 174.94 174.69 1ixr s ASP 97 N 0.91 6.49 -1.09 3.58 3.68 -0.83 -2.15 116.67 127.26 1ixr s ASP 97 Ca 0.12 1.65 0.00 0.00 2.13 0.00 0.00 52.55 56.45 1ixr s ASP 97 Cb -0.20 -2.52 0.00 0.00 -1.45 0.00 0.00 42.92 38.75 1ixr s ASP 97 CO -0.11 -0.68 0.00 -0.62 0.13 0.00 0.00 175.17 173.89 1ixr n GLU 98 N -1.52 -2.12 -0.16 4.34 1.02 -1.06 0.26 120.64 121.40 1ixr n GLU 98 Ca 0.07 0.62 0.16 0.00 -0.02 0.00 0.00 57.16 57.99 1ixr n GLU 98 Cb 0.54 -5.18 0.52 0.00 -0.02 0.00 0.00 31.44 27.29 1ixr n GLU 98 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1ixr h ILE 99 N 0.00 0.79 0.00 -3.67 2.10 -1.50 -0.81 117.51 114.41 1ixr h ILE 99 Ca -0.29 -0.13 0.00 0.00 1.08 0.00 0.00 64.86 65.52 1ixr h ILE 99 Cb 1.18 0.37 0.00 0.00 -1.09 0.00 0.00 36.82 37.28 1ixr h ILE 99 CO 0.35 0.07 0.10 1.12 -1.08 0.00 0.00 178.15 178.71 1ixr h HIS 100 N 0.38 0.00 -3.20 2.19 2.07 -1.86 -3.25 115.15 111.48 1ixr h HIS 100 Ca 0.36 0.00 -0.72 0.00 -2.85 0.00 0.00 60.37 57.16 1ixr h HIS 100 Cb 0.87 0.00 -0.34 0.00 2.57 0.00 0.00 27.41 30.51 1ixr h HIS 100 CO -0.00 0.00 0.06 0.54 -3.07 0.00 0.00 177.93 175.45 1ixr n ARG 101 N -2.41 2.99 -4.39 5.12 1.74 -0.31 -4.73 116.66 114.67 1ixr n ARG 101 Ca -0.02 -4.50 -0.21 0.00 -0.77 0.00 0.00 57.85 52.35 1ixr n ARG 101 Cb 0.14 -2.43 -0.10 0.00 -1.02 0.00 0.00 32.46 29.04 1ixr n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ixr s LEU 102 N -1.64 2.56 0.37 0.55 1.43 -1.23 -1.92 118.68 118.79 1ixr s LEU 102 Ca 0.30 -1.01 -0.25 0.00 -1.03 0.00 0.00 54.13 52.14 1ixr s LEU 102 Cb -0.04 -0.85 -0.12 0.00 0.03 0.00 0.00 46.19 45.21 1ixr s LEU 102 CO -0.08 -0.08 0.90 -1.20 0.23 0.00 0.00 176.35 176.12 1ixr n SER 103 N -0.40 0.74 -0.40 2.29 7.64 -1.26 -4.78 113.62 117.44 1ixr n SER 103 Ca -0.07 1.06 0.36 0.00 1.01 0.00 0.00 58.87 61.23 1ixr n SER 103 Cb 0.60 -1.27 0.63 0.00 -1.01 0.00 0.00 64.21 63.17 1ixr n SER 103 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ixr n ARG 104 N 0.47 -0.05 -0.07 1.43 1.74 -1.26 -1.87 116.66 117.05 1ixr n ARG 104 Ca 0.10 1.30 -0.09 0.00 -0.77 0.00 0.00 57.85 58.39 1ixr n ARG 104 Cb 0.36 -2.45 -0.08 0.00 -1.02 0.00 0.00 32.46 29.27 1ixr n ARG 104 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ixr n GLN 105 N -4.93 1.13 -0.44 5.56 0.00 -1.26 -4.55 117.38 112.89 1ixr n GLN 105 Ca 0.39 0.05 0.36 0.00 0.00 0.00 0.00 57.00 57.80 1ixr n GLN 105 Cb 1.43 -1.31 0.64 0.00 0.00 0.00 0.00 30.24 31.01 1ixr n GLN 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ixr h ALA 106 N 0.27 2.69 0.00 2.61 0.00 -1.71 3.91 119.26 127.04 1ixr h ALA 106 Ca -0.34 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1ixr h ALA 106 Cb 1.63 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1ixr h ALA 106 CO -0.02 -1.33 0.00 -0.85 0.00 0.00 0.00 179.25 177.05 1ixr n GLU 107 N -4.73 0.09 0.00 0.00 0.28 -1.09 -3.39 120.64 111.80 1ixr n GLU 107 Ca 0.37 0.01 -0.22 0.00 -0.16 0.00 0.00 57.16 57.17 1ixr n GLU 107 Cb 1.42 -1.50 -0.14 0.00 1.43 0.00 0.00 31.44 32.65 1ixr n GLU 107 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1ixr h GLU 108 N 0.00 0.24 -2.00 3.44 5.08 0.72 -3.32 114.58 118.74 1ixr h GLU 108 Ca 0.00 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 57.91 1ixr h GLU 108 Cb 0.44 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 1ixr h GLU 108 CO 0.00 1.20 -0.08 0.72 -1.00 0.00 0.00 179.01 179.85 1ixr n HIS 109 N -3.78 0.00 0.00 4.33 8.25 -0.82 -2.57 115.22 120.63 1ixr n HIS 109 Ca -0.28 -1.08 0.00 0.00 -0.26 0.00 0.00 57.72 56.09 1ixr n HIS 109 Cb 0.95 -0.72 0.00 0.00 1.12 0.00 0.00 29.99 31.35 1ixr n HIS 109 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1ixr n LEU 110 N 1.71 0.00 0.01 2.41 0.00 -1.25 -4.75 117.00 115.13 1ixr n LEU 110 Ca 0.09 -0.09 -0.08 0.00 0.00 0.00 0.00 56.01 55.92 1ixr n LEU 110 Cb 0.58 0.00 0.08 0.00 0.00 0.00 0.00 43.42 44.07 1ixr n LEU 110 CO 0.02 0.00 0.51 1.88 0.00 0.00 0.00 177.39 179.81 1ixr h TYR 111 N 0.00 0.65 -0.59 1.96 0.05 -1.70 -3.21 116.97 114.13 1ixr h TYR 111 Ca 0.00 -0.22 0.10 0.00 0.05 0.00 0.00 58.73 58.67 1ixr h TYR 111 Cb 0.00 -0.13 -0.08 0.00 1.01 0.00 0.00 36.73 37.53 1ixr h TYR 111 CO 0.00 0.93 0.14 -1.35 -1.05 0.00 0.00 178.16 176.83 1ixr h PRO 112 N 0.41 0.28 0.00 4.88 0.11 -1.80 0.47 132.00 136.35 1ixr h PRO 112 Ca 0.02 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1ixr h PRO 112 Cb 1.04 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1ixr h PRO 112 CO 0.10 0.18 0.00 0.00 -0.21 0.00 0.00 178.00 178.07 1ixr n ALA 113 N -2.56 1.97 -0.00 -0.75 0.00 -0.74 -3.00 120.51 115.43 1ixr n ALA 113 Ca 0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.52 1ixr n ALA 113 Cb 0.30 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 18.75 1ixr n ALA 113 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1ixr n MET 114 N -0.51 0.02 -0.35 0.00 0.00 0.17 -4.53 117.12 111.92 1ixr n MET 114 Ca 0.00 0.16 0.23 0.00 0.00 0.00 0.00 57.70 58.10 1ixr n MET 114 Cb 0.00 -0.70 0.48 0.00 0.00 0.00 0.00 33.22 33.01 1ixr n MET 114 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 175.97 177.02 1ixr h GLU 115 N -0.05 0.38 0.00 2.12 4.11 -1.61 -3.43 114.58 116.10 1ixr h GLU 115 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.41 1ixr h GLU 115 Cb 0.03 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1ixr h GLU 115 CO 0.00 0.25 0.00 -0.25 0.07 0.00 0.00 179.01 179.08 1ixr n ASP 116 N -4.83 0.00 -0.59 3.06 8.00 -1.25 -5.07 116.55 115.86 1ixr n ASP 116 Ca 0.29 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.78 1ixr n ASP 116 Cb 0.94 0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 42.26 1ixr n ASP 116 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1ixr n PHE 117 N -1.85 0.00 -2.75 1.24 1.16 -1.25 -4.66 117.46 109.35 1ixr n PHE 117 Ca 0.00 -0.10 -0.20 0.00 -1.87 0.00 0.00 57.45 55.28 1ixr n PHE 117 Cb 0.00 0.30 0.09 0.00 -1.61 0.00 0.00 39.48 38.26 1ixr n PHE 117 CO 0.00 0.00 0.00 1.33 -1.87 0.00 0.00 176.76 176.22 1ixr n VAL 118 N 0.00 0.00 -2.71 1.97 0.24 -1.16 -1.29 118.33 115.38 1ixr n VAL 118 Ca -0.06 -1.54 -0.07 0.00 -2.04 0.00 0.00 64.34 60.63 1ixr n VAL 118 Cb 0.34 -0.80 0.09 0.00 -1.47 0.00 0.00 33.84 32.00 1ixr n VAL 118 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 1ixr n MET 119 N -2.48 0.84 -1.68 7.34 1.56 -1.26 -1.78 117.12 119.65 1ixr n MET 119 Ca 0.15 -1.59 -0.48 0.00 -0.27 0.00 0.00 57.70 55.50 1ixr n MET 119 Cb 0.54 -0.59 -0.05 0.00 2.15 0.00 0.00 33.22 35.27 1ixr n MET 119 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 1ixr n ASP 120 N 0.12 3.40 -4.28 6.12 10.43 -1.26 -4.26 116.55 126.83 1ixr n ASP 120 Ca -0.01 0.98 -0.44 0.00 2.57 0.00 0.00 54.79 57.90 1ixr n ASP 120 Cb 0.74 -1.37 -0.06 0.00 1.84 0.00 0.00 41.12 42.26 1ixr n ASP 120 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1ixr s ILE 121 N 3.77 4.88 0.58 0.53 1.01 0.96 -4.92 121.20 128.01 1ixr s ILE 121 Ca 0.92 -1.59 -0.19 0.00 0.00 0.00 0.00 60.65 59.78 1ixr s ILE 121 Cb -0.70 -4.15 -0.05 0.00 0.01 0.00 0.00 42.46 37.57 1ixr s ILE 121 CO 0.51 -0.84 1.02 0.52 0.00 0.00 0.00 174.94 176.15 1ixr n VAL 122 N 5.14 3.64 -3.62 2.92 0.31 -1.26 -1.56 118.33 123.90 1ixr n VAL 122 Ca -0.12 -0.50 -0.14 0.00 -0.01 0.00 0.00 64.34 63.58 1ixr n VAL 122 Cb 0.40 -1.22 -0.07 0.00 -0.91 0.00 0.00 33.84 32.05 1ixr n VAL 122 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 1ixr s ILE 123 N -1.46 0.00 0.00 2.52 2.07 -1.25 -4.85 121.20 118.23 1ixr s ILE 123 Ca 0.74 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.98 1ixr s ILE 123 Cb -0.43 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.16 1ixr s ILE 123 CO 0.48 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 174.12 1ixr n GLY 124 N 2.42 1.65 0.04 1.50 0.00 -1.26 -2.63 105.19 106.91 1ixr n GLY 124 Ca -0.14 -0.44 -0.05 0.00 0.00 0.00 0.00 46.02 45.39 1ixr n GLY 124 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ixr n GLN 125 N -0.30 0.38 0.00 1.61 1.13 -1.26 -4.78 117.38 114.16 1ixr n GLN 125 Ca 0.00 0.04 0.00 0.00 -1.94 0.00 0.00 57.00 55.10 1ixr n GLN 125 Cb 0.00 -1.16 0.00 0.00 0.11 0.00 0.00 30.24 29.19 1ixr n GLN 125 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ixr n GLY 126 N 3.09 0.99 3.76 1.08 0.00 -1.26 -4.72 105.19 108.13 1ixr n GLY 126 Ca -0.14 0.29 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 1ixr n GLY 126 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ixr s PRO 127 N 0.00 4.66 0.48 1.61 0.02 -1.26 -5.10 135.00 135.41 1ixr s PRO 127 Ca 0.00 1.56 -0.17 0.00 0.02 0.00 0.00 61.00 62.41 1ixr s PRO 127 Cb 0.00 -3.08 -0.14 0.00 0.02 0.00 0.00 34.50 31.30 1ixr s PRO 127 CO 0.00 0.31 -0.12 0.00 -0.33 0.00 0.00 177.00 176.85 1ixr n ALA 128 N 1.05 -3.00 -1.90 -1.55 0.00 -1.26 -4.99 120.51 108.85 1ixr n ALA 128 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1ixr n ALA 128 Cb 0.47 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1ixr n ALA 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ixr n ALA 129 N -1.42 0.00 -1.06 0.00 0.00 -1.08 -4.88 120.51 112.07 1ixr n ALA 129 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1ixr n ALA 129 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1ixr n ALA 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ixr n ARG 130 N 0.00 1.14 -3.48 0.00 1.74 -1.26 -4.91 116.66 109.89 1ixr n ARG 130 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1ixr n ARG 130 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 1ixr n ARG 130 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1ixr s THR 131 N 0.24 -0.31 0.42 0.55 -1.32 -1.26 -3.88 115.64 110.07 1ixr s THR 131 Ca 0.00 0.00 -0.21 0.00 -1.21 0.00 0.00 61.69 60.27 1ixr s THR 131 Cb 0.00 -1.00 -0.11 0.00 -1.51 0.00 0.00 72.50 69.88 1ixr s THR 131 CO 0.00 0.00 0.94 -0.63 -2.21 0.00 0.00 174.62 172.72 1ixr s ILE 132 N 2.04 4.39 0.13 5.08 1.01 -0.60 -4.81 121.20 128.44 1ixr s ILE 132 Ca -0.05 1.49 0.07 0.00 0.00 0.00 0.00 60.65 62.16 1ixr s ILE 132 Cb -0.05 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.75 1ixr s ILE 132 CO -0.16 -0.28 -0.16 0.00 0.00 0.00 0.00 174.94 174.34 1ixr s ARG 133 N -3.09 1.11 0.00 2.79 1.70 -1.26 0.32 118.95 120.52 1ixr s ARG 133 Ca 0.61 -1.28 0.00 0.00 -0.47 0.00 0.00 55.73 54.59 1ixr s ARG 133 Cb -0.10 -1.08 0.00 0.00 -0.57 0.00 0.00 34.95 33.20 1ixr s ARG 133 CO 0.14 0.22 0.00 1.28 -1.08 0.00 0.00 175.30 175.86 1ixr n LEU 134 N 0.53 0.00 0.00 -1.89 4.77 -1.26 -4.95 117.00 114.21 1ixr n LEU 134 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1ixr n LEU 134 Cb 0.57 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.66 1ixr n LEU 134 CO 0.27 0.00 0.00 1.21 -1.33 0.00 0.00 177.39 177.54 1ixr n GLU 135 N 0.00 0.00 -1.73 3.23 2.13 -1.26 -4.94 120.64 118.07 1ixr n GLU 135 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 1ixr n GLU 135 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 1ixr n GLU 135 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1ixr n LEU 136 N 0.00 4.06 -4.48 4.31 4.32 -0.41 -4.95 117.00 119.84 1ixr n LEU 136 Ca 0.00 1.13 -0.29 0.00 -0.02 0.00 0.00 56.01 56.83 1ixr n LEU 136 Cb 0.00 -1.56 0.25 0.00 -1.62 0.00 0.00 43.42 40.49 1ixr n LEU 136 CO 0.00 0.03 0.53 -2.16 -1.22 0.00 0.00 177.39 174.57 1ixr s PRO 137 N -0.25 -1.49 -0.21 3.23 0.04 -1.26 -4.45 135.00 130.62 1ixr s PRO 137 Ca 0.67 0.30 -0.27 0.00 0.04 0.00 0.00 61.00 61.73 1ixr s PRO 137 Cb -0.53 -1.53 -0.00 0.00 0.04 0.00 0.00 34.50 32.48 1ixr s PRO 137 CO 0.46 -3.97 0.95 -0.98 0.04 0.00 0.00 177.00 173.51 1ixr s ARG 138 N -4.99 4.26 0.20 4.56 1.70 -1.26 -4.70 118.95 118.72 1ixr s ARG 138 Ca 0.69 1.20 -0.05 0.00 -0.47 0.00 0.00 55.73 57.09 1ixr s ARG 138 Cb -0.16 -3.62 -0.03 0.00 -0.57 0.00 0.00 34.95 30.57 1ixr s ARG 138 CO 0.59 -0.52 0.24 -0.59 -1.08 0.00 0.00 175.30 173.94 1ixr s PHE 139 N 2.81 0.78 -0.16 5.89 -0.71 -1.26 -1.83 117.98 123.51 1ixr s PHE 139 Ca 0.41 -1.08 -0.04 0.00 -1.04 0.00 0.00 56.93 55.18 1ixr s PHE 139 Cb -0.16 -0.26 -0.03 0.00 -1.21 0.00 0.00 43.02 41.36 1ixr s PHE 139 CO 0.09 -0.73 -0.03 0.95 -1.34 0.00 0.00 175.22 174.15 1ixr s THR 140 N -4.08 3.99 -0.15 -4.49 -4.23 -1.21 -4.77 115.64 100.70 1ixr s THR 140 Ca 0.29 -0.32 -0.04 0.00 -1.18 0.00 0.00 61.69 60.44 1ixr s THR 140 Cb 0.04 -2.75 -0.03 0.00 1.34 0.00 0.00 72.50 71.10 1ixr s THR 140 CO 0.08 0.49 -0.03 -0.22 -0.54 0.00 0.00 174.62 174.40 1ixr s LEU 141 N 0.34 3.29 -0.24 4.79 0.20 -1.26 -1.11 118.68 124.70 1ixr s LEU 141 Ca -0.03 -0.10 -0.00 0.00 0.69 0.00 0.00 54.13 54.68 1ixr s LEU 141 Cb -0.14 -1.79 0.03 0.00 -0.43 0.00 0.00 46.19 43.86 1ixr s LEU 141 CO 0.03 0.18 -0.10 -0.63 -0.29 0.00 0.00 176.35 175.54 1ixr s ILE 142 N 0.28 2.54 -0.42 6.68 -1.09 0.01 -0.68 121.20 128.53 1ixr s ILE 142 Ca -0.03 -1.14 0.03 0.00 -2.23 0.00 0.00 60.65 57.28 1ixr s ILE 142 Cb -0.14 -2.29 0.12 0.00 -1.58 0.00 0.00 42.46 38.57 1ixr s ILE 142 CO 0.03 0.22 0.17 -0.83 -1.23 0.00 0.00 174.94 173.30 1ixr s GLY 143 N 1.27 1.89 0.32 6.18 0.00 -0.85 0.20 107.32 116.33 1ixr s GLY 143 Ca -0.01 -2.65 -0.11 0.00 0.00 0.00 0.00 44.72 41.95 1ixr s GLY 143 CO -0.06 1.23 0.68 0.00 0.00 0.00 0.00 173.10 174.94 1ixr s ALA 144 N 0.50 3.42 -0.04 3.20 0.00 -0.91 -2.88 121.76 125.05 1ixr s ALA 144 Ca 0.14 -0.16 0.02 0.00 0.00 0.00 0.00 51.96 51.96 1ixr s ALA 144 Cb -0.22 -2.62 0.01 0.00 0.00 0.00 0.00 23.12 20.29 1ixr s ALA 144 CO -0.06 0.28 -0.09 0.99 0.00 0.00 0.00 175.76 176.88 1ixr s THR 145 N -2.05 0.82 -0.41 0.00 2.01 0.06 -2.55 115.64 113.52 1ixr s THR 145 Ca 0.51 -0.34 0.23 0.00 0.31 0.00 0.00 61.69 62.39 1ixr s THR 145 Cb -0.11 -0.76 0.32 0.00 0.01 0.00 0.00 72.50 71.97 1ixr s THR 145 CO 0.23 0.27 1.60 0.71 -0.69 0.00 0.00 174.62 176.75 1ixr h THR 146 N 5.70 0.07 -1.26 -0.82 1.35 -1.85 -3.40 112.91 112.70 1ixr h THR 146 Ca -0.34 -1.08 -0.35 0.00 -0.55 0.00 0.00 66.41 64.09 1ixr h THR 146 Cb 1.17 2.02 -0.25 0.00 -1.73 0.00 0.00 68.15 69.36 1ixr h THR 146 CO 0.48 0.04 -0.72 -1.14 -0.25 0.00 0.00 175.52 173.92 1ixr n ARG 147 N -3.11 0.55 0.32 4.72 0.63 -1.26 -4.68 116.66 113.83 1ixr n ARG 147 Ca 0.04 -2.45 -0.17 0.00 -0.92 0.00 0.00 57.85 54.35 1ixr n ARG 147 Cb 0.54 -1.47 -0.09 0.00 0.45 0.00 0.00 32.46 31.90 1ixr n ARG 147 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1ixr h PRO 148 N 4.71 -0.77 0.00 -0.14 0.11 -1.94 -3.43 132.00 130.54 1ixr h PRO 148 Ca 0.06 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1ixr h PRO 148 Cb 1.00 0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ixr h PRO 148 CO 0.26 -0.48 0.00 0.41 -0.21 0.00 0.00 178.00 177.98 1ixr n GLY 149 N -1.20 0.21 2.31 -0.55 0.00 -1.26 -0.35 105.19 104.35 1ixr n GLY 149 Ca -0.13 0.24 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1ixr n GLY 149 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ixr n LEU 150 N 0.00 1.37 0.00 0.99 -0.00 -1.26 -4.77 117.00 113.33 1ixr n LEU 150 Ca 0.00 -5.07 0.00 0.00 -0.00 0.00 0.00 56.01 50.94 1ixr n LEU 150 Cb 0.00 0.53 0.00 0.00 -0.00 0.00 0.00 43.42 43.95 1ixr n LEU 150 CO 0.00 2.28 0.01 -0.38 -0.00 0.00 0.00 177.39 179.30 1ixr n ILE 151 N 0.19 0.00 -3.12 1.96 5.41 0.52 -4.89 119.36 119.43 1ixr n ILE 151 Ca 0.25 -0.08 -0.44 0.00 1.00 0.00 0.00 62.75 63.48 1ixr n ILE 151 Cb 0.63 1.29 0.00 0.00 -0.71 0.00 0.00 39.64 40.85 1ixr n ILE 151 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1ixr n THR 152 N -0.11 4.87 -0.55 1.39 -1.04 -1.23 -4.76 114.28 112.86 1ixr n THR 152 Ca 0.00 -5.53 -0.12 0.00 -2.04 0.00 0.00 64.05 56.36 1ixr n THR 152 Cb 0.07 -2.36 0.01 0.00 -1.82 0.00 0.00 70.33 66.23 1ixr n THR 152 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ixr n ALA 153 N 2.36 -0.19 0.01 2.41 0.00 -1.26 -4.22 120.51 119.61 1ixr n ALA 153 Ca 0.26 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1ixr n ALA 153 Cb 0.37 -0.24 0.01 0.00 0.00 0.00 0.00 19.45 19.58 1ixr n ALA 153 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1ixr n PRO 154 N 1.41 0.00 0.00 0.00 -0.02 -1.26 -0.87 135.00 134.26 1ixr n PRO 154 Ca -0.01 0.10 0.01 0.00 -2.02 0.00 0.00 63.50 61.58 1ixr n PRO 154 Cb 0.23 -1.95 0.04 0.00 -0.02 0.00 0.00 33.50 31.80 1ixr n PRO 154 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1ixr n LEU 155 N -1.12 0.00 0.24 2.45 -0.00 -1.26 -0.35 117.00 116.96 1ixr n LEU 155 Ca -0.00 0.34 0.09 0.00 -0.00 0.00 0.00 56.01 56.45 1ixr n LEU 155 Cb 0.45 -0.34 0.62 0.00 -0.00 0.00 0.00 43.42 44.14 1ixr n LEU 155 CO 0.00 -0.33 0.92 0.17 -0.00 0.00 0.00 177.39 178.16 1ixr h LEU 156 N 0.00 0.00 0.73 1.47 -0.00 -1.18 -2.48 115.31 113.85 1ixr h LEU 156 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.84 1ixr h LEU 156 Cb 0.02 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.68 1ixr h LEU 156 CO 0.00 0.17 -0.35 0.28 -0.00 0.00 0.00 178.44 178.54 1ixr h SER 157 N 0.00 -0.82 -0.81 0.17 0.02 -0.96 -3.04 113.55 108.11 1ixr h SER 157 Ca -0.00 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 61.11 1ixr h SER 157 Cb 0.38 0.21 -0.06 0.00 0.14 0.00 0.00 62.40 63.08 1ixr h SER 157 CO 0.02 -0.50 0.54 0.03 -1.14 0.00 0.00 176.83 175.79 1ixr h ARG 158 N -1.14 0.47 -6.99 3.45 -0.00 -1.65 -3.41 114.38 105.12 1ixr h ARG 158 Ca -0.10 -0.03 -0.53 0.00 -0.50 0.00 0.00 59.98 58.82 1ixr h ARG 158 Cb 0.77 -0.11 0.10 0.00 0.00 0.00 0.00 29.97 30.73 1ixr h ARG 158 CO 0.16 0.31 0.60 -0.06 0.00 0.00 0.00 179.97 180.98 1ixr s PHE 159 N -5.48 2.66 0.00 3.04 0.40 -0.96 -4.76 117.98 112.87 1ixr s PHE 159 Ca -0.08 1.41 0.00 0.00 -0.60 0.00 0.00 56.93 57.65 1ixr s PHE 159 Cb 0.22 -3.68 0.00 0.00 0.51 0.00 0.00 43.02 40.07 1ixr s PHE 159 CO 0.77 -2.28 0.00 0.41 0.70 0.00 0.00 175.22 174.83 1ixr n GLY 160 N 0.63 -0.07 3.77 4.36 0.00 0.20 -4.85 105.19 109.23 1ixr n GLY 160 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1ixr n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ixr s ILE 161 N 0.00 5.25 -0.61 -0.61 -4.36 -0.67 -4.91 121.20 115.29 1ixr s ILE 161 Ca 0.00 0.61 -0.05 0.00 -0.26 0.00 0.00 60.65 60.95 1ixr s ILE 161 Cb 0.00 -3.64 0.16 0.00 1.25 0.00 0.00 42.46 40.23 1ixr s ILE 161 CO 0.00 0.46 0.45 -0.69 0.24 0.00 0.00 174.94 175.40 1ixr s VAL 162 N -0.10 3.96 -0.03 8.37 1.01 -1.26 -2.99 120.40 129.36 1ixr s VAL 162 Ca 0.19 -2.70 0.01 0.00 0.00 0.00 0.00 61.98 59.49 1ixr s VAL 162 Cb -0.14 -3.57 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1ixr s VAL 162 CO 0.07 -0.87 -0.04 -1.83 0.00 0.00 0.00 175.10 172.43 1ixr s GLU 163 N 0.22 2.72 0.63 2.72 4.04 -1.26 -5.07 118.70 122.71 1ixr s GLU 163 Ca 0.15 -0.61 -0.06 0.00 0.04 0.00 0.00 54.97 54.50 1ixr s GLU 163 Cb -0.20 -2.61 0.03 0.00 0.02 0.00 0.00 34.13 31.38 1ixr s GLU 163 CO -0.04 0.64 0.94 -3.38 -1.84 0.00 0.00 175.26 171.57 1ixr s HIS 164 N -0.96 3.08 -0.00 4.83 -3.43 -1.26 -3.50 115.29 114.04 1ixr s HIS 164 Ca 0.16 0.50 0.01 0.00 -0.80 0.00 0.00 55.06 54.93 1ixr s HIS 164 Cb -0.11 -2.93 -0.00 0.00 -1.43 0.00 0.00 32.58 28.11 1ixr s HIS 164 CO 0.06 -1.07 -0.03 -0.51 -2.00 0.00 0.00 174.74 171.19 1ixr s LEU 165 N -5.07 1.96 0.00 5.38 1.43 -1.24 -4.82 118.68 116.31 1ixr s LEU 165 Ca 0.57 -0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.61 1ixr s LEU 165 Cb -0.11 -0.17 0.00 0.00 0.03 0.00 0.00 46.19 45.94 1ixr s LEU 165 CO 0.44 0.03 0.00 1.21 0.23 0.00 0.00 176.35 178.26 1ixr n GLU 166 N 3.07 1.37 -2.78 1.70 4.07 -1.26 -3.34 120.64 123.48 1ixr n GLU 166 Ca -0.13 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.57 1ixr n GLU 166 Cb 0.58 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 31.90 1ixr n GLU 166 CO 0.00 0.00 0.00 0.71 -0.06 0.00 0.00 177.13 177.78 1ixr s TYR 167 N -0.76 3.98 -0.96 4.31 2.02 -1.26 -4.86 117.35 119.81 1ixr s TYR 167 Ca 0.00 1.88 -0.12 0.00 -0.37 0.00 0.00 57.07 58.46 1ixr s TYR 167 Cb 0.00 -2.96 0.24 0.00 -0.40 0.00 0.00 41.96 38.84 1ixr s TYR 167 CO 0.00 0.46 0.95 0.71 -1.57 0.00 0.00 175.55 176.10 1ixr s TYR 168 N -1.15 3.94 0.00 2.71 2.02 -1.13 -4.98 117.35 118.75 1ixr s TYR 168 Ca 0.40 -2.26 0.00 0.00 -0.37 0.00 0.00 57.07 54.85 1ixr s TYR 168 Cb -0.26 -3.87 0.00 0.00 -0.40 0.00 0.00 41.96 37.44 1ixr s TYR 168 CO 0.31 -1.01 0.00 0.25 -1.57 0.00 0.00 175.55 173.53 1ixr n THR 169 N 3.55 0.00 -0.33 -0.71 -2.24 -1.26 -2.57 114.28 110.71 1ixr n THR 169 Ca 0.19 0.00 0.20 0.00 -2.27 0.00 0.00 64.05 62.18 1ixr n THR 169 Cb 0.44 0.00 0.42 0.00 -2.10 0.00 0.00 70.33 69.09 1ixr n THR 169 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1ixr h PRO 170 N 0.00 0.40 0.18 -0.78 0.11 -1.93 0.00 132.00 129.98 1ixr h PRO 170 Ca 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 1ixr h PRO 170 Cb 0.00 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.02 1ixr h PRO 170 CO 0.00 0.26 -0.09 0.93 -0.21 0.00 0.00 178.00 178.89 1ixr h GLU 171 N 0.41 -0.24 -0.72 1.05 3.07 -1.90 0.21 114.58 116.46 1ixr h GLU 171 Ca 0.68 0.02 0.16 0.00 -0.50 0.00 0.00 59.36 59.72 1ixr h GLU 171 Cb 1.45 0.05 -0.12 0.00 -0.84 0.00 0.00 28.75 29.29 1ixr h GLU 171 CO -0.56 -0.16 0.01 0.93 -1.40 0.00 0.00 179.01 177.83 1ixr h GLU 172 N -0.27 0.11 -0.31 2.33 5.08 -1.41 1.98 114.58 122.09 1ixr h GLU 172 Ca -0.03 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.17 1ixr h GLU 172 Cb 0.19 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1ixr h GLU 172 CO 0.04 0.07 -0.44 -0.07 -1.00 0.00 0.00 179.01 177.61 1ixr h LEU 173 N 0.12 0.87 -0.62 1.33 3.38 -0.77 0.18 115.31 119.80 1ixr h LEU 173 Ca 0.39 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1ixr h LEU 173 Cb 0.67 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1ixr h LEU 173 CO -0.62 1.18 0.15 0.00 0.09 0.00 0.00 178.44 179.24 1ixr h ALA 174 N 0.85 0.81 0.28 1.53 0.00 0.59 -0.68 119.26 122.64 1ixr h ALA 174 Ca 0.04 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1ixr h ALA 174 Cb 1.01 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 1ixr h ALA 174 CO 0.10 0.52 -0.48 0.37 0.00 0.00 0.00 179.25 179.75 1ixr h GLN 175 N 0.90 -0.79 -0.24 0.00 4.15 0.35 -1.97 115.11 117.51 1ixr h GLN 175 Ca 0.19 0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.70 1ixr h GLN 175 Cb 0.35 0.18 -0.05 0.00 0.21 0.00 0.00 27.48 28.17 1ixr h GLN 175 CO 0.00 -0.52 -0.38 0.78 -1.93 0.00 0.00 178.83 176.78 1ixr h GLY 176 N -0.82 -1.30 -0.63 2.39 0.00 -0.68 0.95 103.07 102.97 1ixr h GLY 176 Ca -0.03 0.74 0.26 0.00 0.00 0.00 0.00 47.33 48.30 1ixr h GLY 176 CO -0.17 -0.32 0.36 -0.62 0.00 0.00 0.00 176.54 175.78 1ixr n VAL 177 N -4.51 -0.24 0.43 4.60 0.31 -0.29 0.63 118.33 119.26 1ixr n VAL 177 Ca -0.03 1.20 -0.19 0.00 -0.01 0.00 0.00 64.34 65.31 1ixr n VAL 177 Cb 0.24 -1.95 -0.10 0.00 -0.91 0.00 0.00 33.84 31.12 1ixr n VAL 177 CO 0.00 0.00 0.00 -0.03 -1.32 0.00 0.00 176.83 175.48 1ixr h MET 178 N 0.00 -1.15 0.00 5.55 -1.53 -0.07 0.30 114.93 118.02 1ixr h MET 178 Ca 0.51 0.08 0.00 0.00 -3.44 0.00 0.00 59.70 56.85 1ixr h MET 178 Cb 1.40 0.26 0.00 0.00 -0.55 0.00 0.00 31.60 32.72 1ixr h MET 178 CO -0.44 -0.77 0.16 -0.09 0.14 0.00 0.00 176.91 175.91 1ixr h ARG 179 N -1.19 0.00 -0.01 0.39 9.65 0.21 1.81 114.38 125.23 1ixr h ARG 179 Ca -0.11 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 1ixr h ARG 179 Cb 0.96 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.54 1ixr h ARG 179 CO 0.10 0.00 0.00 -0.25 2.80 0.00 0.00 179.97 182.62 1ixr n ASP 180 N -2.70 0.90 -0.04 -3.80 10.43 0.01 -3.03 116.55 118.34 1ixr n ASP 180 Ca -0.02 -1.30 0.13 0.00 2.57 0.00 0.00 54.79 56.17 1ixr n ASP 180 Cb 0.20 -0.00 0.48 0.00 1.84 0.00 0.00 41.12 43.65 1ixr n ASP 180 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1ixr n ALA 181 N -0.29 2.89 -3.36 2.24 0.00 0.62 -4.17 120.51 118.43 1ixr n ALA 181 Ca 0.21 -0.24 -0.38 0.00 0.00 0.00 0.00 53.44 53.04 1ixr n ALA 181 Cb 0.26 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.37 1ixr n ALA 181 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ixr n ARG 182 N -1.34 3.32 0.00 0.00 1.74 -1.17 -4.47 116.66 114.75 1ixr n ARG 182 Ca 0.09 -4.54 0.00 0.00 -0.77 0.00 0.00 57.85 52.62 1ixr n ARG 182 Cb 0.32 -2.43 0.00 0.00 -1.02 0.00 0.00 32.46 29.33 1ixr n ARG 182 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1ixr n LEU 183 N 1.75 0.00 -3.32 0.55 4.77 -1.26 -5.07 117.00 114.41 1ixr n LEU 183 Ca 0.25 0.00 -0.25 0.00 -0.03 0.00 0.00 56.01 55.98 1ixr n LEU 183 Cb 0.37 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.37 1ixr n LEU 183 CO 0.50 0.00 -0.30 0.18 -1.33 0.00 0.00 177.39 176.44 1ixr n LEU 184 N 0.00 -0.50 -0.74 2.23 4.77 -1.26 -4.97 117.00 116.53 1ixr n LEU 184 Ca 0.00 -4.37 0.00 0.00 -0.03 0.00 0.00 56.01 51.61 1ixr n LEU 184 Cb 0.00 0.58 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1ixr n LEU 184 CO 0.00 1.91 0.00 0.61 -1.33 0.00 0.00 177.39 178.58 1ixr n GLY 185 N 2.55 0.52 3.64 -0.72 0.00 -1.26 -5.11 105.19 104.82 1ixr n GLY 185 Ca 0.28 -0.35 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 1ixr n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ixr s VAL 186 N -2.43 0.00 -0.14 1.61 0.11 -1.26 -4.99 120.40 113.31 1ixr s VAL 186 Ca 0.00 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.07 1ixr s VAL 186 Cb 0.00 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 1ixr s VAL 186 CO 0.00 0.00 -0.20 -0.60 -3.33 0.00 0.00 175.10 170.97 1ixr s ARG 187 N 1.15 2.78 0.17 1.54 6.06 -1.26 -4.56 118.95 124.83 1ixr s ARG 187 Ca -0.06 -0.76 0.10 0.00 -2.50 0.00 0.00 55.73 52.50 1ixr s ARG 187 Cb -0.04 -2.30 -0.04 0.00 0.06 0.00 0.00 34.95 32.63 1ixr s ARG 187 CO -0.14 -0.06 -0.22 -1.50 -2.50 0.00 0.00 175.30 170.89 1ixr s ILE 188 N 0.94 2.11 0.35 4.11 2.07 -1.25 -2.38 121.20 127.14 1ixr s ILE 188 Ca -0.05 -1.92 0.02 0.00 -1.41 0.00 0.00 60.65 57.29 1ixr s ILE 188 Cb -0.15 -1.97 -0.02 0.00 0.13 0.00 0.00 42.46 40.45 1ixr s ILE 188 CO -0.03 -0.15 0.53 0.28 -1.91 0.00 0.00 174.94 173.65 1ixr s THR 189 N -1.68 4.80 0.00 4.00 -1.32 -0.50 -4.97 115.64 115.97 1ixr s THR 189 Ca 0.17 -0.62 0.00 0.00 -1.21 0.00 0.00 61.69 60.03 1ixr s THR 189 Cb -0.08 -3.74 0.00 0.00 -1.51 0.00 0.00 72.50 67.18 1ixr s THR 189 CO 0.08 -0.43 0.28 1.21 -2.21 0.00 0.00 174.62 173.55 1ixr n GLU 190 N -1.76 0.00 -0.21 7.08 4.07 -1.26 -0.28 120.64 128.28 1ixr n GLU 190 Ca -0.04 0.00 0.14 0.00 -0.06 0.00 0.00 57.16 57.20 1ixr n GLU 190 Cb 0.57 -0.78 0.27 0.00 -0.06 0.00 0.00 31.44 31.44 1ixr n GLU 190 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1ixr n GLU 191 N -0.29 -0.04 0.32 5.31 -0.00 -1.26 0.27 120.64 124.94 1ixr n GLU 191 Ca 0.00 0.89 -0.13 0.00 -0.00 0.00 0.00 57.16 57.92 1ixr n GLU 191 Cb 0.00 -1.50 -0.06 0.00 -0.00 0.00 0.00 31.44 29.88 1ixr n GLU 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ixr h ALA 192 N 1.24 -1.21 -0.66 -1.84 0.00 -1.90 0.05 119.26 114.93 1ixr h ALA 192 Ca 0.44 -0.18 0.19 0.00 0.00 0.00 0.00 54.91 55.37 1ixr h ALA 192 Cb 1.06 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 1ixr h ALA 192 CO -0.53 -1.15 0.86 0.00 0.00 0.00 0.00 179.25 178.42 1ixr h ALA 193 N -1.57 2.48 -0.22 0.00 0.00 0.69 3.64 119.26 124.28 1ixr h ALA 193 Ca -0.08 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1ixr h ALA 193 Cb 0.64 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1ixr h ALA 193 CO 0.12 -1.20 -0.11 -0.07 0.00 0.00 0.00 179.25 178.00 1ixr h LEU 194 N 0.00 0.34 0.09 0.00 -0.00 0.19 0.30 115.31 116.22 1ixr h LEU 194 Ca 0.32 -0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 58.12 1ixr h LEU 194 Cb 2.03 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 42.59 1ixr h LEU 194 CO -0.00 0.48 -0.11 -0.33 -0.00 0.00 0.00 178.44 178.47 1ixr h GLU 195 N 0.34 -0.20 -0.87 1.13 4.39 0.72 -2.40 114.58 117.67 1ixr h GLU 195 Ca 0.07 0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.89 1ixr h GLU 195 Cb 0.40 0.05 -0.13 0.00 -0.10 0.00 0.00 28.75 28.97 1ixr h GLU 195 CO 0.02 -0.13 -0.48 0.82 -1.16 0.00 0.00 179.01 178.08 1ixr h ILE 196 N -0.21 0.02 -0.59 3.13 2.04 -1.52 -1.47 117.51 118.92 1ixr h ILE 196 Ca -0.01 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.97 1ixr h ILE 196 Cb 0.19 0.02 -0.11 0.00 -0.74 0.00 0.00 36.82 36.18 1ixr h ILE 196 CO -0.03 0.00 -0.14 0.61 0.00 0.00 0.00 178.15 178.60 1ixr n GLY 197 N -1.37 -0.97 0.65 5.37 0.00 0.07 0.76 105.19 109.70 1ixr n GLY 197 Ca 0.05 0.62 0.07 0.00 0.00 0.00 0.00 46.02 46.76 1ixr n GLY 197 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1ixr n ARG 198 N -4.94 1.83 0.00 1.61 0.00 -0.56 -3.31 116.66 111.29 1ixr n ARG 198 Ca 0.10 -1.28 0.07 0.00 -0.00 0.00 0.00 57.85 56.74 1ixr n ARG 198 Cb 0.31 -1.31 0.01 0.00 0.00 0.00 0.00 32.46 31.46 1ixr n ARG 198 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1ixr n ARG 199 N 0.52 1.69 -3.46 -0.14 3.00 0.23 -4.57 116.66 113.94 1ixr n ARG 199 Ca 0.13 -0.85 -0.40 0.00 -0.01 0.00 0.00 57.85 56.72 1ixr n ARG 199 Cb 0.32 -1.23 -0.03 0.00 0.00 0.00 0.00 32.46 31.51 1ixr n ARG 199 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 1ixr n SER 200 N -0.01 4.94 -2.55 0.55 7.64 -1.08 -4.52 113.62 118.59 1ixr n SER 200 Ca 0.06 -3.12 0.00 0.00 1.01 0.00 0.00 58.87 56.83 1ixr n SER 200 Cb 0.31 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.31 1ixr n SER 200 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ixr n ARG 201 N 2.37 0.00 -3.98 1.43 3.00 -1.26 -2.07 116.66 116.15 1ixr n ARG 201 Ca 0.23 0.00 -0.29 0.00 -0.01 0.00 0.00 57.85 57.78 1ixr n ARG 201 Cb 0.38 -0.66 0.00 0.00 0.00 0.00 0.00 32.46 32.18 1ixr n ARG 201 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ixr n GLY 202 N 2.12 -0.38 3.19 -0.13 0.00 -1.26 -4.91 105.19 103.81 1ixr n GLY 202 Ca 0.00 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.07 1ixr n GLY 202 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ixr s THR 203 N -3.53 -0.48 0.34 2.61 2.01 -0.88 -2.82 115.64 112.90 1ixr s THR 203 Ca 0.42 0.19 0.03 0.00 0.31 0.00 0.00 61.69 62.63 1ixr s THR 203 Cb -0.22 -0.59 0.27 0.00 0.01 0.00 0.00 72.50 71.98 1ixr s THR 203 CO 0.87 0.08 1.98 0.24 -0.69 0.00 0.00 174.62 177.10 1ixr h MET 204 N 8.03 0.85 0.22 4.92 2.86 -1.88 -0.22 114.93 129.71 1ixr h MET 204 Ca -0.19 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1ixr h MET 204 Cb 1.12 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 1ixr h MET 204 CO 0.16 0.56 -0.30 -0.09 1.06 0.00 0.00 176.91 178.30 1ixr h ARG 205 N 0.87 -0.52 0.00 1.72 1.12 -1.95 0.41 114.38 116.03 1ixr h ARG 205 Ca 0.28 0.04 0.00 0.00 -1.11 0.00 0.00 59.98 59.19 1ixr h ARG 205 Cb 0.04 0.12 0.00 0.00 -0.01 0.00 0.00 29.97 30.12 1ixr h ARG 205 CO -0.08 -0.35 0.00 1.33 -3.11 0.00 0.00 179.97 177.77 1ixr n VAL 206 N -4.17 0.00 0.66 0.20 0.24 -1.04 -2.17 118.33 112.04 1ixr n VAL 206 Ca -0.06 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.35 1ixr n VAL 206 Cb 0.26 -0.47 0.26 0.00 -1.47 0.00 0.00 33.84 32.42 1ixr n VAL 206 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ixr n ALA 207 N -0.71 2.46 -0.00 2.33 0.00 0.14 -4.31 120.51 120.42 1ixr n ALA 207 Ca 0.05 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.67 1ixr n ALA 207 Cb 0.02 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1ixr n ALA 207 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ixr n LYS 208 N 1.10 4.34 -0.13 0.00 5.02 -0.92 -4.84 118.16 122.73 1ixr n LYS 208 Ca 0.18 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.40 1ixr n LYS 208 Cb 0.52 -0.36 -0.00 0.00 -0.02 0.00 0.00 35.03 35.16 1ixr n LYS 208 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ixr h ARG 209 N 0.00 -0.20 -0.97 1.97 2.47 -1.73 -1.70 114.38 114.22 1ixr h ARG 209 Ca 0.00 0.01 0.25 0.00 -1.26 0.00 0.00 59.98 58.98 1ixr h ARG 209 Cb 0.00 0.05 -0.18 0.00 -1.65 0.00 0.00 29.97 28.18 1ixr h ARG 209 CO 0.00 -0.13 -0.05 1.28 0.56 0.00 0.00 179.97 181.63 1ixr n LEU 210 N -5.41 -0.17 0.01 3.04 4.32 -1.26 -2.36 117.00 115.17 1ixr n LEU 210 Ca 0.02 1.66 -0.20 0.00 -0.02 0.00 0.00 56.01 57.46 1ixr n LEU 210 Cb 0.33 -0.58 -0.14 0.00 -1.62 0.00 0.00 43.42 41.41 1ixr n LEU 210 CO 0.08 -1.66 -0.74 -0.26 -1.22 0.00 0.00 177.39 173.59 1ixr h PHE 211 N 0.00 0.48 -0.97 -1.77 0.04 -1.80 -3.28 116.94 109.64 1ixr h PHE 211 Ca 0.56 -0.35 0.31 0.00 2.80 0.00 0.00 57.97 61.29 1ixr h PHE 211 Cb 1.09 -0.02 -0.16 0.00 2.20 0.00 0.00 35.95 39.07 1ixr h PHE 211 CO -0.56 1.70 0.44 0.00 -0.60 0.00 0.00 178.31 179.30 1ixr h ARG 212 N 0.07 0.21 0.03 1.51 3.08 -0.93 1.09 114.38 119.44 1ixr h ARG 212 Ca -0.40 -0.01 -0.23 0.00 0.07 0.00 0.00 59.98 59.40 1ixr h ARG 212 Cb 2.04 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 32.02 1ixr h ARG 212 CO 0.10 0.14 -1.15 -0.09 -1.07 0.00 0.00 179.97 177.91 1ixr h ARG 213 N 0.22 0.06 -1.01 0.04 2.43 -1.73 -3.25 114.38 111.14 1ixr h ARG 213 Ca 0.70 -0.10 0.26 0.00 -0.81 0.00 0.00 59.98 60.03 1ixr h ARG 213 Cb 1.60 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 31.12 1ixr h ARG 213 CO -0.67 0.99 0.67 0.28 -1.51 0.00 0.00 179.97 179.73 1ixr h VAL 214 N 0.02 0.55 0.00 0.20 2.07 0.11 -2.87 116.25 116.34 1ixr h VAL 214 Ca -0.07 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1ixr h VAL 214 Cb 1.84 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 1ixr h VAL 214 CO 0.14 0.05 0.00 0.54 0.02 0.00 0.00 177.57 178.32 1ixr n ARG 215 N -4.49 0.00 -1.77 1.57 3.00 -0.63 -2.86 116.66 111.48 1ixr n ARG 215 Ca 0.23 0.79 -0.42 0.00 -0.01 0.00 0.00 57.85 58.44 1ixr n ARG 215 Cb 0.89 -1.41 -0.00 0.00 0.00 0.00 0.00 32.46 31.94 1ixr n ARG 215 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1ixr n ASP 216 N -2.41 4.84 -3.87 0.55 4.64 -1.08 -4.85 116.55 114.37 1ixr n ASP 216 Ca 0.00 -2.85 -0.14 0.00 -1.38 0.00 0.00 54.79 50.42 1ixr n ASP 216 Cb 0.00 -1.61 -0.15 0.00 -1.04 0.00 0.00 41.12 38.32 1ixr n ASP 216 CO 0.00 0.00 0.00 0.12 -0.82 0.00 0.00 177.20 176.50 1ixr s PHE 217 N 2.52 0.15 0.00 -0.67 2.19 -1.13 -5.08 117.98 115.96 1ixr s PHE 217 Ca 0.49 -0.00 0.00 0.00 0.33 0.00 0.00 56.93 57.75 1ixr s PHE 217 Cb 0.14 -0.16 0.00 0.00 -1.31 0.00 0.00 43.02 41.69 1ixr s PHE 217 CO -0.07 -0.03 0.00 0.00 1.83 0.00 0.00 175.22 176.94 1ixr n ALA 218 N 3.36 0.00 -0.13 11.12 0.00 -1.26 -3.82 120.51 129.78 1ixr n ALA 218 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.25 1ixr n ALA 218 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.00 1ixr n ALA 218 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1ixr n GLN 219 N 0.00 0.29 0.00 0.00 -0.06 -1.26 -2.04 117.38 114.32 1ixr n GLN 219 Ca 0.00 -0.24 0.00 0.00 -2.00 0.00 0.00 57.00 54.76 1ixr n GLN 219 Cb 0.00 -1.67 0.00 0.00 -4.06 0.00 0.00 30.24 24.51 1ixr n GLN 219 CO 0.00 0.00 0.00 1.55 -0.20 0.00 0.00 177.06 178.41 1ixr n VAL 220 N 3.32 0.00 0.10 1.69 3.14 -1.25 -4.83 118.33 120.50 1ixr n VAL 220 Ca 0.06 0.00 0.05 0.00 -2.96 0.00 0.00 64.34 61.49 1ixr n VAL 220 Cb 0.10 0.00 -0.00 0.00 -1.06 0.00 0.00 33.84 32.87 1ixr n VAL 220 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ixr h ALA 221 N 0.00 0.67 -0.01 1.55 0.00 -1.51 -2.55 119.26 117.40 1ixr h ALA 221 Ca 0.00 -0.44 -0.20 0.00 0.00 0.00 0.00 54.91 54.27 1ixr h ALA 221 Cb 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ixr h ALA 221 CO 0.00 0.52 -0.87 0.78 0.00 0.00 0.00 179.25 179.68 1ixr h GLY 222 N 3.75 0.33 -2.96 0.00 0.00 -1.89 -3.15 103.07 99.15 1ixr h GLY 222 Ca -0.06 -0.56 -0.36 0.00 0.00 0.00 0.00 47.33 46.35 1ixr h GLY 222 CO 0.04 0.50 0.21 1.18 0.00 0.00 0.00 176.54 178.46 1ixr n GLU 223 N -3.72 2.13 0.00 4.80 4.71 -1.25 -4.87 120.64 122.43 1ixr n GLU 223 Ca -0.05 -3.19 0.00 0.00 -0.01 0.00 0.00 57.16 53.91 1ixr n GLU 223 Cb 0.79 -2.00 0.00 0.00 -1.01 0.00 0.00 31.44 29.22 1ixr n GLU 223 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1ixr n GLU 224 N -1.10 0.00 -1.25 3.49 1.02 -0.96 -4.47 120.64 117.37 1ixr n GLU 224 Ca 0.45 0.00 -0.39 0.00 -0.02 0.00 0.00 57.16 57.21 1ixr n GLU 224 Cb 1.23 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 32.66 1ixr n GLU 224 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ixr n VAL 225 N -2.72 0.22 -3.36 2.62 0.31 -1.26 -4.82 118.33 109.33 1ixr n VAL 225 Ca 0.00 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.72 1ixr n VAL 225 Cb 0.00 -0.07 -0.08 0.00 -0.91 0.00 0.00 33.84 32.78 1ixr n VAL 225 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1ixr s ILE 226 N -1.98 -0.56 0.46 2.52 -4.36 -1.00 -4.92 121.20 111.36 1ixr s ILE 226 Ca 0.57 -0.17 0.05 0.00 -0.26 0.00 0.00 60.65 60.84 1ixr s ILE 226 Cb -0.46 -0.86 -0.04 0.00 1.25 0.00 0.00 42.46 42.35 1ixr s ILE 226 CO 0.66 -0.20 0.11 0.42 0.24 0.00 0.00 174.94 176.17 1ixr s THR 227 N 2.50 1.80 -1.24 8.37 -4.23 -1.26 -1.42 115.64 120.16 1ixr s THR 227 Ca 0.11 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 1ixr s THR 227 Cb -0.15 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1ixr s THR 227 CO -0.20 0.00 0.30 -1.14 -0.54 0.00 0.00 174.62 173.04 1ixr n ARG 228 N -1.24 0.00 -0.09 3.99 0.63 -1.26 0.26 116.66 118.95 1ixr n ARG 228 Ca -0.08 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.74 1ixr n ARG 228 Cb 0.66 -1.49 -0.05 0.00 0.45 0.00 0.00 32.46 32.04 1ixr n ARG 228 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1ixr n GLU 229 N -0.80 0.50 0.04 -0.14 0.28 -1.26 -3.90 120.64 115.36 1ixr n GLU 229 Ca 0.00 0.47 -0.05 0.00 -0.16 0.00 0.00 57.16 57.43 1ixr n GLU 229 Cb 0.00 -1.65 0.17 0.00 1.43 0.00 0.00 31.44 31.38 1ixr n GLU 229 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ixr h ARG 230 N -1.00 0.41 -0.53 3.44 3.08 -1.34 0.15 114.38 118.58 1ixr h ARG 230 Ca -0.13 -0.20 0.10 0.00 0.07 0.00 0.00 59.98 59.82 1ixr h ARG 230 Cb 0.85 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.79 1ixr h ARG 230 CO -0.08 0.74 -0.33 0.00 -1.07 0.00 0.00 179.97 179.23 1ixr h ALA 231 N 1.24 -0.08 -0.02 0.04 0.00 -0.39 0.11 119.26 120.17 1ixr h ALA 231 Ca 0.03 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ixr h ALA 231 Cb 0.84 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1ixr h ALA 231 CO 0.07 -0.69 -0.20 -0.11 0.00 0.00 0.00 179.25 178.33 1ixr n LEU 232 N -5.43 1.85 0.00 0.00 0.00 -1.19 -4.06 117.00 108.16 1ixr n LEU 232 Ca 0.03 -0.61 0.00 0.00 0.00 0.00 0.00 56.01 55.43 1ixr n LEU 232 Cb 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 43.42 43.73 1ixr n LEU 232 CO 0.03 0.32 0.00 1.21 0.00 0.00 0.00 177.39 178.95 1ixr n GLU 233 N 0.16 0.00 0.00 1.96 2.13 0.20 -2.23 120.64 122.86 1ixr n GLU 233 Ca 0.13 0.09 0.00 0.00 0.66 0.00 0.00 57.16 58.05 1ixr n GLU 233 Cb 0.44 -0.48 0.00 0.00 0.27 0.00 0.00 31.44 31.66 1ixr n GLU 233 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ixr n ALA 234 N -1.15 1.64 -0.03 4.31 0.00 -0.11 0.14 120.51 125.31 1ixr n ALA 234 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1ixr n ALA 234 Cb 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.43 1ixr n ALA 234 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ixr n LEU 235 N 0.37 1.97 0.02 0.00 7.94 -1.25 -2.08 117.00 123.98 1ixr n LEU 235 Ca 0.00 0.01 0.12 0.00 -1.11 0.00 0.00 56.01 55.03 1ixr n LEU 235 Cb 0.11 -0.17 0.15 0.00 0.53 0.00 0.00 43.42 44.05 1ixr n LEU 235 CO 0.00 0.40 0.29 0.00 -1.11 0.00 0.00 177.39 176.97 1ixr n ALA 236 N -2.88 3.40 -1.32 1.96 0.00 -0.13 -2.73 120.51 118.81 1ixr n ALA 236 Ca -0.10 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1ixr n ALA 236 Cb 0.59 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1ixr n ALA 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ixr n ALA 237 N -1.67 0.00 1.02 0.00 0.00 0.37 -4.41 120.51 115.83 1ixr n ALA 237 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.60 1ixr n ALA 237 Cb 0.39 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.19 1ixr n ALA 237 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1ixr n LEU 238 N 0.00 0.40 0.00 0.00 0.00 -1.26 -2.52 117.00 113.62 1ixr n LEU 238 Ca 0.00 0.11 0.04 0.00 0.00 0.00 0.00 56.01 56.15 1ixr n LEU 238 Cb 0.00 -0.30 0.23 0.00 0.00 0.00 0.00 43.42 43.35 1ixr n LEU 238 CO 0.00 0.10 0.43 0.61 0.00 0.00 0.00 177.39 178.53 1ixr n GLY 239 N 1.49 -0.36 4.05 -3.96 0.00 -0.88 -4.81 105.19 100.72 1ixr n GLY 239 Ca 0.06 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 1ixr n GLY 239 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ixr n LEU 240 N -0.84 -0.23 0.00 0.99 4.77 -1.05 -4.89 117.00 115.75 1ixr n LEU 240 Ca 0.06 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.91 1ixr n LEU 240 Cb 0.03 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 39.76 1ixr n LEU 240 CO 0.04 0.66 0.00 -0.90 -1.33 0.00 0.00 177.39 175.86 1ixr n ASP 241 N -1.85 0.00 0.00 -1.43 5.68 -1.11 -3.74 116.55 114.10 1ixr n ASP 241 Ca -0.13 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.16 1ixr n ASP 241 Cb 0.51 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.49 1ixr n ASP 241 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1ixr n GLU 242 N -0.15 0.00 -2.06 0.11 -0.00 -1.18 -3.70 120.64 113.65 1ixr n GLU 242 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.16 56.88 1ixr n GLU 242 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 31.44 31.39 1ixr n GLU 242 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 1ixr s LEU 243 N 0.00 3.19 0.00 -1.84 2.96 -1.26 -4.61 118.68 117.11 1ixr s LEU 243 Ca 0.00 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 1ixr s LEU 243 Cb 0.00 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1ixr s LEU 243 CO 0.00 -2.68 0.00 0.61 -1.32 0.00 0.00 176.35 172.96 1ixr n GLY 244 N 6.75 0.67 0.61 7.98 0.00 -1.26 -4.84 105.19 115.10 1ixr n GLY 244 Ca 0.38 0.61 -0.11 0.00 0.00 0.00 0.00 46.02 46.90 1ixr n GLY 244 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ixr n LEU 245 N 0.00 0.19 -4.16 0.99 4.77 -1.26 -4.88 117.00 112.65 1ixr n LEU 245 Ca 0.00 0.19 -0.16 0.00 -0.03 0.00 0.00 56.01 56.00 1ixr n LEU 245 Cb 0.00 -0.15 -0.11 0.00 -2.33 0.00 0.00 43.42 40.83 1ixr n LEU 245 CO 0.00 -0.14 -0.44 -1.83 -1.33 0.00 0.00 177.39 173.65 1ixr s GLU 246 N 0.55 0.80 0.00 3.23 -1.05 -1.26 -3.10 118.70 117.87 1ixr s GLU 246 Ca 0.18 -1.01 0.00 0.00 -0.15 0.00 0.00 54.97 53.99 1ixr s GLU 246 Cb -0.25 -0.68 0.00 0.00 -0.44 0.00 0.00 34.13 32.76 1ixr s GLU 246 CO 0.13 0.14 0.00 1.17 0.95 0.00 0.00 175.26 177.65 1ixr n LYS 247 N 1.04 0.00 -0.27 -4.83 4.81 -1.25 0.30 118.16 117.96 1ixr n LYS 247 Ca -0.19 0.00 0.25 0.00 -0.87 0.00 0.00 58.31 57.50 1ixr n LYS 247 Cb 0.55 0.00 0.59 0.00 0.02 0.00 0.00 35.03 36.20 1ixr n LYS 247 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1ixr h ARG 248 N 0.00 0.24 0.02 1.64 9.65 -1.97 0.57 114.38 124.53 1ixr h ARG 248 Ca 0.00 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1ixr h ARG 248 Cb 0.00 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 1ixr h ARG 248 CO 0.00 0.16 -0.01 -0.44 2.80 0.00 0.00 179.97 182.48 1ixr h ASP 249 N 0.25 -0.02 -0.16 -3.80 3.32 0.42 0.35 116.42 116.78 1ixr h ASP 249 Ca 0.53 -0.43 0.04 0.00 0.02 0.00 0.00 57.03 57.18 1ixr h ASP 249 Cb 1.60 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 41.11 1ixr h ASP 249 CO -0.16 0.42 -0.08 -0.09 -1.72 0.00 0.00 179.24 177.61 1ixr h ARG 250 N -0.47 -0.06 0.05 3.56 2.43 -0.85 -0.79 114.38 118.25 1ixr h ARG 250 Ca -0.00 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1ixr h ARG 250 Cb 0.45 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.96 1ixr h ARG 250 CO 0.00 -0.04 -0.45 0.93 -1.51 0.00 0.00 179.97 178.90 1ixr h GLU 251 N -0.06 -0.62 0.00 0.20 5.08 0.16 0.86 114.58 120.21 1ixr h GLU 251 Ca 0.09 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ixr h GLU 251 Cb 0.20 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1ixr h GLU 251 CO -0.21 -0.41 0.00 -0.89 -1.00 0.00 0.00 179.01 176.50 1ixr n ILE 252 N -5.46 0.00 -0.29 3.13 5.41 0.12 -0.11 119.36 122.15 1ixr n ILE 252 Ca -0.07 1.45 -0.03 0.00 1.00 0.00 0.00 62.75 65.11 1ixr n ILE 252 Cb 0.39 -1.98 0.03 0.00 -0.71 0.00 0.00 39.64 37.36 1ixr n ILE 252 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1ixr h LEU 253 N 0.00 -1.25 -0.77 1.39 3.38 -0.72 1.09 115.31 118.44 1ixr h LEU 253 Ca 0.00 0.27 0.16 0.00 0.09 0.00 0.00 57.88 58.39 1ixr h LEU 253 Cb 0.00 0.65 -0.15 0.00 0.09 0.00 0.00 40.66 41.26 1ixr h LEU 253 CO 0.00 -0.30 -0.17 -0.33 0.09 0.00 0.00 178.44 177.73 1ixr h GLU 254 N -0.08 0.01 -0.05 1.13 5.08 0.26 2.49 114.58 123.42 1ixr h GLU 254 Ca 0.30 -0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.46 1ixr h GLU 254 Cb 0.58 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 1ixr h GLU 254 CO -0.84 0.01 -0.80 0.28 -1.00 0.00 0.00 179.01 176.66 1ixr h VAL 255 N 0.01 1.39 0.14 3.13 2.07 0.40 0.74 116.25 124.12 1ixr h VAL 255 Ca 0.38 -2.25 -0.01 0.00 0.82 0.00 0.00 66.70 65.64 1ixr h VAL 255 Cb 0.59 2.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.57 1ixr h VAL 255 CO -0.78 0.67 -0.07 0.25 0.02 0.00 0.00 177.57 177.67 1ixr h LEU 256 N 0.26 -0.16 0.00 2.57 7.12 0.61 -2.52 115.31 123.19 1ixr h LEU 256 Ca -0.05 -0.08 -0.01 0.00 0.13 0.00 0.00 57.88 57.88 1ixr h LEU 256 Cb 1.39 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 41.56 1ixr h LEU 256 CO 0.14 -0.02 -0.03 -0.29 -0.13 0.00 0.00 178.44 178.10 1ixr h ILE 257 N -0.28 1.67 0.57 4.05 6.09 0.40 -1.19 117.51 128.80 1ixr h ILE 257 Ca -0.02 -2.26 -0.03 0.00 -1.37 0.00 0.00 64.86 61.18 1ixr h ILE 257 Cb 0.22 3.16 0.01 0.00 0.47 0.00 0.00 36.82 40.68 1ixr h ILE 257 CO 0.03 0.56 -0.27 -0.07 -3.07 0.00 0.00 178.15 175.33 1ixr h LEU 258 N -1.00 -0.65 -0.01 2.19 3.38 0.40 0.42 115.31 120.04 1ixr h LEU 258 Ca -0.01 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1ixr h LEU 258 Cb 0.95 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1ixr h LEU 258 CO -0.00 -0.26 0.00 -0.09 0.09 0.00 0.00 178.44 178.17 1ixr h ARG 259 N -1.10 0.02 0.05 1.13 2.43 -1.51 -3.37 114.38 112.04 1ixr h ARG 259 Ca -0.08 -0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 58.71 1ixr h ARG 259 Cb 0.64 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.14 1ixr h ARG 259 CO 0.13 0.26 -2.23 1.19 -1.51 0.00 0.00 179.97 177.81 1ixr n PHE 260 N -4.96 0.59 0.00 2.20 3.01 -1.09 -5.07 117.46 112.14 1ixr n PHE 260 Ca -0.08 0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.52 1ixr n PHE 260 Cb 0.14 -1.08 0.00 0.00 -0.01 0.00 0.00 39.48 38.53 1ixr n PHE 260 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ixr n GLY 261 N 2.07 -0.16 0.11 1.37 0.00 0.14 -4.41 105.19 104.31 1ixr n GLY 261 Ca -0.38 -2.25 0.15 0.00 0.00 0.00 0.00 46.02 43.54 1ixr n GLY 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ixr n GLY 262 N 0.00 -0.77 3.71 -0.02 0.00 -1.26 -3.31 105.19 103.54 1ixr n GLY 262 Ca 0.00 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 1ixr n GLY 262 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ixr s GLY 263 N -1.95 1.67 0.32 -0.02 0.00 -1.26 -2.07 107.32 104.00 1ixr s GLY 263 Ca 0.44 0.34 -0.27 0.00 0.00 0.00 0.00 44.72 45.23 1ixr s GLY 263 CO 0.35 0.75 0.99 2.56 0.00 0.00 0.00 173.10 177.74 1ixr s PRO 264 N -4.78 4.54 0.01 2.90 0.04 -1.15 -4.32 135.00 132.25 1ixr s PRO 264 Ca 0.64 1.46 0.00 0.00 0.04 0.00 0.00 61.00 63.14 1ixr s PRO 264 Cb -0.20 -2.87 0.00 0.00 0.04 0.00 0.00 34.50 31.47 1ixr s PRO 264 CO 0.57 0.21 0.00 0.28 0.04 0.00 0.00 177.00 178.10 1ixr n VAL 265 N 0.65 0.15 0.00 -0.36 0.31 -0.00 -4.80 118.33 114.27 1ixr n VAL 265 Ca 0.02 0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1ixr n VAL 265 Cb 0.49 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 1ixr n VAL 265 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ixr n GLY 266 N 3.40 2.83 0.14 2.92 0.00 -1.26 -4.64 105.19 108.57 1ixr n GLY 266 Ca 0.00 -1.14 0.12 0.00 0.00 0.00 0.00 46.02 45.00 1ixr n GLY 266 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ixr n LEU 267 N 0.00 0.11 0.00 0.99 4.77 -1.26 -1.54 117.00 120.07 1ixr n LEU 267 Ca 0.00 0.71 0.00 0.00 -0.03 0.00 0.00 56.01 56.69 1ixr n LEU 267 Cb 0.00 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.76 1ixr n LEU 267 CO 0.00 -0.78 0.02 0.00 -1.33 0.00 0.00 177.39 175.30 1ixr n ALA 268 N -2.84 0.00 -0.48 -1.18 0.00 -1.26 -0.58 120.51 114.18 1ixr n ALA 268 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1ixr n ALA 268 Cb 0.51 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1ixr n ALA 268 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1ixr n THR 269 N -0.09 0.00 -0.18 0.00 -1.04 -0.59 -3.55 114.28 108.83 1ixr n THR 269 Ca 0.00 1.26 -0.02 0.00 -2.04 0.00 0.00 64.05 63.25 1ixr n THR 269 Cb 0.00 -2.15 0.00 0.00 -1.82 0.00 0.00 70.33 66.36 1ixr n THR 269 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1ixr n LEU 270 N -1.45 -0.35 -0.20 -4.42 7.94 -1.16 0.18 117.00 117.54 1ixr n LEU 270 Ca 0.00 0.82 0.25 0.00 -1.11 0.00 0.00 56.01 55.97 1ixr n LEU 270 Cb 0.00 -0.17 0.64 0.00 0.53 0.00 0.00 43.42 44.42 1ixr n LEU 270 CO 0.00 -0.72 1.24 0.00 -1.11 0.00 0.00 177.39 176.81 1ixr h ALA 271 N 0.54 2.58 0.14 1.96 0.00 -0.89 0.51 119.26 124.11 1ixr h ALA 271 Ca 0.14 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.79 1ixr h ALA 271 Cb 0.26 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1ixr h ALA 271 CO -0.46 -0.86 -1.19 1.15 0.00 0.00 0.00 179.25 177.90 1ixr h THR 272 N 0.16 1.25 0.00 0.00 2.02 0.19 1.66 112.91 118.20 1ixr h THR 272 Ca 0.44 -2.49 0.00 0.00 0.77 0.00 0.00 66.41 65.13 1ixr h THR 272 Cb 1.49 2.95 0.00 0.00 -1.74 0.00 0.00 68.15 70.85 1ixr h THR 272 CO -0.08 0.73 0.00 0.00 0.37 0.00 0.00 175.52 176.54 1ixr h ALA 273 N 0.03 1.00 -0.14 6.16 0.00 -0.29 1.21 119.26 127.23 1ixr h ALA 273 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1ixr h ALA 273 Cb 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1ixr h ALA 273 CO 0.12 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.65 1ixr n LEU 274 N -2.35 3.10 -3.81 0.00 4.77 0.17 -4.96 117.00 113.91 1ixr n LEU 274 Ca 0.01 -1.14 -0.24 0.00 -0.03 0.00 0.00 56.01 54.61 1ixr n LEU 274 Cb 0.18 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.20 1ixr n LEU 274 CO 0.18 0.57 -0.15 -1.20 -1.33 0.00 0.00 177.39 175.46 1ixr n SER 275 N 1.36 -1.35 -4.19 -1.43 7.64 0.42 -4.98 113.62 111.09 1ixr n SER 275 Ca 0.16 -0.93 -0.11 0.00 1.01 0.00 0.00 58.87 58.99 1ixr n SER 275 Cb 0.59 -3.52 -0.10 0.00 -1.01 0.00 0.00 64.21 60.17 1ixr n SER 275 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1ixr s GLU 276 N -6.22 0.93 -0.70 1.43 2.56 0.57 -4.98 118.70 112.28 1ixr s GLU 276 Ca 0.07 -1.41 -0.26 0.00 0.00 0.00 0.00 54.97 53.37 1ixr s GLU 276 Cb -0.02 -0.19 -0.00 0.00 2.00 0.00 0.00 34.13 35.92 1ixr s GLU 276 CO 0.85 -0.07 1.66 -0.51 -0.56 0.00 0.00 175.26 176.63 1ixr s ASP 277 N -3.08 5.61 0.19 -1.70 1.11 -1.26 -4.13 116.67 113.40 1ixr s ASP 277 Ca 0.17 -0.11 0.03 0.00 0.18 0.00 0.00 52.55 52.81 1ixr s ASP 277 Cb 0.06 -2.54 0.50 0.00 1.07 0.00 0.00 42.92 42.00 1ixr s ASP 277 CO -0.02 -2.19 0.93 -0.81 1.18 0.00 0.00 175.17 174.26 1ixr n PRO 278 N 9.20 -0.05 -0.00 8.23 -0.04 -1.26 0.38 135.00 151.46 1ixr n PRO 278 Ca 0.18 0.88 -0.12 0.00 -0.04 0.00 0.00 63.50 64.40 1ixr n PRO 278 Cb 0.51 -1.42 -0.07 0.00 -0.04 0.00 0.00 33.50 32.47 1ixr n PRO 278 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ixr h GLY 279 N 0.00 0.08 1.76 0.55 0.00 -1.97 -2.00 103.07 101.50 1ixr h GLY 279 Ca 0.38 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.68 1ixr h GLY 279 CO -0.55 0.05 0.10 -0.84 0.00 0.00 0.00 176.54 175.30 1ixr h THR 280 N -0.12 0.48 0.00 4.70 2.02 0.67 -0.82 112.91 119.84 1ixr h THR 280 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1ixr h THR 280 Cb 0.21 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.55 1ixr h THR 280 CO -0.00 0.00 0.00 -0.11 0.37 0.00 0.00 175.52 175.78 1ixr n LEU 281 N -3.80 0.67 0.28 2.58 7.94 0.42 -0.51 117.00 124.58 1ixr n LEU 281 Ca -0.01 0.10 0.04 0.00 -1.11 0.00 0.00 56.01 55.04 1ixr n LEU 281 Cb 0.19 0.00 0.24 0.00 0.53 0.00 0.00 43.42 44.38 1ixr n LEU 281 CO 0.27 0.00 0.96 1.05 -1.11 0.00 0.00 177.39 178.56 1ixr h GLU 282 N 0.00 0.00 0.02 1.96 -0.00 -1.54 -0.74 114.58 114.29 1ixr h GLU 282 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 59.36 58.98 1ixr h GLU 282 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 28.75 28.69 1ixr h GLU 282 CO 0.00 0.00 -2.33 0.39 -0.00 0.00 0.00 179.01 177.07 1ixr n GLU 283 N -2.39 0.68 -0.05 1.06 1.02 -0.31 -4.11 120.64 116.52 1ixr n GLU 283 Ca -0.01 0.15 0.06 0.00 -0.02 0.00 0.00 57.16 57.34 1ixr n GLU 283 Cb 0.72 -1.57 0.09 0.00 -0.02 0.00 0.00 31.44 30.66 1ixr n GLU 283 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ixr n VAL 284 N -3.18 1.54 0.12 2.62 0.31 0.33 -4.71 118.33 115.36 1ixr n VAL 284 Ca -0.39 -1.75 0.00 0.00 -0.01 0.00 0.00 64.34 62.19 1ixr n VAL 284 Cb 1.04 0.06 0.00 0.00 -0.91 0.00 0.00 33.84 34.02 1ixr n VAL 284 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1ixr n HIS 285 N -1.02 -2.42 -0.52 3.52 8.25 -0.69 -4.88 115.22 117.46 1ixr n HIS 285 Ca 0.10 0.55 0.43 0.00 -0.26 0.00 0.00 57.72 58.53 1ixr n HIS 285 Cb 0.49 1.22 0.70 0.00 1.12 0.00 0.00 29.99 33.53 1ixr n HIS 285 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1ixr n GLU 286 N -3.18 -0.03 0.00 -0.41 1.02 -0.99 -3.45 120.64 113.60 1ixr n GLU 286 Ca 0.00 1.19 0.00 0.00 -0.02 0.00 0.00 57.16 58.33 1ixr n GLU 286 Cb 0.00 -2.44 0.00 0.00 -0.02 0.00 0.00 31.44 28.98 1ixr n GLU 286 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1ixr n PRO 287 N -4.48 0.00 -0.35 3.49 -0.02 -1.26 -1.90 135.00 130.48 1ixr n PRO 287 Ca 0.41 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.98 1ixr n PRO 287 Cb 1.65 -0.41 0.19 0.00 -0.02 0.00 0.00 33.50 34.92 1ixr n PRO 287 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1ixr n TYR 288 N 0.00 0.45 0.00 6.00 9.36 -1.22 -1.07 117.16 130.68 1ixr n TYR 288 Ca 0.00 1.20 0.00 0.00 3.32 0.00 0.00 57.90 62.42 1ixr n TYR 288 Cb 0.00 -1.13 0.00 0.00 -0.63 0.00 0.00 39.34 37.58 1ixr n TYR 288 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1ixr n LEU 289 N -5.57 0.00 -0.38 2.98 4.77 -1.19 -1.33 117.00 116.28 1ixr n LEU 289 Ca 0.18 0.50 -0.05 0.00 -0.03 0.00 0.00 56.01 56.62 1ixr n LEU 289 Cb 0.59 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 1ixr n LEU 289 CO -0.10 -0.05 0.51 -0.38 -1.33 0.00 0.00 177.39 176.04 1ixr n ILE 290 N -1.17 -0.56 -0.36 -0.08 5.41 -0.23 -0.90 119.36 121.47 1ixr n ILE 290 Ca 0.00 2.24 -0.03 0.00 1.00 0.00 0.00 62.75 65.96 1ixr n ILE 290 Cb 0.00 -2.88 -0.04 0.00 -0.71 0.00 0.00 39.64 36.01 1ixr n ILE 290 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 1ixr n ARG 291 N -5.30 0.73 -2.66 0.38 1.85 -0.44 -3.58 116.66 107.64 1ixr n ARG 291 Ca 0.06 -0.25 -0.04 0.00 -1.00 0.00 0.00 57.85 56.63 1ixr n ARG 291 Cb 0.32 -1.51 0.07 0.00 -1.05 0.00 0.00 32.46 30.30 1ixr n ARG 291 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 1ixr n GLN 292 N 2.27 0.05 -2.14 2.89 0.00 -0.08 -4.92 117.38 115.46 1ixr n GLN 292 Ca 0.11 -0.59 0.00 0.00 -0.00 0.00 0.00 57.00 56.52 1ixr n GLN 292 Cb 0.35 -0.05 0.00 0.00 0.00 0.00 0.00 30.24 30.54 1ixr n GLN 292 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ixr n GLY 293 N 1.63 0.00 1.44 1.69 0.00 -1.23 -4.58 105.19 104.13 1ixr n GLY 293 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1ixr n GLY 293 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ixr n LEU 294 N -0.49 0.00 -4.83 0.99 4.77 -1.25 -4.38 117.00 111.81 1ixr n LEU 294 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.61 1ixr n LEU 294 Cb 0.00 0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 1ixr n LEU 294 CO 0.00 -0.36 0.01 -0.22 -1.33 0.00 0.00 177.39 175.49 1ixr s LEU 295 N -4.16 4.41 -0.09 2.23 2.96 -1.25 -0.74 118.68 122.05 1ixr s LEU 295 Ca 0.00 0.75 -0.01 0.00 -0.22 0.00 0.00 54.13 54.65 1ixr s LEU 295 Cb 0.00 -2.40 0.03 0.00 0.50 0.00 0.00 46.19 44.31 1ixr s LEU 295 CO 0.00 0.31 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.76 1ixr s LYS 296 N -0.82 1.12 -0.33 1.98 1.02 -1.01 -3.73 119.74 117.97 1ixr s LYS 296 Ca 0.20 -0.11 -0.25 0.00 0.02 0.00 0.00 55.97 55.84 1ixr s LYS 296 Cb -0.15 -1.28 0.01 0.00 -0.52 0.00 0.00 37.83 35.89 1ixr s LYS 296 CO 0.09 -0.25 0.85 1.03 -0.92 0.00 0.00 175.35 176.16 1ixr s ARG 297 N 1.69 3.91 0.02 1.68 0.52 -1.26 -1.82 118.95 123.68 1ixr s ARG 297 Ca 0.03 0.59 0.08 0.00 -0.52 0.00 0.00 55.73 55.91 1ixr s ARG 297 Cb -0.13 -3.76 -0.02 0.00 0.52 0.00 0.00 34.95 31.56 1ixr s ARG 297 CO -0.06 -0.80 -0.24 0.99 0.02 0.00 0.00 175.30 175.21 1ixr s THR 298 N 3.19 1.96 -0.70 0.02 2.01 -0.60 -5.00 115.64 116.52 1ixr s THR 298 Ca 0.35 -1.20 0.00 0.00 0.31 0.00 0.00 61.69 61.15 1ixr s THR 298 Cb -0.13 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.72 1ixr s THR 298 CO 0.15 0.41 0.81 -2.65 -0.69 0.00 0.00 174.62 172.65 1ixr n PRO 299 N 2.09 0.00 -0.01 4.92 -0.02 -1.26 0.27 135.00 140.99 1ixr n PRO 299 Ca -0.16 0.32 0.01 0.00 -2.02 0.00 0.00 63.50 61.64 1ixr n PRO 299 Cb 0.52 -1.66 -0.12 0.00 -0.02 0.00 0.00 33.50 32.22 1ixr n PRO 299 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ixr n ARG 300 N -1.31 0.65 -0.40 -0.52 5.12 -1.26 -5.08 116.66 113.86 1ixr n ARG 300 Ca 0.00 0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.98 1ixr n ARG 300 Cb 0.16 -1.67 0.00 0.00 -1.16 0.00 0.00 32.46 29.79 1ixr n ARG 300 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ixr n GLY 301 N 1.44 0.69 3.67 -0.13 0.00 0.76 -4.34 105.19 107.28 1ixr n GLY 301 Ca -0.14 -1.87 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 1ixr n GLY 301 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ixr s ARG 302 N -1.45 0.64 0.03 1.61 1.81 -1.26 -1.55 118.95 118.78 1ixr s ARG 302 Ca 0.00 0.77 -0.28 0.00 -1.72 0.00 0.00 55.73 54.50 1ixr s ARG 302 Cb 0.00 -1.74 0.07 0.00 -0.45 0.00 0.00 34.95 32.83 1ixr s ARG 302 CO 0.00 -2.65 0.65 0.14 -0.68 0.00 0.00 175.30 172.76 1ixr s VAL 303 N -2.86 0.00 -0.24 3.52 -7.23 -0.76 -0.82 120.40 112.02 1ixr s VAL 303 Ca 0.65 0.00 -0.14 0.00 -1.81 0.00 0.00 61.98 60.68 1ixr s VAL 303 Cb -0.19 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 35.70 1ixr s VAL 303 CO 0.58 0.00 0.33 0.00 -0.31 0.00 0.00 175.10 175.70 1ixr s ALA 304 N -2.22 3.57 0.33 1.32 0.00 -0.88 -2.41 121.76 121.47 1ixr s ALA 304 Ca -0.06 -0.72 -0.28 0.00 0.00 0.00 0.00 51.96 50.90 1ixr s ALA 304 Cb -0.00 -2.59 -0.09 0.00 0.00 0.00 0.00 23.12 20.43 1ixr s ALA 304 CO 0.01 -0.41 1.17 -0.08 0.00 0.00 0.00 175.76 176.45 1ixr s THR 305 N 1.52 3.20 0.25 0.00 -1.32 0.08 -4.79 115.64 114.59 1ixr s THR 305 Ca 0.15 1.13 -0.12 0.00 -1.21 0.00 0.00 61.69 61.64 1ixr s THR 305 Cb -0.15 -3.69 0.35 0.00 -1.51 0.00 0.00 72.50 67.50 1ixr s THR 305 CO 0.08 0.22 1.57 -0.08 -2.21 0.00 0.00 174.62 174.19 1ixr h GLU 306 N 3.30 -0.01 0.00 7.08 4.81 -1.93 0.43 114.58 128.26 1ixr h GLU 306 Ca -0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1ixr h GLU 306 Cb 1.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1ixr h GLU 306 CO 0.65 -0.01 0.01 1.28 -0.73 0.00 0.00 179.01 180.21 1ixr n LEU 307 N -5.55 0.00 -0.10 1.64 4.77 -1.26 -0.99 117.00 115.51 1ixr n LEU 307 Ca 0.13 0.01 -0.17 0.00 -0.03 0.00 0.00 56.01 55.95 1ixr n LEU 307 Cb 0.44 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1ixr n LEU 307 CO -0.09 -0.01 -0.80 0.00 -1.33 0.00 0.00 177.39 175.16 1ixr n ALA 308 N -0.78 0.86 -0.07 -1.18 0.00 0.15 -3.85 120.51 115.63 1ixr n ALA 308 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1ixr n ALA 308 Cb 0.01 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.39 1ixr n ALA 308 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ixr n ARG 309 N -4.43 0.00 -0.33 0.00 0.00 -0.16 -1.06 116.66 110.69 1ixr n ARG 309 Ca -0.28 0.62 0.31 0.00 -0.00 0.00 0.00 57.85 58.49 1ixr n ARG 309 Cb 0.60 -1.47 0.66 0.00 -0.00 0.00 0.00 32.46 32.26 1ixr n ARG 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ixr h ARG 310 N 0.00 0.14 -0.38 2.89 2.47 -1.82 0.97 114.38 118.66 1ixr h ARG 310 Ca 0.00 -0.01 -0.06 0.00 -1.26 0.00 0.00 59.98 58.65 1ixr h ARG 310 Cb 0.00 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.27 1ixr h ARG 310 CO 0.00 0.09 -0.02 1.25 0.56 0.00 0.00 179.97 181.85 1ixr h HIS 311 N 0.15 0.65 0.00 3.04 2.76 -1.50 -3.52 115.15 116.73 1ixr h HIS 311 Ca 0.59 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.68 1ixr h HIS 311 Cb 2.01 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 30.79 1ixr h HIS 311 CO -0.00 0.64 0.00 1.28 -1.30 0.00 0.00 177.93 178.54