#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ai9 s LEU 1 N 0.00 4.57 0.40 3.17 1.43 -1.26 -5.05 118.68 121.93 2ai9 s LEU 1 Ca 0.00 2.14 0.04 0.00 -1.03 0.00 0.00 54.13 55.28 2ai9 s LEU 1 Cb 0.00 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.58 2ai9 s LEU 1 CO 0.00 -0.07 0.14 0.42 0.23 0.00 0.00 176.35 177.07 2ai9 s THR 2 N -0.96 0.55 0.61 5.49 -4.23 -1.26 -4.87 115.64 110.96 2ai9 s THR 2 Ca 0.44 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.25 2ai9 s THR 2 Cb -0.30 -2.37 0.36 0.00 1.34 0.00 0.00 72.50 71.53 2ai9 s THR 2 CO 0.37 0.00 2.01 0.24 -0.54 0.00 0.00 174.62 176.70 2ai9 h MET 3 N 1.84 0.00 0.00 3.99 2.86 -1.86 0.84 114.93 122.61 2ai9 h MET 3 Ca -0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 2ai9 h MET 3 Cb 1.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.93 2ai9 h MET 3 CO 0.55 0.00 0.00 1.63 1.06 0.00 0.00 176.91 180.15 2ai9 n LYS 4 N -3.57 0.15 0.00 1.72 5.02 -1.26 -2.18 118.16 118.03 2ai9 n LYS 4 Ca 0.03 0.46 0.12 0.00 -2.02 0.00 0.00 58.31 56.89 2ai9 n LYS 4 Cb 0.43 -1.82 0.11 0.00 -0.02 0.00 0.00 35.03 33.73 2ai9 n LYS 4 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2ai9 n ASP 5 N -2.10 2.25 -4.48 4.39 9.92 0.29 -4.86 116.55 121.95 2ai9 n ASP 5 Ca 0.01 -1.63 -0.43 0.00 -0.53 0.00 0.00 54.79 52.21 2ai9 n ASP 5 Cb 0.16 0.24 -0.06 0.00 -0.64 0.00 0.00 41.12 40.82 2ai9 n ASP 5 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2ai9 s ILE 6 N -2.28 4.81 0.27 0.53 1.01 -0.93 -4.27 121.20 120.35 2ai9 s ILE 6 Ca 0.24 -0.18 -0.29 0.00 0.00 0.00 0.00 60.65 60.42 2ai9 s ILE 6 Cb 0.19 -4.28 -0.09 0.00 0.01 0.00 0.00 42.46 38.29 2ai9 s ILE 6 CO 0.45 -0.75 1.22 0.27 0.00 0.00 0.00 174.94 176.13 2ai9 s ILE 7 N 2.82 3.20 0.39 2.92 -4.36 -0.37 -4.96 121.20 120.85 2ai9 s ILE 7 Ca 0.19 1.13 0.01 0.00 -0.26 0.00 0.00 60.65 61.73 2ai9 s ILE 7 Cb -0.16 -3.72 -0.02 0.00 1.25 0.00 0.00 42.46 39.81 2ai9 s ILE 7 CO 0.15 0.24 0.59 -0.13 0.24 0.00 0.00 174.94 176.04 2ai9 s ARG 8 N -1.14 3.24 0.00 0.37 1.81 -1.26 -4.61 118.95 117.36 2ai9 s ARG 8 Ca 0.49 -0.50 -0.36 0.00 -1.72 0.00 0.00 55.73 53.65 2ai9 s ARG 8 Cb -0.35 -2.64 -0.14 0.00 -0.45 0.00 0.00 34.95 31.37 2ai9 s ARG 8 CO 0.44 -0.06 1.63 -3.47 -0.68 0.00 0.00 175.30 173.16 2ai9 n ASP 9 N -1.90 2.71 0.00 0.23 2.03 0.13 -1.80 116.55 117.95 2ai9 n ASP 9 Ca -0.01 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.36 2ai9 n ASP 9 Cb 0.57 -1.30 0.00 0.00 -0.72 0.00 0.00 41.12 39.67 2ai9 n ASP 9 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ai9 n GLY 10 N 3.59 1.42 3.73 0.27 0.00 -1.26 -5.05 105.19 107.88 2ai9 n GLY 10 Ca 0.20 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2ai9 n GLY 10 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2ai9 s HIS 11 N -0.48 3.02 0.29 1.61 5.65 -0.74 -4.90 115.29 119.74 2ai9 s HIS 11 Ca 0.00 0.78 0.04 0.00 0.25 0.00 0.00 55.06 56.13 2ai9 s HIS 11 Cb 0.00 -3.90 0.68 0.00 -1.18 0.00 0.00 32.58 28.18 2ai9 s HIS 11 CO 0.00 -3.17 1.77 -1.35 -0.65 0.00 0.00 174.74 171.33 2ai9 h PRO 12 N 6.01 0.68 -0.44 2.88 0.11 -1.99 -2.60 132.00 136.66 2ai9 h PRO 12 Ca -0.44 -0.04 0.07 0.00 0.11 0.00 0.00 66.00 65.70 2ai9 h PRO 12 Cb 1.21 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2ai9 h PRO 12 CO 0.86 0.45 0.30 1.15 -0.21 0.00 0.00 178.00 180.55 2ai9 h THR 13 N 0.70 0.93 0.00 -1.15 2.02 -1.93 -1.44 112.91 112.04 2ai9 h THR 13 Ca 0.55 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.62 2ai9 h THR 13 Cb 0.85 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 2ai9 h THR 13 CO -0.39 0.05 0.00 0.18 0.37 0.00 0.00 175.52 175.74 2ai9 n LEU 14 N -4.47 0.60 -0.42 2.58 4.77 -0.98 -2.47 117.00 116.61 2ai9 n LEU 14 Ca 0.06 0.67 0.05 0.00 -0.03 0.00 0.00 56.01 56.76 2ai9 n LEU 14 Cb 0.29 -0.62 0.05 0.00 -2.33 0.00 0.00 43.42 40.82 2ai9 n LEU 14 CO 0.35 -0.62 0.43 0.54 -1.33 0.00 0.00 177.39 176.76 2ai9 n ARG 15 N -2.18 0.67 -1.97 3.23 3.00 -0.55 -4.25 116.66 114.60 2ai9 n ARG 15 Ca 0.01 -1.20 -0.29 0.00 -0.01 0.00 0.00 57.85 56.36 2ai9 n ARG 15 Cb 0.18 -1.20 0.18 0.00 0.00 0.00 0.00 32.46 31.62 2ai9 n ARG 15 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2ai9 s GLN 16 N -0.85 0.76 -0.23 5.56 -0.21 -1.03 -4.58 119.66 119.08 2ai9 s GLN 16 Ca 0.13 -0.43 -0.06 0.00 0.02 0.00 0.00 55.36 55.02 2ai9 s GLN 16 Cb 0.09 -1.88 -0.02 0.00 1.00 0.00 0.00 33.01 32.19 2ai9 s GLN 16 CO 0.13 -2.32 0.01 0.21 -2.12 0.00 0.00 175.29 171.20 2ai9 s LYS 17 N -5.83 3.55 0.57 2.91 2.20 -1.26 -2.39 119.74 119.49 2ai9 s LYS 17 Ca 0.73 -0.54 -0.20 0.00 -0.36 0.00 0.00 55.97 55.60 2ai9 s LYS 17 Cb -0.04 -3.16 -0.04 0.00 -1.51 0.00 0.00 37.83 33.08 2ai9 s LYS 17 CO 0.52 -0.15 1.28 0.00 -0.36 0.00 0.00 175.35 176.64 2ai9 s ALA 18 N 1.43 2.67 0.03 3.13 0.00 0.56 -4.97 121.76 124.62 2ai9 s ALA 18 Ca 0.05 1.16 -0.13 0.00 0.00 0.00 0.00 51.96 53.05 2ai9 s ALA 18 Cb -0.15 -3.51 -0.06 0.00 0.00 0.00 0.00 23.12 19.41 2ai9 s ALA 18 CO 0.01 -1.26 0.40 0.00 0.00 0.00 0.00 175.76 174.91 2ai9 s ALA 19 N -1.44 3.71 0.81 0.00 0.00 -0.71 -4.68 121.76 119.45 2ai9 s ALA 19 Ca 0.74 -0.28 -0.13 0.00 0.00 0.00 0.00 51.96 52.29 2ai9 s ALA 19 Cb -0.35 -2.34 0.08 0.00 0.00 0.00 0.00 23.12 20.51 2ai9 s ALA 19 CO 0.40 0.51 1.20 -1.21 0.00 0.00 0.00 175.76 176.67 2ai9 s GLU 20 N -1.42 1.63 -0.10 0.00 2.02 -1.26 -1.70 118.70 117.87 2ai9 s GLU 20 Ca 0.27 1.74 -0.06 0.00 0.02 0.00 0.00 54.97 56.95 2ai9 s GLU 20 Cb -0.15 -1.78 -0.04 0.00 0.10 0.00 0.00 34.13 32.26 2ai9 s GLU 20 CO 0.15 -2.22 0.15 -0.51 0.02 0.00 0.00 175.26 172.85 2ai9 s LEU 21 N -5.73 4.38 -0.05 1.80 1.02 -1.26 -4.82 118.68 114.01 2ai9 s LEU 21 Ca 0.73 0.44 -0.24 0.00 0.02 0.00 0.00 54.13 55.08 2ai9 s LEU 21 Cb -0.28 -2.17 -0.04 0.00 0.02 0.00 0.00 46.19 43.72 2ai9 s LEU 21 CO 0.51 0.38 0.71 -1.61 0.02 0.00 0.00 176.35 176.36 2ai9 s GLU 22 N -1.20 4.44 0.01 1.70 0.41 -1.26 -4.97 118.70 117.82 2ai9 s GLU 22 Ca 0.17 0.90 -0.13 0.00 -0.41 0.00 0.00 54.97 55.50 2ai9 s GLU 22 Cb -0.12 -3.44 -0.06 0.00 -1.78 0.00 0.00 34.13 28.74 2ai9 s GLU 22 CO 0.07 0.09 0.39 -0.51 -0.49 0.00 0.00 175.26 174.81 2ai9 s LEU 23 N 0.70 4.44 0.56 1.80 2.01 -1.26 -3.46 118.68 123.48 2ai9 s LEU 23 Ca 0.38 0.90 -0.16 0.00 0.01 0.00 0.00 54.13 55.26 2ai9 s LEU 23 Cb -0.18 -2.64 -0.06 0.00 0.01 0.00 0.00 46.19 43.32 2ai9 s LEU 23 CO 0.19 0.30 1.02 -2.16 1.01 0.00 0.00 176.35 176.71 2ai9 s PRO 24 N -1.26 3.63 1.08 1.29 0.04 -1.26 -5.15 135.00 133.38 2ai9 s PRO 24 Ca 0.25 1.06 -0.13 0.00 0.04 0.00 0.00 61.00 62.22 2ai9 s PRO 24 Cb -0.16 -2.08 0.23 0.00 0.04 0.00 0.00 34.50 32.53 2ai9 s PRO 24 CO 0.14 -0.55 1.07 -0.51 0.04 0.00 0.00 177.00 177.19 2ai9 s LEU 25 N -4.34 1.19 0.32 -3.56 1.43 -1.22 -5.03 118.68 107.47 2ai9 s LEU 25 Ca 0.61 1.24 0.02 0.00 -1.03 0.00 0.00 54.13 54.96 2ai9 s LEU 25 Cb -0.13 -3.28 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 2ai9 s LEU 25 CO 0.35 -3.61 0.50 0.42 0.23 0.00 0.00 176.35 174.24 2ai9 s THR 26 N -2.79 5.11 0.24 5.49 -4.23 -1.26 -4.93 115.64 113.26 2ai9 s THR 26 Ca 0.67 -0.60 -0.07 0.00 -1.18 0.00 0.00 61.69 60.50 2ai9 s THR 26 Cb -0.20 -3.85 0.26 0.00 1.34 0.00 0.00 72.50 70.05 2ai9 s THR 26 CO 0.60 -0.49 1.64 0.50 -0.54 0.00 0.00 174.62 176.33 2ai9 h LYS 27 N 0.85 0.12 -0.84 3.99 1.63 -2.00 -0.65 116.57 119.66 2ai9 h LYS 27 Ca -0.50 -0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.28 2ai9 h LYS 27 Cb 1.22 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.79 2ai9 h LYS 27 CO 0.61 0.08 0.47 1.49 -3.45 0.00 0.00 179.45 178.65 2ai9 h GLU 28 N 0.12 1.17 -0.54 1.90 4.81 -1.99 -1.84 114.58 118.21 2ai9 h GLU 28 Ca 0.40 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 2ai9 h GLU 28 Cb 0.70 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 2ai9 h GLU 28 CO -0.63 0.85 0.08 0.93 -0.73 0.00 0.00 179.01 179.51 2ai9 h GLU 29 N 1.17 0.85 -0.40 1.92 5.08 -1.53 -1.14 114.58 120.54 2ai9 h GLU 29 Ca 0.30 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.39 2ai9 h GLU 29 Cb 0.01 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2ai9 h GLU 29 CO -0.05 0.80 -0.02 0.87 -1.00 0.00 0.00 179.01 179.61 2ai9 h LYS 30 N 0.81 0.72 -0.83 2.33 1.57 -0.98 -1.77 116.57 118.43 2ai9 h LYS 30 Ca 0.17 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2ai9 h LYS 30 Cb 0.37 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 2ai9 h LYS 30 CO 0.01 0.82 0.46 0.93 -0.57 0.00 0.00 179.45 181.10 2ai9 h GLU 31 N 0.55 1.14 -0.18 3.15 5.08 -1.06 0.58 114.58 123.84 2ai9 h GLU 31 Ca 0.11 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2ai9 h GLU 31 Cb 0.51 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2ai9 h GLU 31 CO 0.02 0.83 0.05 1.15 -1.00 0.00 0.00 179.01 180.06 2ai9 h THR 32 N 1.15 1.20 -0.56 1.13 2.02 -0.98 0.15 112.91 117.03 2ai9 h THR 32 Ca 0.29 -0.63 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 2ai9 h THR 32 Cb 0.01 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2ai9 h THR 32 CO -0.05 0.19 0.05 0.25 0.37 0.00 0.00 175.52 176.33 2ai9 h LEU 33 N 0.10 0.93 -0.92 2.58 5.85 -1.02 0.38 115.31 123.21 2ai9 h LEU 33 Ca 0.06 -0.28 -0.06 0.00 0.84 0.00 0.00 57.88 58.43 2ai9 h LEU 33 Cb 0.26 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2ai9 h LEU 33 CO -0.00 0.98 0.10 0.40 -0.34 0.00 0.00 178.44 179.58 2ai9 h ILE 34 N 0.84 1.24 -0.43 4.05 2.04 -0.79 -0.53 117.51 123.93 2ai9 h ILE 34 Ca 0.16 -0.91 -0.05 0.00 1.00 0.00 0.00 64.86 65.06 2ai9 h ILE 34 Cb 0.47 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.24 2ai9 h ILE 34 CO 0.02 0.34 0.06 0.00 0.00 0.00 0.00 178.15 178.57 2ai9 h ALA 35 N 1.26 0.57 -0.44 1.87 0.00 -0.12 0.10 119.26 122.51 2ai9 h ALA 35 Ca 0.18 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2ai9 h ALA 35 Cb 0.36 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2ai9 h ALA 35 CO 0.01 0.30 0.18 0.52 0.00 0.00 0.00 179.25 180.25 2ai9 h MET 36 N 0.57 0.35 -0.30 0.00 2.86 0.28 0.11 114.93 118.80 2ai9 h MET 36 Ca 0.13 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 2ai9 h MET 36 Cb 0.39 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.95 2ai9 h MET 36 CO 0.01 0.23 0.14 -0.09 1.06 0.00 0.00 176.91 178.27 2ai9 h ARG 37 N 0.36 0.44 -0.34 1.72 2.43 -0.80 -2.51 114.38 115.69 2ai9 h ARG 37 Ca 0.20 -0.07 0.10 0.00 -0.81 0.00 0.00 59.98 59.40 2ai9 h ARG 37 Cb 0.16 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2ai9 h ARG 37 CO -0.18 0.42 0.24 1.49 -1.51 0.00 0.00 179.97 180.43 2ai9 h GLU 38 N 0.36 0.00 -0.10 0.20 4.57 0.10 -1.72 114.58 117.99 2ai9 h GLU 38 Ca 0.10 -0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.27 2ai9 h GLU 38 Cb 0.12 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.71 2ai9 h GLU 38 CO -0.01 0.00 -0.00 0.35 -1.18 0.00 0.00 179.01 178.16 2ai9 h PHE 39 N 0.00 0.19 -0.91 0.92 3.57 -0.35 -2.34 116.94 118.01 2ai9 h PHE 39 Ca 0.16 -0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.71 2ai9 h PHE 39 Cb 0.64 -0.05 -0.07 0.00 2.79 0.00 0.00 35.95 39.27 2ai9 h PHE 39 CO -0.00 0.44 0.59 -0.07 -2.23 0.00 0.00 178.31 177.04 2ai9 h LEU 40 N -0.11 0.86 0.75 0.59 3.38 -1.21 0.11 115.31 119.68 2ai9 h LEU 40 Ca 0.03 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2ai9 h LEU 40 Cb 0.36 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.96 2ai9 h LEU 40 CO 0.01 0.52 -0.36 0.58 0.09 0.00 0.00 178.44 179.27 2ai9 h VAL 41 N 0.96 0.00 -0.97 1.22 2.07 -1.38 -1.78 116.25 116.37 2ai9 h VAL 41 Ca 0.42 -0.10 0.23 0.00 0.82 0.00 0.00 66.70 68.07 2ai9 h VAL 41 Cb 0.34 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.04 2ai9 h VAL 41 CO -0.18 0.00 0.64 0.78 0.02 0.00 0.00 177.57 178.83 2ai9 h ASN 42 N -1.11 0.41 0.75 0.57 2.35 -0.99 0.43 115.58 117.99 2ai9 h ASN 42 Ca -0.10 0.06 -0.09 0.00 -0.55 0.00 0.00 56.30 55.61 2ai9 h ASN 42 Cb 0.77 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 2ai9 h ASN 42 CO 0.17 0.13 -0.44 0.77 -1.65 0.00 0.00 177.43 176.41 2ai9 h SER 43 N 0.39 0.00 0.46 5.81 4.64 -0.61 -2.85 113.55 121.38 2ai9 h SER 43 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 2ai9 h SER 43 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2ai9 h SER 43 CO -0.22 0.44 -0.33 0.00 -0.87 0.00 0.00 176.83 175.85 2ai9 n GLN 44 N -3.64 0.32 -2.69 4.77 6.02 0.14 -3.95 117.38 118.36 2ai9 n GLN 44 Ca -0.01 -0.17 -0.42 0.00 -0.01 0.00 0.00 57.00 56.40 2ai9 n GLN 44 Cb 0.53 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.26 2ai9 n GLN 44 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2ai9 s ASP 45 N -2.79 6.53 0.18 1.08 2.15 -0.58 -4.86 116.67 118.37 2ai9 s ASP 45 Ca 0.17 -1.61 0.12 0.00 0.43 0.00 0.00 52.55 51.66 2ai9 s ASP 45 Cb 0.18 -2.51 0.62 0.00 -0.30 0.00 0.00 42.92 40.91 2ai9 s ASP 45 CO 0.60 -1.37 0.67 -0.62 -0.17 0.00 0.00 175.17 174.28 2ai9 n GLU 46 N 8.11 -0.02 0.00 4.34 1.02 -1.26 -1.40 120.64 131.42 2ai9 n GLU 46 Ca 0.29 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.98 2ai9 n GLU 46 Cb 0.50 -1.06 0.00 0.00 -0.02 0.00 0.00 31.44 30.86 2ai9 n GLU 46 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2ai9 n GLU 47 N -3.68 0.00 -0.36 3.49 4.07 -1.26 -3.83 120.64 119.07 2ai9 n GLU 47 Ca 0.17 0.20 0.37 0.00 -0.06 0.00 0.00 57.16 57.84 2ai9 n GLU 47 Cb 0.63 -0.82 0.74 0.00 -0.06 0.00 0.00 31.44 31.92 2ai9 n GLU 47 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 2ai9 h ILE 48 N 0.00 0.28 -0.34 6.31 2.04 -1.51 0.47 117.51 124.75 2ai9 h ILE 48 Ca 0.00 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 2ai9 h ILE 48 Cb 0.00 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 2ai9 h ILE 48 CO 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 178.15 178.06 2ai9 h ALA 49 N 1.25 1.20 -0.37 1.87 0.00 -1.24 -2.93 119.26 119.04 2ai9 h ALA 49 Ca 0.60 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 55.15 2ai9 h ALA 49 Cb 2.55 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 20.18 2ai9 h ALA 49 CO -0.01 0.52 -0.14 0.87 0.00 0.00 0.00 179.25 180.49 2ai9 h LYS 50 N 0.54 0.74 -0.23 0.00 1.57 -0.16 0.10 116.57 119.13 2ai9 h LYS 50 Ca 0.10 -0.31 -0.09 0.00 -1.87 0.00 0.00 60.65 58.48 2ai9 h LYS 50 Cb 0.49 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 2ai9 h LYS 50 CO 0.03 0.92 -0.24 0.00 -0.57 0.00 0.00 179.45 179.59 2ai9 h ARG 51 N 0.53 0.44 -0.43 3.15 3.08 -1.53 -3.16 114.38 116.47 2ai9 h ARG 51 Ca 0.09 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2ai9 h ARG 51 Cb 0.68 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.69 2ai9 h ARG 51 CO 0.05 0.65 0.00 0.66 -1.07 0.00 0.00 179.97 180.25 2ai9 n TYR 52 N -4.14 0.80 -3.86 3.04 4.02 -1.11 -4.98 117.16 110.93 2ai9 n TYR 52 Ca -0.00 -0.60 -0.28 0.00 -0.01 0.00 0.00 57.90 57.01 2ai9 n TYR 52 Cb 0.39 -0.12 0.03 0.00 -0.02 0.00 0.00 39.34 39.61 2ai9 n TYR 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ai9 n GLY 53 N 0.54 -0.46 3.74 2.72 0.00 -0.18 -4.64 105.19 106.91 2ai9 n GLY 53 Ca 0.18 0.18 -0.39 0.00 0.00 0.00 0.00 46.02 45.99 2ai9 n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ai9 s LEU 54 N -7.17 4.39 -0.10 0.99 1.02 0.19 -4.76 118.68 113.24 2ai9 s LEU 54 Ca 0.52 1.23 -0.22 0.00 0.02 0.00 0.00 54.13 55.69 2ai9 s LEU 54 Cb -0.26 -3.04 -0.04 0.00 0.02 0.00 0.00 46.19 42.88 2ai9 s LEU 54 CO 0.82 0.01 0.64 -0.13 0.02 0.00 0.00 176.35 177.71 2ai9 s ARG 55 N 0.16 4.37 0.32 1.70 0.52 -1.26 -4.76 118.95 120.00 2ai9 s ARG 55 Ca 0.35 0.73 -0.29 0.00 -0.52 0.00 0.00 55.73 56.00 2ai9 s ARG 55 Cb -0.19 -3.47 -0.12 0.00 0.52 0.00 0.00 34.95 31.70 2ai9 s ARG 55 CO 0.19 0.03 1.41 0.45 0.02 0.00 0.00 175.30 177.39 2ai9 n SER 56 N 4.00 3.18 -3.66 0.23 2.88 -1.25 -4.87 113.62 114.13 2ai9 n SER 56 Ca -0.03 1.19 -0.12 0.00 -1.33 0.00 0.00 58.87 58.58 2ai9 n SER 56 Cb 0.51 -1.52 -0.06 0.00 -0.75 0.00 0.00 64.21 62.39 2ai9 n SER 56 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ai9 s GLY 57 N -0.01 -0.27 0.00 0.46 0.00 -1.26 -5.02 107.32 101.21 2ai9 s GLY 57 Ca 0.59 0.20 0.07 0.00 0.00 0.00 0.00 44.72 45.58 2ai9 s GLY 57 CO 0.58 -0.05 0.67 3.33 0.00 0.00 0.00 173.10 177.62 2ai9 n VAL 58 N 0.30 0.00 -3.72 1.40 0.24 -1.26 -4.75 118.33 110.54 2ai9 n VAL 58 Ca -0.18 -0.48 -0.14 0.00 -2.04 0.00 0.00 64.34 61.50 2ai9 n VAL 58 Cb 0.61 1.13 -0.08 0.00 -1.47 0.00 0.00 33.84 34.02 2ai9 n VAL 58 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2ai9 s GLY 59 N -0.70 -0.24 -0.18 7.63 0.00 -1.26 -0.02 107.32 112.54 2ai9 s GLY 59 Ca 0.07 0.59 -0.09 0.00 0.00 0.00 0.00 44.72 45.29 2ai9 s GLY 59 CO 0.11 0.37 0.43 -2.27 0.00 0.00 0.00 173.10 171.74 2ai9 s LEU 60 N -1.11 -0.23 -0.03 0.66 2.96 -0.69 -4.98 118.68 115.27 2ai9 s LEU 60 Ca -0.11 0.96 -0.01 0.00 -0.22 0.00 0.00 54.13 54.74 2ai9 s LEU 60 Cb -0.04 1.43 -0.04 0.00 0.50 0.00 0.00 46.19 48.05 2ai9 s LEU 60 CO 0.05 -0.20 0.07 0.00 -1.32 0.00 0.00 176.35 174.95 2ai9 s ALA 61 N 1.56 3.55 0.26 5.97 0.00 -1.26 -1.65 121.76 130.20 2ai9 s ALA 61 Ca -0.09 -0.84 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 2ai9 s ALA 61 Cb -0.09 -1.59 0.55 0.00 0.00 0.00 0.00 23.12 22.00 2ai9 s ALA 61 CO -0.13 0.67 1.73 0.00 0.00 0.00 0.00 175.76 178.03 2ai9 h ALA 62 N 4.36 1.24 -0.32 0.00 0.00 -1.54 0.86 119.26 123.85 2ai9 h ALA 62 Ca -0.50 0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.62 2ai9 h ALA 62 Cb 1.19 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2ai9 h ALA 62 CO 0.60 -0.19 0.45 -1.35 0.00 0.00 0.00 179.25 178.76 2ai9 h PRO 63 N 0.50 0.00 0.00 0.00 0.11 -1.58 0.11 132.00 131.14 2ai9 h PRO 63 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 2ai9 h PRO 63 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 2ai9 h PRO 63 CO -0.42 0.00 0.00 1.96 -0.21 0.00 0.00 178.00 179.33 2ai9 h GLN 64 N 0.00 0.00 -0.47 1.05 4.20 -1.11 -1.98 115.11 116.80 2ai9 h GLN 64 Ca 0.15 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.57 2ai9 h GLN 64 Cb 1.06 0.00 -0.19 0.00 0.30 0.00 0.00 27.48 28.65 2ai9 h GLN 64 CO -0.00 0.00 -0.18 0.44 -0.67 0.00 0.00 178.83 178.42 2ai9 n ILE 65 N -2.73 2.63 -3.31 2.54 -5.35 0.35 -1.23 119.36 112.26 2ai9 n ILE 65 Ca 0.02 -3.13 -0.24 0.00 -0.27 0.00 0.00 62.75 59.13 2ai9 n ILE 65 Cb 0.31 -0.57 0.04 0.00 -1.74 0.00 0.00 39.64 37.68 2ai9 n ILE 65 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 2ai9 n ASN 66 N -1.02 -5.89 -3.95 7.28 4.05 -0.75 -4.95 115.26 110.04 2ai9 n ASN 66 Ca 0.37 -0.42 -0.31 0.00 0.45 0.00 0.00 54.58 54.68 2ai9 n ASN 66 Cb 0.96 -4.72 -0.15 0.00 1.23 0.00 0.00 39.78 37.10 2ai9 n ASN 66 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2ai9 s ILE 67 N -3.21 1.87 -1.00 -1.44 1.01 -0.99 -4.99 121.20 112.45 2ai9 s ILE 67 Ca 0.43 -1.96 -0.15 0.00 0.00 0.00 0.00 60.65 58.97 2ai9 s ILE 67 Cb -0.20 -2.33 -0.09 0.00 0.01 0.00 0.00 42.46 39.85 2ai9 s ILE 67 CO 0.53 -0.53 2.12 -0.24 0.00 0.00 0.00 174.94 176.82 2ai9 n SER 68 N 4.44 4.01 -4.16 3.58 2.88 -1.26 -1.91 113.62 121.20 2ai9 n SER 68 Ca -0.00 -2.58 -0.17 0.00 -1.33 0.00 0.00 58.87 54.79 2ai9 n SER 68 Cb 0.42 -1.23 -0.12 0.00 -0.75 0.00 0.00 64.21 62.54 2ai9 n SER 68 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2ai9 s LYS 69 N 3.98 0.81 -1.36 -1.46 1.02 -1.26 -1.74 119.74 119.72 2ai9 s LYS 69 Ca 0.51 -1.00 -0.13 0.00 0.02 0.00 0.00 55.97 55.37 2ai9 s LYS 69 Cb 0.13 -0.70 0.10 0.00 -0.52 0.00 0.00 37.83 36.84 2ai9 s LYS 69 CO 0.02 0.14 1.97 0.54 -0.92 0.00 0.00 175.35 177.10 2ai9 n ARG 70 N 1.07 3.19 -4.33 1.68 1.74 -0.69 -4.38 116.66 114.94 2ai9 n ARG 70 Ca -0.20 -3.11 -0.18 0.00 -0.77 0.00 0.00 57.85 53.59 2ai9 n ARG 70 Cb 0.55 -3.19 -0.14 0.00 -1.02 0.00 0.00 32.46 28.66 2ai9 n ARG 70 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2ai9 s MET 71 N 2.37 0.78 0.04 5.56 -1.94 -1.26 -0.54 119.30 124.32 2ai9 s MET 71 Ca 0.46 -0.52 -0.04 0.00 -1.71 0.00 0.00 55.69 53.87 2ai9 s MET 71 Cb 0.09 -0.75 -0.02 0.00 2.01 0.00 0.00 34.83 36.17 2ai9 s MET 71 CO -0.02 0.19 0.06 0.96 -0.01 0.00 0.00 175.02 176.20 2ai9 s ILE 72 N -0.57 0.14 -0.06 2.53 -4.36 -0.59 -1.68 121.20 116.61 2ai9 s ILE 72 Ca 0.01 -1.17 0.03 0.00 -0.26 0.00 0.00 60.65 59.26 2ai9 s ILE 72 Cb -0.06 -0.90 0.01 0.00 1.25 0.00 0.00 42.46 42.76 2ai9 s ILE 72 CO 0.00 -0.65 -0.14 0.00 0.24 0.00 0.00 174.94 174.40 2ai9 s ALA 73 N -2.65 1.33 -0.06 2.27 0.00 -0.66 -0.79 121.76 121.20 2ai9 s ALA 73 Ca -0.05 -0.49 0.03 0.00 0.00 0.00 0.00 51.96 51.46 2ai9 s ALA 73 Cb -0.01 -0.55 0.01 0.00 0.00 0.00 0.00 23.12 22.56 2ai9 s ALA 73 CO -0.05 0.15 -0.14 0.08 0.00 0.00 0.00 175.76 175.80 2ai9 s VAL 74 N 0.51 1.28 -0.34 0.00 1.01 0.12 -1.70 120.40 121.28 2ai9 s VAL 74 Ca -0.12 -0.58 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 2ai9 s VAL 74 Cb -0.15 -1.14 0.14 0.00 0.00 0.00 0.00 36.38 35.23 2ai9 s VAL 74 CO 0.04 0.38 0.21 -0.22 0.00 0.00 0.00 175.10 175.51 2ai9 s LEU 75 N 0.45 0.87 -0.27 3.92 2.96 0.98 -0.60 118.68 126.99 2ai9 s LEU 75 Ca -0.12 -2.05 -0.09 0.00 -0.22 0.00 0.00 54.13 51.64 2ai9 s LEU 75 Cb -0.15 -0.34 -0.04 0.00 0.50 0.00 0.00 46.19 46.16 2ai9 s LEU 75 CO 0.04 -0.32 0.14 -0.63 -1.32 0.00 0.00 176.35 174.26 2ai9 s ILE 76 N 1.21 4.87 0.60 6.68 1.01 0.94 -4.47 121.20 132.05 2ai9 s ILE 76 Ca 0.17 -0.00 -0.17 0.00 0.00 0.00 0.00 60.65 60.65 2ai9 s ILE 76 Cb -0.22 -3.32 -0.03 0.00 0.01 0.00 0.00 42.46 38.91 2ai9 s ILE 76 CO -0.03 0.27 1.13 -2.84 0.00 0.00 0.00 174.94 173.47 2ai9 s PRO 77 N 1.69 3.03 -0.49 2.79 0.02 -1.26 -1.52 135.00 139.26 2ai9 s PRO 77 Ca 0.07 1.55 -0.26 0.00 0.02 0.00 0.00 61.00 62.38 2ai9 s PRO 77 Cb -0.16 -1.97 -0.07 0.00 0.02 0.00 0.00 34.50 32.32 2ai9 s PRO 77 CO 0.08 -1.10 2.42 -3.47 -0.33 0.00 0.00 177.00 174.60 2ai9 n ASP 78 N -1.85 2.30 0.00 2.53 4.64 -1.26 -4.76 116.55 118.14 2ai9 n ASP 78 Ca 0.11 -0.49 0.00 0.00 -1.38 0.00 0.00 54.79 53.04 2ai9 n ASP 78 Cb 0.51 -1.58 0.03 0.00 -1.04 0.00 0.00 41.12 39.04 2ai9 n ASP 78 CO 0.00 0.00 0.00 -0.90 -0.82 0.00 0.00 177.20 175.48 2ai9 n ASP 79 N 15.82 0.00 0.00 1.67 5.68 -1.26 -4.65 116.55 133.81 2ai9 n ASP 79 Ca 0.37 -0.14 0.00 0.00 -0.50 0.00 0.00 54.79 54.52 2ai9 n ASP 79 Cb 0.54 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 2ai9 n ASP 79 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ai9 n GLY 80 N -0.55 1.55 0.00 6.12 0.00 -1.26 -5.05 105.19 106.00 2ai9 n GLY 80 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 2ai9 n GLY 80 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2ai9 n SER 81 N 0.05 0.00 -0.07 1.61 2.88 -1.26 -4.97 113.62 111.85 2ai9 n SER 81 Ca 0.00 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 2ai9 n SER 81 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2ai9 n SER 81 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ai9 n GLY 82 N 1.91 -0.54 3.73 0.46 0.00 -1.26 -5.00 105.19 104.49 2ai9 n GLY 82 Ca 0.00 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 2ai9 n GLY 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ai9 s LYS 83 N -2.34 4.20 -0.10 1.61 1.02 -1.26 -4.98 119.74 117.90 2ai9 s LYS 83 Ca -0.12 2.41 -0.08 0.00 0.02 0.00 0.00 55.97 58.19 2ai9 s LYS 83 Cb 0.05 -3.12 0.03 0.00 -0.52 0.00 0.00 37.83 34.26 2ai9 s LYS 83 CO 0.51 -0.60 0.25 0.45 -0.92 0.00 0.00 175.35 175.04 2ai9 s SER 84 N 0.97 -0.26 -0.14 2.83 0.15 -1.26 -3.98 113.70 112.01 2ai9 s SER 84 Ca 0.68 0.51 0.01 0.00 0.70 0.00 0.00 55.95 57.85 2ai9 s SER 84 Cb -0.45 0.50 0.02 0.00 -1.71 0.00 0.00 66.02 64.38 2ai9 s SER 84 CO 0.35 -0.10 -0.15 -0.31 1.20 0.00 0.00 173.24 174.23 2ai9 s TYR 85 N 0.28 2.16 -0.38 3.44 1.51 -0.57 -5.00 117.35 118.78 2ai9 s TYR 85 Ca -0.01 -1.15 0.01 0.00 -1.01 0.00 0.00 57.07 54.91 2ai9 s TYR 85 Cb -0.03 -1.56 0.13 0.00 -0.11 0.00 0.00 41.96 40.38 2ai9 s TYR 85 CO -0.01 -0.61 0.19 0.34 -1.11 0.00 0.00 175.55 174.36 2ai9 s ASP 86 N 1.27 3.54 0.01 2.29 -1.08 -1.26 -0.04 116.67 121.41 2ai9 s ASP 86 Ca 0.00 -2.22 0.03 0.00 -0.52 0.00 0.00 52.55 49.84 2ai9 s ASP 86 Cb -0.14 -0.79 -0.01 0.00 -1.46 0.00 0.00 42.92 40.52 2ai9 s ASP 86 CO -0.07 -0.32 -0.09 -0.31 0.52 0.00 0.00 175.17 174.90 2ai9 s TYR 87 N 0.91 0.77 -0.23 -5.34 1.51 0.23 -4.99 117.35 110.20 2ai9 s TYR 87 Ca 0.16 -0.23 0.02 0.00 -1.01 0.00 0.00 57.07 56.01 2ai9 s TYR 87 Cb -0.22 -0.48 0.05 0.00 -0.11 0.00 0.00 41.96 41.20 2ai9 s TYR 87 CO -0.07 -0.02 -0.14 -1.64 -1.11 0.00 0.00 175.55 172.58 2ai9 s MET 88 N -0.58 2.47 -0.05 -0.62 -1.94 -1.26 0.14 119.30 117.46 2ai9 s MET 88 Ca 0.01 -1.16 0.05 0.00 -1.71 0.00 0.00 55.69 52.88 2ai9 s MET 88 Cb -0.05 -2.77 -0.02 0.00 2.01 0.00 0.00 34.83 34.01 2ai9 s MET 88 CO 0.00 -0.45 -0.21 -0.51 -0.01 0.00 0.00 175.02 173.84 2ai9 s LEU 89 N 1.18 2.34 -0.18 -0.03 1.43 0.03 -4.27 118.68 119.17 2ai9 s LEU 89 Ca -0.04 -0.38 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 2ai9 s LEU 89 Cb -0.18 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 44.57 2ai9 s LEU 89 CO -0.08 0.29 -0.02 -0.69 0.23 0.00 0.00 176.35 176.09 2ai9 s VAL 90 N -0.42 3.94 -1.32 -1.59 1.01 -0.34 -1.55 120.40 120.14 2ai9 s VAL 90 Ca 0.04 -0.33 -0.02 0.00 0.00 0.00 0.00 61.98 61.67 2ai9 s VAL 90 Cb -0.12 -2.76 0.01 0.00 0.00 0.00 0.00 36.38 33.52 2ai9 s VAL 90 CO 0.02 0.46 0.81 0.59 0.00 0.00 0.00 175.10 176.98 2ai9 n ASN 91 N 3.92 -2.02 -4.76 3.32 3.02 0.30 -2.14 115.26 116.90 2ai9 n ASN 91 Ca -0.17 -0.76 -0.39 0.00 -0.03 0.00 0.00 54.58 53.22 2ai9 n ASN 91 Cb 0.52 -4.29 0.01 0.00 -0.61 0.00 0.00 39.78 35.40 2ai9 n ASN 91 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2ai9 s PRO 92 N -5.95 3.77 -0.08 3.52 0.04 -1.26 -4.58 135.00 130.45 2ai9 s PRO 92 Ca 0.11 2.16 -0.04 0.00 0.04 0.00 0.00 61.00 63.27 2ai9 s PRO 92 Cb -0.05 -2.62 0.04 0.00 0.04 0.00 0.00 34.50 31.90 2ai9 s PRO 92 CO 0.79 -0.66 0.19 0.21 0.04 0.00 0.00 177.00 177.58 2ai9 s LYS 93 N -2.43 0.16 -0.36 4.56 2.20 -0.13 -4.98 119.74 118.75 2ai9 s LYS 93 Ca 0.60 0.43 -0.25 0.00 -0.36 0.00 0.00 55.97 56.39 2ai9 s LYS 93 Cb -0.38 -0.12 0.01 0.00 -1.51 0.00 0.00 37.83 35.83 2ai9 s LYS 93 CO 0.48 -0.15 0.88 0.42 -0.36 0.00 0.00 175.35 176.62 2ai9 s ILE 94 N 1.08 4.64 -0.10 5.43 1.01 -1.26 -0.05 121.20 131.95 2ai9 s ILE 94 Ca -0.08 1.11 0.21 0.00 0.00 0.00 0.00 60.65 61.88 2ai9 s ILE 94 Cb -0.10 -4.29 -0.25 0.00 0.01 0.00 0.00 42.46 37.84 2ai9 s ILE 94 CO -0.06 -0.49 0.55 1.33 0.00 0.00 0.00 174.94 176.27 2ai9 n VAL 95 N 5.89 0.42 -3.60 2.92 0.24 -0.05 -4.98 118.33 119.17 2ai9 n VAL 95 Ca 0.06 -0.58 -0.15 0.00 -2.04 0.00 0.00 64.34 61.63 2ai9 n VAL 95 Cb 0.48 -0.19 -0.07 0.00 -1.47 0.00 0.00 33.84 32.59 2ai9 n VAL 95 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2ai9 s SER 96 N -4.92 -0.65 0.19 -1.34 1.04 -1.20 -5.02 113.70 101.79 2ai9 s SER 96 Ca -0.06 1.03 -0.09 0.00 0.48 0.00 0.00 55.95 57.30 2ai9 s SER 96 Cb 0.12 0.98 -0.01 0.00 0.10 0.00 0.00 66.02 67.21 2ai9 s SER 96 CO 0.87 -0.39 0.32 -1.38 0.98 0.00 0.00 173.24 173.64 2ai9 s HIS 97 N -0.35 0.45 0.62 5.02 -0.00 -1.26 -0.03 115.29 119.75 2ai9 s HIS 97 Ca -0.05 -0.80 -0.11 0.00 -0.00 0.00 0.00 55.06 54.10 2ai9 s HIS 97 Cb -0.03 -0.04 -0.04 0.00 -0.00 0.00 0.00 32.58 32.48 2ai9 s HIS 97 CO 0.05 -0.78 1.02 -1.54 -0.00 0.00 0.00 174.74 173.49 2ai9 s SER 98 N -3.00 6.16 0.00 7.38 1.04 0.73 -4.97 113.70 121.05 2ai9 s SER 98 Ca 0.20 1.37 0.04 0.00 0.48 0.00 0.00 55.95 58.05 2ai9 s SER 98 Cb 0.03 -2.41 -0.24 0.00 0.10 0.00 0.00 66.02 63.49 2ai9 s SER 98 CO 0.03 -0.90 0.85 0.58 0.98 0.00 0.00 173.24 174.79 2ai9 h VAL 99 N -0.32 1.13 -2.88 5.02 2.07 -2.00 -3.44 116.25 115.82 2ai9 h VAL 99 Ca -0.44 -2.87 -0.53 0.00 0.82 0.00 0.00 66.70 63.68 2ai9 h VAL 99 Cb 1.20 2.64 0.04 0.00 -1.52 0.00 0.00 31.29 33.65 2ai9 h VAL 99 CO 0.62 0.74 0.84 -1.58 0.02 0.00 0.00 177.57 178.21 2ai9 s GLN 100 N -2.63 4.24 0.31 1.57 0.74 -1.26 -4.95 119.66 117.68 2ai9 s GLN 100 Ca -0.06 2.29 -0.00 0.00 0.05 0.00 0.00 55.36 57.63 2ai9 s GLN 100 Cb 0.08 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.98 2ai9 s GLN 100 CO 0.83 -0.56 0.51 -1.21 -0.55 0.00 0.00 175.29 174.31 2ai9 s GLU 101 N 1.08 3.51 0.21 1.67 2.02 -1.25 -1.60 118.70 124.35 2ai9 s GLU 101 Ca 0.68 -0.31 0.01 0.00 0.02 0.00 0.00 54.97 55.37 2ai9 s GLU 101 Cb -0.42 -2.70 -0.05 0.00 0.10 0.00 0.00 34.13 31.06 2ai9 s GLU 101 CO 0.31 0.21 0.08 0.00 0.02 0.00 0.00 175.26 175.88 2ai9 s ALA 102 N -2.19 1.41 -0.20 5.21 0.00 0.61 -1.15 121.76 125.44 2ai9 s ALA 102 Ca 0.40 -1.72 -0.30 0.00 0.00 0.00 0.00 51.96 50.34 2ai9 s ALA 102 Cb -0.10 0.99 0.15 0.00 0.00 0.00 0.00 23.12 24.15 2ai9 s ALA 102 CO 0.34 -0.46 1.14 1.52 0.00 0.00 0.00 175.76 178.30 2ai9 s TYR 103 N -3.86 -0.23 0.16 0.00 -0.85 -1.08 -1.15 117.35 110.35 2ai9 s TYR 103 Ca 0.33 0.35 -0.22 0.00 -0.52 0.00 0.00 57.07 57.01 2ai9 s TYR 103 Cb 0.07 0.48 -0.08 0.00 0.38 0.00 0.00 41.96 42.81 2ai9 s TYR 103 CO 0.10 -0.23 0.71 -0.51 -1.52 0.00 0.00 175.55 174.09 2ai9 s LEU 104 N -1.30 4.49 0.10 -3.49 1.43 -1.26 -0.80 118.68 117.85 2ai9 s LEU 104 Ca 0.04 1.47 -0.30 0.00 -1.03 0.00 0.00 54.13 54.31 2ai9 s LEU 104 Cb -0.01 -3.31 -0.12 0.00 0.03 0.00 0.00 46.19 42.79 2ai9 s LEU 104 CO -0.03 0.16 1.62 -0.65 0.23 0.00 0.00 176.35 177.68 2ai9 h PRO 105 N 4.05 -0.64 0.00 1.29 0.11 -1.96 -2.54 132.00 132.31 2ai9 h PRO 105 Ca -0.48 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2ai9 h PRO 105 Cb 1.20 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.46 2ai9 h PRO 105 CO 0.65 -0.43 0.00 -2.37 -0.21 0.00 0.00 178.00 175.64 2ai9 n THR 106 N -5.44 0.00 -4.18 -1.15 5.66 -1.26 -4.89 114.28 103.02 2ai9 n THR 106 Ca -0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 2ai9 n THR 106 Cb 0.34 -0.64 0.00 0.00 -1.55 0.00 0.00 70.33 68.49 2ai9 n THR 106 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2ai9 n GLY 107 N -0.17 -1.22 3.39 1.09 0.00 -0.96 -4.87 105.19 102.45 2ai9 n GLY 107 Ca 0.06 -1.25 -0.20 0.00 0.00 0.00 0.00 46.02 44.63 2ai9 n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ai9 s GLU 108 N 0.00 1.46 0.23 1.61 2.02 -1.26 -4.73 118.70 118.03 2ai9 s GLU 108 Ca 0.00 -1.67 0.06 0.00 0.02 0.00 0.00 54.97 53.38 2ai9 s GLU 108 Cb 0.00 -1.30 -0.05 0.00 0.10 0.00 0.00 34.13 32.88 2ai9 s GLU 108 CO 0.00 0.20 -0.07 0.20 0.02 0.00 0.00 175.26 175.60 2ai9 s GLY 109 N -3.39 1.57 -0.13 -1.39 0.00 -1.26 -4.71 107.32 98.00 2ai9 s GLY 109 Ca 0.26 -1.76 -0.08 0.00 0.00 0.00 0.00 44.72 43.14 2ai9 s GLY 109 CO 0.10 -1.75 0.32 0.00 0.00 0.00 0.00 173.10 171.77 2ai9 h LEU 111 N 6.83 0.00 -0.22 0.00 3.38 -1.96 -0.03 115.31 123.31 2ai9 h LEU 111 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2ai9 h LEU 111 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2ai9 h LEU 111 CO 0.33 0.01 -0.30 -1.20 0.09 0.00 0.00 178.44 177.38 2ai9 n SER 112 N -3.40 0.65 -4.11 -0.43 7.64 -1.26 -4.68 113.62 108.03 2ai9 n SER 112 Ca -0.03 -0.48 -0.35 0.00 1.01 0.00 0.00 58.87 59.02 2ai9 n SER 112 Cb 0.11 0.09 -0.13 0.00 -1.01 0.00 0.00 64.21 63.27 2ai9 n SER 112 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2ai9 s VAL 113 N -2.72 3.00 0.19 0.44 1.01 -0.03 0.22 120.40 122.51 2ai9 s VAL 113 Ca 0.19 -1.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.07 2ai9 s VAL 113 Cb 0.19 -3.02 0.11 0.00 0.00 0.00 0.00 36.38 33.66 2ai9 s VAL 113 CO 0.58 -0.56 1.82 0.44 0.00 0.00 0.00 175.10 177.38 2ai9 h ASP 114 N 7.94 0.81 -3.29 3.32 3.32 -1.83 -3.42 116.42 123.27 2ai9 h ASP 114 Ca -0.13 -0.07 -0.58 0.00 0.02 0.00 0.00 57.03 56.27 2ai9 h ASP 114 Cb 1.04 -0.20 -0.08 0.00 0.22 0.00 0.00 39.33 40.31 2ai9 h ASP 114 CO 0.63 0.65 -0.20 -1.81 -1.72 0.00 0.00 179.24 176.78 2ai9 s ASP 115 N -5.92 6.62 0.31 6.45 1.01 -1.26 -5.04 116.67 118.84 2ai9 s ASP 115 Ca -0.13 0.73 -0.29 0.00 0.71 0.00 0.00 52.55 53.57 2ai9 s ASP 115 Cb 0.14 -2.25 -0.11 0.00 1.01 0.00 0.00 42.92 41.71 2ai9 s ASP 115 CO 0.78 0.06 1.56 0.20 0.21 0.00 0.00 175.17 177.98 2ai9 s ASN 116 N 0.42 6.38 -0.15 0.27 0.01 -1.26 -5.00 114.94 115.61 2ai9 s ASN 116 Ca 0.23 2.97 0.01 0.00 -0.71 0.00 0.00 52.86 55.35 2ai9 s ASN 116 Cb -0.15 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.87 2ai9 s ASN 116 CO 0.08 -0.89 -0.17 -0.69 -1.51 0.00 0.00 177.10 173.92 2ai9 s VAL 117 N -0.31 2.50 0.36 1.60 1.01 -1.26 -5.12 120.40 119.18 2ai9 s VAL 117 Ca 0.60 -0.83 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 2ai9 s VAL 117 Cb -0.47 -2.04 -0.08 0.00 0.00 0.00 0.00 36.38 33.79 2ai9 s VAL 117 CO 0.52 0.53 0.76 0.00 0.00 0.00 0.00 175.10 176.91 2ai9 s ALA 118 N 0.79 3.32 0.00 5.51 0.00 -1.26 -4.71 121.76 125.40 2ai9 s ALA 118 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.86 2ai9 s ALA 118 Cb -0.15 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.20 2ai9 s ALA 118 CO -0.00 0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.35 2ai9 n GLY 119 N -0.75 3.91 3.79 0.00 0.00 -1.26 -4.96 105.19 105.91 2ai9 n GLY 119 Ca 0.03 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 2ai9 n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ai9 s LEU 120 N 0.00 4.57 -0.37 0.99 1.43 0.15 -4.28 118.68 121.16 2ai9 s LEU 120 Ca 0.00 1.52 -0.06 0.00 -1.03 0.00 0.00 54.13 54.55 2ai9 s LEU 120 Cb 0.00 -3.16 0.07 0.00 0.03 0.00 0.00 46.19 43.12 2ai9 s LEU 120 CO 0.00 0.22 0.17 -0.69 0.23 0.00 0.00 176.35 176.28 2ai9 s VAL 121 N -1.10 3.79 -0.29 -1.59 1.01 -1.26 -4.40 120.40 116.56 2ai9 s VAL 121 Ca 0.34 -1.39 -0.22 0.00 0.00 0.00 0.00 61.98 60.70 2ai9 s VAL 121 Cb -0.22 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 32.88 2ai9 s VAL 121 CO 0.24 -0.37 0.73 -1.00 0.00 0.00 0.00 175.10 174.71 2ai9 s HIS 122 N 1.36 3.22 0.24 5.22 3.76 -1.26 -4.47 115.29 123.36 2ai9 s HIS 122 Ca 0.01 0.78 0.00 0.00 -0.15 0.00 0.00 55.06 55.71 2ai9 s HIS 122 Cb -0.21 -3.10 -0.00 0.00 1.11 0.00 0.00 32.58 30.37 2ai9 s HIS 122 CO 0.01 -0.50 0.01 0.54 -0.85 0.00 0.00 174.74 173.95 2ai9 n ARG 123 N 6.05 1.32 -2.74 1.40 1.74 -0.30 -4.92 116.66 119.20 2ai9 n ARG 123 Ca 0.02 -1.78 -0.41 0.00 -0.77 0.00 0.00 57.85 54.91 2ai9 n ARG 123 Cb 0.48 0.54 -0.05 0.00 -1.02 0.00 0.00 32.46 32.41 2ai9 n ARG 123 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 2ai9 s HIS 124 N -1.94 3.83 0.24 -1.55 3.76 -1.26 -0.28 115.29 118.09 2ai9 s HIS 124 Ca 0.01 1.81 0.20 0.00 -0.15 0.00 0.00 55.06 56.93 2ai9 s HIS 124 Cb 0.00 -3.04 0.85 0.00 1.11 0.00 0.00 32.58 31.50 2ai9 s HIS 124 CO 0.01 0.24 1.82 -0.97 -0.85 0.00 0.00 174.74 174.99 2ai9 h ASN 125 N 5.39 0.00 -3.75 1.40 -0.00 -1.54 -3.42 115.58 113.67 2ai9 h ASN 125 Ca -0.43 0.00 -0.33 0.00 -0.00 0.00 0.00 56.30 55.54 2ai9 h ASN 125 Cb 1.21 0.00 -0.30 0.00 -0.00 0.00 0.00 38.32 39.23 2ai9 h ASN 125 CO 0.71 0.32 -0.75 -0.13 -0.00 0.00 0.00 177.43 177.58 2ai9 s ARG 126 N -3.81 0.40 0.04 6.67 0.52 -1.26 -0.31 118.95 121.20 2ai9 s ARG 126 Ca -0.01 -0.10 -0.03 0.00 -0.52 0.00 0.00 55.73 55.07 2ai9 s ARG 126 Cb 0.12 -0.43 -0.02 0.00 0.52 0.00 0.00 34.95 35.14 2ai9 s ARG 126 CO 0.67 0.03 0.03 0.96 0.02 0.00 0.00 175.30 177.00 2ai9 s ILE 127 N 0.25 0.17 -0.16 1.52 -4.36 -0.84 -0.19 121.20 117.58 2ai9 s ILE 127 Ca -0.02 -1.36 0.00 0.00 -0.26 0.00 0.00 60.65 59.01 2ai9 s ILE 127 Cb -0.06 -1.06 0.03 0.00 1.25 0.00 0.00 42.46 42.62 2ai9 s ILE 127 CO -0.00 -0.75 -0.10 -0.89 0.24 0.00 0.00 174.94 173.43 2ai9 s THR 128 N -3.02 1.43 -0.12 8.37 2.01 0.96 -1.56 115.64 123.71 2ai9 s THR 128 Ca -0.01 -0.70 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 2ai9 s THR 128 Cb 0.01 -1.45 -0.03 0.00 0.01 0.00 0.00 72.50 71.04 2ai9 s THR 128 CO -0.07 0.30 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.50 2ai9 s ILE 129 N 1.52 3.96 -0.11 1.82 1.01 0.13 -0.87 121.20 128.66 2ai9 s ILE 129 Ca 0.02 -0.35 0.00 0.00 0.00 0.00 0.00 60.65 60.32 2ai9 s ILE 129 Cb -0.14 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 2ai9 s ILE 129 CO -0.09 0.54 -0.10 -0.54 0.00 0.00 0.00 174.94 174.75 2ai9 s LYS 130 N -0.16 3.15 0.35 2.79 1.02 0.92 -0.73 119.74 127.08 2ai9 s LYS 130 Ca 0.03 -0.63 -0.14 0.00 0.02 0.00 0.00 55.97 55.26 2ai9 s LYS 130 Cb -0.13 -2.63 0.06 0.00 -0.52 0.00 0.00 37.83 34.60 2ai9 s LYS 130 CO 0.02 0.39 0.75 0.00 -0.92 0.00 0.00 175.35 175.59 2ai9 n ALA 131 N 3.03 -1.72 -2.49 5.17 0.00 -0.03 -0.96 120.51 123.50 2ai9 n ALA 131 Ca -0.18 -1.15 -0.30 0.00 0.00 0.00 0.00 53.44 51.81 2ai9 n ALA 131 Cb 0.53 0.90 -0.11 0.00 0.00 0.00 0.00 19.45 20.76 2ai9 n ALA 131 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2ai9 s LYS 132 N -2.08 1.90 0.37 0.00 1.02 -0.91 -0.50 119.74 119.53 2ai9 s LYS 132 Ca 0.15 -1.11 -0.03 0.00 0.02 0.00 0.00 55.97 55.00 2ai9 s LYS 132 Cb -0.04 -2.16 0.08 0.00 -0.52 0.00 0.00 37.83 35.19 2ai9 s LYS 132 CO 0.10 0.50 0.50 -0.40 -0.92 0.00 0.00 175.35 175.13 2ai9 n ASP 133 N 0.95 0.40 0.13 2.83 5.68 0.58 -1.20 116.55 125.93 2ai9 n ASP 133 Ca -0.15 -1.40 0.10 0.00 -0.50 0.00 0.00 54.79 52.83 2ai9 n ASP 133 Cb 0.52 -0.35 0.48 0.00 -1.14 0.00 0.00 41.12 40.64 2ai9 n ASP 133 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2ai9 n ILE 134 N -2.32 1.12 -0.76 2.12 3.06 -1.26 -2.27 119.36 119.06 2ai9 n ILE 134 Ca 0.07 0.59 0.08 0.00 -2.50 0.00 0.00 62.75 60.99 2ai9 n ILE 134 Cb 0.26 -1.57 0.22 0.00 0.54 0.00 0.00 39.64 39.09 2ai9 n ILE 134 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2ai9 n GLU 135 N -2.13 2.80 -0.49 9.51 -0.58 -1.26 -4.75 120.64 123.74 2ai9 n GLU 135 Ca -0.00 -2.58 0.00 0.00 -0.42 0.00 0.00 57.16 54.16 2ai9 n GLU 135 Cb 0.07 -1.65 0.00 0.00 -0.57 0.00 0.00 31.44 29.30 2ai9 n GLU 135 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ai9 n GLY 136 N -0.32 1.23 3.89 0.62 0.00 -0.96 -5.03 105.19 104.62 2ai9 n GLY 136 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2ai9 n GLY 136 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ai9 s ASN 137 N -3.12 6.26 0.10 1.61 0.01 -1.26 -4.75 114.94 113.78 2ai9 s ASN 137 Ca 0.00 1.16 -0.25 0.00 -0.71 0.00 0.00 52.86 53.06 2ai9 s ASN 137 Cb 0.00 -2.35 -0.07 0.00 0.41 0.00 0.00 41.25 39.24 2ai9 s ASN 137 CO 0.00 -0.70 0.77 -1.81 -1.51 0.00 0.00 177.10 173.85 2ai9 s ASP 138 N -4.10 7.30 -0.04 -1.22 1.01 -1.26 -0.31 116.67 118.05 2ai9 s ASP 138 Ca 0.51 1.54 -0.00 0.00 0.71 0.00 0.00 52.55 55.31 2ai9 s ASP 138 Cb -0.11 -2.48 0.03 0.00 1.01 0.00 0.00 42.92 41.37 2ai9 s ASP 138 CO 0.48 0.10 0.00 -0.51 0.21 0.00 0.00 175.17 175.46 2ai9 s ILE 139 N -0.55 0.20 -0.15 0.77 1.10 0.34 -4.88 121.20 118.05 2ai9 s ILE 139 Ca 0.37 0.11 0.02 0.00 -0.51 0.00 0.00 60.65 60.64 2ai9 s ILE 139 Cb -0.22 -0.32 0.01 0.00 0.15 0.00 0.00 42.46 42.09 2ai9 s ILE 139 CO 0.25 0.17 -0.21 -1.58 -2.11 0.00 0.00 174.94 171.45 2ai9 s GLN 140 N 1.26 2.95 -0.00 3.50 0.74 -1.26 -0.85 119.66 125.99 2ai9 s GLN 140 Ca -0.06 -0.83 0.03 0.00 0.05 0.00 0.00 55.36 54.55 2ai9 s GLN 140 Cb -0.13 -2.42 -0.03 0.00 1.10 0.00 0.00 33.01 31.52 2ai9 s GLN 140 CO -0.02 -0.06 -0.08 -0.51 -0.55 0.00 0.00 175.29 174.07 2ai9 s LEU 141 N 0.93 3.11 -0.23 3.68 1.43 0.09 -4.97 118.68 122.72 2ai9 s LEU 141 Ca -0.04 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.92 2ai9 s LEU 141 Cb -0.15 -1.77 0.05 0.00 0.03 0.00 0.00 46.19 44.35 2ai9 s LEU 141 CO -0.04 0.29 -0.09 -0.13 0.23 0.00 0.00 176.35 176.61 2ai9 s ARG 142 N -1.33 1.99 0.25 1.70 0.52 -1.26 -0.69 118.95 120.12 2ai9 s ARG 142 Ca 0.16 -1.06 0.11 0.00 -0.52 0.00 0.00 55.73 54.43 2ai9 s ARG 142 Cb -0.11 -2.64 -0.05 0.00 0.52 0.00 0.00 34.95 32.68 2ai9 s ARG 142 CO 0.06 -0.53 -0.18 -0.51 0.02 0.00 0.00 175.30 174.16 2ai9 s LEU 143 N 1.30 2.63 0.02 2.53 1.43 -0.60 -5.01 118.68 120.98 2ai9 s LEU 143 Ca -0.05 -0.91 -0.09 0.00 -1.03 0.00 0.00 54.13 52.05 2ai9 s LEU 143 Cb -0.18 -1.22 0.00 0.00 0.03 0.00 0.00 46.19 44.82 2ai9 s LEU 143 CO -0.07 0.06 0.18 -1.59 0.23 0.00 0.00 176.35 175.17 2ai9 s LYS 144 N -3.23 0.61 5.75 1.70 -2.85 -1.26 -1.98 119.74 118.48 2ai9 s LYS 144 Ca 0.27 -0.53 0.00 0.00 -1.00 0.00 0.00 55.97 54.71 2ai9 s LYS 144 Cb -0.06 0.26 0.00 0.00 -2.06 0.00 0.00 37.83 35.96 2ai9 s LYS 144 CO 0.14 -0.17 0.00 0.41 0.10 0.00 0.00 175.35 175.83 2ai9 n GLY 145 N 0.99 2.70 0.33 0.59 0.00 0.58 -3.61 105.19 106.76 2ai9 n GLY 145 Ca -0.20 -0.43 -0.07 0.00 0.00 0.00 0.00 46.02 45.32 2ai9 n GLY 145 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2ai9 h TYR 146 N 0.00 -0.89 -0.85 1.61 3.20 -1.91 -0.20 116.97 117.93 2ai9 h TYR 146 Ca 0.00 0.06 0.10 0.00 3.14 0.00 0.00 58.73 62.03 2ai9 h TYR 146 Cb 0.00 0.45 -0.08 0.00 1.54 0.00 0.00 36.73 38.65 2ai9 h TYR 146 CO 0.00 -0.38 0.49 -1.35 -1.64 0.00 0.00 178.16 175.28 2ai9 h PRO 147 N -0.24 0.78 -0.56 1.82 0.11 -1.98 0.14 132.00 132.07 2ai9 h PRO 147 Ca 0.18 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.25 2ai9 h PRO 147 Cb 0.54 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.44 2ai9 h PRO 147 CO -0.54 0.52 0.37 0.00 -0.21 0.00 0.00 178.00 178.13 2ai9 h ALA 148 N 1.47 1.61 0.75 -0.75 0.00 -1.25 -2.18 119.26 118.90 2ai9 h ALA 148 Ca 0.41 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 2ai9 h ALA 148 Cb 0.40 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.97 2ai9 h ALA 148 CO -0.26 0.36 -0.36 0.82 0.00 0.00 0.00 179.25 179.82 2ai9 h ILE 149 N 0.76 0.21 -0.93 0.00 1.08 0.91 -2.54 117.51 116.99 2ai9 h ILE 149 Ca 0.21 -0.12 0.16 0.00 -0.39 0.00 0.00 64.86 64.72 2ai9 h ILE 149 Cb -0.08 0.24 -0.08 0.00 -3.07 0.00 0.00 36.82 33.83 2ai9 h ILE 149 CO -0.05 0.01 0.59 0.58 -0.69 0.00 0.00 178.15 178.60 2ai9 h VAL 150 N -1.10 0.80 -0.22 1.67 2.07 -0.82 -0.50 116.25 118.17 2ai9 h VAL 150 Ca -0.10 -0.24 -0.21 0.00 0.82 0.00 0.00 66.70 66.97 2ai9 h VAL 150 Cb 0.79 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2ai9 h VAL 150 CO 0.17 0.13 -0.67 -0.26 0.02 0.00 0.00 177.57 176.95 2ai9 h PHE 151 N 0.71 1.10 -0.15 1.57 -1.00 -1.37 -2.19 116.94 115.62 2ai9 h PHE 151 Ca 0.48 -0.44 -0.07 0.00 2.81 0.00 0.00 57.97 60.75 2ai9 h PHE 151 Cb 0.78 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 40.15 2ai9 h PHE 151 CO -0.00 1.28 -0.23 1.96 -1.61 0.00 0.00 178.31 179.70 2ai9 h GLN 152 N 0.60 0.26 0.50 1.51 4.20 -0.93 0.62 115.11 121.87 2ai9 h GLN 152 Ca -0.02 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.58 2ai9 h GLN 152 Cb 1.29 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.06 2ai9 h GLN 152 CO 0.14 0.48 -0.24 1.25 -0.67 0.00 0.00 178.83 179.79 2ai9 h HIS 153 N 0.23 -0.62 -0.20 2.96 2.76 -0.96 -0.12 115.15 119.20 2ai9 h HIS 153 Ca 0.04 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.18 2ai9 h HIS 153 Cb 0.54 0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.70 2ai9 h HIS 153 CO 0.01 -0.37 0.07 0.93 -1.30 0.00 0.00 177.93 177.27 2ai9 h GLU 154 N -0.71 0.31 -0.58 5.26 4.39 -1.11 -2.45 114.58 119.69 2ai9 h GLU 154 Ca -0.07 -0.06 0.07 0.00 0.34 0.00 0.00 59.36 59.64 2ai9 h GLU 154 Cb 0.53 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 2ai9 h GLU 154 CO 0.11 0.40 0.39 0.82 -1.16 0.00 0.00 179.01 179.57 2ai9 h ILE 155 N 0.16 0.97 -0.80 3.13 2.04 -0.84 0.59 117.51 122.76 2ai9 h ILE 155 Ca 0.07 -0.18 0.09 0.00 1.00 0.00 0.00 64.86 65.84 2ai9 h ILE 155 Cb 0.21 0.41 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 2ai9 h ILE 155 CO -0.00 0.09 0.52 0.44 0.00 0.00 0.00 178.15 179.20 2ai9 h ASP 156 N 0.52 0.69 -0.95 1.72 3.32 -0.52 -1.48 116.42 119.72 2ai9 h ASP 156 Ca 0.26 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.35 2ai9 h ASP 156 Cb 0.34 -0.13 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 2ai9 h ASP 156 CO -0.07 0.42 0.63 0.45 -1.72 0.00 0.00 179.24 178.94 2ai9 h HIS 157 N 0.76 1.17 0.00 4.55 3.86 -0.77 -0.31 115.15 124.41 2ai9 h HIS 157 Ca 0.36 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.60 2ai9 h HIS 157 Cb 0.40 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 28.48 2ai9 h HIS 157 CO -0.00 0.70 0.00 -0.07 0.86 0.00 0.00 177.93 179.42 2ai9 h LEU 158 N 1.23 0.00 -3.01 2.43 3.38 -1.26 -1.70 115.31 116.38 2ai9 h LEU 158 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 2ai9 h LEU 158 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2ai9 h LEU 158 CO -0.10 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.02 2ai9 n ASN 159 N -2.82 3.78 -1.20 -0.43 3.02 -0.54 -0.32 115.26 116.76 2ai9 n ASN 159 Ca -0.01 -2.32 -0.10 0.00 -0.03 0.00 0.00 54.58 52.12 2ai9 n ASN 159 Cb 0.16 -0.43 -0.00 0.00 -0.61 0.00 0.00 39.78 38.90 2ai9 n ASN 159 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ai9 n GLY 160 N 0.65 -0.05 3.41 7.41 0.00 -0.64 -4.74 105.19 111.23 2ai9 n GLY 160 Ca 0.19 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 2ai9 n GLY 160 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ai9 s VAL 161 N -2.53 3.34 0.13 1.61 1.01 -0.24 -4.61 120.40 119.11 2ai9 s VAL 161 Ca 0.01 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.46 2ai9 s VAL 161 Cb -0.00 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 2ai9 s VAL 161 CO 0.01 0.51 0.24 -0.04 0.00 0.00 0.00 175.10 175.82 2ai9 s MET 162 N 0.36 3.32 0.25 2.72 -1.94 -1.26 -3.50 119.30 119.25 2ai9 s MET 162 Ca -0.09 -0.63 -0.06 0.00 -1.71 0.00 0.00 55.69 53.21 2ai9 s MET 162 Cb -0.15 -2.91 0.30 0.00 2.01 0.00 0.00 34.83 34.08 2ai9 s MET 162 CO 0.05 0.53 1.89 0.27 -0.01 0.00 0.00 175.02 177.75 2ai9 h PHE 163 N 2.39 1.13 0.00 -0.03 -5.15 -1.97 -1.88 116.94 111.43 2ai9 h PHE 163 Ca -0.48 0.03 0.00 0.00 -0.20 0.00 0.00 57.97 57.32 2ai9 h PHE 163 Cb 1.19 -0.37 0.00 0.00 0.22 0.00 0.00 35.95 36.98 2ai9 h PHE 163 CO 0.56 0.64 0.00 2.48 -2.00 0.00 0.00 178.31 179.99 2ai9 n TYR 164 N -4.50 0.81 0.30 6.09 0.18 -1.26 -1.90 117.16 116.88 2ai9 n TYR 164 Ca 0.12 0.37 0.17 0.00 1.88 0.00 0.00 57.90 60.45 2ai9 n TYR 164 Cb 0.10 -1.10 0.93 0.00 -0.38 0.00 0.00 39.34 38.89 2ai9 n TYR 164 CO 0.00 0.00 0.00 -0.44 -2.08 0.00 0.00 176.86 174.34 2ai9 h ASP 165 N 0.00 0.00 0.75 9.48 5.19 -1.75 -2.57 116.42 127.53 2ai9 h ASP 165 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2ai9 h ASP 165 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.67 2ai9 h ASP 165 CO 0.00 0.04 -0.88 1.41 -3.12 0.00 0.00 179.24 176.68 2ai9 n HIS 166 N -3.40 0.58 -2.09 4.55 8.25 -0.80 -4.93 115.22 117.38 2ai9 n HIS 166 Ca -0.02 0.17 -0.42 0.00 -0.26 0.00 0.00 57.72 57.19 2ai9 n HIS 166 Cb 0.16 -0.68 -0.03 0.00 1.12 0.00 0.00 29.99 30.57 2ai9 n HIS 166 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2ai9 s ILE 167 N -3.24 3.04 0.01 1.59 1.01 -0.97 -4.69 121.20 117.95 2ai9 s ILE 167 Ca 0.03 0.76 -0.30 0.00 0.00 0.00 0.00 60.65 61.14 2ai9 s ILE 167 Cb 0.13 -3.49 -0.06 0.00 0.01 0.00 0.00 42.46 39.04 2ai9 s ILE 167 CO 0.77 0.07 1.54 1.51 0.00 0.00 0.00 174.94 178.82 2ai9 s ASP 168 N 0.99 6.73 0.00 3.58 3.84 -1.26 -4.86 116.67 125.69 2ai9 s ASP 168 Ca 0.65 2.26 0.00 0.00 -0.00 0.00 0.00 52.55 55.46 2ai9 s ASP 168 Cb -0.39 -2.56 0.00 0.00 -1.38 0.00 0.00 42.92 38.59 2ai9 s ASP 168 CO 0.32 -0.82 0.76 2.29 -0.00 0.00 0.00 175.17 177.72 2ai9 n LYS 169 N 5.82 0.79 0.00 2.11 2.85 -1.26 -3.42 118.16 125.04 2ai9 n LYS 169 Ca 0.15 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.41 2ai9 n LYS 169 Cb 0.42 -1.13 0.00 0.00 -0.65 0.00 0.00 35.03 33.68 2ai9 n LYS 169 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2ai9 n ASN 170 N 0.57 0.00 -3.39 -5.58 4.05 -1.26 -4.98 115.26 104.66 2ai9 n ASN 170 Ca 0.00 0.00 -0.27 0.00 0.45 0.00 0.00 54.58 54.76 2ai9 n ASN 170 Cb 0.38 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.31 2ai9 n ASN 170 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2ai9 n HIS 171 N -1.15 3.19 -0.40 1.20 8.25 -1.25 -4.95 115.22 120.11 2ai9 n HIS 171 Ca 0.00 -4.09 0.34 0.00 -0.26 0.00 0.00 57.72 53.71 2ai9 n HIS 171 Cb 0.00 -0.53 0.61 0.00 1.12 0.00 0.00 29.99 31.18 2ai9 n HIS 171 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2ai9 h PRO 172 N 4.14 0.11 -0.08 -0.41 0.11 -1.93 0.55 132.00 134.48 2ai9 h PRO 172 Ca 0.18 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 2ai9 h PRO 172 Cb 0.69 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.77 2ai9 h PRO 172 CO 0.79 0.07 0.00 1.28 -0.21 0.00 0.00 178.00 179.94 2ai9 n LEU 173 N -4.84 0.88 -4.61 2.35 4.77 -1.26 0.30 117.00 114.60 2ai9 n LEU 173 Ca 0.36 -0.36 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 2ai9 n LEU 173 Cb 1.32 -0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 42.26 2ai9 n LEU 173 CO 0.16 0.18 -0.17 -1.58 -1.33 0.00 0.00 177.39 174.65 2ai9 s GLN 174 N -1.90 3.98 0.79 3.23 -0.44 0.19 -4.93 119.66 120.57 2ai9 s GLN 174 Ca 0.31 -0.31 -0.12 0.00 -2.50 0.00 0.00 55.36 52.74 2ai9 s GLN 174 Cb 0.16 -3.63 0.07 0.00 -1.64 0.00 0.00 33.01 27.97 2ai9 s GLN 174 CO 0.25 -0.12 1.14 -2.14 0.50 0.00 0.00 175.29 174.92 2ai9 s PRO 175 N 1.58 1.94 0.00 1.67 0.02 -1.26 -4.92 135.00 134.03 2ai9 s PRO 175 Ca 0.07 1.47 0.25 0.00 0.02 0.00 0.00 61.00 62.81 2ai9 s PRO 175 Cb -0.15 -1.84 1.30 0.00 0.02 0.00 0.00 34.50 33.82 2ai9 s PRO 175 CO 0.09 -1.92 1.86 0.72 -0.33 0.00 0.00 177.00 177.42 2ai9 n HIS 176 N -3.35 0.00 0.00 6.54 8.25 -1.26 -4.92 115.22 120.48 2ai9 n HIS 176 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2ai9 n HIS 176 Cb 0.52 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.36 2ai9 n HIS 176 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 2ai9 n THR 177 N -1.27 0.00 -1.35 1.59 -1.04 -1.26 -4.77 114.28 106.17 2ai9 n THR 177 Ca 0.12 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.81 2ai9 n THR 177 Cb 0.20 0.00 0.10 0.00 -1.82 0.00 0.00 70.33 68.80 2ai9 n THR 177 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 2ai9 n ASP 178 N 2.08 6.79 -4.18 8.00 5.75 -1.26 -4.96 116.55 128.77 2ai9 n ASP 178 Ca 0.00 -3.76 -0.28 0.00 -0.01 0.00 0.00 54.79 50.75 2ai9 n ASP 178 Cb 0.00 -0.92 -0.16 0.00 -1.03 0.00 0.00 41.12 39.01 2ai9 n ASP 178 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ai9 s ALA 179 N -3.72 1.71 0.69 2.12 0.00 -1.26 -3.80 121.76 117.51 2ai9 s ALA 179 Ca 0.62 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 51.66 2ai9 s ALA 179 Cb 0.50 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 23.09 2ai9 s ALA 179 CO 0.01 0.33 1.06 0.08 0.00 0.00 0.00 175.76 177.25 2ai9 s VAL 180 N -0.09 3.99 -0.15 0.00 1.01 -0.30 -4.93 120.40 119.91 2ai9 s VAL 180 Ca -0.02 0.67 -0.05 0.00 0.00 0.00 0.00 61.98 62.58 2ai9 s VAL 180 Cb -0.11 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.85 2ai9 s VAL 180 CO 0.02 -0.82 0.01 -1.61 0.00 0.00 0.00 175.10 172.70 2ai9 s GLU 181 N -4.96 3.67 0.00 2.72 2.02 -1.26 -2.63 118.70 118.25 2ai9 s GLU 181 Ca 0.59 -0.43 0.00 0.00 0.02 0.00 0.00 54.97 55.15 2ai9 s GLU 181 Cb -0.14 -3.01 0.00 0.00 0.10 0.00 0.00 34.13 31.08 2ai9 s GLU 181 CO 0.54 0.34 0.00 0.28 0.02 0.00 0.00 175.26 176.44