#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgn n ASP 2 N 0.00 7.32 0.29 6.12 10.43 -1.26 -4.60 116.55 134.86 1xgn n ASP 2 Ca 0.00 -3.21 0.18 0.00 2.57 0.00 0.00 54.79 54.33 1xgn n ASP 2 Cb 0.00 -1.29 0.99 0.00 1.84 0.00 0.00 41.12 42.66 1xgn n ASP 2 CO 0.00 0.00 0.00 0.71 -1.07 0.00 0.00 177.20 176.84 1xgn h THR 3 N 2.30 0.29 0.00 -3.53 1.35 -2.02 0.18 112.91 111.48 1xgn h THR 3 Ca 0.56 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 66.38 1xgn h THR 3 Cb 0.48 0.93 -0.01 0.00 -1.73 0.00 0.00 68.15 67.82 1xgn h THR 3 CO 1.20 0.00 -0.18 -0.33 -0.25 0.00 0.00 175.52 175.96 1xgn h GLU 4 N 0.00 0.00 0.06 4.72 3.07 -1.99 -0.46 114.58 119.98 1xgn h GLU 4 Ca 0.02 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1xgn h GLU 4 Cb 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1xgn h GLU 4 CO -0.00 0.18 -0.03 0.87 -1.40 0.00 0.00 179.01 178.63 1xgn h LYS 5 N 0.00 -0.08 -0.99 2.33 6.56 -1.04 -2.18 116.57 121.17 1xgn h LYS 5 Ca -0.00 0.01 0.36 0.00 -1.06 0.00 0.00 60.65 59.95 1xgn h LYS 5 Cb 0.33 0.02 -0.18 0.00 -0.57 0.00 0.00 32.23 31.83 1xgn h LYS 5 CO 0.02 -0.05 0.36 -0.07 -2.06 0.00 0.00 179.45 177.65 1xgn h LEU 6 N -0.52 0.06 0.10 2.94 3.38 -1.47 0.64 115.31 120.45 1xgn h LEU 6 Ca -0.01 0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 1xgn h LEU 6 Cb 0.07 0.33 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1xgn h LEU 6 CO 0.01 -0.38 -0.05 -0.03 0.09 0.00 0.00 178.44 178.09 1xgn h MET 7 N 0.04 -0.14 -0.26 1.13 4.05 -1.20 -0.79 114.93 117.77 1xgn h MET 7 Ca 0.75 0.01 0.06 0.00 -0.28 0.00 0.00 59.70 60.24 1xgn h MET 7 Cb 1.83 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 32.65 1xgn h MET 7 CO -0.80 0.23 0.18 -0.22 0.23 0.00 0.00 176.91 176.53 1xgn h LYS 8 N -0.53 0.08 -0.04 0.39 1.63 0.81 0.13 116.57 119.04 1xgn h LYS 8 Ca -0.01 -0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.71 1xgn h LYS 8 Cb 0.43 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.05 1xgn h LYS 8 CO 0.02 0.05 -0.26 0.00 -3.45 0.00 0.00 179.45 175.81 1xgn h ALA 9 N 1.87 0.09 -0.79 5.00 0.00 -0.60 -2.74 119.26 122.08 1xgn h ALA 9 Ca 0.12 -0.43 0.10 0.00 0.00 0.00 0.00 54.91 54.70 1xgn h ALA 9 Cb 0.37 -0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.08 1xgn h ALA 9 CO -0.01 0.11 0.42 0.78 0.00 0.00 0.00 179.25 180.56 1xgn h GLY 10 N -0.30 1.22 0.57 0.00 0.00 0.25 0.23 103.07 105.05 1xgn h GLY 10 Ca -0.02 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.09 1xgn h GLY 10 CO 0.05 0.07 -0.00 -2.09 0.00 0.00 0.00 176.54 174.57 1xgn h GLU 11 N 0.69 0.07 -0.58 4.80 4.81 -0.75 0.33 114.58 123.95 1xgn h GLU 11 Ca 0.39 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.59 1xgn h GLU 11 Cb 0.42 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 1xgn h GLU 11 CO -0.28 0.05 0.23 0.82 -0.73 0.00 0.00 179.01 179.10 1xgn h ILE 12 N 0.08 1.23 -0.11 2.32 2.04 -1.07 -2.31 117.51 119.68 1xgn h ILE 12 Ca 0.13 -0.70 0.04 0.00 1.00 0.00 0.00 64.86 65.32 1xgn h ILE 12 Cb 0.17 0.60 -0.06 0.00 -0.74 0.00 0.00 36.82 36.78 1xgn h ILE 12 CO -0.22 0.27 -0.45 0.00 0.00 0.00 0.00 178.15 177.75 1xgn h ALA 13 N 1.08 -0.68 0.05 1.87 0.00 0.10 0.15 119.26 121.84 1xgn h ALA 13 Ca 0.19 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1xgn h ALA 13 Cb 0.20 0.84 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1xgn h ALA 13 CO -0.02 -0.97 -0.53 -0.22 0.00 0.00 0.00 179.25 177.51 1xgn h LYS 14 N -0.53 -0.68 -0.33 0.00 3.64 -0.26 0.18 116.57 118.59 1xgn h LYS 14 Ca 0.06 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.56 1xgn h LYS 14 Cb 0.65 0.15 -0.08 0.00 -0.41 0.00 0.00 32.23 32.55 1xgn h LYS 14 CO -0.40 -0.45 -0.18 0.87 -2.27 0.00 0.00 179.45 177.02 1xgn h LYS 15 N -0.70 -0.12 0.00 1.90 1.79 -0.87 0.25 116.57 118.81 1xgn h LYS 15 Ca 0.00 0.01 -0.07 0.00 -2.18 0.00 0.00 60.65 58.41 1xgn h LYS 15 Cb 0.74 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.40 1xgn h LYS 15 CO -0.33 -0.08 -0.34 -0.24 -1.08 0.00 0.00 179.45 177.38 1xgn h VAL 16 N -0.13 0.92 -0.17 0.50 3.04 -0.37 -2.65 116.25 117.40 1xgn h VAL 16 Ca 0.17 -1.31 -0.01 0.00 -1.01 0.00 0.00 66.70 64.54 1xgn h VAL 16 Cb 0.39 1.78 -0.01 0.00 -2.01 0.00 0.00 31.29 31.44 1xgn h VAL 16 CO -0.41 0.33 0.07 -0.09 -1.01 0.00 0.00 177.57 176.45 1xgn h ARG 17 N 0.00 0.26 -0.07 4.17 2.43 0.25 -0.66 114.38 120.76 1xgn h ARG 17 Ca -0.00 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1xgn h ARG 17 Cb 0.75 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.23 1xgn h ARG 17 CO 0.04 0.34 -0.10 0.93 -1.51 0.00 0.00 179.97 179.67 1xgn h GLU 18 N 0.12 -0.14 -0.98 0.20 4.39 -0.72 -0.92 114.58 116.53 1xgn h GLU 18 Ca 0.06 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.79 1xgn h GLU 18 Cb 0.18 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.81 1xgn h GLU 18 CO -0.00 -0.09 0.64 0.87 -1.16 0.00 0.00 179.01 179.27 1xgn h LYS 19 N -0.14 1.25 -0.68 2.33 1.57 -1.37 -0.29 116.57 119.24 1xgn h LYS 19 Ca 0.06 -0.07 0.10 0.00 -1.87 0.00 0.00 60.65 58.87 1xgn h LYS 19 Cb 0.23 -0.28 -0.08 0.00 0.08 0.00 0.00 32.23 32.19 1xgn h LYS 19 CO -0.16 0.82 0.29 0.00 -0.57 0.00 0.00 179.45 179.84 1xgn h ALA 20 N 1.38 0.91 0.32 3.86 0.00 -0.28 0.30 119.26 125.75 1xgn h ALA 20 Ca 0.37 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 1xgn h ALA 20 Cb -0.08 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1xgn h ALA 20 CO -0.10 -0.14 -0.24 0.82 0.00 0.00 0.00 179.25 179.60 1xgn h ILE 21 N 0.49 0.50 -0.83 0.00 2.04 0.23 -1.92 117.51 118.02 1xgn h ILE 21 Ca 0.34 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.26 1xgn h ILE 21 Cb 0.42 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 36.94 1xgn h ILE 21 CO -0.31 0.00 0.54 0.11 0.00 0.00 0.00 178.15 178.50 1xgn h LYS 22 N -0.55 0.93 -0.01 2.37 1.79 0.51 -2.27 116.57 119.33 1xgn h LYS 22 Ca -0.02 -0.06 -0.13 0.00 -2.18 0.00 0.00 60.65 58.26 1xgn h LYS 22 Cb 0.48 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.91 1xgn h LYS 22 CO -0.00 0.62 -0.59 -0.07 -1.08 0.00 0.00 179.45 178.33 1xgn h LEU 23 N 0.96 0.05 -8.19 2.94 4.07 -0.20 -3.40 115.31 111.54 1xgn h LEU 23 Ca 0.35 -0.03 -0.05 0.00 0.08 0.00 0.00 57.88 58.23 1xgn h LEU 23 Cb 0.15 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 41.87 1xgn h LEU 23 CO -0.12 0.63 0.14 0.00 -1.08 0.00 0.00 178.44 178.01 1xgn s ALA 24 N -3.71 0.70 0.32 1.53 0.00 -0.75 -4.88 121.76 114.96 1xgn s ALA 24 Ca -0.02 -1.25 0.09 0.00 0.00 0.00 0.00 51.96 50.79 1xgn s ALA 24 Cb 0.13 -4.64 -0.05 0.00 0.00 0.00 0.00 23.12 18.55 1xgn s ALA 24 CO 0.77 -6.31 -0.01 1.03 0.00 0.00 0.00 175.76 171.24 1xgn s ARG 25 N 8.43 2.09 0.56 0.00 0.52 -1.26 -4.71 118.95 124.58 1xgn s ARG 25 Ca 0.84 -1.68 -0.20 0.00 -0.52 0.00 0.00 55.73 54.17 1xgn s ARG 25 Cb -0.08 -1.96 -0.04 0.00 0.52 0.00 0.00 34.95 33.38 1xgn s ARG 25 CO 0.13 0.20 1.26 -2.14 0.02 0.00 0.00 175.30 174.76 1xgn s PRO 26 N -3.69 3.09 0.00 3.54 0.02 -1.26 -1.93 135.00 134.76 1xgn s PRO 26 Ca 0.34 1.97 0.00 0.00 0.02 0.00 0.00 61.00 63.33 1xgn s PRO 26 Cb -0.02 -2.09 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1xgn s PRO 26 CO 0.19 -1.15 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 1xgn n GLY 27 N 0.62 2.32 3.63 0.52 0.00 0.30 -4.95 105.19 107.63 1xgn n GLY 27 Ca 0.12 -0.25 -0.54 0.00 0.00 0.00 0.00 46.02 45.35 1xgn n GLY 27 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1xgn n MET 28 N 0.00 1.14 -2.54 1.61 0.00 -0.81 -4.48 117.12 112.03 1xgn n MET 28 Ca 0.00 0.41 -0.41 0.00 0.00 0.00 0.00 57.70 57.70 1xgn n MET 28 Cb 0.00 -2.07 -0.04 0.00 0.00 0.00 0.00 33.22 31.11 1xgn n MET 28 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 1xgn s LEU 29 N 1.53 4.48 0.12 -0.89 0.20 -1.26 -1.04 118.68 121.82 1xgn s LEU 29 Ca 0.89 2.03 -0.20 0.00 0.69 0.00 0.00 54.13 57.55 1xgn s LEU 29 Cb -1.00 -3.60 -0.06 0.00 -0.43 0.00 0.00 46.19 41.10 1xgn s LEU 29 CO 0.53 -0.22 1.77 0.25 -0.29 0.00 0.00 176.35 178.39 1xgn h LEU 30 N 5.37 0.18 -0.73 -0.68 5.85 -0.20 -2.73 115.31 122.37 1xgn h LEU 30 Ca -0.44 0.00 0.15 0.00 0.84 0.00 0.00 57.88 58.44 1xgn h LEU 30 Cb 1.21 -0.04 -0.10 0.00 0.37 0.00 0.00 40.66 42.10 1xgn h LEU 30 CO 0.73 0.13 0.21 0.25 -0.34 0.00 0.00 178.44 179.42 1xgn h LEU 31 N 0.23 0.09 0.83 2.25 7.12 -1.80 -2.42 115.31 121.60 1xgn h LEU 31 Ca 0.07 0.13 -0.04 0.00 0.13 0.00 0.00 57.88 58.18 1xgn h LEU 31 Cb -0.00 0.16 0.00 0.00 -0.53 0.00 0.00 40.66 40.29 1xgn h LEU 31 CO -0.04 0.00 -0.46 -0.33 -0.13 0.00 0.00 178.44 177.49 1xgn h GLU 32 N 0.31 -1.15 -0.83 1.25 5.08 -1.88 -2.45 114.58 114.92 1xgn h GLU 32 Ca 0.41 0.08 0.20 0.00 -1.00 0.00 0.00 59.36 59.05 1xgn h GLU 32 Cb 0.67 0.26 -0.14 0.00 0.50 0.00 0.00 28.75 30.04 1xgn h GLU 32 CO -0.47 -0.76 0.09 1.25 -1.00 0.00 0.00 179.01 178.11 1xgn h LEU 33 N -1.19 -0.24 0.23 1.33 6.46 -1.38 0.42 115.31 120.94 1xgn h LEU 33 Ca -0.11 0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 1xgn h LEU 33 Cb 0.93 0.33 -0.03 0.00 -0.73 0.00 0.00 40.66 41.16 1xgn h LEU 33 CO 0.15 -0.19 -0.45 0.00 -0.62 0.00 0.00 178.44 177.33 1xgn h ALA 34 N 1.77 -1.00 -0.72 1.25 0.00 -1.29 -1.30 119.26 117.96 1xgn h ALA 34 Ca 0.48 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.31 1xgn h ALA 34 Cb 0.91 0.78 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1xgn h ALA 34 CO -0.69 -1.08 0.44 0.93 0.00 0.00 0.00 179.25 178.84 1xgn h GLU 35 N -0.74 0.80 -0.10 0.00 5.08 -0.21 -0.49 114.58 118.92 1xgn h GLU 35 Ca -0.02 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1xgn h GLU 35 Cb 0.70 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 1xgn h GLU 35 CO -0.18 0.53 -0.13 0.77 -1.00 0.00 0.00 179.01 179.01 1xgn h SER 36 N 0.82 -0.39 0.58 1.42 0.02 -0.08 0.25 113.55 116.18 1xgn h SER 36 Ca 0.31 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.31 1xgn h SER 36 Cb 0.10 0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 1xgn h SER 36 CO -0.15 -0.17 -0.43 0.40 -1.14 0.00 0.00 176.83 175.35 1xgn h ILE 37 N -0.16 0.00 -0.96 3.27 2.04 -0.71 -1.16 117.51 119.83 1xgn h ILE 37 Ca 0.08 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.18 1xgn h ILE 37 Cb 0.28 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.29 1xgn h ILE 37 CO -0.20 0.00 0.64 -0.33 0.00 0.00 0.00 178.15 178.26 1xgn h GLU 38 N -0.97 0.29 -0.02 2.37 5.08 -0.86 0.19 114.58 120.67 1xgn h GLU 38 Ca -0.08 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 58.09 1xgn h GLU 38 Cb 0.80 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1xgn h GLU 38 CO 0.04 0.19 -0.78 0.87 -1.00 0.00 0.00 179.01 178.33 1xgn h LYS 39 N 0.29 0.16 -0.19 2.33 6.56 -0.06 -3.01 116.57 122.66 1xgn h LYS 39 Ca 0.50 -0.15 -0.12 0.00 -1.06 0.00 0.00 60.65 59.81 1xgn h LYS 39 Cb 1.45 0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 33.13 1xgn h LYS 39 CO -0.16 0.86 -0.41 1.98 -2.06 0.00 0.00 179.45 179.65 1xgn h MET 40 N 0.10 0.44 -0.15 3.15 4.05 0.61 -0.85 114.93 122.28 1xgn h MET 40 Ca -0.03 -0.22 0.04 0.00 -0.28 0.00 0.00 59.70 59.22 1xgn h MET 40 Cb 1.36 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 32.11 1xgn h MET 40 CO 0.11 0.78 -0.14 0.82 0.23 0.00 0.00 176.91 178.71 1xgn h ILE 41 N 0.36 0.61 0.08 1.77 5.03 -1.23 -1.05 117.51 123.09 1xgn h ILE 41 Ca 0.03 0.00 -0.00 0.00 -0.12 0.00 0.00 64.86 64.77 1xgn h ILE 41 Cb 0.88 0.61 0.00 0.00 -3.03 0.00 0.00 36.82 35.28 1xgn h ILE 41 CO 0.07 0.00 -0.04 0.24 -0.68 0.00 0.00 178.15 177.75 1xgn h MET 42 N -0.16 -0.10 0.00 2.37 2.86 -1.53 0.20 114.93 118.56 1xgn h MET 42 Ca 0.10 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1xgn h MET 42 Cb 0.31 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.99 1xgn h MET 42 CO -0.25 0.02 0.23 1.49 1.06 0.00 0.00 176.91 179.46 1xgn h GLU 43 N -0.20 0.00 -0.21 1.72 4.81 -0.51 0.42 114.58 120.61 1xgn h GLU 43 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1xgn h GLU 43 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1xgn h GLU 43 CO 0.02 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.58 1xgn n LEU 44 N -2.39 3.21 0.00 1.64 7.99 -0.46 -4.90 117.00 122.11 1xgn n LEU 44 Ca -0.01 -1.24 0.00 0.00 -0.01 0.00 0.00 56.01 54.75 1xgn n LEU 44 Cb 0.26 -0.12 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 1xgn n LEU 44 CO 0.10 0.62 0.00 0.61 -1.51 0.00 0.00 177.39 177.20 1xgn n GLY 45 N 1.43 0.79 4.01 -0.72 0.00 0.15 -5.02 105.19 105.82 1xgn n GLY 45 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 1xgn n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xgn s GLY 46 N -1.71 1.79 -0.01 -0.02 0.00 -0.00 -4.96 107.32 102.41 1xgn s GLY 46 Ca 0.00 -1.78 0.00 0.00 0.00 0.00 0.00 44.72 42.94 1xgn s GLY 46 CO 0.00 -1.36 0.01 0.54 0.00 0.00 0.00 173.10 172.29 1xgn s LYS 47 N -4.79 -0.01 0.11 2.90 -0.14 -1.08 -3.45 119.74 113.27 1xgn s LYS 47 Ca 0.61 0.08 -0.31 0.00 -1.36 0.00 0.00 55.97 54.99 1xgn s LYS 47 Cb -0.07 -0.11 -0.08 0.00 -1.68 0.00 0.00 37.83 35.89 1xgn s LYS 47 CO 0.40 -0.07 1.49 -1.25 -0.76 0.00 0.00 175.35 175.16 1xgn s PRO 48 N 0.45 4.26 0.17 -1.68 0.04 -1.26 -0.17 135.00 136.82 1xgn s PRO 48 Ca -0.04 2.20 0.25 0.00 0.04 0.00 0.00 61.00 63.45 1xgn s PRO 48 Cb -0.05 -3.31 0.91 0.00 0.04 0.00 0.00 34.50 32.09 1xgn s PRO 48 CO -0.01 -0.56 1.76 0.00 0.04 0.00 0.00 177.00 178.23 1xgn n ALA 49 N 4.37 2.06 -3.61 8.56 0.00 0.23 -4.64 120.51 127.48 1xgn n ALA 49 Ca 0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.55 1xgn n ALA 49 Cb 0.41 -1.43 -0.01 0.00 0.00 0.00 0.00 19.45 18.42 1xgn n ALA 49 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1xgn s PHE 50 N -3.14 -0.06 0.33 0.00 -0.71 -1.25 -4.11 117.98 109.04 1xgn s PHE 50 Ca 0.09 0.02 -0.29 0.00 -1.04 0.00 0.00 56.93 55.71 1xgn s PHE 50 Cb 0.12 0.52 -0.12 0.00 -1.21 0.00 0.00 43.02 42.33 1xgn s PHE 50 CO 0.50 -0.15 1.44 -2.30 -1.34 0.00 0.00 175.22 173.37 1xgn n PRO 51 N -0.21 2.42 -1.93 1.99 -0.02 -1.26 -4.60 135.00 131.38 1xgn n PRO 51 Ca -0.02 0.85 -0.41 0.00 -2.02 0.00 0.00 63.50 61.91 1xgn n PRO 51 Cb 0.59 -2.53 -0.01 0.00 -0.02 0.00 0.00 33.50 31.53 1xgn n PRO 51 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1xgn s VAL 52 N -0.72 2.36 -0.15 -1.45 0.11 -1.26 -4.88 120.40 114.41 1xgn s VAL 52 Ca 0.58 0.34 -0.03 0.00 -2.93 0.00 0.00 61.98 59.94 1xgn s VAL 52 Cb -0.53 -3.22 -0.03 0.00 -1.53 0.00 0.00 36.38 31.07 1xgn s VAL 52 CO 0.58 0.07 -0.05 0.20 -3.33 0.00 0.00 175.10 172.58 1xgn s ASN 53 N -0.09 4.73 -0.31 3.54 0.02 -0.21 -4.62 114.94 118.00 1xgn s ASN 53 Ca 0.54 -0.14 0.01 0.00 -1.02 0.00 0.00 52.86 52.25 1xgn s ASN 53 Cb -0.44 -1.75 0.09 0.00 0.02 0.00 0.00 41.25 39.18 1xgn s ASN 53 CO 0.55 0.18 0.06 -0.76 0.02 0.00 0.00 177.10 177.15 1xgn s LEU 54 N 0.30 3.21 -0.16 0.60 1.43 0.02 -0.84 118.68 123.24 1xgn s LEU 54 Ca -0.04 -1.75 -0.05 0.00 -1.03 0.00 0.00 54.13 51.26 1xgn s LEU 54 Cb -0.14 -1.19 -0.03 0.00 0.03 0.00 0.00 46.19 44.86 1xgn s LEU 54 CO 0.03 -0.37 -0.01 -0.44 0.23 0.00 0.00 176.35 175.78 1xgn s SER 55 N 1.32 4.96 -0.16 2.29 0.01 -0.56 -4.52 113.70 117.05 1xgn s SER 55 Ca 0.08 -0.09 -0.07 0.00 1.31 0.00 0.00 55.95 57.18 1xgn s SER 55 Cb -0.18 -1.82 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 1xgn s SER 55 CO -0.16 0.16 0.07 0.27 0.41 0.00 0.00 173.24 174.00 1xgn s ILE 56 N 0.41 4.90 0.00 1.44 -0.00 -1.24 -0.65 121.20 126.06 1xgn s ILE 56 Ca -0.02 -0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.62 1xgn s ILE 56 Cb -0.14 -3.17 0.00 0.00 -0.00 0.00 0.00 42.46 39.15 1xgn s ILE 56 CO 0.02 0.51 0.00 0.59 -0.00 0.00 0.00 174.94 176.06 1xgn n ASN 57 N 3.03 0.00 0.24 4.36 3.02 -0.50 -1.60 115.26 123.82 1xgn n ASN 57 Ca -0.17 0.00 0.16 0.00 -0.03 0.00 0.00 54.58 54.54 1xgn n ASN 57 Cb 0.53 0.00 0.70 0.00 -0.61 0.00 0.00 39.78 40.40 1xgn n ASN 57 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 1xgn h GLU 58 N 0.00 0.00 -5.59 3.52 9.09 -1.90 -2.90 114.58 116.81 1xgn h GLU 58 Ca 0.00 0.00 -0.60 0.00 0.05 0.00 0.00 59.36 58.81 1xgn h GLU 58 Cb 0.00 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.00 1xgn h GLU 58 CO 0.00 0.00 0.20 0.96 0.05 0.00 0.00 179.01 180.22 1xgn s ILE 59 N -3.63 4.97 -0.13 -1.06 -4.36 -0.63 -2.14 121.20 114.23 1xgn s ILE 59 Ca 0.01 1.22 -0.27 0.00 -0.26 0.00 0.00 60.65 61.35 1xgn s ILE 59 Cb 0.09 -3.97 -0.26 0.00 1.25 0.00 0.00 42.46 39.58 1xgn s ILE 59 CO 0.46 0.03 0.72 0.00 0.24 0.00 0.00 174.94 176.39 1xgn h ALA 60 N 7.77 0.02 -2.89 2.27 0.00 -1.14 -3.30 119.26 121.99 1xgn h ALA 60 Ca -0.27 -0.62 -0.26 0.00 0.00 0.00 0.00 54.91 53.76 1xgn h ALA 60 Cb 1.12 0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.93 1xgn h ALA 60 CO 0.79 0.15 -0.24 0.00 0.00 0.00 0.00 179.25 179.95 1xgn s ALA 61 N -2.27 0.76 -1.74 0.00 0.00 -1.25 -4.76 121.76 112.50 1xgn s ALA 61 Ca -0.19 -1.50 -0.01 0.00 0.00 0.00 0.00 51.96 50.26 1xgn s ALA 61 Cb -0.01 1.19 0.00 0.00 0.00 0.00 0.00 23.12 24.30 1xgn s ALA 61 CO 0.70 -0.77 0.12 0.72 0.00 0.00 0.00 175.76 176.53 1xgn n HIS 62 N -0.52 -1.20 -4.45 0.00 8.25 -1.26 -2.46 115.22 113.58 1xgn n HIS 62 Ca 0.01 0.10 -0.33 0.00 -0.26 0.00 0.00 57.72 57.24 1xgn n HIS 62 Cb 0.62 -4.08 -0.15 0.00 1.12 0.00 0.00 29.99 27.50 1xgn n HIS 62 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1xgn s TYR 63 N -3.07 2.78 -0.04 4.41 6.14 -1.26 -4.26 117.35 122.05 1xgn s TYR 63 Ca 0.06 -1.17 0.02 0.00 0.64 0.00 0.00 57.07 56.62 1xgn s TYR 63 Cb -0.03 -1.90 0.01 0.00 0.42 0.00 0.00 41.96 40.47 1xgn s TYR 63 CO 0.07 -0.55 -0.08 -0.08 0.64 0.00 0.00 175.55 175.56 1xgn s THR 64 N 0.94 0.74 1.29 4.34 -1.32 -1.26 -0.80 115.64 119.56 1xgn s THR 64 Ca -0.03 -0.27 -0.17 0.00 -1.21 0.00 0.00 61.69 60.01 1xgn s THR 64 Cb -0.15 -0.70 0.33 0.00 -1.51 0.00 0.00 72.50 70.47 1xgn s THR 64 CO -0.03 0.26 0.97 -2.16 -2.21 0.00 0.00 174.62 171.45 1xgn s PRO 65 N 0.62 -1.94 0.15 7.08 0.04 -1.26 -4.95 135.00 134.74 1xgn s PRO 65 Ca -0.10 0.58 -0.01 0.00 0.04 0.00 0.00 61.00 61.51 1xgn s PRO 65 Cb -0.13 -1.46 -0.04 0.00 0.04 0.00 0.00 34.50 32.92 1xgn s PRO 65 CO 0.01 -4.33 0.07 1.52 0.04 0.00 0.00 177.00 174.31 1xgn s TYR 66 N -2.32 0.94 -0.36 0.56 -0.85 -1.26 -4.72 117.35 109.34 1xgn s TYR 66 Ca 0.69 -1.27 -0.28 0.00 -0.52 0.00 0.00 57.07 55.68 1xgn s TYR 66 Cb -0.21 -0.50 -0.02 0.00 0.38 0.00 0.00 41.96 41.60 1xgn s TYR 66 CO 0.63 -0.55 1.85 0.15 -1.52 0.00 0.00 175.55 176.11 1xgn s LYS 67 N -4.08 3.20 0.00 -3.49 3.01 -1.26 -0.95 119.74 116.17 1xgn s LYS 67 Ca 0.28 1.37 0.00 0.00 -1.01 0.00 0.00 55.97 56.61 1xgn s LYS 67 Cb 0.07 -4.24 0.00 0.00 -1.01 0.00 0.00 37.83 32.65 1xgn s LYS 67 CO 0.04 -2.02 0.00 0.41 0.51 0.00 0.00 175.35 174.30 1xgn n GLY 68 N 5.49 1.14 3.69 -3.33 0.00 -1.26 -5.09 105.19 105.83 1xgn n GLY 68 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1xgn n GLY 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xgn s ASP 69 N -1.27 7.26 -0.21 1.61 3.68 -0.12 -4.92 116.67 122.69 1xgn s ASP 69 Ca 0.00 1.55 0.15 0.00 2.13 0.00 0.00 52.55 56.39 1xgn s ASP 69 Cb 0.00 -2.56 0.65 0.00 -1.45 0.00 0.00 42.92 39.57 1xgn s ASP 69 CO 0.00 -0.43 1.57 0.35 0.13 0.00 0.00 175.17 176.79 1xgn n THR 70 N 4.47 2.52 -2.35 1.71 -2.24 -1.26 -4.54 114.28 112.58 1xgn n THR 70 Ca 0.08 -1.71 -0.42 0.00 -2.27 0.00 0.00 64.05 59.74 1xgn n THR 70 Cb 0.49 -0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 68.41 1xgn n THR 70 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1xgn s THR 71 N -2.83 3.65 0.10 4.28 2.01 -1.26 -4.92 115.64 116.67 1xgn s THR 71 Ca 0.48 1.29 0.08 0.00 0.31 0.00 0.00 61.69 63.85 1xgn s THR 71 Cb 0.38 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 69.03 1xgn s THR 71 CO 0.12 0.16 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.31 1xgn s VAL 72 N 0.43 1.72 -0.35 3.82 1.01 -1.26 0.58 120.40 126.34 1xgn s VAL 72 Ca 0.56 -1.52 -0.29 0.00 0.00 0.00 0.00 61.98 60.73 1xgn s VAL 72 Cb -0.32 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.52 1xgn s VAL 72 CO 0.34 -0.04 1.17 -0.76 0.00 0.00 0.00 175.10 175.81 1xgn s LEU 73 N -1.85 3.84 0.26 3.92 1.02 -0.21 -4.91 118.68 120.76 1xgn s LEU 73 Ca 0.07 0.98 -0.12 0.00 0.02 0.00 0.00 54.13 55.07 1xgn s LEU 73 Cb -0.10 -3.54 -0.08 0.00 0.02 0.00 0.00 46.19 42.49 1xgn s LEU 73 CO 0.04 -1.04 0.63 -0.54 0.02 0.00 0.00 176.35 175.46 1xgn s LYS 74 N 4.02 3.90 0.31 1.70 1.02 -1.26 -0.54 119.74 128.90 1xgn s LYS 74 Ca 0.50 0.46 -0.29 0.00 0.02 0.00 0.00 55.97 56.66 1xgn s LYS 74 Cb -0.13 -2.58 -0.11 0.00 -0.52 0.00 0.00 37.83 34.50 1xgn s LYS 74 CO 0.22 0.26 1.54 -2.00 -0.92 0.00 0.00 175.35 174.45 1xgn s GLU 75 N -2.82 4.14 0.00 1.68 2.12 -1.26 -1.63 118.70 120.93 1xgn s GLU 75 Ca 0.50 2.54 0.00 0.00 0.36 0.00 0.00 54.97 58.37 1xgn s GLU 75 Cb -0.11 -3.02 0.00 0.00 0.26 0.00 0.00 34.13 31.26 1xgn s GLU 75 CO 0.19 -0.57 0.00 0.41 -0.54 0.00 0.00 175.26 174.76 1xgn n GLY 76 N 1.62 2.65 3.75 -1.50 0.00 0.51 -5.01 105.19 107.22 1xgn n GLY 76 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1xgn n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xgn s ASP 77 N -1.28 5.28 -0.82 1.61 -0.00 -0.65 -4.65 116.67 116.17 1xgn s ASP 77 Ca 0.00 2.77 -0.12 0.00 -0.00 0.00 0.00 52.55 55.20 1xgn s ASP 77 Cb 0.00 -2.64 0.21 0.00 -0.00 0.00 0.00 42.92 40.50 1xgn s ASP 77 CO 0.00 -1.56 0.74 -0.31 -0.00 0.00 0.00 175.17 174.04 1xgn s TYR 78 N -1.30 3.74 -0.45 4.23 1.51 -1.26 -0.42 117.35 123.40 1xgn s TYR 78 Ca 0.71 -2.18 -0.23 0.00 -1.01 0.00 0.00 57.07 54.36 1xgn s TYR 78 Cb -0.40 -3.71 0.02 0.00 -0.11 0.00 0.00 41.96 37.76 1xgn s TYR 78 CO 0.48 -0.96 0.80 -1.17 -1.11 0.00 0.00 175.55 173.59 1xgn s LEU 79 N -0.01 4.22 -0.09 -1.29 2.96 0.11 -1.41 118.68 123.17 1xgn s LEU 79 Ca 0.19 -0.06 -0.20 0.00 -0.22 0.00 0.00 54.13 53.84 1xgn s LEU 79 Cb -0.12 -2.99 -0.04 0.00 0.50 0.00 0.00 46.19 43.54 1xgn s LEU 79 CO -0.08 -0.92 0.55 -0.54 -1.32 0.00 0.00 176.35 174.04 1xgn s LYS 80 N 3.34 4.37 -0.29 1.98 1.02 0.18 0.06 119.74 130.39 1xgn s LYS 80 Ca 0.31 0.60 0.01 0.00 0.02 0.00 0.00 55.97 56.91 1xgn s LYS 80 Cb -0.12 -3.43 0.06 0.00 -0.52 0.00 0.00 37.83 33.82 1xgn s LYS 80 CO 0.23 0.15 -0.04 0.42 -0.92 0.00 0.00 175.35 175.18 1xgn s ILE 81 N 0.61 2.54 -0.21 2.17 1.01 0.11 -1.50 121.20 125.93 1xgn s ILE 81 Ca 0.30 -1.63 -0.06 0.00 0.00 0.00 0.00 60.65 59.26 1xgn s ILE 81 Cb -0.16 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 1xgn s ILE 81 CO 0.13 -0.14 0.02 -0.62 0.00 0.00 0.00 174.94 174.33 1xgn s ASP 82 N 1.17 4.95 0.13 3.58 3.68 -0.02 -1.43 116.67 128.74 1xgn s ASP 82 Ca -0.05 -0.19 0.10 0.00 2.13 0.00 0.00 52.55 54.54 1xgn s ASP 82 Cb -0.20 -1.86 -0.04 0.00 -1.45 0.00 0.00 42.92 39.37 1xgn s ASP 82 CO -0.04 0.04 -0.24 -0.69 0.13 0.00 0.00 175.17 174.37 1xgn s VAL 83 N 1.16 2.05 -0.18 1.11 1.01 0.07 -1.05 120.40 124.56 1xgn s VAL 83 Ca 0.03 -1.74 -0.11 0.00 0.00 0.00 0.00 61.98 60.16 1xgn s VAL 83 Cb -0.14 -1.85 0.06 0.00 0.00 0.00 0.00 36.38 34.44 1xgn s VAL 83 CO 0.02 -0.03 0.45 -0.83 0.00 0.00 0.00 175.10 174.71 1xgn s GLY 84 N -2.16 -0.37 0.02 4.51 0.00 -1.26 -1.04 107.32 107.03 1xgn s GLY 84 Ca 0.13 1.60 0.02 0.00 0.00 0.00 0.00 44.72 46.47 1xgn s GLY 84 CO 0.06 1.69 -0.07 -1.34 0.00 0.00 0.00 173.10 173.43 1xgn s VAL 85 N 1.26 0.55 0.12 1.40 -7.23 -0.58 -0.60 120.40 115.32 1xgn s VAL 85 Ca -0.08 -0.74 0.07 0.00 -1.81 0.00 0.00 61.98 59.42 1xgn s VAL 85 Cb -0.07 -0.55 -0.04 0.00 0.56 0.00 0.00 36.38 36.28 1xgn s VAL 85 CO -0.12 -0.15 -0.17 -1.38 -0.31 0.00 0.00 175.10 172.97 1xgn s HIS 86 N -0.84 1.60 -0.13 2.82 -3.43 0.76 -1.77 115.29 114.30 1xgn s HIS 86 Ca -0.04 -0.48 -0.00 0.00 -0.80 0.00 0.00 55.06 53.74 1xgn s HIS 86 Cb -0.07 -0.85 0.03 0.00 -1.43 0.00 0.00 32.58 30.26 1xgn s HIS 86 CO 0.00 0.20 -0.09 0.42 -2.00 0.00 0.00 174.74 173.27 1xgn s ILE 87 N -1.68 1.19 -0.27 -5.38 -1.09 -0.84 -2.65 121.20 110.48 1xgn s ILE 87 Ca 0.08 -0.42 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 1xgn s ILE 87 Cb -0.07 -1.19 0.00 0.00 -1.58 0.00 0.00 42.46 39.61 1xgn s ILE 87 CO 0.04 0.37 0.00 0.47 -1.23 0.00 0.00 174.94 174.59 1xgn n ASP 88 N 4.89 -3.12 0.00 3.58 8.00 -1.26 -0.61 116.55 128.03 1xgn n ASP 88 Ca -0.14 0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.43 1xgn n ASP 88 Cb 0.50 -2.25 0.00 0.00 -0.02 0.00 0.00 41.12 39.34 1xgn n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xgn n GLY 89 N 0.36 1.37 3.68 0.44 0.00 -1.26 -4.87 105.19 104.90 1xgn n GLY 89 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 1xgn n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xgn s PHE 90 N -2.02 3.42 0.22 1.61 0.08 0.22 -0.44 117.98 121.07 1xgn s PHE 90 Ca 0.00 0.93 -0.02 0.00 0.12 0.00 0.00 56.93 57.97 1xgn s PHE 90 Cb 0.00 -2.74 -0.04 0.00 -0.57 0.00 0.00 43.02 39.67 1xgn s PHE 90 CO 0.00 -0.07 0.43 0.42 -0.10 0.00 0.00 175.22 175.89 1xgn s ILE 91 N 1.52 5.16 -0.09 0.64 1.01 -1.26 -1.98 121.20 126.20 1xgn s ILE 91 Ca 0.28 -0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.64 1xgn s ILE 91 Cb -0.16 -3.73 0.04 0.00 0.01 0.00 0.00 42.46 38.62 1xgn s ILE 91 CO 0.11 -0.20 0.07 0.00 0.00 0.00 0.00 174.94 174.92 1xgn s ALA 92 N -1.91 0.31 -0.23 9.38 0.00 -0.73 -4.78 121.76 123.80 1xgn s ALA 92 Ca 0.40 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.38 1xgn s ALA 92 Cb -0.11 -0.77 0.05 0.00 0.00 0.00 0.00 23.12 22.28 1xgn s ALA 92 CO 0.29 -0.74 -0.14 0.34 0.00 0.00 0.00 175.76 175.52 1xgn s ASP 93 N 2.15 3.97 0.03 0.00 2.15 -1.26 -1.53 116.67 122.18 1xgn s ASP 93 Ca 0.04 -1.13 0.02 0.00 0.43 0.00 0.00 52.55 51.91 1xgn s ASP 93 Cb -0.13 -1.50 -0.02 0.00 -0.30 0.00 0.00 42.92 40.97 1xgn s ASP 93 CO -0.05 -0.13 -0.07 0.28 -0.17 0.00 0.00 175.17 175.02 1xgn s THR 94 N 1.18 0.54 0.09 1.71 -1.32 -0.21 -3.39 115.64 114.24 1xgn s THR 94 Ca -0.04 -0.86 -0.09 0.00 -1.21 0.00 0.00 61.69 59.49 1xgn s THR 94 Cb -0.18 -0.56 -0.00 0.00 -1.51 0.00 0.00 72.50 70.25 1xgn s THR 94 CO -0.08 -0.24 0.20 0.00 -2.21 0.00 0.00 174.62 172.29 1xgn s ALA 95 N -1.04 -0.25 -0.13 11.08 0.00 -0.68 -0.75 121.76 129.98 1xgn s ALA 95 Ca -0.06 -0.59 -0.25 0.00 0.00 0.00 0.00 51.96 51.05 1xgn s ALA 95 Cb -0.08 0.49 0.06 0.00 0.00 0.00 0.00 23.12 23.59 1xgn s ALA 95 CO 0.00 -0.51 0.62 0.54 0.00 0.00 0.00 175.76 176.42 1xgn s VAL 96 N -3.84 0.01 0.05 0.00 0.11 -0.52 -1.33 120.40 114.88 1xgn s VAL 96 Ca 0.05 -0.05 -0.05 0.00 -2.93 0.00 0.00 61.98 59.00 1xgn s VAL 96 Cb 0.05 -0.91 -0.05 0.00 -1.53 0.00 0.00 36.38 33.94 1xgn s VAL 96 CO -0.11 -0.03 0.28 -0.89 -3.33 0.00 0.00 175.10 171.02 1xgn s THR 97 N -0.52 5.29 -0.01 5.04 2.01 -0.74 0.08 115.64 126.78 1xgn s THR 97 Ca -0.06 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.94 1xgn s THR 97 Cb -0.03 -3.59 0.02 0.00 0.01 0.00 0.00 72.50 68.91 1xgn s THR 97 CO 0.05 0.23 0.02 -0.69 -0.69 0.00 0.00 174.62 173.54 1xgn s VAL 98 N -1.44 -0.01 -0.68 3.82 1.01 0.11 -4.95 120.40 118.26 1xgn s VAL 98 Ca 0.32 0.12 -0.19 0.00 0.00 0.00 0.00 61.98 62.24 1xgn s VAL 98 Cb -0.13 -0.07 0.12 0.00 0.00 0.00 0.00 36.38 36.30 1xgn s VAL 98 CO 0.21 0.06 0.80 -0.60 0.00 0.00 0.00 175.10 175.57 1xgn s ARG 99 N 0.68 3.21 -0.58 2.72 3.00 -1.26 0.06 118.95 126.77 1xgn s ARG 99 Ca -0.06 -1.49 -0.40 0.00 -1.00 0.00 0.00 55.73 52.78 1xgn s ARG 99 Cb -0.08 -4.39 -0.19 0.00 0.00 0.00 0.00 34.95 30.29 1xgn s ARG 99 CO -0.02 -1.57 2.26 0.28 0.00 0.00 0.00 175.30 176.25 1xgn n VAL 100 N 5.38 0.02 -1.25 7.11 0.31 0.44 -0.66 118.33 129.67 1xgn n VAL 100 Ca -0.01 -0.04 -0.05 0.00 -0.01 0.00 0.00 64.34 64.24 1xgn n VAL 100 Cb 0.44 -0.66 -0.02 0.00 -0.91 0.00 0.00 33.84 32.70 1xgn n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xgn n GLY 101 N 7.18 0.68 3.50 2.92 0.00 -1.26 -0.36 105.19 117.85 1xgn n GLY 101 Ca 0.55 -0.83 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1xgn n GLY 101 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xgn s MET 102 N -2.62 1.80 0.39 1.61 1.00 0.16 -4.88 119.30 116.76 1xgn s MET 102 Ca 0.00 -1.63 -0.05 0.00 0.00 0.00 0.00 55.69 54.01 1xgn s MET 102 Cb 0.00 0.44 -0.04 0.00 0.00 0.00 0.00 34.83 35.23 1xgn s MET 102 CO 0.00 -0.74 0.67 -1.21 0.00 0.00 0.00 175.02 173.74 1xgn s GLU 103 N -3.31 3.60 -0.08 2.03 8.01 -1.26 -4.51 118.70 123.18 1xgn s GLU 103 Ca 0.29 0.09 -0.36 0.00 0.01 0.00 0.00 54.97 55.00 1xgn s GLU 103 Cb -0.00 -2.51 -0.13 0.00 -4.31 0.00 0.00 34.13 27.18 1xgn s GLU 103 CO 0.17 0.01 1.75 0.39 0.01 0.00 0.00 175.26 177.59 1xgn n GLU 104 N -1.63 1.85 -2.69 1.61 1.02 -1.26 -4.87 120.64 114.67 1xgn n GLU 104 Ca -0.01 0.67 -0.22 0.00 -0.02 0.00 0.00 57.16 57.58 1xgn n GLU 104 Cb 0.55 -2.45 0.08 0.00 -0.02 0.00 0.00 31.44 29.60 1xgn n GLU 104 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1xgn s ASP 105 N 3.11 4.68 0.42 1.62 -4.77 -1.26 -4.93 116.67 115.55 1xgn s ASP 105 Ca 0.91 -0.39 0.10 0.00 -3.30 0.00 0.00 52.55 49.87 1xgn s ASP 105 Cb -0.80 -0.13 0.94 0.00 -1.09 0.00 0.00 42.92 41.84 1xgn s ASP 105 CO 0.52 -1.61 2.03 -0.33 0.70 0.00 0.00 175.17 176.49 1xgn h GLU 106 N -0.26 0.46 0.42 2.11 3.07 -1.99 -2.19 114.58 116.20 1xgn h GLU 106 Ca -0.36 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.45 1xgn h GLU 106 Cb 1.28 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 29.09 1xgn h GLU 106 CO 0.42 0.31 -0.20 1.25 -1.40 0.00 0.00 179.01 179.39 1xgn h LEU 107 N 0.48 -0.48 -0.94 1.33 6.46 -1.97 -1.33 115.31 118.86 1xgn h LEU 107 Ca 0.19 -0.11 0.18 0.00 -0.12 0.00 0.00 57.88 58.03 1xgn h LEU 107 Cb 0.17 0.12 -0.11 0.00 -0.73 0.00 0.00 40.66 40.12 1xgn h LEU 107 CO -0.05 -0.13 0.52 0.24 -0.62 0.00 0.00 178.44 178.41 1xgn h MET 108 N -0.89 0.65 -0.69 1.25 2.86 -1.89 0.20 114.93 116.43 1xgn h MET 108 Ca -0.06 -0.04 0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1xgn h MET 108 Cb 0.56 -0.15 -0.05 0.00 0.06 0.00 0.00 31.60 32.02 1xgn h MET 108 CO 0.10 0.43 0.41 1.49 1.06 0.00 0.00 176.91 180.40 1xgn h GLU 109 N 0.67 0.76 -0.37 1.72 4.81 -1.00 -0.13 114.58 121.03 1xgn h GLU 109 Ca 0.54 -0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.78 1xgn h GLU 109 Cb 0.84 -0.17 -0.05 0.00 0.63 0.00 0.00 28.75 30.00 1xgn h GLU 109 CO -0.40 0.50 0.04 0.00 -0.73 0.00 0.00 179.01 178.42 1xgn h ALA 110 N 1.33 0.37 0.53 2.92 0.00 0.54 0.35 119.26 125.30 1xgn h ALA 110 Ca 0.30 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.27 1xgn h ALA 110 Cb 0.11 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1xgn h ALA 110 CO -0.15 -0.36 -0.25 0.00 0.00 0.00 0.00 179.25 178.49 1xgn h ALA 111 N 1.30 -0.71 -0.87 0.00 0.00 -0.69 -0.64 119.26 117.64 1xgn h ALA 111 Ca 0.18 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.06 1xgn h ALA 111 Cb 0.23 0.28 -0.10 0.00 0.00 0.00 0.00 17.79 18.19 1xgn h ALA 111 CO -0.26 -0.81 0.45 -0.22 0.00 0.00 0.00 179.25 178.41 1xgn h LYS 112 N -0.89 0.60 -0.46 0.00 3.64 -0.83 0.18 116.57 118.81 1xgn h LYS 112 Ca -0.07 -0.04 -0.10 0.00 -1.27 0.00 0.00 60.65 59.17 1xgn h LYS 112 Cb 0.61 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 1xgn h LYS 112 CO 0.12 0.40 -0.12 0.93 -2.27 0.00 0.00 179.45 178.51 1xgn h GLU 113 N 0.62 0.85 -0.01 1.90 4.39 -0.12 -2.39 114.58 119.83 1xgn h GLU 113 Ca 0.48 -0.30 0.01 0.00 0.34 0.00 0.00 59.36 59.90 1xgn h GLU 113 Cb 0.71 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.28 1xgn h GLU 113 CO -0.38 0.93 -0.07 0.00 -1.16 0.00 0.00 179.01 178.33 1xgn h ALA 114 N 1.09 -0.07 -0.25 3.43 0.00 0.89 -1.42 119.26 122.93 1xgn h ALA 114 Ca 0.12 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.10 1xgn h ALA 114 Cb 0.63 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.49 1xgn h ALA 114 CO 0.04 -0.56 -0.16 1.25 0.00 0.00 0.00 179.25 179.82 1xgn h LEU 115 N -0.12 -0.52 -0.14 0.00 5.85 -0.87 0.06 115.31 119.56 1xgn h LEU 115 Ca 0.03 0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.91 1xgn h LEU 115 Cb 0.17 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 1xgn h LEU 115 CO -0.08 -0.20 -0.34 0.78 -0.34 0.00 0.00 178.44 178.26 1xgn h ASN 116 N -0.14 -1.07 -0.99 1.25 2.35 -1.07 0.12 115.58 116.03 1xgn h ASN 116 Ca 0.14 0.15 0.17 0.00 -0.55 0.00 0.00 56.30 56.22 1xgn h ASN 116 Cb 0.35 0.45 -0.09 0.00 0.05 0.00 0.00 38.32 39.08 1xgn h ASN 116 CO -0.34 -0.37 0.61 0.00 -1.65 0.00 0.00 177.43 175.68 1xgn h ALA 117 N 0.37 1.72 0.29 -0.83 0.00 -0.45 0.35 119.26 120.70 1xgn h ALA 117 Ca 0.10 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1xgn h ALA 117 Cb 0.57 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1xgn h ALA 117 CO -0.37 -0.05 -0.14 0.00 0.00 0.00 0.00 179.25 178.69 1xgn h ALA 118 N 1.61 -0.38 -0.25 0.00 0.00 0.36 -3.14 119.26 117.46 1xgn h ALA 118 Ca 0.54 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.34 1xgn h ALA 118 Cb 0.83 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.71 1xgn h ALA 118 CO -0.32 -0.57 -0.19 0.82 0.00 0.00 0.00 179.25 178.99 1xgn h ILE 119 N -0.68 0.48 -0.34 0.00 2.04 0.19 -1.76 117.51 117.43 1xgn h ILE 119 Ca -0.04 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.92 1xgn h ILE 119 Cb 0.47 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 1xgn h ILE 119 CO 0.06 0.00 0.32 0.77 0.00 0.00 0.00 178.15 179.30 1xgn h SER 120 N -0.19 0.00 -0.01 1.72 4.64 -0.49 -1.18 113.55 118.05 1xgn h SER 120 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1xgn h SER 120 Cb 0.40 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1xgn h SER 120 CO -0.36 0.00 -0.51 1.33 -0.87 0.00 0.00 176.83 176.42 1xgn n VAL 121 N -3.95 0.00 -2.30 0.95 0.24 -0.73 -4.94 118.33 107.60 1xgn n VAL 121 Ca 0.05 -0.24 -0.42 0.00 -2.04 0.00 0.00 64.34 61.69 1xgn n VAL 121 Cb 0.49 1.14 -0.03 0.00 -1.47 0.00 0.00 33.84 33.97 1xgn n VAL 121 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xgn s ALA 122 N -2.24 3.49 0.15 2.33 0.00 -0.45 -4.96 121.76 120.08 1xgn s ALA 122 Ca 0.12 0.98 -0.25 0.00 0.00 0.00 0.00 51.96 52.81 1xgn s ALA 122 Cb 0.14 -3.49 0.06 0.00 0.00 0.00 0.00 23.12 19.83 1xgn s ALA 122 CO 0.53 -0.53 0.92 -0.98 0.00 0.00 0.00 175.76 175.70 1xgn s ARG 123 N 1.10 1.21 0.72 0.00 1.70 -1.26 -4.08 118.95 118.34 1xgn s ARG 123 Ca 0.62 -0.64 -0.16 0.00 -0.47 0.00 0.00 55.73 55.07 1xgn s ARG 123 Cb -0.33 0.43 0.03 0.00 -0.57 0.00 0.00 34.95 34.51 1xgn s ARG 123 CO 0.30 -0.55 1.26 0.00 -1.08 0.00 0.00 175.30 175.23 1xgn s ALA 124 N -3.34 2.14 -1.33 7.88 0.00 -0.92 -3.40 121.76 122.79 1xgn s ALA 124 Ca 0.11 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.14 1xgn s ALA 124 Cb -0.02 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1xgn s ALA 124 CO 0.01 -1.92 0.00 0.41 0.00 0.00 0.00 175.76 174.26 1xgn n GLY 125 N 0.75 0.00 3.19 0.00 0.00 0.21 -4.90 105.19 104.43 1xgn n GLY 125 Ca 0.15 -0.26 -0.27 0.00 0.00 0.00 0.00 46.02 45.64 1xgn n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xgn s VAL 126 N -2.72 1.56 0.31 1.61 0.11 -1.22 -4.82 120.40 115.22 1xgn s VAL 126 Ca 0.00 -0.82 -0.29 0.00 -2.93 0.00 0.00 61.98 57.94 1xgn s VAL 126 Cb 0.00 -1.31 -0.10 0.00 -1.53 0.00 0.00 36.38 33.44 1xgn s VAL 126 CO 0.00 0.44 1.31 -1.61 -3.33 0.00 0.00 175.10 171.91 1xgn s GLU 127 N -0.27 4.36 0.32 1.54 2.02 -1.26 -1.69 118.70 123.73 1xgn s GLU 127 Ca 0.03 2.19 0.07 0.00 0.02 0.00 0.00 54.97 57.28 1xgn s GLU 127 Cb -0.09 -3.09 0.75 0.00 0.10 0.00 0.00 34.13 31.79 1xgn s GLU 127 CO 0.01 -0.20 1.81 0.82 0.02 0.00 0.00 175.26 177.72 1xgn h ILE 128 N 3.16 0.77 -0.48 -1.63 2.04 -1.29 -0.97 117.51 119.10 1xgn h ILE 128 Ca -0.48 -0.26 0.14 0.00 1.00 0.00 0.00 64.86 65.25 1xgn h ILE 128 Cb 1.22 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1xgn h ILE 128 CO 0.68 0.14 0.57 0.07 0.00 0.00 0.00 178.15 179.61 1xgn h LYS 129 N 0.77 0.00 -0.02 2.37 2.10 -1.80 0.85 116.57 120.84 1xgn h LYS 129 Ca 0.53 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 59.17 1xgn h LYS 129 Cb 0.82 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.15 1xgn h LYS 129 CO -0.31 0.00 -0.01 0.93 -2.00 0.00 0.00 179.45 178.06 1xgn h GLU 130 N 0.00 0.05 0.03 0.07 4.39 -1.49 0.75 114.58 118.37 1xgn h GLU 130 Ca 0.23 -0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.93 1xgn h GLU 130 Cb 1.36 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.96 1xgn h GLU 130 CO -0.00 0.49 -0.43 -0.07 -1.16 0.00 0.00 179.01 177.84 1xgn h LEU 131 N -0.40 -1.30 -1.52 1.33 -0.00 0.58 0.15 115.31 114.15 1xgn h LEU 131 Ca 0.00 0.15 0.14 0.00 -0.00 0.00 0.00 57.88 58.18 1xgn h LEU 131 Cb 0.48 0.50 -0.05 0.00 -0.00 0.00 0.00 40.66 41.59 1xgn h LEU 131 CO 0.00 -0.47 0.51 1.23 -0.00 0.00 0.00 178.44 179.71 1xgn h GLY 132 N -0.60 0.79 1.27 0.83 0.00 -1.29 0.26 103.07 104.33 1xgn h GLY 132 Ca 0.04 -0.20 -0.10 0.00 0.00 0.00 0.00 47.33 47.06 1xgn h GLY 132 CO -0.30 0.08 -0.12 1.70 0.00 0.00 0.00 176.54 177.89 1xgn h LYS 133 N 0.48 0.86 -0.20 4.80 3.64 0.17 -1.43 116.57 124.89 1xgn h LYS 133 Ca 0.37 -0.30 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 1xgn h LYS 133 Cb 0.78 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1xgn h LYS 133 CO -0.13 0.94 0.04 0.00 -2.27 0.00 0.00 179.45 178.02 1xgn h ALA 134 N 1.09 0.26 0.27 5.00 0.00 0.18 -2.12 119.26 123.95 1xgn h ALA 134 Ca 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1xgn h ALA 134 Cb 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1xgn h ALA 134 CO 0.04 -0.07 -0.13 0.82 0.00 0.00 0.00 179.25 179.91 1xgn h ILE 135 N 0.13 0.75 -0.46 0.00 2.04 -1.08 -2.91 117.51 115.98 1xgn h ILE 135 Ca 0.06 -0.13 0.09 0.00 1.00 0.00 0.00 64.86 65.88 1xgn h ILE 135 Cb 0.30 0.82 -0.08 0.00 -0.74 0.00 0.00 36.82 37.13 1xgn h ILE 135 CO 0.00 0.03 0.00 -0.08 0.00 0.00 0.00 178.15 178.10 1xgn h GLU 136 N -0.43 0.11 -0.12 2.37 4.81 -1.20 -2.31 114.58 117.81 1xgn h GLU 136 Ca -0.04 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1xgn h GLU 136 Cb 0.33 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1xgn h GLU 136 CO 0.06 0.07 -0.11 -0.91 -0.73 0.00 0.00 179.01 177.39 1xgn h ASN 137 N 0.11 0.17 0.90 1.04 4.21 -1.33 -0.92 115.58 119.77 1xgn h ASN 137 Ca 0.23 -0.03 -0.19 0.00 1.21 0.00 0.00 56.30 57.52 1xgn h ASN 137 Cb 0.34 -0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 37.47 1xgn h ASN 137 CO -0.38 0.31 -0.92 -0.08 -1.29 0.00 0.00 177.43 175.07 1xgn h GLU 138 N 0.18 0.01 0.18 0.81 4.57 -1.22 -0.62 114.58 118.49 1xgn h GLU 138 Ca 0.04 -0.01 -0.30 0.00 -1.18 0.00 0.00 59.36 57.90 1xgn h GLU 138 Cb 0.31 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.93 1xgn h GLU 138 CO 0.02 0.92 -1.34 0.82 -1.18 0.00 0.00 179.01 178.25 1xgn h ILE 139 N 0.00 1.39 0.01 2.32 2.04 -1.16 -3.27 117.51 118.85 1xgn h ILE 139 Ca -0.01 -2.85 -0.24 0.00 1.00 0.00 0.00 64.86 62.76 1xgn h ILE 139 Cb 1.63 2.95 0.01 0.00 -0.74 0.00 0.00 36.82 40.67 1xgn h ILE 139 CO 0.12 0.84 -1.00 0.03 0.00 0.00 0.00 178.15 178.15 1xgn h ARG 140 N 0.13 0.48 -0.17 2.37 3.08 -1.21 -2.20 114.38 116.86 1xgn h ARG 140 Ca -0.19 -0.54 0.04 0.00 0.07 0.00 0.00 59.98 59.37 1xgn h ARG 140 Cb 2.04 0.16 -0.01 0.00 0.08 0.00 0.00 29.97 32.24 1xgn h ARG 140 CO 0.24 1.18 0.12 1.57 -1.07 0.00 0.00 179.97 182.01 1xgn h LYS 141 N 0.26 0.03 -0.11 0.04 2.10 -1.21 -0.31 116.57 117.37 1xgn h LYS 141 Ca -0.10 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 1xgn h LYS 141 Cb 1.64 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.97 1xgn h LYS 141 CO 0.18 0.02 0.00 0.54 -2.00 0.00 0.00 179.45 178.19 1xgn n ARG 142 N -4.49 1.87 0.00 0.07 1.74 -1.20 -4.93 116.66 109.71 1xgn n ARG 142 Ca 0.01 -1.28 0.00 0.00 -0.77 0.00 0.00 57.85 55.81 1xgn n ARG 142 Cb 0.24 -1.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 1xgn n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xgn n GLY 143 N 1.22 0.37 1.66 -0.13 0.00 -0.13 -5.05 105.19 103.13 1xgn n GLY 143 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1xgn n GLY 143 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1xgn n PHE 144 N -1.64 -2.31 -4.96 1.61 3.01 -0.83 -5.00 117.46 107.33 1xgn n PHE 144 Ca 0.00 -0.93 -0.28 0.00 1.01 0.00 0.00 57.45 57.25 1xgn n PHE 144 Cb 0.00 -0.22 -0.16 0.00 -0.01 0.00 0.00 39.48 39.08 1xgn n PHE 144 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1xgn s LYS 145 N -3.08 2.11 0.19 -1.08 1.02 -0.32 -3.84 119.74 114.74 1xgn s LYS 145 Ca 0.23 -0.70 -0.29 0.00 0.02 0.00 0.00 55.97 55.23 1xgn s LYS 145 Cb -0.02 -1.78 -0.08 0.00 -0.52 0.00 0.00 37.83 35.44 1xgn s LYS 145 CO 0.15 0.25 0.92 -1.25 -0.92 0.00 0.00 175.35 174.50 1xgn s PRO 146 N 0.08 4.77 -0.14 -1.68 0.04 -1.26 -0.00 135.00 136.82 1xgn s PRO 146 Ca -0.07 1.43 -0.29 0.00 0.04 0.00 0.00 61.00 62.11 1xgn s PRO 146 Cb -0.13 -3.31 -0.05 0.00 0.04 0.00 0.00 34.50 31.05 1xgn s PRO 146 CO 0.03 0.43 1.82 0.42 0.04 0.00 0.00 177.00 179.75 1xgn s ILE 147 N -0.82 3.39 0.10 0.56 -1.09 -0.57 -4.78 121.20 118.00 1xgn s ILE 147 Ca 0.42 0.45 -0.16 0.00 -2.23 0.00 0.00 60.65 59.13 1xgn s ILE 147 Cb -0.25 -3.38 -0.07 0.00 -1.58 0.00 0.00 42.46 37.19 1xgn s ILE 147 CO 0.31 -0.14 1.49 0.58 -1.23 0.00 0.00 174.94 175.95 1xgn h VAL 148 N 6.13 1.28 -0.40 2.92 2.07 -1.49 -3.31 116.25 123.45 1xgn h VAL 148 Ca -0.40 -1.15 -0.18 0.00 0.82 0.00 0.00 66.70 65.79 1xgn h VAL 148 Cb 1.19 1.40 -0.11 0.00 -1.52 0.00 0.00 31.29 32.25 1xgn h VAL 148 CO 0.97 0.37 0.23 -0.46 0.02 0.00 0.00 177.57 178.70 1xgn n ASN 149 N -4.45 3.29 -3.96 0.57 6.94 -1.26 -4.65 115.26 111.73 1xgn n ASN 149 Ca -0.03 -2.65 -0.15 0.00 -0.02 0.00 0.00 54.58 51.72 1xgn n ASN 149 Cb 0.34 -0.64 -0.14 0.00 -2.36 0.00 0.00 39.78 36.98 1xgn n ASN 149 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1xgn s LEU 150 N -1.41 2.03 0.33 -4.53 1.43 -1.25 -4.91 118.68 110.37 1xgn s LEU 150 Ca 0.25 -0.13 -0.06 0.00 -1.03 0.00 0.00 54.13 53.17 1xgn s LEU 150 Cb 0.21 -0.25 0.01 0.00 0.03 0.00 0.00 46.19 46.19 1xgn s LEU 150 CO 0.05 0.04 0.51 -0.44 0.23 0.00 0.00 176.35 176.74 1xgn s SER 151 N -0.23 0.64 0.74 2.29 0.01 -1.26 -3.96 113.70 111.92 1xgn s SER 151 Ca 0.01 -1.36 -0.07 0.00 1.31 0.00 0.00 55.95 55.84 1xgn s SER 151 Cb -0.03 0.67 0.09 0.00 0.21 0.00 0.00 66.02 66.97 1xgn s SER 151 CO -0.00 -1.32 1.05 -0.83 0.41 0.00 0.00 173.24 172.55 1xgn s GLY 152 N -3.18 1.72 0.01 3.44 0.00 0.13 -4.80 107.32 104.63 1xgn s GLY 152 Ca 0.27 -1.11 0.00 0.00 0.00 0.00 0.00 44.72 43.89 1xgn s GLY 152 CO 0.17 -0.62 -0.02 -2.38 0.00 0.00 0.00 173.10 170.25 1xgn s HIS 153 N -3.32 0.18 0.39 1.90 -3.43 -0.95 -2.39 115.29 107.67 1xgn s HIS 153 Ca 0.63 -0.24 -0.25 0.00 -0.80 0.00 0.00 55.06 54.40 1xgn s HIS 153 Cb -0.09 -0.12 -0.09 0.00 -1.43 0.00 0.00 32.58 30.85 1xgn s HIS 153 CO 0.46 -0.08 1.10 0.21 -2.00 0.00 0.00 174.74 174.43 1xgn s LYS 154 N -0.67 4.14 0.07 -0.38 2.20 -0.63 -1.48 119.74 123.00 1xgn s LYS 154 Ca -0.07 1.65 0.10 0.00 -0.36 0.00 0.00 55.97 57.29 1xgn s LYS 154 Cb -0.05 -2.63 -0.03 0.00 -1.51 0.00 0.00 37.83 33.61 1xgn s LYS 154 CO -0.00 -0.19 -0.26 0.42 -0.36 0.00 0.00 175.35 174.96 1xgn s ILE 155 N -1.53 2.26 0.03 5.43 1.01 0.29 -1.33 121.20 127.36 1xgn s ILE 155 Ca 0.57 -1.49 -0.06 0.00 0.00 0.00 0.00 60.65 59.67 1xgn s ILE 155 Cb -0.26 -1.93 -0.01 0.00 0.01 0.00 0.00 42.46 40.27 1xgn s ILE 155 CO 0.32 0.27 0.10 -1.61 0.00 0.00 0.00 174.94 174.02 1xgn s GLU 156 N -1.53 0.57 0.12 2.79 2.02 -1.02 -4.37 118.70 117.26 1xgn s GLU 156 Ca 0.13 -0.70 -0.35 0.00 0.02 0.00 0.00 54.97 54.06 1xgn s GLU 156 Cb -0.10 0.22 -0.17 0.00 0.10 0.00 0.00 34.13 34.19 1xgn s GLU 156 CO 0.04 -0.14 1.22 -2.13 0.02 0.00 0.00 175.26 174.26 1xgn n ARG 157 N 0.88 1.00 -3.34 1.61 0.63 -1.26 -0.60 116.66 115.59 1xgn n ARG 157 Ca -0.20 0.36 -0.22 0.00 -0.92 0.00 0.00 57.85 56.87 1xgn n ARG 157 Cb 0.58 -1.91 -0.01 0.00 0.45 0.00 0.00 32.46 31.57 1xgn n ARG 157 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1xgn n TYR 158 N 1.92 -1.72 -3.40 -0.14 4.01 0.41 -4.89 117.16 113.35 1xgn n TYR 158 Ca 0.17 0.41 -0.18 0.00 -0.16 0.00 0.00 57.90 58.14 1xgn n TYR 158 Cb 0.20 -2.62 -0.10 0.00 -0.31 0.00 0.00 39.34 36.51 1xgn n TYR 158 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1xgn s LYS 159 N -5.97 0.39 0.36 -0.72 2.20 0.23 -4.69 119.74 111.54 1xgn s LYS 159 Ca 0.38 -0.38 0.08 0.00 -0.36 0.00 0.00 55.97 55.69 1xgn s LYS 159 Cb -0.20 -0.73 0.68 0.00 -1.51 0.00 0.00 37.83 36.07 1xgn s LYS 159 CO 0.46 -1.07 1.86 1.25 -0.36 0.00 0.00 175.35 177.49 1xgn h LEU 160 N 7.95 0.26 -6.91 5.43 5.85 -1.90 -2.71 115.31 123.27 1xgn h LEU 160 Ca -0.09 -0.06 -0.56 0.00 0.84 0.00 0.00 57.88 58.01 1xgn h LEU 160 Cb 1.06 -0.07 -0.40 0.00 0.37 0.00 0.00 40.66 41.62 1xgn h LEU 160 CO 0.31 0.46 -0.78 -2.28 -0.34 0.00 0.00 178.44 175.82 1xgn s HIS 161 N -4.60 0.94 0.33 1.25 2.46 -1.26 -4.65 115.29 109.75 1xgn s HIS 161 Ca -0.05 -1.33 0.01 0.00 0.47 0.00 0.00 55.06 54.15 1xgn s HIS 161 Cb 0.15 -1.25 0.55 0.00 -0.13 0.00 0.00 32.58 31.91 1xgn s HIS 161 CO 0.75 -0.85 1.96 0.00 -2.47 0.00 0.00 174.74 174.13 1xgn h ALA 162 N 8.09 1.45 0.00 1.58 0.00 -1.39 -3.47 119.26 125.52 1xgn h ALA 162 Ca -0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1xgn h ALA 162 Cb 1.00 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1xgn h ALA 162 CO 0.44 0.47 0.00 0.41 0.00 0.00 0.00 179.25 180.56 1xgn n GLY 163 N -1.29 0.46 3.55 0.00 0.00 -1.26 -5.04 105.19 101.61 1xgn n GLY 163 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1xgn n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xgn s ILE 164 N -0.56 4.01 0.18 -0.61 -1.09 -1.26 -5.02 121.20 116.85 1xgn s ILE 164 Ca 0.00 -0.33 0.09 0.00 -2.23 0.00 0.00 60.65 58.18 1xgn s ILE 164 Cb 0.00 -2.73 -0.04 0.00 -1.58 0.00 0.00 42.46 38.11 1xgn s ILE 164 CO 0.00 0.52 -0.09 -0.44 -1.23 0.00 0.00 174.94 173.71 1xgn s SER 165 N 0.01 4.30 -0.51 3.58 0.01 -1.26 -1.61 113.70 118.21 1xgn s SER 165 Ca 0.01 -0.56 0.04 0.00 1.31 0.00 0.00 55.95 56.75 1xgn s SER 165 Cb -0.13 -0.75 0.13 0.00 0.21 0.00 0.00 66.02 65.48 1xgn s SER 165 CO 0.02 0.10 0.27 -0.63 0.41 0.00 0.00 173.24 173.42 1xgn s ILE 166 N -1.71 2.30 0.93 1.44 1.01 -1.01 -4.95 121.20 119.22 1xgn s ILE 166 Ca 0.25 -3.21 -0.11 0.00 0.00 0.00 0.00 60.65 57.58 1xgn s ILE 166 Cb -0.09 -2.59 0.15 0.00 0.01 0.00 0.00 42.46 39.94 1xgn s ILE 166 CO 0.15 -0.84 1.09 -2.16 0.00 0.00 0.00 174.94 173.18 1xgn s PRO 167 N -0.23 0.96 -0.41 2.79 0.04 -1.26 -0.70 135.00 136.20 1xgn s PRO 167 Ca 0.18 0.91 0.02 0.00 0.04 0.00 0.00 61.00 62.15 1xgn s PRO 167 Cb -0.24 -1.77 0.47 0.00 0.04 0.00 0.00 34.50 33.01 1xgn s PRO 167 CO -0.01 -2.47 1.82 0.09 0.04 0.00 0.00 177.00 176.46 1xgn n ASN 168 N -4.05 4.68 -4.01 6.66 5.03 -1.25 -4.06 115.26 118.25 1xgn n ASN 168 Ca 0.07 -3.33 -0.10 0.00 0.87 0.00 0.00 54.58 52.09 1xgn n ASN 168 Cb 0.55 -0.84 -0.08 0.00 -1.02 0.00 0.00 39.78 38.39 1xgn n ASN 168 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1xgn s ILE 169 N -2.96 0.07 -0.26 2.41 -1.09 -1.24 -3.94 121.20 114.20 1xgn s ILE 169 Ca 0.47 -1.52 -0.09 0.00 -2.23 0.00 0.00 60.65 57.27 1xgn s ILE 169 Cb 0.38 -1.93 -0.04 0.00 -1.58 0.00 0.00 42.46 39.29 1xgn s ILE 169 CO 0.06 -0.30 0.13 -0.47 -1.23 0.00 0.00 174.94 173.13 1xgn s TYR 170 N -4.00 3.17 -0.04 3.97 6.14 -1.25 -3.99 117.35 121.36 1xgn s TYR 170 Ca 0.20 -0.11 0.06 0.00 0.64 0.00 0.00 57.07 57.86 1xgn s TYR 170 Cb 0.04 -2.29 -0.01 0.00 0.42 0.00 0.00 41.96 40.12 1xgn s TYR 170 CO 0.01 -0.20 -0.23 1.03 0.64 0.00 0.00 175.55 176.80 1xgn s ARG 171 N 1.54 2.14 0.00 4.97 0.52 -1.26 -5.00 118.95 121.86 1xgn s ARG 171 Ca 0.06 -0.82 0.17 0.00 -0.52 0.00 0.00 55.73 54.62 1xgn s ARG 171 Cb -0.15 -1.91 0.77 0.00 0.52 0.00 0.00 34.95 34.18 1xgn s ARG 171 CO 0.07 0.40 1.51 -0.35 0.02 0.00 0.00 175.30 176.95 1xgn n PRO 172 N 2.82 0.12 -0.30 3.54 -0.04 -1.26 -2.82 135.00 137.06 1xgn n PRO 172 Ca -0.17 0.17 0.07 0.00 -0.04 0.00 0.00 63.50 63.54 1xgn n PRO 172 Cb 0.52 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.68 1xgn n PRO 172 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1xgn n HIS 173 N -1.39 0.66 -3.05 0.54 1.44 -1.26 -4.73 115.22 107.42 1xgn n HIS 173 Ca 0.06 -0.71 -0.44 0.00 -2.01 0.00 0.00 57.72 54.61 1xgn n HIS 173 Cb 0.16 -0.18 -0.00 0.00 0.12 0.00 0.00 29.99 30.09 1xgn n HIS 173 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1xgn s ASP 174 N -1.56 7.06 -0.05 4.39 1.01 -1.13 -4.82 116.67 121.58 1xgn s ASP 174 Ca 0.32 -3.01 0.17 0.00 0.71 0.00 0.00 52.55 50.74 1xgn s ASP 174 Cb 0.23 -2.35 0.57 0.00 1.01 0.00 0.00 42.92 42.38 1xgn s ASP 174 CO 0.11 -0.67 1.46 -0.46 0.21 0.00 0.00 175.17 175.82 1xgn n ASN 175 N 5.01 3.63 -4.75 0.27 0.23 -1.26 -2.70 115.26 115.69 1xgn n ASN 175 Ca 0.31 -2.18 -0.42 0.00 -0.53 0.00 0.00 54.58 51.76 1xgn n ASN 175 Cb 0.43 -0.46 -0.02 0.00 -2.08 0.00 0.00 39.78 37.65 1xgn n ASN 175 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1xgn s TYR 176 N -1.50 2.81 -0.18 -2.53 6.14 -1.26 -4.77 117.35 116.07 1xgn s TYR 176 Ca 0.41 0.77 -0.07 0.00 0.64 0.00 0.00 57.07 58.82 1xgn s TYR 176 Cb 0.24 -4.04 -0.04 0.00 0.42 0.00 0.00 41.96 38.54 1xgn s TYR 176 CO 0.24 -3.54 0.06 0.54 0.64 0.00 0.00 175.55 173.49 1xgn s VAL 177 N 0.14 4.74 0.16 3.14 0.11 -1.26 -1.27 120.40 126.15 1xgn s VAL 177 Ca 0.64 -0.05 -0.32 0.00 -2.93 0.00 0.00 61.98 59.32 1xgn s VAL 177 Cb -0.47 -3.13 -0.12 0.00 -1.53 0.00 0.00 36.38 31.13 1xgn s VAL 177 CO 0.45 0.47 1.77 0.18 -3.33 0.00 0.00 175.10 174.64 1xgn n LEU 178 N 3.49 3.95 -4.62 2.54 4.77 -0.68 -4.80 117.00 121.65 1xgn n LEU 178 Ca -0.17 1.03 -0.32 0.00 -0.03 0.00 0.00 56.01 56.52 1xgn n LEU 178 Cb 0.52 -1.55 -0.10 0.00 -2.33 0.00 0.00 43.42 39.96 1xgn n LEU 178 CO 0.35 0.15 -0.37 -0.54 -1.33 0.00 0.00 177.39 175.65 1xgn s LYS 179 N 1.90 2.61 0.40 3.23 1.02 -1.26 0.65 119.74 128.29 1xgn s LYS 179 Ca 0.79 -0.69 -0.24 0.00 0.02 0.00 0.00 55.97 55.84 1xgn s LYS 179 Cb -0.51 -2.55 -0.12 0.00 -0.52 0.00 0.00 37.83 34.14 1xgn s LYS 179 CO 0.35 0.61 0.89 0.39 -0.92 0.00 0.00 175.35 176.67 1xgn n GLU 180 N 1.51 1.12 0.00 1.68 1.02 -1.26 -1.23 120.64 123.48 1xgn n GLU 180 Ca -0.15 0.40 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1xgn n GLU 180 Cb 0.53 -1.86 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1xgn n GLU 180 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xgn n GLY 181 N 1.35 2.90 3.77 0.62 0.00 0.15 -4.99 105.19 108.99 1xgn n GLY 181 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 1xgn n GLY 181 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xgn s ASP 182 N -2.36 5.95 -0.13 1.61 1.01 -0.36 -4.60 116.67 117.78 1xgn s ASP 182 Ca 0.00 2.94 0.01 0.00 0.71 0.00 0.00 52.55 56.21 1xgn s ASP 182 Cb 0.00 -2.66 0.02 0.00 1.01 0.00 0.00 42.92 41.29 1xgn s ASP 182 CO 0.00 -1.13 -0.16 0.54 0.21 0.00 0.00 175.17 174.64 1xgn s VAL 183 N -1.19 1.61 0.18 -1.27 0.11 -1.26 0.14 120.40 118.72 1xgn s VAL 183 Ca 0.60 -0.68 0.09 0.00 -2.93 0.00 0.00 61.98 59.05 1xgn s VAL 183 Cb -0.44 -1.48 -0.04 0.00 -1.53 0.00 0.00 36.38 32.88 1xgn s VAL 183 CO 0.57 0.46 -0.18 -0.36 -3.33 0.00 0.00 175.10 172.26 1xgn s PHE 184 N 1.23 1.88 -0.16 1.54 0.08 0.11 -0.54 117.98 122.12 1xgn s PHE 184 Ca -0.00 -0.46 -0.02 0.00 0.12 0.00 0.00 56.93 56.56 1xgn s PHE 184 Cb -0.14 -0.92 -0.02 0.00 -0.57 0.00 0.00 43.02 41.38 1xgn s PHE 184 CO -0.07 0.37 -0.08 0.00 -0.10 0.00 0.00 175.22 175.34 1xgn s ALA 185 N -2.16 2.76 -0.24 5.36 0.00 -0.55 0.12 121.76 127.05 1xgn s ALA 185 Ca 0.18 -0.96 -0.06 0.00 0.00 0.00 0.00 51.96 51.12 1xgn s ALA 185 Cb -0.05 -1.44 -0.02 0.00 0.00 0.00 0.00 23.12 21.61 1xgn s ALA 185 CO 0.07 0.03 0.02 0.42 0.00 0.00 0.00 175.76 176.30 1xgn s ILE 186 N 0.70 3.86 -0.34 0.00 1.01 -1.00 -2.23 121.20 123.19 1xgn s ILE 186 Ca -0.04 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.27 1xgn s ILE 186 Cb -0.15 -2.79 0.12 0.00 0.01 0.00 0.00 42.46 39.65 1xgn s ILE 186 CO 0.02 0.37 0.16 -1.83 0.00 0.00 0.00 174.94 173.67 1xgn s GLU 187 N 1.55 0.65 0.42 2.79 -1.05 -1.26 -3.35 118.70 118.44 1xgn s GLU 187 Ca 0.06 -1.19 -0.22 0.00 -0.15 0.00 0.00 54.97 53.47 1xgn s GLU 187 Cb -0.15 -1.66 -0.10 0.00 -0.44 0.00 0.00 34.13 31.78 1xgn s GLU 187 CO 0.00 -1.09 0.97 -1.25 0.95 0.00 0.00 175.26 174.84 1xgn s PRO 188 N 1.34 4.21 -0.02 -4.83 0.04 -1.21 -4.49 135.00 130.05 1xgn s PRO 188 Ca 0.13 1.22 0.05 0.00 0.04 0.00 0.00 61.00 62.44 1xgn s PRO 188 Cb -0.20 -2.29 -0.01 0.00 0.04 0.00 0.00 34.50 32.04 1xgn s PRO 188 CO -0.16 -0.05 -0.15 -0.06 0.04 0.00 0.00 177.00 176.62 1xgn s PHE 189 N -2.02 1.37 0.10 0.56 0.08 -1.26 -3.44 117.98 113.36 1xgn s PHE 189 Ca 0.61 -0.28 0.04 0.00 0.12 0.00 0.00 56.93 57.42 1xgn s PHE 189 Cb -0.13 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.40 1xgn s PHE 189 CO 0.17 -0.04 -0.10 0.00 -0.10 0.00 0.00 175.22 175.15 1xgn s ALA 190 N -0.29 1.11 0.26 5.36 0.00 0.20 -1.51 121.76 126.89 1xgn s ALA 190 Ca 0.04 -1.19 -0.20 0.00 0.00 0.00 0.00 51.96 50.62 1xgn s ALA 190 Cb -0.06 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.11 1xgn s ALA 190 CO -0.00 -0.04 0.66 -0.08 0.00 0.00 0.00 175.76 176.29 1xgn s THR 191 N -2.48 0.00 -2.29 0.00 -1.32 1.00 -0.42 115.64 110.14 1xgn s THR 191 Ca 0.06 -0.98 0.21 0.00 -1.21 0.00 0.00 61.69 59.76 1xgn s THR 191 Cb -0.03 -1.93 0.09 0.00 -1.51 0.00 0.00 72.50 69.13 1xgn s THR 191 CO -0.00 -0.01 1.09 2.30 -2.21 0.00 0.00 174.62 175.79 1xgn n ILE 192 N -0.43 0.00 -0.19 5.08 -5.35 -1.17 -1.17 119.36 116.13 1xgn n ILE 192 Ca -0.05 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.02 1xgn n ILE 192 Cb 0.60 1.35 0.00 0.00 -1.74 0.00 0.00 39.64 39.85 1xgn n ILE 192 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xgn n GLY 193 N 1.24 1.20 0.23 3.28 0.00 -1.26 -4.92 105.19 104.96 1xgn n GLY 193 Ca 0.11 -1.56 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 1xgn n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xgn h ALA 194 N -1.70 0.53 0.00 4.61 0.00 -1.93 -3.46 119.26 117.30 1xgn h ALA 194 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1xgn h ALA 194 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1xgn h ALA 194 CO 0.00 0.69 0.00 0.41 0.00 0.00 0.00 179.25 180.35 1xgn n GLY 195 N 0.40 1.62 3.25 0.00 0.00 -1.26 -5.01 105.19 104.18 1xgn n GLY 195 Ca -0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1xgn n GLY 195 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xgn s GLN 196 N -0.40 0.73 0.22 1.61 0.74 -1.26 -1.17 119.66 120.12 1xgn s GLN 196 Ca 0.00 -0.31 0.10 0.00 0.05 0.00 0.00 55.36 55.19 1xgn s GLN 196 Cb 0.00 0.32 -0.05 0.00 1.10 0.00 0.00 33.01 34.39 1xgn s GLN 196 CO 0.00 -0.22 -0.19 0.08 -0.55 0.00 0.00 175.29 174.41 1xgn s VAL 197 N -1.84 2.11 -0.02 1.34 1.01 -1.26 -1.36 120.40 120.38 1xgn s VAL 197 Ca -0.10 -2.16 -0.07 0.00 0.00 0.00 0.00 61.98 59.65 1xgn s VAL 197 Cb -0.03 -2.08 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1xgn s VAL 197 CO 0.01 -0.37 0.15 -0.51 0.00 0.00 0.00 175.10 174.38 1xgn s ILE 198 N -2.33 0.06 0.37 2.22 2.07 0.03 -4.83 121.20 118.79 1xgn s ILE 198 Ca 0.23 -0.48 -0.28 0.00 -1.41 0.00 0.00 60.65 58.70 1xgn s ILE 198 Cb -0.05 -0.38 -0.10 0.00 0.13 0.00 0.00 42.46 42.06 1xgn s ILE 198 CO 0.10 -0.27 1.39 -1.61 -1.91 0.00 0.00 174.94 172.65 1xgn s GLU 199 N -0.95 4.14 -0.10 3.50 8.01 -1.26 -1.24 118.70 130.80 1xgn s GLU 199 Ca -0.10 2.38 -0.15 0.00 0.01 0.00 0.00 54.97 57.10 1xgn s GLU 199 Cb -0.06 -2.95 0.03 0.00 -4.31 0.00 0.00 34.13 26.85 1xgn s GLU 199 CO 0.01 -0.43 0.38 0.08 0.01 0.00 0.00 175.26 175.31 1xgn s VAL 200 N -1.15 0.02 0.78 2.63 1.01 0.13 -4.89 120.40 118.93 1xgn s VAL 200 Ca 0.53 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 62.24 1xgn s VAL 200 Cb -0.43 -0.60 0.06 0.00 0.00 0.00 0.00 36.38 35.42 1xgn s VAL 200 CO 0.57 -0.09 1.09 -2.16 0.00 0.00 0.00 175.10 174.51 1xgn s PRO 201 N -0.40 2.17 0.35 2.72 0.04 -1.26 -0.87 135.00 137.75 1xgn s PRO 201 Ca -0.05 1.14 -0.04 0.00 0.04 0.00 0.00 61.00 62.09 1xgn s PRO 201 Cb -0.03 -1.89 0.08 0.00 0.04 0.00 0.00 34.50 32.69 1xgn s PRO 201 CO 0.02 -1.70 0.48 -0.35 0.04 0.00 0.00 177.00 175.50 1xgn n PRO 202 N -3.56 -0.12 -4.29 0.56 -0.04 -1.26 -4.79 135.00 121.50 1xgn n PRO 202 Ca 0.09 -0.97 -0.33 0.00 -0.04 0.00 0.00 63.50 62.24 1xgn n PRO 202 Cb 0.53 -0.42 -0.15 0.00 -0.04 0.00 0.00 33.50 33.42 1xgn n PRO 202 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1xgn s THR 203 N -1.67 2.51 -0.26 0.52 -4.23 -1.26 -2.88 115.64 108.37 1xgn s THR 203 Ca 0.29 -0.80 0.06 0.00 -1.18 0.00 0.00 61.69 60.06 1xgn s THR 203 Cb -0.01 -2.07 -0.07 0.00 1.34 0.00 0.00 72.50 71.69 1xgn s THR 203 CO 0.20 0.51 0.24 0.18 -0.54 0.00 0.00 174.62 175.21 1xgn n LEU 204 N 4.39 0.26 -4.18 4.79 4.32 -1.26 -4.93 117.00 120.39 1xgn n LEU 204 Ca -0.20 -0.45 -0.29 0.00 -0.02 0.00 0.00 56.01 55.06 1xgn n LEU 204 Cb 0.51 0.00 -0.17 0.00 -1.62 0.00 0.00 43.42 42.14 1xgn n LEU 204 CO 0.28 0.06 -0.53 -0.63 -1.22 0.00 0.00 177.39 175.35 1xgn s ILE 205 N -1.67 1.75 0.15 -0.08 1.01 -1.26 0.16 121.20 121.27 1xgn s ILE 205 Ca 0.02 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 59.83 1xgn s ILE 205 Cb 0.05 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 1xgn s ILE 205 CO 0.25 0.49 -0.05 -0.31 0.00 0.00 0.00 174.94 175.32 1xgn s TYR 206 N 0.21 1.17 -0.03 3.97 2.02 -0.14 -1.05 117.35 123.51 1xgn s TYR 206 Ca -0.11 -0.89 0.00 0.00 -0.37 0.00 0.00 57.07 55.70 1xgn s TYR 206 Cb -0.15 -0.64 0.03 0.00 -0.40 0.00 0.00 41.96 40.79 1xgn s TYR 206 CO 0.05 -0.08 0.00 1.41 -1.57 0.00 0.00 175.55 175.37 1xgn s MET 207 N -3.83 0.26 0.11 -0.62 -2.45 -0.09 -0.27 119.30 112.41 1xgn s MET 207 Ca 0.18 0.09 -0.31 0.00 -1.25 0.00 0.00 55.69 54.40 1xgn s MET 207 Cb 0.05 -0.45 -0.09 0.00 1.25 0.00 0.00 34.83 35.59 1xgn s MET 207 CO 0.01 -0.14 1.52 -0.47 1.05 0.00 0.00 175.02 176.98 1xgn s TYR 208 N 1.03 2.96 0.00 4.11 5.04 -1.26 0.16 117.35 129.39 1xgn s TYR 208 Ca -0.10 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.21 1xgn s TYR 208 Cb -0.13 -3.84 0.00 0.00 0.35 0.00 0.00 41.96 38.34 1xgn s TYR 208 CO -0.02 -3.11 0.00 1.33 -1.34 0.00 0.00 175.55 172.41 1xgn n VAL 209 N 4.20 0.00 -3.70 3.14 0.24 0.14 -4.76 118.33 117.58 1xgn n VAL 209 Ca 0.13 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.32 1xgn n VAL 209 Cb 0.41 0.10 -0.10 0.00 -1.47 0.00 0.00 33.84 32.78 1xgn n VAL 209 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1xgn s ARG 210 N -1.57 0.46 -1.12 7.34 3.52 -0.95 -4.97 118.95 121.64 1xgn s ARG 210 Ca 0.00 0.74 -0.20 0.00 -0.13 0.00 0.00 55.73 56.13 1xgn s ARG 210 Cb 0.00 0.09 0.07 0.00 -1.56 0.00 0.00 34.95 33.56 1xgn s ARG 210 CO 0.00 -0.12 1.53 0.34 -0.81 0.00 0.00 175.30 176.24 1xgn s ASP 211 N 0.94 6.67 0.17 -2.12 3.68 -1.26 -4.18 116.67 120.56 1xgn s ASP 211 Ca -0.06 -1.96 0.08 0.00 2.13 0.00 0.00 52.55 52.74 1xgn s ASP 211 Cb -0.06 -2.55 -0.04 0.00 -1.45 0.00 0.00 42.92 38.82 1xgn s ASP 211 CO -0.08 -1.30 -0.05 0.68 0.13 0.00 0.00 175.17 174.55 1xgn s VAL 212 N 4.30 3.47 0.01 1.11 -7.23 -1.26 -5.11 120.40 115.70 1xgn s VAL 212 Ca 0.48 -1.49 -0.30 0.00 -1.81 0.00 0.00 61.98 58.85 1xgn s VAL 212 Cb 0.01 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 1xgn s VAL 212 CO -0.03 -0.08 1.08 -2.16 -0.31 0.00 0.00 175.10 173.60 1xgn s PRO 213 N -2.80 4.49 -0.14 4.82 0.04 -1.26 -4.98 135.00 135.17 1xgn s PRO 213 Ca 0.26 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.86 1xgn s PRO 213 Cb -0.09 -3.43 -0.01 0.00 0.04 0.00 0.00 34.50 31.01 1xgn s PRO 213 CO 0.17 -0.17 -0.15 0.14 0.04 0.00 0.00 177.00 177.03 1xgn s VAL 214 N 1.18 2.82 0.05 -0.36 -7.23 -1.26 -5.04 120.40 110.57 1xgn s VAL 214 Ca 0.54 -0.73 -0.25 0.00 -1.81 0.00 0.00 61.98 59.73 1xgn s VAL 214 Cb -0.24 -2.18 -0.17 0.00 0.56 0.00 0.00 36.38 34.35 1xgn s VAL 214 CO 0.27 0.52 1.56 0.03 -0.31 0.00 0.00 175.10 177.18 1xgn h ARG 215 N 6.93 -0.14 -6.71 4.82 2.47 -2.01 -3.42 114.38 116.32 1xgn h ARG 215 Ca -0.27 0.01 -0.52 0.00 -1.26 0.00 0.00 59.98 57.93 1xgn h ARG 215 Cb 1.21 0.03 0.04 0.00 -1.65 0.00 0.00 29.97 29.60 1xgn h ARG 215 CO 0.55 0.04 0.68 0.08 0.56 0.00 0.00 179.97 181.88 1xgn s VAL 216 N -5.57 3.00 0.16 2.04 1.01 -1.26 -4.97 120.40 114.81 1xgn s VAL 216 Ca -0.14 0.84 -0.16 0.00 0.00 0.00 0.00 61.98 62.52 1xgn s VAL 216 Cb 0.04 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.92 1xgn s VAL 216 CO 0.65 0.13 1.75 0.00 0.00 0.00 0.00 175.10 177.63 1xgn h ALA 217 N 5.12 0.43 -0.13 5.51 0.00 -2.00 -2.51 119.26 125.68 1xgn h ALA 217 Ca -0.45 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.51 1xgn h ALA 217 Cb 1.22 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1xgn h ALA 217 CO 0.77 -0.27 0.06 1.96 0.00 0.00 0.00 179.25 181.77 1xgn h GLN 218 N 0.27 0.14 -0.02 0.00 7.50 -1.98 -2.57 115.11 118.45 1xgn h GLN 218 Ca 0.17 -0.01 0.03 0.00 0.50 0.00 0.00 58.65 59.35 1xgn h GLN 218 Cb 0.15 -0.03 -0.05 0.00 0.05 0.00 0.00 27.48 27.60 1xgn h GLN 218 CO -0.18 0.09 -0.31 0.00 -1.50 0.00 0.00 178.83 176.93 1xgn h ALA 219 N 1.06 -0.43 -0.58 3.87 0.00 -1.81 0.22 119.26 121.59 1xgn h ALA 219 Ca 0.05 -0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.12 1xgn h ALA 219 Cb 0.00 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1xgn h ALA 219 CO -0.03 -0.81 0.42 -0.09 0.00 0.00 0.00 179.25 178.74 1xgn h ARG 220 N -0.45 0.00 0.15 0.00 2.43 -1.33 0.64 114.38 115.82 1xgn h ARG 220 Ca 0.07 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1xgn h ARG 220 Cb 0.54 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1xgn h ARG 220 CO -0.27 0.00 -0.07 0.35 -1.51 0.00 0.00 179.97 178.46 1xgn h PHE 221 N 0.00 -0.19 -0.52 2.20 3.57 -0.60 -0.90 116.94 120.50 1xgn h PHE 221 Ca 0.28 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.86 1xgn h PHE 221 Cb 1.12 0.06 -0.10 0.00 2.79 0.00 0.00 35.95 39.82 1xgn h PHE 221 CO 0.00 0.13 -0.41 1.25 -2.23 0.00 0.00 178.31 177.05 1xgn h LEU 222 N -0.98 -1.39 -0.28 0.59 6.46 0.55 0.58 115.31 120.84 1xgn h LEU 222 Ca -0.02 0.23 0.06 0.00 -0.12 0.00 0.00 57.88 58.03 1xgn h LEU 222 Cb 0.41 0.64 -0.06 0.00 -0.73 0.00 0.00 40.66 40.91 1xgn h LEU 222 CO 0.03 -0.34 -0.14 0.25 -0.62 0.00 0.00 178.44 177.63 1xgn h LEU 223 N -0.24 -0.47 -1.76 2.25 7.12 0.14 0.52 115.31 122.86 1xgn h LEU 223 Ca 0.18 0.11 -0.02 0.00 0.13 0.00 0.00 57.88 58.28 1xgn h LEU 223 Cb 0.57 0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.95 1xgn h LEU 223 CO -0.65 -0.18 -0.04 0.00 -0.13 0.00 0.00 178.44 177.45 1xgn h ALA 224 N 1.11 1.81 0.13 1.25 0.00 0.42 0.78 119.26 124.76 1xgn h ALA 224 Ca 0.15 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1xgn h ALA 224 Cb 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1xgn h ALA 224 CO -0.35 0.15 -0.06 -0.22 0.00 0.00 0.00 179.25 178.77 1xgn h LYS 225 N 0.10 -0.17 -0.50 0.00 3.64 0.39 -2.50 116.57 117.52 1xgn h LYS 225 Ca 0.02 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.47 1xgn h LYS 225 Cb 0.14 0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 31.91 1xgn h LYS 225 CO 0.01 0.30 -0.56 0.82 -2.27 0.00 0.00 179.45 177.75 1xgn h ILE 226 N -0.77 0.01 -0.37 2.00 2.04 0.52 -0.17 117.51 120.77 1xgn h ILE 226 Ca -0.02 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.92 1xgn h ILE 226 Cb 0.54 0.01 -0.08 0.00 -0.74 0.00 0.00 36.82 36.54 1xgn h ILE 226 CO 0.03 0.00 -0.22 0.50 0.00 0.00 0.00 178.15 178.46 1xgn h LYS 227 N -0.33 -0.16 0.00 2.37 3.64 -0.95 0.30 116.57 121.44 1xgn h LYS 227 Ca 0.09 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1xgn h LYS 227 Cb 0.57 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1xgn h LYS 227 CO -0.65 -0.11 0.00 -2.13 -2.27 0.00 0.00 179.45 174.29 1xgn n ARG 228 N -5.38 0.00 0.18 1.90 3.00 -0.33 -1.77 116.66 114.25 1xgn n ARG 228 Ca 0.02 0.49 0.02 0.00 -0.00 0.00 0.00 57.85 58.38 1xgn n ARG 228 Cb 0.30 -1.40 0.34 0.00 0.00 0.00 0.00 32.46 31.69 1xgn n ARG 228 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 1xgn h GLU 229 N 0.00 0.01 0.00 -0.14 4.22 -1.06 -3.38 114.58 114.24 1xgn h GLU 229 Ca 0.00 -0.01 -0.35 0.00 0.08 0.00 0.00 59.36 59.08 1xgn h GLU 229 Cb 0.00 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 1xgn h GLU 229 CO 0.00 0.40 -2.20 0.66 -2.18 0.00 0.00 179.01 175.69 1xgn n TYR 230 N -4.07 0.00 -4.34 0.92 4.01 0.10 -5.08 117.16 108.71 1xgn n TYR 230 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1xgn n TYR 230 Cb 0.42 -0.78 0.00 0.00 -0.31 0.00 0.00 39.34 38.67 1xgn n TYR 230 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xgn n GLY 231 N 1.89 0.16 0.28 2.72 0.00 -0.73 -3.61 105.19 105.90 1xgn n GLY 231 Ca -0.41 -0.93 0.12 0.00 0.00 0.00 0.00 46.02 44.80 1xgn n GLY 231 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1xgn h THR 232 N 0.00 0.71 -3.46 2.61 1.35 -1.85 -3.40 112.91 108.87 1xgn h THR 232 Ca 0.00 -0.13 -0.52 0.00 -0.55 0.00 0.00 66.41 65.21 1xgn h THR 232 Cb 0.00 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 1xgn h THR 232 CO 0.00 0.03 0.49 -0.76 -0.25 0.00 0.00 175.52 175.03 1xgn s LEU 233 N -8.08 4.45 0.34 3.87 1.43 -1.24 -4.65 118.68 114.80 1xgn s LEU 233 Ca -0.05 2.04 -0.26 0.00 -1.03 0.00 0.00 54.13 54.84 1xgn s LEU 233 Cb 0.15 -3.60 -0.13 0.00 0.03 0.00 0.00 46.19 42.65 1xgn s LEU 233 CO 0.60 -0.29 0.86 -2.65 0.23 0.00 0.00 176.35 175.10 1xgn n PRO 234 N 2.87 1.06 -4.24 1.29 -0.02 -1.26 -4.76 135.00 129.95 1xgn n PRO 234 Ca 0.04 0.38 -0.18 0.00 -2.02 0.00 0.00 63.50 61.72 1xgn n PRO 234 Cb 0.47 -1.75 -0.11 0.00 -0.02 0.00 0.00 33.50 32.09 1xgn n PRO 234 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1xgn s PHE 235 N -1.20 1.39 0.32 6.00 -0.12 0.63 -4.23 117.98 120.76 1xgn s PHE 235 Ca 0.61 -0.56 -0.08 0.00 -0.05 0.00 0.00 56.93 56.85 1xgn s PHE 235 Cb -0.66 -0.73 -0.06 0.00 -0.63 0.00 0.00 43.02 40.94 1xgn s PHE 235 CO 0.58 0.14 0.64 0.00 -0.05 0.00 0.00 175.22 176.53 1xgn s ALA 236 N -2.13 3.50 0.19 1.99 0.00 -1.26 -0.97 121.76 123.08 1xgn s ALA 236 Ca 0.09 -0.34 -0.08 0.00 0.00 0.00 0.00 51.96 51.62 1xgn s ALA 236 Cb -0.05 -2.49 0.10 0.00 0.00 0.00 0.00 23.12 20.67 1xgn s ALA 236 CO 0.03 0.22 1.66 -0.92 0.00 0.00 0.00 175.76 176.75 1xgn h TYR 237 N 1.76 1.16 -0.93 0.00 3.20 -0.65 -2.20 116.97 119.31 1xgn h TYR 237 Ca -0.47 -0.19 0.21 0.00 3.14 0.00 0.00 58.73 61.42 1xgn h TYR 237 Cb 1.18 -0.31 -0.07 0.00 1.54 0.00 0.00 36.73 39.08 1xgn h TYR 237 CO 0.60 1.01 0.61 -0.09 -1.64 0.00 0.00 178.16 178.65 1xgn h ARG 238 N 0.98 0.40 0.00 1.82 2.43 -1.84 -0.78 114.38 117.38 1xgn h ARG 238 Ca 0.18 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 1xgn h ARG 238 Cb 0.54 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1xgn h ARG 238 CO 0.03 0.26 -0.27 -1.49 -1.51 0.00 0.00 179.97 176.99 1xgn h TRP 239 N 0.41 0.00 -0.30 2.20 6.55 -1.78 -2.78 115.95 120.25 1xgn h TRP 239 Ca 0.49 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.33 1xgn h TRP 239 Cb 1.22 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.52 1xgn h TRP 239 CO -0.00 0.27 0.00 1.28 -1.05 0.00 0.00 178.44 178.94 1xgn n LEU 240 N -3.61 2.79 0.22 -4.49 4.77 -0.31 -4.47 117.00 111.90 1xgn n LEU 240 Ca -0.01 -1.18 0.09 0.00 -0.03 0.00 0.00 56.01 54.88 1xgn n LEU 240 Cb 0.40 -0.19 0.46 0.00 -2.33 0.00 0.00 43.42 41.76 1xgn n LEU 240 CO 0.34 0.59 0.79 1.56 -1.33 0.00 0.00 177.39 179.35 1xgn h GLN 241 N 3.66 0.00 -0.89 3.23 4.20 -1.42 -3.08 115.11 120.81 1xgn h GLN 241 Ca 0.00 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.36 1xgn h GLN 241 Cb 0.80 0.00 -0.21 0.00 0.30 0.00 0.00 27.48 28.37 1xgn h GLN 241 CO 0.00 0.25 0.45 0.27 -0.67 0.00 0.00 178.83 179.13 1xgn n ASN 242 N -3.48 4.19 -0.05 1.46 6.94 -1.26 -4.09 115.26 118.96 1xgn n ASN 242 Ca -0.00 -3.33 -0.07 0.00 -0.02 0.00 0.00 54.58 51.15 1xgn n ASN 242 Cb 0.42 -0.78 -0.04 0.00 -2.36 0.00 0.00 39.78 37.02 1xgn n ASN 242 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1xgn n ASP 243 N -0.60 3.08 -3.71 0.53 10.43 -1.16 -5.07 116.55 120.06 1xgn n ASP 243 Ca 0.48 -0.04 -0.14 0.00 2.57 0.00 0.00 54.79 57.66 1xgn n ASP 243 Cb 1.48 -0.16 -0.09 0.00 1.84 0.00 0.00 41.12 44.19 1xgn n ASP 243 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1xgn s MET 244 N -2.20 0.66 0.31 -1.24 0.23 -1.25 -5.14 119.30 110.68 1xgn s MET 244 Ca -0.13 0.22 -0.28 0.00 -1.03 0.00 0.00 55.69 54.47 1xgn s MET 244 Cb 0.04 0.31 -0.13 0.00 -1.53 0.00 0.00 34.83 33.51 1xgn s MET 244 CO 0.22 -0.15 1.14 -0.35 -2.03 0.00 0.00 175.02 173.85 1xgn n PRO 245 N 1.89 1.72 0.00 3.16 -0.04 -1.26 -4.53 135.00 135.94 1xgn n PRO 245 Ca -0.18 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 1xgn n PRO 245 Cb 0.57 -2.07 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 1xgn n PRO 245 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1xgn n GLU 246 N 0.64 0.00 -0.33 0.54 2.13 -1.26 -1.21 120.64 121.15 1xgn n GLU 246 Ca 0.07 0.42 0.26 0.00 0.66 0.00 0.00 57.16 58.58 1xgn n GLU 246 Cb 0.34 -0.70 0.51 0.00 0.27 0.00 0.00 31.44 31.86 1xgn n GLU 246 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1xgn h GLY 247 N 0.00 2.09 0.41 8.31 0.00 -1.99 0.79 103.07 112.68 1xgn h GLY 247 Ca 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 1xgn h GLY 247 CO 0.00 -0.62 -0.20 1.46 0.00 0.00 0.00 176.54 177.18 1xgn h GLN 248 N 0.17 -0.53 -0.89 4.80 1.08 -1.51 -2.76 115.11 115.47 1xgn h GLN 248 Ca 0.77 0.04 0.15 0.00 -1.45 0.00 0.00 58.65 58.15 1xgn h GLN 248 Cb 1.87 0.12 -0.15 0.00 -0.05 0.00 0.00 27.48 29.26 1xgn h GLN 248 CO -0.69 -0.36 -0.34 1.25 -0.95 0.00 0.00 178.83 177.74 1xgn h LEU 249 N -0.82 -1.25 -0.76 1.46 5.85 -0.70 0.56 115.31 119.65 1xgn h LEU 249 Ca -0.06 0.29 0.12 0.00 0.84 0.00 0.00 57.88 59.07 1xgn h LEU 249 Cb 0.42 0.68 -0.13 0.00 0.37 0.00 0.00 40.66 42.00 1xgn h LEU 249 CO 0.09 -0.30 -0.36 0.50 -0.34 0.00 0.00 178.44 178.03 1xgn h LYS 250 N -0.03 -0.09 -0.24 1.25 1.63 -0.90 0.47 116.57 118.65 1xgn h LYS 250 Ca 0.34 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.15 1xgn h LYS 250 Cb 0.60 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.24 1xgn h LYS 250 CO -0.91 -0.06 0.13 -0.07 -3.45 0.00 0.00 179.45 175.08 1xgn h LEU 251 N -0.10 0.30 -0.26 5.20 -0.00 0.27 -1.27 115.31 119.46 1xgn h LEU 251 Ca 0.28 -0.09 0.03 0.00 -0.00 0.00 0.00 57.88 58.10 1xgn h LEU 251 Cb 0.57 -0.08 -0.06 0.00 -0.00 0.00 0.00 40.66 41.10 1xgn h LEU 251 CO -0.81 0.30 -0.39 0.00 -0.00 0.00 0.00 178.44 177.54 1xgn h ALA 252 N 1.01 -0.66 -0.15 1.53 0.00 0.29 0.16 119.26 121.45 1xgn h ALA 252 Ca 0.08 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.04 1xgn h ALA 252 Cb 0.07 0.99 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 1xgn h ALA 252 CO -0.01 -0.84 -0.22 -0.07 0.00 0.00 0.00 179.25 178.11 1xgn h LEU 253 N -0.30 -0.69 -0.55 0.00 4.07 -0.34 -1.57 115.31 115.93 1xgn h LEU 253 Ca 0.05 0.12 0.10 0.00 0.08 0.00 0.00 57.88 58.22 1xgn h LEU 253 Cb 0.43 0.31 -0.08 0.00 1.08 0.00 0.00 40.66 42.40 1xgn h LEU 253 CO -0.40 -0.27 0.12 0.11 -1.08 0.00 0.00 178.44 176.92 1xgn h LYS 254 N -0.27 0.26 -0.10 1.13 1.79 -0.65 0.86 116.57 119.59 1xgn h LYS 254 Ca 0.11 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1xgn h LYS 254 Cb 0.43 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.02 1xgn h LYS 254 CO -0.31 0.17 0.06 1.15 -1.08 0.00 0.00 179.45 179.44 1xgn h THR 255 N 0.26 1.04 -0.67 -0.16 2.02 0.07 0.11 112.91 115.58 1xgn h THR 255 Ca 0.28 -0.08 0.08 0.00 0.77 0.00 0.00 66.41 67.46 1xgn h THR 255 Cb 0.39 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 1xgn h THR 255 CO -0.35 0.03 0.44 -0.07 0.37 0.00 0.00 175.52 175.94 1xgn h LEU 256 N 0.12 0.55 0.00 2.58 -0.00 -0.51 -1.21 115.31 116.84 1xgn h LEU 256 Ca 0.03 0.01 -0.00 0.00 -0.00 0.00 0.00 57.88 57.92 1xgn h LEU 256 Cb 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 40.55 1xgn h LEU 256 CO -0.01 0.34 -0.00 -0.08 -0.00 0.00 0.00 178.44 178.70 1xgn h GLU 257 N 0.62 -0.01 -0.16 1.13 4.81 0.12 -0.18 114.58 120.92 1xgn h GLU 257 Ca 0.30 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.51 1xgn h GLU 257 Cb 0.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 1xgn h GLU 257 CO -0.10 0.30 0.00 0.87 -0.73 0.00 0.00 179.01 179.35 1xgn h LYS 258 N -0.31 0.22 -0.30 1.92 1.57 -0.08 -1.67 116.57 117.93 1xgn h LYS 258 Ca -0.00 -0.03 -0.18 0.00 -1.87 0.00 0.00 60.65 58.57 1xgn h LYS 258 Cb 0.31 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1xgn h LYS 258 CO 0.00 0.25 -0.53 0.00 -0.57 0.00 0.00 179.45 178.60 1xgn h ALA 259 N 1.79 0.47 0.00 3.86 0.00 -1.08 -3.48 119.26 120.81 1xgn h ALA 259 Ca 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1xgn h ALA 259 Cb 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1xgn h ALA 259 CO 0.00 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.34 1xgn n GLY 260 N 0.35 1.23 0.03 0.00 0.00 -0.16 -5.03 105.19 101.60 1xgn n GLY 260 Ca -0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1xgn n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xgn n ALA 261 N -0.20 3.16 -3.20 4.61 0.00 -0.68 -3.99 120.51 120.20 1xgn n ALA 261 Ca 0.00 -0.47 -0.13 0.00 0.00 0.00 0.00 53.44 52.84 1xgn n ALA 261 Cb 0.00 -0.84 -0.09 0.00 0.00 0.00 0.00 19.45 18.51 1xgn n ALA 261 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1xgn s ILE 262 N -3.37 0.05 -0.08 0.00 -4.36 -1.26 0.23 121.20 112.42 1xgn s ILE 262 Ca -0.03 -0.38 -0.05 0.00 -0.26 0.00 0.00 60.65 59.94 1xgn s ILE 262 Cb 0.14 -0.53 -0.04 0.00 1.25 0.00 0.00 42.46 43.27 1xgn s ILE 262 CO 0.87 -0.21 0.13 -0.47 0.24 0.00 0.00 174.94 175.50 1xgn s TYR 263 N -0.93 3.51 -0.15 1.37 5.04 0.43 -4.56 117.35 122.07 1xgn s TYR 263 Ca -0.10 0.42 -0.15 0.00 -2.44 0.00 0.00 57.07 54.80 1xgn s TYR 263 Cb -0.05 -1.88 -0.05 0.00 0.35 0.00 0.00 41.96 40.34 1xgn s TYR 263 CO 0.03 0.67 0.33 0.20 -1.34 0.00 0.00 175.55 175.44 1xgn s GLY 264 N -1.30 2.25 -0.74 8.97 0.00 -1.26 -0.91 107.32 114.32 1xgn s GLY 264 Ca 0.19 -0.40 -0.09 0.00 0.00 0.00 0.00 44.72 44.42 1xgn s GLY 264 CO 0.08 0.48 0.63 -0.19 0.00 0.00 0.00 173.10 174.10 1xgn s TYR 265 N 0.45 3.61 1.08 1.90 2.02 -0.21 -5.02 117.35 121.17 1xgn s TYR 265 Ca 0.18 -2.35 -0.12 0.00 -0.37 0.00 0.00 57.07 54.41 1xgn s TYR 265 Cb -0.13 -3.53 0.23 0.00 -0.40 0.00 0.00 41.96 38.13 1xgn s TYR 265 CO 0.05 -0.92 1.06 -2.14 -1.57 0.00 0.00 175.55 172.04 1xgn s PRO 266 N -0.00 -0.23 0.49 -1.71 0.02 -1.26 -3.99 135.00 128.31 1xgn s PRO 266 Ca 0.18 0.83 -0.20 0.00 0.02 0.00 0.00 61.00 61.82 1xgn s PRO 266 Cb -0.15 -1.64 -0.08 0.00 0.02 0.00 0.00 34.50 32.66 1xgn s PRO 266 CO -0.06 -3.26 1.05 0.08 -0.33 0.00 0.00 177.00 174.48 1xgn s VAL 267 N -2.64 3.73 -0.20 3.83 1.01 -0.05 -4.78 120.40 121.30 1xgn s VAL 267 Ca 0.67 1.08 -0.02 0.00 0.00 0.00 0.00 61.98 63.72 1xgn s VAL 267 Cb -0.23 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.72 1xgn s VAL 267 CO 0.62 -0.22 -0.11 -0.76 0.00 0.00 0.00 175.10 174.62 1xgn s LEU 268 N -3.49 2.57 0.03 3.92 1.43 -1.03 0.19 118.68 122.31 1xgn s LEU 268 Ca 0.68 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 53.36 1xgn s LEU 268 Cb -0.17 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.39 1xgn s LEU 268 CO 0.21 -0.00 -0.22 -0.75 0.23 0.00 0.00 176.35 175.82 1xgn s LYS 269 N 1.35 1.99 0.35 1.70 2.20 -0.37 -0.71 119.74 126.25 1xgn s LYS 269 Ca 0.05 -1.01 -0.29 0.00 -0.36 0.00 0.00 55.97 54.36 1xgn s LYS 269 Cb -0.14 -2.11 -0.11 0.00 -1.51 0.00 0.00 37.83 33.97 1xgn s LYS 269 CO -0.07 0.54 1.44 -2.00 -0.36 0.00 0.00 175.35 174.90 1xgn s GLU 270 N -1.26 4.20 0.45 4.03 -6.30 -0.91 -0.79 118.70 118.11 1xgn s GLU 270 Ca 0.13 2.44 0.31 0.00 -2.50 0.00 0.00 54.97 55.35 1xgn s GLU 270 Cb -0.10 -3.02 1.56 0.00 0.00 0.00 0.00 34.13 32.57 1xgn s GLU 270 CO 0.03 -0.43 1.93 -0.84 0.02 0.00 0.00 175.26 175.98 1xgn h ILE 271 N 3.07 0.00 0.00 -3.70 3.07 -1.54 -1.39 117.51 117.03 1xgn h ILE 271 Ca -0.50 -0.11 -0.03 0.00 1.55 0.00 0.00 64.86 65.78 1xgn h ILE 271 Cb 1.23 0.86 -0.07 0.00 -0.27 0.00 0.00 36.82 38.57 1xgn h ILE 271 CO 0.67 0.00 -0.43 0.54 -1.05 0.00 0.00 178.15 177.88 1xgn n ARG 272 N -2.62 0.91 -3.90 0.16 1.74 -1.26 -4.98 116.66 106.70 1xgn n ARG 272 Ca -0.01 -2.40 -0.26 0.00 -0.77 0.00 0.00 57.85 54.41 1xgn n ARG 272 Cb 0.11 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.47 1xgn n ARG 272 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1xgn n ASN 273 N -0.73 -1.53 -4.74 0.55 3.02 -0.52 -4.87 115.26 106.43 1xgn n ASN 273 Ca 0.12 -0.92 -0.36 0.00 -0.03 0.00 0.00 54.58 53.40 1xgn n ASN 273 Cb 0.76 -3.45 -0.08 0.00 -0.61 0.00 0.00 39.78 36.40 1xgn n ASN 273 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1xgn s GLY 274 N -4.10 2.11 0.29 7.41 0.00 -1.26 -4.90 107.32 106.86 1xgn s GLY 274 Ca 0.18 -0.61 -0.27 0.00 0.00 0.00 0.00 44.72 44.02 1xgn s GLY 274 CO 0.86 0.18 0.71 1.39 0.00 0.00 0.00 173.10 176.24 1xgn n ILE 275 N 3.38 1.91 -4.99 0.90 2.08 -1.26 -4.56 119.36 116.82 1xgn n ILE 275 Ca -0.15 -0.50 -0.29 0.00 0.56 0.00 0.00 62.75 62.37 1xgn n ILE 275 Cb 0.52 -0.51 -0.16 0.00 -0.75 0.00 0.00 39.64 38.73 1xgn n ILE 275 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1xgn s VAL 276 N -1.14 1.69 0.20 1.39 1.01 -1.09 -3.05 120.40 119.41 1xgn s VAL 276 Ca 0.61 -0.83 0.10 0.00 0.00 0.00 0.00 61.98 61.86 1xgn s VAL 276 Cb -0.76 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 1xgn s VAL 276 CO 0.58 0.48 -0.16 0.00 0.00 0.00 0.00 175.10 176.00 1xgn s ALA 277 N 0.18 2.76 -0.06 5.51 0.00 0.44 -4.81 121.76 125.78 1xgn s ALA 277 Ca -0.10 -1.60 -0.28 0.00 0.00 0.00 0.00 51.96 49.98 1xgn s ALA 277 Cb -0.15 -0.51 0.06 0.00 0.00 0.00 0.00 23.12 22.53 1xgn s ALA 277 CO 0.05 0.42 0.62 -1.14 0.00 0.00 0.00 175.76 175.71 1xgn s GLN 278 N -2.89 0.97 -0.05 0.00 0.74 -1.26 -0.63 119.66 116.54 1xgn s GLN 278 Ca 0.24 0.26 -0.10 0.00 0.05 0.00 0.00 55.36 55.81 1xgn s GLN 278 Cb -0.08 0.46 0.02 0.00 1.10 0.00 0.00 33.01 34.51 1xgn s GLN 278 CO 0.13 -0.28 0.25 -0.06 -0.55 0.00 0.00 175.29 174.78 1xgn s PHE 279 N -1.05 -0.19 -0.06 1.67 0.08 -1.22 -1.80 117.98 115.41 1xgn s PHE 279 Ca -0.10 0.41 -0.25 0.00 0.12 0.00 0.00 56.93 57.11 1xgn s PHE 279 Cb -0.01 0.07 0.06 0.00 -0.57 0.00 0.00 43.02 42.56 1xgn s PHE 279 CO 0.08 -0.24 0.56 -2.00 -0.10 0.00 0.00 175.22 173.53 1xgn s GLU 280 N -0.59 0.91 0.04 0.44 2.12 -0.44 -3.33 118.70 117.84 1xgn s GLU 280 Ca -0.07 0.19 -0.01 0.00 0.36 0.00 0.00 54.97 55.44 1xgn s GLU 280 Cb -0.04 0.42 -0.03 0.00 0.26 0.00 0.00 34.13 34.74 1xgn s GLU 280 CO 0.02 -0.26 -0.03 -1.01 -0.54 0.00 0.00 175.26 173.43 1xgn s HIS 281 N -1.08 0.46 -0.15 5.30 3.76 -1.21 -1.69 115.29 120.68 1xgn s HIS 281 Ca -0.11 -0.93 -0.10 0.00 -0.15 0.00 0.00 55.06 53.78 1xgn s HIS 281 Cb -0.02 -0.34 -0.05 0.00 1.11 0.00 0.00 32.58 33.28 1xgn s HIS 281 CO 0.07 -0.33 0.19 0.99 -0.85 0.00 0.00 174.74 174.81 1xgn s THR 282 N -3.27 5.39 -0.01 1.30 2.01 -1.22 -2.39 115.64 117.46 1xgn s THR 282 Ca 0.01 0.32 0.06 0.00 0.31 0.00 0.00 61.69 62.39 1xgn s THR 282 Cb 0.03 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 69.03 1xgn s THR 282 CO -0.08 0.50 -0.21 0.27 -0.69 0.00 0.00 174.62 174.42 1xgn s ILE 283 N -0.17 1.62 -0.31 1.82 -4.36 0.31 -1.75 121.20 118.37 1xgn s ILE 283 Ca 0.13 -0.92 -0.06 0.00 -0.26 0.00 0.00 60.65 59.53 1xgn s ILE 283 Cb -0.12 -1.36 0.02 0.00 1.25 0.00 0.00 42.46 42.25 1xgn s ILE 283 CO 0.02 0.42 0.08 -0.63 0.24 0.00 0.00 174.94 175.08 1xgn s ILE 284 N -0.53 3.85 -0.36 8.37 1.01 -0.83 0.10 121.20 132.82 1xgn s ILE 284 Ca 0.08 -0.88 -0.28 0.00 0.00 0.00 0.00 60.65 59.57 1xgn s ILE 284 Cb -0.08 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 1xgn s ILE 284 CO -0.00 -0.02 2.05 -0.69 0.00 0.00 0.00 174.94 176.28 1xgn s VAL 285 N 1.45 3.23 0.00 2.92 1.01 0.37 -1.97 120.40 127.41 1xgn s VAL 285 Ca 0.01 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.20 1xgn s VAL 285 Cb -0.18 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1xgn s VAL 285 CO 0.02 -0.27 0.00 -0.62 0.00 0.00 0.00 175.10 174.23 1xgn n GLU 286 N 8.73 1.44 -0.01 2.72 1.02 -1.03 0.30 120.64 133.81 1xgn n GLU 286 Ca 0.27 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 57.27 1xgn n GLU 286 Cb 0.48 0.00 -0.14 0.00 -0.02 0.00 0.00 31.44 31.76 1xgn n GLU 286 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1xgn n LYS 287 N -0.51 0.69 -0.01 3.49 0.00 -1.26 -2.17 118.16 118.39 1xgn n LYS 287 Ca 0.00 0.28 0.01 0.00 -0.00 0.00 0.00 58.31 58.60 1xgn n LYS 287 Cb 0.00 -1.75 -0.03 0.00 -0.00 0.00 0.00 35.03 33.24 1xgn n LYS 287 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1xgn n ASP 288 N -3.24 3.95 -3.24 -5.58 9.92 -1.26 -3.52 116.55 113.58 1xgn n ASP 288 Ca -0.24 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 53.83 1xgn n ASP 288 Cb 1.05 1.00 -0.07 0.00 -0.64 0.00 0.00 41.12 42.46 1xgn n ASP 288 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1xgn s SER 289 N -2.87 1.62 0.44 -2.24 1.04 -1.26 -4.89 113.70 105.52 1xgn s SER 289 Ca -0.02 -1.73 0.06 0.00 0.48 0.00 0.00 55.95 54.74 1xgn s SER 289 Cb 0.02 0.60 -0.06 0.00 0.10 0.00 0.00 66.02 66.68 1xgn s SER 289 CO 0.18 -1.15 0.02 0.68 0.98 0.00 0.00 173.24 173.95 1xgn s VAL 290 N -3.26 1.81 -0.17 5.02 -7.23 -1.26 -2.46 120.40 112.85 1xgn s VAL 290 Ca 0.38 -1.99 -0.00 0.00 -1.81 0.00 0.00 61.98 58.56 1xgn s VAL 290 Cb 0.01 -2.79 0.04 0.00 0.56 0.00 0.00 36.38 34.20 1xgn s VAL 290 CO 0.27 0.00 -0.06 -0.51 -0.31 0.00 0.00 175.10 174.49 1xgn s ILE 291 N -2.75 1.22 -0.97 -0.62 2.07 -0.83 -4.87 121.20 114.44 1xgn s ILE 291 Ca 0.28 -0.70 -0.24 0.00 -1.41 0.00 0.00 60.65 58.59 1xgn s ILE 291 Cb 0.08 -1.37 0.02 0.00 0.13 0.00 0.00 42.46 41.32 1xgn s ILE 291 CO 0.15 0.14 1.60 0.68 -1.91 0.00 0.00 174.94 175.60 1xgn s VAL 292 N 1.59 3.76 0.66 4.00 -7.23 -1.26 -1.96 120.40 119.96 1xgn s VAL 292 Ca 0.00 -0.60 0.28 0.00 -1.81 0.00 0.00 61.98 59.86 1xgn s VAL 292 Cb -0.15 -4.72 0.28 0.00 0.56 0.00 0.00 36.38 32.35 1xgn s VAL 292 CO -0.08 -1.62 1.86 0.71 -0.31 0.00 0.00 175.10 175.66 1xgn h THR 293 N 6.92 0.01 -0.13 5.32 1.35 -1.72 -2.50 112.91 122.16 1xgn h THR 293 Ca 0.15 0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 65.92 1xgn h THR 293 Cb 1.01 0.62 -0.06 0.00 -1.73 0.00 0.00 68.15 67.99 1xgn h THR 293 CO 1.36 0.00 -0.47 0.35 -0.25 0.00 0.00 175.52 176.51 1xgn n THR 294 N -2.88 2.30 -1.55 6.82 -2.24 -1.26 -3.75 114.28 111.72 1xgn n THR 294 Ca -0.02 -3.29 0.00 0.00 -2.27 0.00 0.00 64.05 58.48 1xgn n THR 294 Cb 0.43 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.31 1xgn n THR 294 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71