#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgs s ASP 2 N 0.00 1.84 0.46 6.12 1.11 -1.26 -4.97 116.67 119.97 1xgs s ASP 2 Ca 0.00 -0.31 0.30 0.00 0.18 0.00 0.00 52.55 52.72 1xgs s ASP 2 Cb 0.00 -0.78 1.13 0.00 1.07 0.00 0.00 42.92 44.34 1xgs s ASP 2 CO 0.00 0.06 1.87 0.71 1.18 0.00 0.00 175.17 178.99 1xgs h THR 3 N 5.80 0.00 -0.32 -1.27 1.35 -2.02 -3.10 112.91 113.35 1xgs h THR 3 Ca -0.31 -0.52 -0.04 0.00 -0.55 0.00 0.00 66.41 65.00 1xgs h THR 3 Cb 1.19 1.46 -0.01 0.00 -1.73 0.00 0.00 68.15 69.06 1xgs h THR 3 CO 0.48 0.00 0.05 -0.33 -0.25 0.00 0.00 175.52 175.47 1xgs h GLU 4 N 0.00 0.53 -0.63 4.72 5.08 -1.98 0.35 114.58 122.65 1xgs h GLU 4 Ca 0.00 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.13 1xgs h GLU 4 Cb 0.56 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 1xgs h GLU 4 CO 0.00 0.62 0.04 0.87 -1.00 0.00 0.00 179.01 179.54 1xgs h LYS 5 N 0.36 1.09 -0.52 2.33 1.57 -1.91 0.11 116.57 119.59 1xgs h LYS 5 Ca 0.10 -0.33 -0.02 0.00 -1.87 0.00 0.00 60.65 58.53 1xgs h LYS 5 Cb 0.35 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 1xgs h LYS 5 CO 0.01 1.04 0.25 -0.07 -0.57 0.00 0.00 179.45 180.10 1xgs h LEU 6 N 1.00 0.68 -0.53 2.94 3.38 -1.49 0.17 115.31 121.47 1xgs h LEU 6 Ca 0.18 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1xgs h LEU 6 Cb 0.52 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1xgs h LEU 6 CO 0.02 0.62 0.18 0.24 0.09 0.00 0.00 178.44 179.59 1xgs h MET 7 N 0.69 0.82 0.01 1.13 2.86 -0.12 -1.12 114.93 119.21 1xgs h MET 7 Ca 0.18 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1xgs h MET 7 Cb 0.12 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1xgs h MET 7 CO -0.02 0.75 -0.01 -0.22 1.06 0.00 0.00 176.91 178.47 1xgs h LYS 8 N 0.73 -0.02 -0.97 1.72 1.63 -0.44 -1.74 116.57 117.49 1xgs h LYS 8 Ca 0.17 0.00 0.09 0.00 -0.85 0.00 0.00 60.65 60.06 1xgs h LYS 8 Cb 0.26 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 31.82 1xgs h LYS 8 CO -0.01 0.13 0.62 0.00 -3.45 0.00 0.00 179.45 176.73 1xgs h ALA 9 N 0.83 1.40 -0.51 5.00 0.00 -0.42 -2.37 119.26 123.20 1xgs h ALA 9 Ca -0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1xgs h ALA 9 Cb 0.15 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1xgs h ALA 9 CO 0.00 0.32 -0.12 0.78 0.00 0.00 0.00 179.25 180.23 1xgs h GLY 10 N 1.06 1.04 0.99 0.00 0.00 -1.01 -1.27 103.07 103.88 1xgs h GLY 10 Ca 0.45 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.95 1xgs h GLY 10 CO -0.21 0.76 0.24 -2.09 0.00 0.00 0.00 176.54 175.24 1xgs h GLU 11 N 0.85 0.52 -0.52 4.80 4.81 -0.83 0.10 114.58 124.31 1xgs h GLU 11 Ca 0.13 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.21 1xgs h GLU 11 Cb 0.67 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1xgs h GLU 11 CO 0.05 0.37 -0.12 0.82 -0.73 0.00 0.00 179.01 179.40 1xgs h ILE 12 N 0.51 1.27 -0.71 2.32 2.04 -1.36 -1.89 117.51 119.69 1xgs h ILE 12 Ca 0.14 -1.27 -0.07 0.00 1.00 0.00 0.00 64.86 64.66 1xgs h ILE 12 Cb -0.02 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 1xgs h ILE 12 CO -0.03 0.45 0.18 0.00 0.00 0.00 0.00 178.15 178.75 1xgs h ALA 13 N 0.97 0.94 0.21 1.87 0.00 -0.91 -1.57 119.26 120.77 1xgs h ALA 13 Ca 0.13 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1xgs h ALA 13 Cb 0.68 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1xgs h ALA 13 CO 0.05 0.66 -0.10 -0.22 0.00 0.00 0.00 179.25 179.64 1xgs h LYS 14 N 1.08 -0.27 -0.23 0.00 3.64 -0.82 0.13 116.57 120.10 1xgs h LYS 14 Ca 0.22 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.68 1xgs h LYS 14 Cb 0.37 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.19 1xgs h LYS 14 CO 0.00 -0.05 -0.17 0.87 -2.27 0.00 0.00 179.45 177.83 1xgs h LYS 15 N -0.46 -0.16 -0.90 1.90 1.57 -1.24 0.21 116.57 117.49 1xgs h LYS 15 Ca -0.03 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1xgs h LYS 15 Cb 0.35 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.65 1xgs h LYS 15 CO 0.05 -0.11 0.60 0.28 -0.57 0.00 0.00 179.45 179.70 1xgs h VAL 16 N -0.17 1.23 -0.40 0.50 2.07 -1.24 -1.29 116.25 116.95 1xgs h VAL 16 Ca 0.13 -0.42 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1xgs h VAL 16 Cb 0.36 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.02 1xgs h VAL 16 CO -0.33 0.22 0.12 -0.09 0.02 0.00 0.00 177.57 177.51 1xgs h ARG 17 N 1.22 0.62 0.00 1.57 2.43 0.28 -0.75 114.38 119.74 1xgs h ARG 17 Ca 0.33 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1xgs h ARG 17 Cb -0.13 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.32 1xgs h ARG 17 CO -0.07 0.63 -0.21 0.93 -1.51 0.00 0.00 179.97 179.73 1xgs h GLU 18 N 0.49 0.00 -0.13 0.20 4.39 -0.23 -2.52 114.58 116.79 1xgs h GLU 18 Ca 0.13 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.72 1xgs h GLU 18 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 1xgs h GLU 18 CO -0.00 0.21 -0.35 -0.22 -1.16 0.00 0.00 179.01 177.50 1xgs h LYS 19 N 0.00 0.46 -0.69 2.33 3.64 -0.75 -3.14 116.57 118.43 1xgs h LYS 19 Ca -0.00 -0.32 0.12 0.00 -1.27 0.00 0.00 60.65 59.17 1xgs h LYS 19 Cb 0.38 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 1xgs h LYS 19 CO 0.03 0.94 0.46 0.00 -2.27 0.00 0.00 179.45 178.61 1xgs h ALA 20 N 0.52 2.01 -0.50 5.00 0.00 -0.76 -0.91 119.26 124.61 1xgs h ALA 20 Ca -0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1xgs h ALA 20 Cb 0.96 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1xgs h ALA 20 CO 0.07 -0.17 0.02 0.82 0.00 0.00 0.00 179.25 180.00 1xgs h ILE 21 N 0.47 1.26 -0.06 0.00 2.04 -1.41 -1.88 117.51 117.93 1xgs h ILE 21 Ca 0.33 -1.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 1xgs h ILE 21 Cb 0.64 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 1xgs h ILE 21 CO -0.10 0.37 -0.23 0.11 0.00 0.00 0.00 178.15 178.29 1xgs h LYS 22 N 0.74 0.10 0.00 2.37 1.79 -1.17 -2.44 116.57 117.96 1xgs h LYS 22 Ca 0.15 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 1xgs h LYS 22 Cb 0.49 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 1xgs h LYS 22 CO 0.02 0.33 -0.35 1.28 -1.08 0.00 0.00 179.45 179.65 1xgs n LEU 23 N -4.22 0.62 -3.85 2.94 4.77 -0.97 -4.50 117.00 111.80 1xgs n LEU 23 Ca -0.02 0.33 -0.42 0.00 -0.03 0.00 0.00 56.01 55.88 1xgs n LEU 23 Cb 0.31 -0.27 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1xgs n LEU 23 CO 0.38 -0.06 2.39 0.00 -1.33 0.00 0.00 177.39 178.77 1xgs n ALA 24 N -1.73 4.54 -2.60 -1.18 0.00 -0.73 -4.83 120.51 113.97 1xgs n ALA 24 Ca 0.05 -3.69 -0.24 0.00 0.00 0.00 0.00 53.44 49.56 1xgs n ALA 24 Cb 0.41 -3.57 -0.08 0.00 0.00 0.00 0.00 19.45 16.21 1xgs n ALA 24 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1xgs s ARG 25 N 3.96 2.14 0.33 0.00 1.70 -1.26 -4.30 118.95 121.52 1xgs s ARG 25 Ca 0.52 -1.43 -0.28 0.00 -0.47 0.00 0.00 55.73 54.06 1xgs s ARG 25 Cb 0.12 -2.10 -0.12 0.00 -0.57 0.00 0.00 34.95 32.28 1xgs s ARG 25 CO -0.00 0.38 1.28 -2.30 -1.08 0.00 0.00 175.30 173.58 1xgs n PRO 26 N -0.62 2.09 -0.04 3.89 -0.02 -1.26 -2.38 135.00 136.65 1xgs n PRO 26 Ca -0.07 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1xgs n PRO 26 Cb 0.58 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1xgs n PRO 26 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xgs n GLY 27 N 0.86 1.41 3.72 -1.23 0.00 0.51 -4.96 105.19 105.50 1xgs n GLY 27 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1xgs n GLY 27 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1xgs s MET 28 N -0.51 4.35 0.13 1.61 0.00 -1.00 -4.71 119.30 119.17 1xgs s MET 28 Ca 0.00 1.99 -0.30 0.00 0.00 0.00 0.00 55.69 57.38 1xgs s MET 28 Cb 0.00 -3.27 -0.07 0.00 0.00 0.00 0.00 34.83 31.49 1xgs s MET 28 CO 0.00 -0.38 1.16 -0.51 0.00 0.00 0.00 175.02 175.29 1xgs s LEU 29 N 1.03 4.43 0.28 4.11 1.43 -1.26 -0.84 118.68 127.86 1xgs s LEU 29 Ca 0.63 2.08 -0.02 0.00 -1.03 0.00 0.00 54.13 55.79 1xgs s LEU 29 Cb -0.35 -3.59 0.43 0.00 0.03 0.00 0.00 46.19 42.71 1xgs s LEU 29 CO 0.30 -0.36 1.92 -0.07 0.23 0.00 0.00 176.35 178.38 1xgs h LEU 30 N 5.88 0.99 -0.64 1.79 3.38 -1.51 -0.67 115.31 124.53 1xgs h LEU 30 Ca -0.43 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.50 1xgs h LEU 30 Cb 1.21 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.71 1xgs h LEU 30 CO 0.76 0.68 0.30 0.25 0.09 0.00 0.00 178.44 180.52 1xgs h LEU 31 N 1.15 0.85 -0.39 1.67 5.85 -1.83 0.10 115.31 122.72 1xgs h LEU 31 Ca 0.37 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 1xgs h LEU 31 Cb 0.04 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 1xgs h LEU 31 CO -0.12 0.76 0.16 -0.33 -0.34 0.00 0.00 178.44 178.56 1xgs h GLU 32 N 0.89 0.58 -0.11 1.25 5.08 -1.78 -1.46 114.58 119.03 1xgs h GLU 32 Ca 0.22 -0.10 -0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1xgs h GLU 32 Cb 0.14 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1xgs h GLU 32 CO -0.03 0.55 0.07 1.25 -1.00 0.00 0.00 179.01 179.85 1xgs h LEU 33 N 0.48 0.13 -0.29 1.33 5.85 -0.72 -1.56 115.31 120.54 1xgs h LEU 33 Ca 0.13 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1xgs h LEU 33 Cb 0.19 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1xgs h LEU 33 CO -0.01 0.13 0.16 0.00 -0.34 0.00 0.00 178.44 178.38 1xgs h ALA 34 N 1.01 0.38 -0.87 1.25 0.00 -0.72 -2.04 119.26 118.26 1xgs h ALA 34 Ca 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1xgs h ALA 34 Cb 0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1xgs h ALA 34 CO -0.01 -0.10 0.50 0.93 0.00 0.00 0.00 179.25 180.57 1xgs h GLU 35 N 0.36 1.20 -0.41 0.00 4.39 -1.17 -1.35 114.58 117.59 1xgs h GLU 35 Ca 0.10 -0.13 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 1xgs h GLU 35 Cb 0.06 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.45 1xgs h GLU 35 CO -0.02 0.86 -0.00 0.77 -1.16 0.00 0.00 179.01 179.46 1xgs h SER 36 N 1.21 0.71 -0.12 1.42 0.02 -1.09 -1.47 113.55 114.22 1xgs h SER 36 Ca 0.31 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1xgs h SER 36 Cb -0.01 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1xgs h SER 36 CO -0.05 0.85 0.05 0.40 -1.14 0.00 0.00 176.83 176.94 1xgs h ILE 37 N 0.56 1.13 -0.35 3.27 1.08 -1.17 -0.72 117.51 121.31 1xgs h ILE 37 Ca 0.12 -0.40 -0.06 0.00 -0.39 0.00 0.00 64.86 64.13 1xgs h ILE 37 Cb 0.48 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 35.39 1xgs h ILE 37 CO 0.02 0.12 -0.05 -0.33 -0.69 0.00 0.00 178.15 177.23 1xgs h GLU 38 N 0.06 0.57 -0.34 2.37 5.08 -1.19 -1.45 114.58 119.68 1xgs h GLU 38 Ca 0.04 -0.15 -0.15 0.00 -1.00 0.00 0.00 59.36 58.10 1xgs h GLU 38 Cb 0.14 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1xgs h GLU 38 CO -0.00 0.63 -0.39 0.87 -1.00 0.00 0.00 179.01 179.12 1xgs h LYS 39 N 0.54 0.82 -0.66 2.33 6.56 -1.08 -2.85 116.57 122.23 1xgs h LYS 39 Ca 0.11 -0.43 -0.06 0.00 -1.06 0.00 0.00 60.65 59.21 1xgs h LYS 39 Cb 0.42 0.01 -0.03 0.00 -0.57 0.00 0.00 32.23 32.06 1xgs h LYS 39 CO 0.02 1.06 0.17 1.98 -2.06 0.00 0.00 179.45 180.63 1xgs h MET 40 N 0.67 1.03 -0.70 3.15 4.05 -0.56 0.22 114.93 122.78 1xgs h MET 40 Ca 0.05 -0.23 0.07 0.00 -0.28 0.00 0.00 59.70 59.32 1xgs h MET 40 Cb 0.96 -0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 31.55 1xgs h MET 40 CO 0.09 0.90 0.37 0.82 0.23 0.00 0.00 176.91 179.32 1xgs h ILE 41 N 0.98 0.92 -0.15 1.77 2.04 -1.08 -0.39 117.51 121.60 1xgs h ILE 41 Ca 0.21 -0.23 -0.14 0.00 1.00 0.00 0.00 64.86 65.70 1xgs h ILE 41 Cb 0.33 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1xgs h ILE 41 CO -0.00 0.12 -0.52 0.24 0.00 0.00 0.00 178.15 177.99 1xgs h MET 42 N 0.67 0.41 -0.36 2.37 2.86 -1.17 -0.93 114.93 118.77 1xgs h MET 42 Ca 0.33 -0.25 -0.08 0.00 -2.06 0.00 0.00 59.70 57.64 1xgs h MET 42 Cb 0.27 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1xgs h MET 42 CO -0.22 0.83 -0.12 0.93 1.06 0.00 0.00 176.91 179.39 1xgs h GLU 43 N 0.32 0.63 0.00 1.72 5.08 0.06 -2.53 114.58 119.86 1xgs h GLU 43 Ca 0.01 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1xgs h GLU 43 Cb 1.03 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1xgs h GLU 43 CO 0.09 0.74 0.00 1.28 -1.00 0.00 0.00 179.01 180.12 1xgs n LEU 44 N -4.18 0.51 0.00 1.33 4.77 -0.26 -4.91 117.00 114.27 1xgs n LEU 44 Ca 0.01 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1xgs n LEU 44 Cb 0.35 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1xgs n LEU 44 CO 0.42 -0.20 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1xgs n GLY 45 N 1.05 1.08 3.83 -0.72 0.00 -0.95 -5.06 105.19 104.42 1xgs n GLY 45 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1xgs n GLY 45 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xgs s GLY 46 N -1.46 2.66 0.04 -0.02 0.00 -0.38 -5.00 107.32 103.17 1xgs s GLY 46 Ca 0.00 -0.93 0.08 0.00 0.00 0.00 0.00 44.72 43.87 1xgs s GLY 46 CO 0.00 -2.05 -0.22 0.54 0.00 0.00 0.00 173.10 171.37 1xgs s LYS 47 N -4.08 1.49 0.30 2.90 1.02 -1.01 -3.47 119.74 116.88 1xgs s LYS 47 Ca 0.22 -0.99 -0.30 0.00 0.02 0.00 0.00 55.97 54.93 1xgs s LYS 47 Cb -0.00 -1.62 -0.11 0.00 -0.52 0.00 0.00 37.83 35.58 1xgs s LYS 47 CO 0.13 0.41 1.51 -2.14 -0.92 0.00 0.00 175.35 174.35 1xgs s PRO 48 N -1.20 4.18 0.36 -1.68 0.02 -1.26 -0.81 135.00 134.61 1xgs s PRO 48 Ca 0.08 2.48 0.23 0.00 0.02 0.00 0.00 61.00 63.81 1xgs s PRO 48 Cb -0.09 -3.04 0.35 0.00 0.02 0.00 0.00 34.50 31.73 1xgs s PRO 48 CO 0.02 -0.53 1.53 0.00 -0.33 0.00 0.00 177.00 177.70 1xgs h ALA 49 N 4.48 0.91 -2.32 -1.55 0.00 -1.47 -3.43 119.26 115.88 1xgs h ALA 49 Ca -0.47 0.00 0.11 0.00 0.00 0.00 0.00 54.91 54.55 1xgs h ALA 49 Cb 1.22 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 1xgs h ALA 49 CO 0.75 0.00 0.48 -0.59 0.00 0.00 0.00 179.25 179.89 1xgs s PHE 50 N -3.22 -0.33 0.51 0.00 -0.71 -1.26 -3.93 117.98 109.04 1xgs s PHE 50 Ca 0.06 0.18 -0.21 0.00 -1.04 0.00 0.00 56.93 55.92 1xgs s PHE 50 Cb 0.07 0.55 -0.06 0.00 -1.21 0.00 0.00 43.02 42.37 1xgs s PHE 50 CO 0.68 -0.59 1.18 -1.25 -1.34 0.00 0.00 175.22 173.90 1xgs s PRO 51 N -3.17 3.47 0.03 1.99 0.04 -1.26 -4.53 135.00 131.56 1xgs s PRO 51 Ca 0.06 1.78 -0.32 0.00 0.04 0.00 0.00 61.00 62.56 1xgs s PRO 51 Cb -0.01 -2.21 -0.11 0.00 0.04 0.00 0.00 34.50 32.22 1xgs s PRO 51 CO -0.08 -0.80 1.89 0.28 0.04 0.00 0.00 177.00 178.34 1xgs n VAL 52 N -0.94 0.57 -3.38 -0.36 0.31 -1.26 -4.89 118.33 108.39 1xgs n VAL 52 Ca 0.10 -0.10 -0.37 0.00 -0.01 0.00 0.00 64.34 63.95 1xgs n VAL 52 Cb 0.49 -2.10 -0.06 0.00 -0.91 0.00 0.00 33.84 31.26 1xgs n VAL 52 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1xgs s ASN 53 N 3.72 6.61 -0.46 4.52 0.02 -0.87 -4.50 114.94 123.98 1xgs s ASN 53 Ca 0.88 0.73 0.02 0.00 -1.02 0.00 0.00 52.86 53.47 1xgs s ASN 53 Cb -0.54 -2.26 0.14 0.00 0.02 0.00 0.00 41.25 38.62 1xgs s ASN 53 CO 0.43 0.03 0.26 -0.76 0.02 0.00 0.00 177.10 177.08 1xgs s LEU 54 N 0.57 2.85 -0.26 0.60 1.43 0.78 -1.67 118.68 122.97 1xgs s LEU 54 Ca 0.23 -2.73 -0.08 0.00 -1.03 0.00 0.00 54.13 50.52 1xgs s LEU 54 Cb -0.14 -1.08 -0.02 0.00 0.03 0.00 0.00 46.19 44.97 1xgs s LEU 54 CO 0.08 -0.25 0.09 -0.44 0.23 0.00 0.00 176.35 176.06 1xgs s SER 55 N 0.20 5.25 -0.17 2.29 0.01 -0.34 -4.71 113.70 116.23 1xgs s SER 55 Ca 0.19 -0.29 -0.11 0.00 1.31 0.00 0.00 55.95 57.05 1xgs s SER 55 Cb -0.22 -1.94 -0.05 0.00 0.21 0.00 0.00 66.02 64.02 1xgs s SER 55 CO -0.02 -0.07 0.19 -0.63 0.41 0.00 0.00 173.24 173.12 1xgs s ILE 56 N 1.61 5.38 0.00 1.44 1.01 -1.25 -0.45 121.20 128.95 1xgs s ILE 56 Ca 0.06 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.03 1xgs s ILE 56 Cb -0.16 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.80 1xgs s ILE 56 CO 0.04 0.46 0.00 0.59 0.00 0.00 0.00 174.94 176.04 1xgs n ASN 57 N 3.20 0.00 0.09 3.58 3.02 -0.11 -1.67 115.26 123.36 1xgs n ASN 57 Ca -0.15 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.52 1xgs n ASN 57 Cb 0.52 0.00 0.45 0.00 -0.61 0.00 0.00 39.78 40.15 1xgs n ASN 57 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 1xgs n GLU 58 N 0.58 0.17 -2.57 3.52 0.00 -1.26 -1.21 120.64 119.87 1xgs n GLU 58 Ca 0.00 0.26 -0.43 0.00 0.00 0.00 0.00 57.16 56.99 1xgs n GLU 58 Cb 0.00 -1.75 -0.02 0.00 0.00 0.00 0.00 31.44 29.67 1xgs n GLU 58 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1xgs s ILE 59 N -3.15 4.34 0.00 3.84 -1.09 -0.67 -0.61 121.20 123.86 1xgs s ILE 59 Ca 0.08 1.49 -0.17 0.00 -2.23 0.00 0.00 60.65 59.83 1xgs s ILE 59 Cb 0.12 -4.39 -0.34 0.00 -1.58 0.00 0.00 42.46 36.26 1xgs s ILE 59 CO 0.47 -0.61 0.93 0.00 -1.23 0.00 0.00 174.94 174.51 1xgs h ALA 60 N 8.70 -0.11 -2.38 9.38 0.00 -0.71 -3.32 119.26 130.81 1xgs h ALA 60 Ca -0.23 -0.85 0.19 0.00 0.00 0.00 0.00 54.91 54.02 1xgs h ALA 60 Cb 1.07 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 1xgs h ALA 60 CO 1.06 0.65 0.60 0.00 0.00 0.00 0.00 179.25 181.56 1xgs s ALA 61 N -2.56 -1.71 -1.06 0.00 0.00 -1.17 -4.89 121.76 110.37 1xgs s ALA 61 Ca -0.11 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.72 1xgs s ALA 61 Cb 0.03 0.71 0.00 0.00 0.00 0.00 0.00 23.12 23.86 1xgs s ALA 61 CO 0.91 -1.06 0.00 0.72 0.00 0.00 0.00 175.76 176.32 1xgs n HIS 62 N -0.64 0.00 -3.78 0.00 8.25 -1.26 -1.19 115.22 116.60 1xgs n HIS 62 Ca -0.04 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.06 1xgs n HIS 62 Cb 0.60 -1.93 -0.12 0.00 1.12 0.00 0.00 29.99 29.66 1xgs n HIS 62 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1xgs s TYR 63 N -2.37 3.13 -0.04 4.41 6.14 -1.26 -4.34 117.35 123.01 1xgs s TYR 63 Ca 0.00 -0.26 0.01 0.00 0.64 0.00 0.00 57.07 57.46 1xgs s TYR 63 Cb 0.00 -2.23 0.02 0.00 0.42 0.00 0.00 41.96 40.17 1xgs s TYR 63 CO 0.00 -0.25 -0.02 -0.08 0.64 0.00 0.00 175.55 175.84 1xgs s THR 64 N 1.44 0.37 1.00 4.34 -1.32 -1.26 -0.16 115.64 120.04 1xgs s THR 64 Ca 0.06 -0.01 -0.14 0.00 -1.21 0.00 0.00 61.69 60.39 1xgs s THR 64 Cb -0.15 -0.44 0.07 0.00 -1.51 0.00 0.00 72.50 70.47 1xgs s THR 64 CO 0.04 0.19 0.37 -2.65 -2.21 0.00 0.00 174.62 170.37 1xgs n PRO 65 N 4.20 -0.69 -4.18 7.08 -0.02 -1.26 -4.91 135.00 135.22 1xgs n PRO 65 Ca -0.24 -0.16 -0.13 0.00 -2.02 0.00 0.00 63.50 60.95 1xgs n PRO 65 Cb 0.51 -1.86 -0.10 0.00 -0.02 0.00 0.00 33.50 32.03 1xgs n PRO 65 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1xgs s TYR 66 N -2.37 1.03 0.09 6.00 -0.85 -1.26 -4.55 117.35 115.44 1xgs s TYR 66 Ca 0.57 -0.74 -0.32 0.00 -0.52 0.00 0.00 57.07 56.06 1xgs s TYR 66 Cb -0.19 -0.56 -0.11 0.00 0.38 0.00 0.00 41.96 41.48 1xgs s TYR 66 CO 0.67 -0.03 1.84 1.63 -1.52 0.00 0.00 175.55 178.14 1xgs n LYS 67 N 0.28 2.68 0.00 -3.49 4.76 -1.26 -1.17 118.16 119.96 1xgs n LYS 67 Ca -0.14 0.98 0.00 0.00 -2.87 0.00 0.00 58.31 56.28 1xgs n LYS 67 Cb 0.59 -2.87 0.00 0.00 -1.84 0.00 0.00 35.03 30.92 1xgs n LYS 67 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xgs n GLY 68 N 4.23 0.46 3.68 0.72 0.00 -1.26 -5.06 105.19 107.97 1xgs n GLY 68 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1xgs n GLY 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xgs s ASP 69 N -2.56 7.07 0.00 1.61 3.68 -0.32 -4.93 116.67 121.22 1xgs s ASP 69 Ca 0.00 1.71 0.22 0.00 2.13 0.00 0.00 52.55 56.61 1xgs s ASP 69 Cb 0.00 -2.55 0.58 0.00 -1.45 0.00 0.00 42.92 39.50 1xgs s ASP 69 CO 0.00 -0.60 1.49 0.35 0.13 0.00 0.00 175.17 176.54 1xgs n THR 70 N 4.81 0.90 -1.85 1.71 -2.24 -1.26 -4.67 114.28 111.68 1xgs n THR 70 Ca 0.11 -0.95 -0.42 0.00 -2.27 0.00 0.00 64.05 60.52 1xgs n THR 70 Cb 0.46 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.26 1xgs n THR 70 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1xgs s THR 71 N -1.09 2.35 0.15 4.28 2.01 -1.26 -4.93 115.64 117.15 1xgs s THR 71 Ca 0.45 0.26 0.09 0.00 0.31 0.00 0.00 61.69 62.79 1xgs s THR 71 Cb 0.24 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 1xgs s THR 71 CO 0.32 0.02 -0.19 0.68 -0.69 0.00 0.00 174.62 174.76 1xgs s VAL 72 N 0.98 1.83 0.24 3.82 -7.23 -1.26 -1.24 120.40 117.53 1xgs s VAL 72 Ca 0.71 -1.83 -0.30 0.00 -1.81 0.00 0.00 61.98 58.75 1xgs s VAL 72 Cb -0.46 -1.79 -0.09 0.00 0.56 0.00 0.00 36.38 34.60 1xgs s VAL 72 CO 0.34 -0.24 1.10 -0.76 -0.31 0.00 0.00 175.10 175.23 1xgs s LEU 73 N -2.47 4.53 0.09 1.32 1.43 -0.02 -4.88 118.68 118.67 1xgs s LEU 73 Ca 0.14 2.19 0.07 0.00 -1.03 0.00 0.00 54.13 55.49 1xgs s LEU 73 Cb -0.07 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.50 1xgs s LEU 73 CO 0.06 -0.17 -0.11 -0.54 0.23 0.00 0.00 176.35 175.83 1xgs s LYS 74 N -0.99 2.16 0.37 1.70 1.02 -1.26 -0.36 119.74 122.37 1xgs s LYS 74 Ca 0.46 -0.99 -0.28 0.00 0.02 0.00 0.00 55.97 55.19 1xgs s LYS 74 Cb -0.31 -2.31 -0.11 0.00 -0.52 0.00 0.00 37.83 34.58 1xgs s LYS 74 CO 0.38 0.52 1.45 -2.00 -0.92 0.00 0.00 175.35 174.78 1xgs s GLU 75 N -2.03 4.16 0.00 1.68 2.12 -1.26 -2.16 118.70 121.21 1xgs s GLU 75 Ca 0.20 2.50 0.00 0.00 0.36 0.00 0.00 54.97 58.03 1xgs s GLU 75 Cb -0.11 -2.99 0.00 0.00 0.26 0.00 0.00 34.13 31.29 1xgs s GLU 75 CO 0.12 -0.46 0.00 0.41 -0.54 0.00 0.00 175.26 174.79 1xgs n GLY 76 N 0.56 3.24 3.75 -1.50 0.00 -0.00 -4.98 105.19 106.26 1xgs n GLY 76 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1xgs n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xgs s ASP 77 N -0.10 6.39 -0.82 1.61 -0.00 -0.92 -4.62 116.67 118.21 1xgs s ASP 77 Ca 0.00 2.93 -0.19 0.00 -0.00 0.00 0.00 52.55 55.29 1xgs s ASP 77 Cb 0.00 -2.63 0.12 0.00 -0.00 0.00 0.00 42.92 40.41 1xgs s ASP 77 CO 0.00 -0.91 1.01 -0.31 -0.00 0.00 0.00 175.17 174.96 1xgs s TYR 78 N 0.11 3.03 -0.26 4.23 1.51 -1.26 -0.25 117.35 124.46 1xgs s TYR 78 Ca 0.64 -1.17 -0.23 0.00 -1.01 0.00 0.00 57.07 55.30 1xgs s TYR 78 Cb -0.48 -4.22 -0.01 0.00 -0.11 0.00 0.00 41.96 37.14 1xgs s TYR 78 CO 0.46 -1.47 0.75 -1.17 -1.11 0.00 0.00 175.55 173.01 1xgs s LEU 79 N 2.87 4.08 -0.33 -1.29 2.96 0.57 -0.94 118.68 126.59 1xgs s LEU 79 Ca 0.27 0.86 -0.13 0.00 -0.22 0.00 0.00 54.13 54.90 1xgs s LEU 79 Cb -0.10 -3.05 -0.02 0.00 0.50 0.00 0.00 46.19 43.52 1xgs s LEU 79 CO -0.03 -0.48 0.25 -0.54 -1.32 0.00 0.00 176.35 174.24 1xgs s LYS 80 N 2.73 3.55 -0.33 1.98 1.02 0.41 -0.86 119.74 128.24 1xgs s LYS 80 Ca 0.31 -0.58 -0.09 0.00 0.02 0.00 0.00 55.97 55.63 1xgs s LYS 80 Cb -0.15 -3.79 0.01 0.00 -0.52 0.00 0.00 37.83 33.38 1xgs s LYS 80 CO 0.08 -0.43 0.15 0.42 -0.92 0.00 0.00 175.35 174.66 1xgs s ILE 81 N 1.76 4.38 -0.21 2.17 1.01 -0.16 -1.20 121.20 128.95 1xgs s ILE 81 Ca 0.07 -0.69 -0.02 0.00 0.00 0.00 0.00 60.65 60.01 1xgs s ILE 81 Cb -0.17 -3.33 0.01 0.00 0.01 0.00 0.00 42.46 38.98 1xgs s ILE 81 CO 0.11 -0.05 -0.11 -0.62 0.00 0.00 0.00 174.94 174.27 1xgs s ASP 82 N 1.55 3.85 0.02 3.58 3.68 -0.67 -1.66 116.67 127.02 1xgs s ASP 82 Ca 0.03 -0.59 0.06 0.00 2.13 0.00 0.00 52.55 54.18 1xgs s ASP 82 Cb -0.18 -1.62 -0.02 0.00 -1.45 0.00 0.00 42.92 39.65 1xgs s ASP 82 CO 0.05 -0.03 -0.19 0.68 0.13 0.00 0.00 175.17 175.81 1xgs s VAL 83 N 1.38 1.51 0.02 1.11 -7.23 0.50 -2.06 120.40 115.63 1xgs s VAL 83 Ca 0.04 -1.02 0.03 0.00 -1.81 0.00 0.00 61.98 59.23 1xgs s VAL 83 Cb -0.14 -1.30 -0.02 0.00 0.56 0.00 0.00 36.38 35.49 1xgs s VAL 83 CO -0.07 0.25 -0.09 -0.83 -0.31 0.00 0.00 175.10 174.05 1xgs s GLY 84 N -0.89 0.52 0.02 2.32 0.00 -1.26 -1.14 107.32 106.89 1xgs s GLY 84 Ca 0.06 -0.59 0.02 0.00 0.00 0.00 0.00 44.72 44.21 1xgs s GLY 84 CO 0.01 -0.58 -0.07 0.14 0.00 0.00 0.00 173.10 172.60 1xgs s VAL 85 N -0.72 0.48 0.05 1.40 1.01 -0.28 -1.36 120.40 120.98 1xgs s VAL 85 Ca -0.01 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.35 1xgs s VAL 85 Cb -0.06 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 1xgs s VAL 85 CO 0.00 -0.14 -0.12 -1.38 0.00 0.00 0.00 175.10 173.47 1xgs s HIS 86 N -0.76 1.00 -0.34 5.22 -3.43 0.01 -0.82 115.29 116.18 1xgs s HIS 86 Ca -0.04 -0.44 0.02 0.00 -0.80 0.00 0.00 55.06 53.80 1xgs s HIS 86 Cb -0.06 -0.58 0.10 0.00 -1.43 0.00 0.00 32.58 30.62 1xgs s HIS 86 CO 0.00 0.00 0.09 0.42 -2.00 0.00 0.00 174.74 173.25 1xgs s ILE 87 N -1.19 1.63 -1.40 -5.38 -1.09 -0.03 -2.41 121.20 111.33 1xgs s ILE 87 Ca -0.04 -1.97 -0.09 0.00 -2.23 0.00 0.00 60.65 56.32 1xgs s ILE 87 Cb -0.09 -2.21 0.04 0.00 -1.58 0.00 0.00 42.46 38.62 1xgs s ILE 87 CO 0.01 -0.65 1.04 0.47 -1.23 0.00 0.00 174.94 174.58 1xgs n ASP 88 N 4.44 -4.79 0.00 3.58 8.00 -1.26 -2.23 116.55 124.29 1xgs n ASP 88 Ca 0.02 -0.67 0.00 0.00 0.71 0.00 0.00 54.79 54.85 1xgs n ASP 88 Cb 0.41 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.01 1xgs n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xgs n GLY 89 N -1.76 3.24 3.63 0.44 0.00 -1.26 -4.89 105.19 104.59 1xgs n GLY 89 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 1xgs n GLY 89 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xgs s PHE 90 N -2.82 3.19 0.03 1.61 0.08 -0.95 -0.81 117.98 118.31 1xgs s PHE 90 Ca 0.00 1.06 -0.03 0.00 0.12 0.00 0.00 56.93 58.08 1xgs s PHE 90 Cb 0.00 -3.46 -0.04 0.00 -0.57 0.00 0.00 43.02 38.95 1xgs s PHE 90 CO 0.00 -0.66 0.22 0.42 -0.10 0.00 0.00 175.22 175.10 1xgs s ILE 91 N 3.33 5.38 -0.09 0.64 1.01 -1.26 -0.85 121.20 129.35 1xgs s ILE 91 Ca 0.40 -0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.89 1xgs s ILE 91 Cb -0.13 -3.58 0.02 0.00 0.01 0.00 0.00 42.46 38.78 1xgs s ILE 91 CO 0.13 0.25 -0.11 0.00 0.00 0.00 0.00 174.94 175.21 1xgs s ALA 92 N -1.41 1.36 -0.14 9.38 0.00 0.00 -4.85 121.76 126.10 1xgs s ALA 92 Ca 0.31 -0.52 -0.00 0.00 0.00 0.00 0.00 51.96 51.74 1xgs s ALA 92 Cb -0.13 -0.77 0.03 0.00 0.00 0.00 0.00 23.12 22.26 1xgs s ALA 92 CO 0.22 -0.16 -0.09 0.34 0.00 0.00 0.00 175.76 176.07 1xgs s ASP 93 N 1.19 2.56 0.05 0.00 2.15 -1.26 -1.13 116.67 120.23 1xgs s ASP 93 Ca -0.04 -0.48 -0.05 0.00 0.43 0.00 0.00 52.55 52.40 1xgs s ASP 93 Cb -0.14 -0.98 -0.01 0.00 -0.30 0.00 0.00 42.92 41.48 1xgs s ASP 93 CO -0.03 -0.12 0.10 0.28 -0.17 0.00 0.00 175.17 175.23 1xgs s THR 94 N 1.61 0.15 0.08 1.71 -1.32 -0.29 -3.12 115.64 114.45 1xgs s THR 94 Ca 0.04 -1.27 -0.20 0.00 -1.21 0.00 0.00 61.69 59.05 1xgs s THR 94 Cb -0.13 -1.15 0.05 0.00 -1.51 0.00 0.00 72.50 69.75 1xgs s THR 94 CO -0.09 -0.70 0.48 0.00 -2.21 0.00 0.00 174.62 172.10 1xgs s ALA 95 N -3.24 -1.19 0.05 11.08 0.00 -0.82 -0.37 121.76 127.27 1xgs s ALA 95 Ca 0.00 0.37 -0.11 0.00 0.00 0.00 0.00 51.96 52.22 1xgs s ALA 95 Cb 0.03 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.66 1xgs s ALA 95 CO -0.08 -0.56 0.24 0.54 0.00 0.00 0.00 175.76 175.91 1xgs s VAL 96 N -2.92 0.10 -0.06 0.00 0.11 -0.66 -1.34 120.40 115.63 1xgs s VAL 96 Ca -0.03 -0.84 0.03 0.00 -2.93 0.00 0.00 61.98 58.22 1xgs s VAL 96 Cb -0.00 -0.98 -0.02 0.00 -1.53 0.00 0.00 36.38 33.85 1xgs s VAL 96 CO -0.06 -0.46 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.22 1xgs s THR 97 N -2.74 3.05 -0.04 5.04 2.01 -1.13 -0.99 115.64 120.84 1xgs s THR 97 Ca -0.04 -0.72 0.02 0.00 0.31 0.00 0.00 61.69 61.26 1xgs s THR 97 Cb -0.00 -2.20 0.01 0.00 0.01 0.00 0.00 72.50 70.32 1xgs s THR 97 CO -0.05 0.59 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.69 1xgs s VAL 98 N -0.65 0.84 -0.61 3.82 1.01 -0.04 -4.97 120.40 119.80 1xgs s VAL 98 Ca 0.10 -0.35 -0.20 0.00 0.00 0.00 0.00 61.98 61.53 1xgs s VAL 98 Cb -0.11 -0.77 0.10 0.00 0.00 0.00 0.00 36.38 35.59 1xgs s VAL 98 CO 0.01 0.28 0.77 -0.60 0.00 0.00 0.00 175.10 175.55 1xgs s ARG 99 N 0.49 3.07 -0.40 2.72 3.52 -1.26 -0.32 118.95 126.77 1xgs s ARG 99 Ca -0.08 -1.23 -0.46 0.00 -0.13 0.00 0.00 55.73 53.83 1xgs s ARG 99 Cb -0.12 -4.27 -0.20 0.00 -1.56 0.00 0.00 34.95 28.80 1xgs s ARG 99 CO 0.01 -1.61 1.51 0.28 -0.81 0.00 0.00 175.30 174.69 1xgs n VAL 100 N 5.62 0.01 -1.02 7.11 0.31 0.65 0.02 118.33 131.03 1xgs n VAL 100 Ca -0.08 -0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.25 1xgs n VAL 100 Cb 0.43 -0.44 -0.00 0.00 -0.91 0.00 0.00 33.84 32.92 1xgs n VAL 100 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xgs n GLY 101 N 3.56 0.23 3.26 2.92 0.00 -1.26 -0.82 105.19 113.08 1xgs n GLY 101 Ca 0.29 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 46.13 1xgs n GLY 101 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xgs s MET 102 N -1.38 1.45 0.39 1.61 1.00 0.10 -4.89 119.30 117.58 1xgs s MET 102 Ca 0.00 -1.80 -0.07 0.00 0.00 0.00 0.00 55.69 53.82 1xgs s MET 102 Cb 0.00 0.17 -0.05 0.00 0.00 0.00 0.00 34.83 34.95 1xgs s MET 102 CO 0.00 -0.47 0.70 -1.83 0.00 0.00 0.00 175.02 173.42 1xgs s GLU 103 N -3.89 3.65 0.44 2.03 -1.05 -1.26 -4.40 118.70 114.23 1xgs s GLU 103 Ca 0.39 0.21 -0.25 0.00 -0.15 0.00 0.00 54.97 55.16 1xgs s GLU 103 Cb 0.05 -2.48 -0.08 0.00 -0.44 0.00 0.00 34.13 31.19 1xgs s GLU 103 CO 0.17 0.00 1.32 -1.83 0.95 0.00 0.00 175.26 175.88 1xgs s GLU 104 N -4.04 3.78 0.08 -4.83 -1.05 -1.26 -4.79 118.70 106.59 1xgs s GLU 104 Ca 0.47 2.18 0.01 0.00 -0.15 0.00 0.00 54.97 57.48 1xgs s GLU 104 Cb -0.10 -2.64 0.01 0.00 -0.44 0.00 0.00 34.13 30.96 1xgs s GLU 104 CO 0.35 -0.65 0.04 -0.40 0.95 0.00 0.00 175.26 175.55 1xgs n ASP 105 N -0.15 1.50 -0.08 0.83 5.75 -1.26 -4.97 116.55 118.17 1xgs n ASP 105 Ca 0.05 -1.30 -0.04 0.00 -0.01 0.00 0.00 54.79 53.49 1xgs n ASP 105 Cb 0.44 0.01 0.17 0.00 -1.03 0.00 0.00 41.12 40.70 1xgs n ASP 105 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1xgs h GLU 106 N 0.00 0.73 -0.16 0.11 3.07 -1.98 -0.36 114.58 115.99 1xgs h GLU 106 Ca -0.05 -0.22 -0.00 0.00 -0.50 0.00 0.00 59.36 58.58 1xgs h GLU 106 Cb 0.19 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.02 1xgs h GLU 106 CO 0.09 0.79 0.08 1.25 -1.40 0.00 0.00 179.01 179.81 1xgs h LEU 107 N 0.67 0.20 -0.69 1.33 5.85 -1.96 -0.51 115.31 120.21 1xgs h LEU 107 Ca 0.12 -0.11 -0.08 0.00 0.84 0.00 0.00 57.88 58.65 1xgs h LEU 107 Cb 0.51 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1xgs h LEU 107 CO 0.03 0.25 0.10 0.24 -0.34 0.00 0.00 178.44 178.72 1xgs h MET 108 N 0.14 1.11 -0.72 1.25 2.86 -1.91 -2.78 114.93 114.88 1xgs h MET 108 Ca 0.05 -0.30 -0.03 0.00 -2.06 0.00 0.00 59.70 57.36 1xgs h MET 108 Cb 0.10 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 1xgs h MET 108 CO -0.01 1.02 0.32 1.49 1.06 0.00 0.00 176.91 180.79 1xgs h GLU 109 N 1.04 1.05 0.03 1.72 4.81 -0.84 -1.78 114.58 120.62 1xgs h GLU 109 Ca 0.20 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1xgs h GLU 109 Cb 0.45 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1xgs h GLU 109 CO 0.01 0.83 -0.01 0.00 -0.73 0.00 0.00 179.01 179.11 1xgs h ALA 110 N 1.31 -0.04 -0.56 2.92 0.00 -0.83 0.83 119.26 122.89 1xgs h ALA 110 Ca 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1xgs h ALA 110 Cb 0.15 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1xgs h ALA 110 CO -0.03 -0.50 0.37 0.00 0.00 0.00 0.00 179.25 179.10 1xgs h ALA 111 N 0.87 0.71 -0.26 0.00 0.00 -1.33 0.84 119.26 120.10 1xgs h ALA 111 Ca -0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1xgs h ALA 111 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1xgs h ALA 111 CO 0.01 0.16 0.10 -0.22 0.00 0.00 0.00 179.25 179.29 1xgs h LYS 112 N 0.76 0.39 -0.30 0.00 3.64 -1.16 -2.07 116.57 117.83 1xgs h LYS 112 Ca 0.21 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.43 1xgs h LYS 112 Cb -0.08 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.66 1xgs h LYS 112 CO -0.04 0.43 -0.16 0.93 -2.27 0.00 0.00 179.45 178.34 1xgs h GLU 113 N 0.26 0.52 -0.92 1.90 4.39 -0.63 -1.50 114.58 118.60 1xgs h GLU 113 Ca 0.08 -0.16 -0.01 0.00 0.34 0.00 0.00 59.36 59.62 1xgs h GLU 113 Cb 0.19 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 28.75 1xgs h GLU 113 CO -0.01 0.66 0.55 0.00 -1.16 0.00 0.00 179.01 179.06 1xgs h ALA 114 N 1.36 1.17 -0.09 3.43 0.00 -0.58 -0.02 119.26 124.54 1xgs h ALA 114 Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1xgs h ALA 114 Cb 0.55 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1xgs h ALA 114 CO 0.04 0.62 0.01 1.25 0.00 0.00 0.00 179.25 181.17 1xgs h LEU 115 N 1.26 0.14 -1.62 0.00 5.85 -0.87 -1.91 115.31 118.16 1xgs h LEU 115 Ca 0.33 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1xgs h LEU 115 Cb -0.05 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1xgs h LEU 115 CO -0.06 0.37 0.26 0.78 -0.34 0.00 0.00 178.44 179.45 1xgs h ASN 116 N -0.10 0.44 -0.34 1.25 2.35 -0.99 -1.89 115.58 116.30 1xgs h ASN 116 Ca 0.03 -0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.66 1xgs h ASN 116 Cb 0.30 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1xgs h ASN 116 CO 0.00 0.32 -0.19 0.00 -1.65 0.00 0.00 177.43 175.91 1xgs h ALA 117 N 1.76 0.48 -0.49 -0.83 0.00 -0.70 -1.82 119.26 117.66 1xgs h ALA 117 Ca 0.15 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1xgs h ALA 117 Cb -0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1xgs h ALA 117 CO -0.03 0.42 -0.02 0.00 0.00 0.00 0.00 179.25 179.61 1xgs h ALA 118 N 0.77 0.66 -0.64 0.00 0.00 -0.99 -3.00 119.26 116.06 1xgs h ALA 118 Ca 0.07 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1xgs h ALA 118 Cb 0.74 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1xgs h ALA 118 CO 0.05 0.49 0.08 0.82 0.00 0.00 0.00 179.25 180.69 1xgs h ILE 119 N 0.73 1.26 0.00 0.00 2.04 -1.32 -2.02 117.51 118.21 1xgs h ILE 119 Ca 0.13 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1xgs h ILE 119 Cb 0.55 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1xgs h ILE 119 CO 0.03 0.39 -0.04 0.77 0.00 0.00 0.00 178.15 179.30 1xgs h SER 120 N 0.99 0.00 0.15 1.72 4.64 -1.21 -2.39 113.55 117.46 1xgs h SER 120 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1xgs h SER 120 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1xgs h SER 120 CO 0.02 0.04 -1.74 1.33 -0.87 0.00 0.00 176.83 175.61 1xgs n VAL 121 N -3.30 0.09 -2.17 0.95 0.24 -1.07 -4.98 118.33 108.08 1xgs n VAL 121 Ca -0.01 -0.45 -0.41 0.00 -2.04 0.00 0.00 64.34 61.42 1xgs n VAL 121 Cb 0.20 0.05 -0.03 0.00 -1.47 0.00 0.00 33.84 32.60 1xgs n VAL 121 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xgs s ALA 122 N -3.44 3.55 -0.20 2.33 0.00 -0.78 -4.94 121.76 118.28 1xgs s ALA 122 Ca -0.05 1.16 -0.36 0.00 0.00 0.00 0.00 51.96 52.71 1xgs s ALA 122 Cb 0.14 -3.50 0.15 0.00 0.00 0.00 0.00 23.12 19.91 1xgs s ALA 122 CO 0.89 -0.58 1.35 -0.98 0.00 0.00 0.00 175.76 176.43 1xgs s ARG 123 N -0.24 0.12 0.29 0.00 1.70 -1.26 -4.14 118.95 115.42 1xgs s ARG 123 Ca 0.57 -0.05 -0.30 0.00 -0.47 0.00 0.00 55.73 55.48 1xgs s ARG 123 Cb -0.38 0.05 -0.11 0.00 -0.57 0.00 0.00 34.95 33.94 1xgs s ARG 123 CO 0.40 -0.05 1.55 0.00 -1.08 0.00 0.00 175.30 176.11 1xgs s ALA 124 N -2.15 3.70 0.00 7.88 0.00 0.12 -3.04 121.76 128.27 1xgs s ALA 124 Ca 0.12 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.60 1xgs s ALA 124 Cb 0.01 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.51 1xgs s ALA 124 CO -0.04 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.19 1xgs n GLY 125 N 1.98 1.94 3.85 0.00 0.00 0.24 -4.84 105.19 108.35 1xgs n GLY 125 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1xgs n GLY 125 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xgs s VAL 126 N -2.32 5.12 0.36 1.61 -7.23 -1.17 -4.78 120.40 111.99 1xgs s VAL 126 Ca 0.00 0.68 -0.25 0.00 -1.81 0.00 0.00 61.98 60.60 1xgs s VAL 126 Cb 0.00 -3.65 -0.10 0.00 0.56 0.00 0.00 36.38 33.19 1xgs s VAL 126 CO 0.00 0.54 0.98 -1.61 -0.31 0.00 0.00 175.10 174.70 1xgs s GLU 127 N -1.19 4.40 0.36 4.82 2.02 -1.26 -0.71 118.70 127.13 1xgs s GLU 127 Ca 0.24 1.35 0.13 0.00 0.02 0.00 0.00 54.97 56.71 1xgs s GLU 127 Cb -0.16 -2.62 0.96 0.00 0.10 0.00 0.00 34.13 32.42 1xgs s GLU 127 CO 0.13 0.10 1.77 0.82 0.02 0.00 0.00 175.26 178.10 1xgs h ILE 128 N 2.36 0.59 -0.71 -1.63 1.08 -0.81 -1.97 117.51 116.43 1xgs h ILE 128 Ca -0.48 -0.18 0.20 0.00 -0.39 0.00 0.00 64.86 64.01 1xgs h ILE 128 Cb 1.20 0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 1xgs h ILE 128 CO 0.63 0.10 0.51 0.07 -0.69 0.00 0.00 178.15 178.77 1xgs h LYS 129 N 0.53 0.03 -0.06 2.37 2.10 -1.51 0.42 116.57 120.45 1xgs h LYS 129 Ca 0.59 -0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 59.15 1xgs h LYS 129 Cb 1.25 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 32.56 1xgs h LYS 129 CO -0.34 0.02 -0.35 0.93 -2.00 0.00 0.00 179.45 177.71 1xgs h GLU 130 N 0.03 0.12 0.11 0.07 4.39 -1.65 0.16 114.58 117.82 1xgs h GLU 130 Ca 0.34 -0.05 -0.29 0.00 0.34 0.00 0.00 59.36 59.70 1xgs h GLU 130 Cb 1.31 -0.01 0.03 0.00 -0.10 0.00 0.00 28.75 29.98 1xgs h GLU 130 CO -0.01 0.45 -1.23 -0.07 -1.16 0.00 0.00 179.01 176.99 1xgs h LEU 131 N 0.10 0.81 -0.36 1.33 3.38 -1.08 -2.72 115.31 116.77 1xgs h LEU 131 Ca 0.01 -0.75 0.02 0.00 0.09 0.00 0.00 57.88 57.26 1xgs h LEU 131 Cb 0.67 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1xgs h LEU 131 CO 0.05 1.56 0.19 1.23 0.09 0.00 0.00 178.44 181.56 1xgs h GLY 132 N 0.50 0.50 0.97 0.83 0.00 -1.01 -0.94 103.07 103.91 1xgs h GLY 132 Ca -0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 1xgs h GLY 132 CO 0.23 0.11 0.19 1.70 0.00 0.00 0.00 176.54 178.77 1xgs h LYS 133 N 0.39 0.48 -0.64 4.80 3.64 -1.03 -0.67 116.57 123.53 1xgs h LYS 133 Ca 0.15 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1xgs h LYS 133 Cb 0.05 -0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1xgs h LYS 133 CO -0.10 0.39 0.41 0.00 -2.27 0.00 0.00 179.45 177.88 1xgs h ALA 134 N 1.06 0.82 0.39 5.00 0.00 -1.20 0.64 119.26 125.98 1xgs h ALA 134 Ca 0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1xgs h ALA 134 Cb 0.05 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1xgs h ALA 134 CO -0.02 0.18 -0.19 0.82 0.00 0.00 0.00 179.25 180.04 1xgs h ILE 135 N 0.81 0.58 -0.99 0.00 2.04 -0.99 -2.88 117.51 116.09 1xgs h ILE 135 Ca 0.25 -0.45 0.08 0.00 1.00 0.00 0.00 64.86 65.73 1xgs h ILE 135 Cb -0.02 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 36.78 1xgs h ILE 135 CO -0.08 0.08 0.64 -0.08 0.00 0.00 0.00 178.15 178.70 1xgs h GLU 136 N -0.79 1.08 -0.64 2.37 4.81 -0.97 -2.32 114.58 118.12 1xgs h GLU 136 Ca -0.05 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.06 1xgs h GLU 136 Cb 0.53 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 1xgs h GLU 136 CO 0.09 0.71 0.18 -0.91 -0.73 0.00 0.00 179.01 178.36 1xgs h ASN 137 N 1.11 0.94 0.07 1.04 2.35 -0.85 -0.63 115.58 119.61 1xgs h ASN 137 Ca 0.44 -0.22 -0.12 0.00 -0.55 0.00 0.00 56.30 55.85 1xgs h ASN 137 Cb 0.25 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1xgs h ASN 137 CO -0.19 0.91 -0.41 -0.33 -1.65 0.00 0.00 177.43 175.76 1xgs h GLU 138 N 0.92 0.43 -0.00 0.81 4.39 -1.21 -1.24 114.58 118.67 1xgs h GLU 138 Ca 0.20 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.67 1xgs h GLU 138 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1xgs h GLU 138 CO -0.00 0.77 -0.08 0.82 -1.16 0.00 0.00 179.01 179.35 1xgs h ILE 139 N 0.35 1.58 -0.47 3.13 2.04 -1.32 -3.31 117.51 119.52 1xgs h ILE 139 Ca 0.03 -1.83 -0.10 0.00 1.00 0.00 0.00 64.86 63.96 1xgs h ILE 139 Cb 0.87 2.79 -0.02 0.00 -0.74 0.00 0.00 36.82 39.72 1xgs h ILE 139 CO 0.07 0.48 -0.11 0.03 0.00 0.00 0.00 178.15 178.63 1xgs h ARG 140 N -0.67 0.86 0.00 2.37 3.08 -1.13 -2.51 114.38 116.39 1xgs h ARG 140 Ca -0.01 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 1xgs h ARG 140 Cb 0.84 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 1xgs h ARG 140 CO 0.02 0.93 -0.04 1.57 -1.07 0.00 0.00 179.97 181.37 1xgs h LYS 141 N 0.77 0.00 -0.13 0.04 2.10 -1.37 -0.15 116.57 117.83 1xgs h LYS 141 Ca 0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.78 1xgs h LYS 141 Cb 0.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.95 1xgs h LYS 141 CO 0.04 0.04 0.00 0.54 -2.00 0.00 0.00 179.45 178.07 1xgs n ARG 142 N -3.27 1.74 -0.57 0.07 1.74 -1.09 -4.93 116.66 110.36 1xgs n ARG 142 Ca -0.01 -1.11 0.00 0.00 -0.77 0.00 0.00 57.85 55.96 1xgs n ARG 142 Cb 0.21 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 1xgs n ARG 142 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xgs n GLY 143 N 1.16 0.73 3.94 -0.13 0.00 -0.07 -5.03 105.19 105.78 1xgs n GLY 143 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1xgs n GLY 143 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xgs s PHE 144 N -2.19 1.71 -0.10 1.61 0.40 -0.96 -5.01 117.98 113.44 1xgs s PHE 144 Ca 0.00 -0.76 0.04 0.00 -0.60 0.00 0.00 56.93 55.61 1xgs s PHE 144 Cb 0.00 -2.04 -0.00 0.00 0.51 0.00 0.00 43.02 41.49 1xgs s PHE 144 CO 0.00 -0.63 -0.22 0.15 0.70 0.00 0.00 175.22 175.22 1xgs s LYS 145 N -4.38 3.07 0.40 0.44 1.02 -0.53 -3.80 119.74 115.97 1xgs s LYS 145 Ca 0.44 -0.85 -0.24 0.00 0.02 0.00 0.00 55.97 55.34 1xgs s LYS 145 Cb -0.03 -2.34 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1xgs s LYS 145 CO 0.27 0.20 1.04 -1.25 -0.92 0.00 0.00 175.35 174.69 1xgs s PRO 146 N 0.30 4.16 -0.20 -1.68 0.04 -1.26 -0.87 135.00 135.49 1xgs s PRO 146 Ca -0.17 1.47 -0.29 0.00 0.04 0.00 0.00 61.00 62.05 1xgs s PRO 146 Cb -0.17 -2.50 -0.00 0.00 0.04 0.00 0.00 34.50 31.86 1xgs s PRO 146 CO 0.08 -0.14 1.16 0.42 0.04 0.00 0.00 177.00 178.56 1xgs s ILE 147 N -1.71 4.46 -0.21 0.56 -1.09 -0.77 -4.66 121.20 117.78 1xgs s ILE 147 Ca 0.58 1.77 0.28 0.00 -2.23 0.00 0.00 60.65 61.05 1xgs s ILE 147 Cb -0.21 -4.15 0.36 0.00 -1.58 0.00 0.00 42.46 36.89 1xgs s ILE 147 CO 0.26 -0.16 1.79 -0.37 -1.23 0.00 0.00 174.94 175.22 1xgs h VAL 148 N 5.48 0.00 -0.03 2.92 -1.51 -1.55 -3.33 116.25 118.23 1xgs h VAL 148 Ca -0.23 -0.75 -0.00 0.00 -1.23 0.00 0.00 66.70 64.49 1xgs h VAL 148 Cb 1.08 1.74 -0.00 0.00 -2.13 0.00 0.00 31.29 31.98 1xgs h VAL 148 CO 0.98 0.00 -0.04 -0.46 -1.23 0.00 0.00 177.57 176.81 1xgs n ASN 149 N -3.05 2.45 -3.89 4.19 6.94 -1.26 -4.90 115.26 115.74 1xgs n ASN 149 Ca 0.02 -3.16 -0.17 0.00 -0.02 0.00 0.00 54.58 51.26 1xgs n ASN 149 Cb 0.42 -0.45 -0.15 0.00 -2.36 0.00 0.00 39.78 37.23 1xgs n ASN 149 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1xgs s LEU 150 N -2.91 1.59 0.00 -4.53 1.43 -1.25 -4.95 118.68 108.06 1xgs s LEU 150 Ca 0.34 -0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 53.24 1xgs s LEU 150 Cb 0.30 -0.27 0.04 0.00 0.03 0.00 0.00 46.19 46.29 1xgs s LEU 150 CO 0.03 -0.02 0.60 -1.54 0.23 0.00 0.00 176.35 175.64 1xgs n SER 151 N 3.58 -1.17 -4.42 2.29 3.41 -1.26 -4.58 113.62 111.46 1xgs n SER 151 Ca -0.20 -1.68 -0.29 0.00 -0.26 0.00 0.00 58.87 56.44 1xgs n SER 151 Cb 0.54 1.92 0.22 0.00 -0.26 0.00 0.00 64.21 66.63 1xgs n SER 151 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1xgs s GLY 152 N -2.68 1.55 -0.03 5.00 0.00 -0.46 -4.73 107.32 105.96 1xgs s GLY 152 Ca 0.13 -0.43 -0.30 0.00 0.00 0.00 0.00 44.72 44.12 1xgs s GLY 152 CO 0.05 0.29 0.66 -2.38 0.00 0.00 0.00 173.10 171.72 1xgs s HIS 153 N -2.78 -0.64 0.25 1.90 -3.43 -0.11 -1.66 115.29 108.82 1xgs s HIS 153 Ca 0.67 1.05 -0.30 0.00 -0.80 0.00 0.00 55.06 55.68 1xgs s HIS 153 Cb -0.19 0.41 -0.09 0.00 -1.43 0.00 0.00 32.58 31.28 1xgs s HIS 153 CO 0.60 -0.62 1.09 0.21 -2.00 0.00 0.00 174.74 174.01 1xgs s LYS 154 N -1.39 4.65 -0.10 -0.38 2.20 0.51 -0.97 119.74 124.26 1xgs s LYS 154 Ca -0.10 1.76 0.03 0.00 -0.36 0.00 0.00 55.97 57.29 1xgs s LYS 154 Cb -0.00 -3.22 -0.01 0.00 -1.51 0.00 0.00 37.83 33.09 1xgs s LYS 154 CO 0.08 0.20 -0.19 0.42 -0.36 0.00 0.00 175.35 175.50 1xgs s ILE 155 N -0.92 2.52 0.29 5.43 1.01 0.29 -0.59 121.20 129.23 1xgs s ILE 155 Ca 0.45 -0.86 0.05 0.00 0.00 0.00 0.00 60.65 60.29 1xgs s ILE 155 Cb -0.31 -2.00 -0.06 0.00 0.01 0.00 0.00 42.46 40.10 1xgs s ILE 155 CO 0.39 0.55 -0.01 -1.61 0.00 0.00 0.00 174.94 174.25 1xgs s GLU 156 N 0.22 1.57 -0.07 2.79 2.02 -0.26 -4.32 118.70 120.65 1xgs s GLU 156 Ca -0.12 -1.83 -0.35 0.00 0.02 0.00 0.00 54.97 52.69 1xgs s GLU 156 Cb -0.16 -1.02 -0.13 0.00 0.10 0.00 0.00 34.13 32.92 1xgs s GLU 156 CO 0.07 -0.06 1.81 -2.13 0.02 0.00 0.00 175.26 174.97 1xgs n ARG 157 N -0.61 2.02 -1.83 1.61 0.63 -1.26 -0.83 116.66 116.38 1xgs n ARG 157 Ca -0.04 0.74 -0.20 0.00 -0.92 0.00 0.00 57.85 57.42 1xgs n ARG 157 Cb 0.65 -2.55 -0.06 0.00 0.45 0.00 0.00 32.46 30.95 1xgs n ARG 157 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1xgs n TYR 158 N 5.92 -0.30 -3.46 -0.14 4.01 0.01 -4.94 117.16 118.27 1xgs n TYR 158 Ca 0.22 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.70 1xgs n TYR 158 Cb 0.27 -3.52 -0.12 0.00 -0.31 0.00 0.00 39.34 35.66 1xgs n TYR 158 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 1xgs s LYS 159 N -4.11 0.45 0.17 -0.72 2.47 -0.01 -4.57 119.74 113.42 1xgs s LYS 159 Ca 0.00 -0.97 -0.14 0.00 -1.56 0.00 0.00 55.97 53.29 1xgs s LYS 159 Cb 0.00 -1.13 0.10 0.00 -1.46 0.00 0.00 37.83 35.34 1xgs s LYS 159 CO 0.00 -1.15 1.77 1.25 0.16 0.00 0.00 175.35 177.39 1xgs h LEU 160 N 7.47 0.28 -7.57 5.43 5.85 -1.88 -0.68 115.31 124.22 1xgs h LEU 160 Ca -0.02 0.03 -0.67 0.00 0.84 0.00 0.00 57.88 58.06 1xgs h LEU 160 Cb 1.00 -0.02 -0.38 0.00 0.37 0.00 0.00 40.66 41.63 1xgs h LEU 160 CO 0.30 0.20 -0.55 -1.00 -0.34 0.00 0.00 178.44 177.06 1xgs s HIS 161 N -6.14 3.43 -1.56 1.25 3.76 -1.26 -4.32 115.29 110.45 1xgs s HIS 161 Ca -0.13 -2.88 0.23 0.00 -0.15 0.00 0.00 55.06 52.13 1xgs s HIS 161 Cb 0.13 -3.02 1.23 0.00 1.11 0.00 0.00 32.58 32.02 1xgs s HIS 161 CO 0.72 -0.85 1.77 0.00 -0.85 0.00 0.00 174.74 175.54 1xgs n ALA 162 N 3.68 2.23 0.00 -1.40 0.00 0.24 -4.93 120.51 120.32 1xgs n ALA 162 Ca 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1xgs n ALA 162 Cb 0.37 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1xgs n ALA 162 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xgs n GLY 163 N 0.64 3.47 3.72 0.00 0.00 -1.26 -4.99 105.19 106.78 1xgs n GLY 163 Ca 0.13 -0.91 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1xgs n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xgs s ILE 164 N 0.00 4.69 0.30 -0.61 -1.09 -1.26 -4.97 121.20 118.26 1xgs s ILE 164 Ca 0.00 1.97 0.11 0.00 -2.23 0.00 0.00 60.65 60.50 1xgs s ILE 164 Cb 0.00 -4.28 -0.05 0.00 -1.58 0.00 0.00 42.46 36.55 1xgs s ILE 164 CO 0.00 0.27 -0.11 -0.94 -1.23 0.00 0.00 174.94 172.93 1xgs s SER 165 N 0.39 3.92 -0.41 3.58 1.04 -1.26 -0.36 113.70 120.59 1xgs s SER 165 Ca 0.47 -0.96 0.04 0.00 0.48 0.00 0.00 55.95 55.98 1xgs s SER 165 Cb -0.22 -0.46 0.11 0.00 0.10 0.00 0.00 66.02 65.55 1xgs s SER 165 CO 0.28 -0.05 0.14 -0.63 0.98 0.00 0.00 173.24 173.95 1xgs s ILE 166 N -2.48 2.43 0.88 -1.02 1.01 -0.67 -4.90 121.20 116.45 1xgs s ILE 166 Ca 0.31 -2.73 -0.11 0.00 0.00 0.00 0.00 60.65 58.13 1xgs s ILE 166 Cb -0.03 -2.75 0.12 0.00 0.01 0.00 0.00 42.46 39.81 1xgs s ILE 166 CO 0.17 -0.68 1.10 -2.84 0.00 0.00 0.00 174.94 172.69 1xgs s PRO 167 N 0.43 1.38 -0.05 2.79 0.02 -1.26 -1.36 135.00 136.95 1xgs s PRO 167 Ca 0.13 1.19 0.14 0.00 0.02 0.00 0.00 61.00 62.48 1xgs s PRO 167 Cb -0.22 -1.80 0.49 0.00 0.02 0.00 0.00 34.50 33.00 1xgs s PRO 167 CO -0.05 -2.26 1.37 0.09 -0.33 0.00 0.00 177.00 175.82 1xgs n ASN 168 N -3.94 3.24 -4.15 2.53 5.03 -1.26 -4.11 115.26 112.60 1xgs n ASN 168 Ca 0.09 -2.21 -0.10 0.00 0.87 0.00 0.00 54.58 53.23 1xgs n ASN 168 Cb 0.53 -0.44 -0.10 0.00 -1.02 0.00 0.00 39.78 38.76 1xgs n ASN 168 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 1xgs s ILE 169 N -1.61 0.60 -0.13 2.41 -4.36 -1.25 -3.36 121.20 113.50 1xgs s ILE 169 Ca 0.35 -1.84 -0.24 0.00 -0.26 0.00 0.00 60.65 58.66 1xgs s ILE 169 Cb 0.21 -1.57 -0.02 0.00 1.25 0.00 0.00 42.46 42.33 1xgs s ILE 169 CO 0.19 -0.86 0.77 -0.47 0.24 0.00 0.00 174.94 174.82 1xgs s TYR 170 N -3.49 3.48 -0.16 1.37 6.14 -1.25 -4.45 117.35 118.98 1xgs s TYR 170 Ca 0.09 1.24 0.00 0.00 0.64 0.00 0.00 57.07 59.04 1xgs s TYR 170 Cb 0.04 -2.93 0.03 0.00 0.42 0.00 0.00 41.96 39.53 1xgs s TYR 170 CO -0.05 -0.12 -0.12 1.03 0.64 0.00 0.00 175.55 176.93 1xgs s ARG 171 N 1.63 2.10 0.61 4.97 0.52 -1.26 -4.98 118.95 122.53 1xgs s ARG 171 Ca 0.38 -0.60 0.29 0.00 -0.52 0.00 0.00 55.73 55.27 1xgs s ARG 171 Cb -0.17 -2.13 1.50 0.00 0.52 0.00 0.00 34.95 34.67 1xgs s ARG 171 CO 0.15 -0.30 1.90 -1.00 0.02 0.00 0.00 175.30 176.06 1xgs h PRO 172 N 8.05 0.00 -0.48 3.54 0.13 -1.96 -2.15 132.00 139.14 1xgs h PRO 172 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1xgs h PRO 172 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1xgs h PRO 172 CO 0.49 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.98 1xgs n HIS 173 N -3.54 1.59 -2.18 1.56 8.25 -1.26 -4.69 115.22 114.96 1xgs n HIS 173 Ca 0.06 -0.75 -0.43 0.00 -0.26 0.00 0.00 57.72 56.34 1xgs n HIS 173 Cb 0.60 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.32 1xgs n HIS 173 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1xgs n ASP 174 N 0.32 4.56 -1.95 0.41 8.00 -0.81 -4.70 116.55 122.39 1xgs n ASP 174 Ca 0.25 -2.96 0.02 0.00 0.71 0.00 0.00 54.79 52.82 1xgs n ASP 174 Cb 1.04 -1.60 0.37 0.00 -0.02 0.00 0.00 41.12 40.91 1xgs n ASP 174 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1xgs n ASN 175 N 5.63 5.46 -4.74 -2.24 0.23 -1.26 -1.41 115.26 116.93 1xgs n ASN 175 Ca 0.46 -3.04 -0.41 0.00 -0.53 0.00 0.00 54.58 51.05 1xgs n ASN 175 Cb 0.39 -0.71 -0.03 0.00 -2.08 0.00 0.00 39.78 37.36 1xgs n ASN 175 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1xgs s TYR 176 N -2.86 3.14 -0.24 -2.53 6.14 -1.26 -4.79 117.35 114.95 1xgs s TYR 176 Ca 0.55 1.12 -0.10 0.00 0.64 0.00 0.00 57.07 59.28 1xgs s TYR 176 Cb 0.43 -3.71 -0.05 0.00 0.42 0.00 0.00 41.96 39.05 1xgs s TYR 176 CO 0.15 -2.28 0.14 0.08 0.64 0.00 0.00 175.55 174.28 1xgs s VAL 177 N 0.05 5.20 0.37 3.14 1.01 -1.26 -0.60 120.40 128.31 1xgs s VAL 177 Ca 0.58 0.12 -0.28 0.00 0.00 0.00 0.00 61.98 62.40 1xgs s VAL 177 Cb -0.39 -3.42 -0.11 0.00 0.00 0.00 0.00 36.38 32.46 1xgs s VAL 177 CO 0.41 0.35 1.47 0.18 0.00 0.00 0.00 175.10 177.51 1xgs n LEU 178 N 4.31 4.66 -4.37 3.92 4.77 0.11 -4.82 117.00 125.58 1xgs n LEU 178 Ca -0.15 1.22 -0.26 0.00 -0.03 0.00 0.00 56.01 56.80 1xgs n LEU 178 Cb 0.52 -1.61 -0.12 0.00 -2.33 0.00 0.00 43.42 39.88 1xgs n LEU 178 CO 0.35 0.10 -0.53 -0.54 -1.33 0.00 0.00 177.39 175.44 1xgs s LYS 179 N -2.03 1.37 0.15 3.23 1.02 -1.26 -0.60 119.74 121.63 1xgs s LYS 179 Ca 0.54 -1.40 -0.34 0.00 0.02 0.00 0.00 55.97 54.79 1xgs s LYS 179 Cb -0.48 -1.66 -0.14 0.00 -0.52 0.00 0.00 37.83 35.02 1xgs s LYS 179 CO 0.63 0.37 1.60 0.39 -0.92 0.00 0.00 175.35 177.42 1xgs n GLU 180 N 0.54 2.19 0.00 1.68 1.02 -1.26 -1.55 120.64 123.25 1xgs n GLU 180 Ca -0.15 0.79 0.00 0.00 -0.02 0.00 0.00 57.16 57.78 1xgs n GLU 180 Cb 0.55 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.41 1xgs n GLU 180 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xgs n GLY 181 N 3.48 1.48 3.77 0.62 0.00 0.22 -4.99 105.19 109.76 1xgs n GLY 181 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1xgs n GLY 181 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1xgs s ASP 182 N -2.01 6.12 -0.13 1.61 1.01 -0.60 -4.77 116.67 117.92 1xgs s ASP 182 Ca 0.00 2.49 0.02 0.00 0.71 0.00 0.00 52.55 55.77 1xgs s ASP 182 Cb 0.00 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.32 1xgs s ASP 182 CO 0.00 -0.97 -0.19 -0.69 0.21 0.00 0.00 175.17 173.53 1xgs s VAL 183 N -1.40 1.82 0.06 -1.27 1.01 -1.26 -0.64 120.40 118.71 1xgs s VAL 183 Ca 0.62 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.78 1xgs s VAL 183 Cb -0.34 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 1xgs s VAL 183 CO 0.42 0.50 -0.07 -0.36 0.00 0.00 0.00 175.10 175.58 1xgs s PHE 184 N 0.88 0.72 -0.16 5.22 0.08 -0.81 -0.55 117.98 123.35 1xgs s PHE 184 Ca -0.07 -0.60 -0.03 0.00 0.12 0.00 0.00 56.93 56.34 1xgs s PHE 184 Cb -0.15 -0.43 -0.02 0.00 -0.57 0.00 0.00 43.02 41.84 1xgs s PHE 184 CO -0.01 -0.10 -0.05 0.00 -0.10 0.00 0.00 175.22 174.96 1xgs s ALA 185 N -1.94 2.94 -0.26 5.36 0.00 -0.14 -0.58 121.76 127.14 1xgs s ALA 185 Ca -0.05 -0.87 -0.09 0.00 0.00 0.00 0.00 51.96 50.95 1xgs s ALA 185 Cb -0.06 -1.54 -0.04 0.00 0.00 0.00 0.00 23.12 21.48 1xgs s ALA 185 CO -0.01 0.13 0.12 0.42 0.00 0.00 0.00 175.76 176.42 1xgs s ILE 186 N 0.51 4.72 -0.42 0.00 1.01 -0.43 -0.93 121.20 125.66 1xgs s ILE 186 Ca -0.04 -0.03 0.03 0.00 0.00 0.00 0.00 60.65 60.61 1xgs s ILE 186 Cb -0.14 -3.22 0.16 0.00 0.01 0.00 0.00 42.46 39.26 1xgs s ILE 186 CO 0.03 0.31 0.30 -1.83 0.00 0.00 0.00 174.94 173.75 1xgs s GLU 187 N 1.64 1.00 0.26 2.79 -1.05 -1.26 -2.76 118.70 119.31 1xgs s GLU 187 Ca 0.07 -1.98 -0.30 0.00 -0.15 0.00 0.00 54.97 52.61 1xgs s GLU 187 Cb -0.15 -1.70 -0.09 0.00 -0.44 0.00 0.00 34.13 31.75 1xgs s GLU 187 CO 0.06 -1.29 1.23 -1.25 0.95 0.00 0.00 175.26 174.96 1xgs s PRO 188 N 0.26 4.46 -0.05 -4.83 0.04 -1.20 -4.17 135.00 129.51 1xgs s PRO 188 Ca 0.26 2.01 0.06 0.00 0.04 0.00 0.00 61.00 63.36 1xgs s PRO 188 Cb -0.09 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.28 1xgs s PRO 188 CO -0.11 -0.08 -0.24 -0.06 0.04 0.00 0.00 177.00 176.55 1xgs s PHE 189 N -0.62 2.32 0.13 0.56 0.08 -1.26 -2.94 117.98 116.25 1xgs s PHE 189 Ca 0.51 -0.68 0.06 0.00 0.12 0.00 0.00 56.93 56.93 1xgs s PHE 189 Cb -0.36 -1.53 -0.04 0.00 -0.57 0.00 0.00 43.02 40.53 1xgs s PHE 189 CO 0.43 -0.21 -0.15 0.00 -0.10 0.00 0.00 175.22 175.20 1xgs s ALA 190 N -0.14 1.57 0.16 5.36 0.00 -0.14 -1.85 121.76 126.72 1xgs s ALA 190 Ca -0.03 -1.33 -0.15 0.00 0.00 0.00 0.00 51.96 50.45 1xgs s ALA 190 Cb -0.13 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.92 1xgs s ALA 190 CO 0.03 0.12 0.41 -0.08 0.00 0.00 0.00 175.76 176.24 1xgs s THR 191 N -2.17 0.05 -2.88 0.00 -1.32 -0.05 -1.11 115.64 108.16 1xgs s THR 191 Ca 0.10 -0.88 0.24 0.00 -1.21 0.00 0.00 61.69 59.94 1xgs s THR 191 Cb -0.05 -1.51 0.25 0.00 -1.51 0.00 0.00 72.50 69.68 1xgs s THR 191 CO 0.03 -0.25 1.30 2.30 -2.21 0.00 0.00 174.62 175.80 1xgs n ILE 192 N -0.26 0.10 -0.09 5.08 -5.35 -1.18 -1.45 119.36 116.21 1xgs n ILE 192 Ca -0.11 -0.54 0.00 0.00 -0.27 0.00 0.00 62.75 61.82 1xgs n ILE 192 Cb 0.63 1.37 0.00 0.00 -1.74 0.00 0.00 39.64 39.90 1xgs n ILE 192 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1xgs n GLY 193 N 1.38 1.28 0.13 3.28 0.00 -1.26 -4.94 105.19 105.06 1xgs n GLY 193 Ca 0.15 -1.53 0.02 0.00 0.00 0.00 0.00 46.02 44.65 1xgs n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xgs h ALA 194 N -1.62 0.65 0.00 4.61 0.00 -1.91 -3.46 119.26 117.53 1xgs h ALA 194 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1xgs h ALA 194 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1xgs h ALA 194 CO 0.00 0.71 0.00 0.41 0.00 0.00 0.00 179.25 180.37 1xgs n GLY 195 N 1.26 1.65 3.21 0.00 0.00 -1.26 -5.00 105.19 105.05 1xgs n GLY 195 Ca 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1xgs n GLY 195 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xgs s GLN 196 N -1.41 0.39 0.03 1.61 0.74 -1.26 -1.27 119.66 118.50 1xgs s GLN 196 Ca 0.00 0.40 0.02 0.00 0.05 0.00 0.00 55.36 55.83 1xgs s GLN 196 Cb 0.00 0.19 -0.04 0.00 1.10 0.00 0.00 33.01 34.26 1xgs s GLN 196 CO 0.00 -0.05 0.02 0.14 -0.55 0.00 0.00 175.29 174.84 1xgs s VAL 197 N 0.06 4.22 0.18 1.34 -7.23 -1.26 -0.39 120.40 117.31 1xgs s VAL 197 Ca -0.01 -0.71 0.10 0.00 -1.81 0.00 0.00 61.98 59.55 1xgs s VAL 197 Cb -0.02 -2.94 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 1xgs s VAL 197 CO 0.01 0.27 -0.20 0.27 -0.31 0.00 0.00 175.10 175.13 1xgs s ILE 198 N -1.20 2.02 0.05 -0.62 -4.36 0.03 -4.87 121.20 112.27 1xgs s ILE 198 Ca 0.23 -1.97 -0.27 0.00 -0.26 0.00 0.00 60.65 58.38 1xgs s ILE 198 Cb -0.12 -1.95 -0.05 0.00 1.25 0.00 0.00 42.46 41.59 1xgs s ILE 198 CO 0.14 -0.25 0.83 -1.61 0.24 0.00 0.00 174.94 174.30 1xgs s GLU 199 N -2.77 4.55 0.04 0.37 2.02 -1.26 -1.25 118.70 120.40 1xgs s GLU 199 Ca 0.18 1.18 0.01 0.00 0.02 0.00 0.00 54.97 56.36 1xgs s GLU 199 Cb -0.06 -3.38 -0.03 0.00 0.10 0.00 0.00 34.13 30.76 1xgs s GLU 199 CO 0.08 0.22 -0.05 0.14 0.02 0.00 0.00 175.26 175.67 1xgs s VAL 200 N 0.11 0.34 0.69 2.63 -7.23 0.08 -4.97 120.40 112.06 1xgs s VAL 200 Ca 0.42 -1.22 -0.13 0.00 -1.81 0.00 0.00 61.98 59.25 1xgs s VAL 200 Cb -0.21 -0.72 0.01 0.00 0.56 0.00 0.00 36.38 36.02 1xgs s VAL 200 CO 0.25 -0.58 1.08 -2.84 -0.31 0.00 0.00 175.10 172.70 1xgs s PRO 201 N -2.13 2.75 0.72 4.82 0.02 -1.26 -1.81 135.00 138.10 1xgs s PRO 201 Ca -0.07 1.17 -0.07 0.00 0.02 0.00 0.00 61.00 62.05 1xgs s PRO 201 Cb -0.06 -1.96 0.07 0.00 0.02 0.00 0.00 34.50 32.58 1xgs s PRO 201 CO -0.02 -1.27 1.03 -1.25 -0.33 0.00 0.00 177.00 175.16 1xgs s PRO 202 N -4.61 2.11 -0.37 5.54 0.04 -1.26 -4.80 135.00 131.64 1xgs s PRO 202 Ca 0.62 -0.28 -0.13 0.00 0.04 0.00 0.00 61.00 61.24 1xgs s PRO 202 Cb -0.17 -2.16 0.01 0.00 0.04 0.00 0.00 34.50 32.22 1xgs s PRO 202 CO 0.49 -1.31 0.26 0.99 0.04 0.00 0.00 177.00 177.47 1xgs s THR 203 N -3.28 5.13 -0.94 1.26 2.01 -1.26 -2.35 115.64 116.22 1xgs s THR 203 Ca 0.61 -0.51 0.08 0.00 0.31 0.00 0.00 61.69 62.18 1xgs s THR 203 Cb -0.10 -3.76 0.05 0.00 0.01 0.00 0.00 72.50 68.70 1xgs s THR 203 CO 0.45 -0.16 0.71 0.18 -0.69 0.00 0.00 174.62 175.10 1xgs n LEU 204 N 5.11 1.53 -3.97 4.42 4.77 -1.26 -4.92 117.00 122.68 1xgs n LEU 204 Ca -0.12 -0.95 -0.16 0.00 -0.03 0.00 0.00 56.01 54.75 1xgs n LEU 204 Cb 0.48 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.43 1xgs n LEU 204 CO 0.38 0.31 -0.41 -0.63 -1.33 0.00 0.00 177.39 175.71 1xgs s ILE 205 N -0.78 0.46 0.24 -0.08 1.01 -1.26 -1.14 121.20 119.65 1xgs s ILE 205 Ca 0.09 -0.26 0.01 0.00 0.00 0.00 0.00 60.65 60.48 1xgs s ILE 205 Cb 0.07 -0.39 -0.04 0.00 0.01 0.00 0.00 42.46 42.10 1xgs s ILE 205 CO 0.12 0.12 0.14 -0.31 0.00 0.00 0.00 174.94 175.01 1xgs s TYR 206 N -0.16 1.39 -0.19 3.97 2.02 -0.00 -1.20 117.35 123.17 1xgs s TYR 206 Ca 0.02 -1.36 -0.14 0.00 -0.37 0.00 0.00 57.07 55.23 1xgs s TYR 206 Cb -0.02 -0.71 0.06 0.00 -0.40 0.00 0.00 41.96 40.88 1xgs s TYR 206 CO -0.00 -0.57 0.49 1.41 -1.57 0.00 0.00 175.55 175.31 1xgs s MET 207 N -4.00 0.52 0.03 -0.62 -2.45 -0.55 -0.27 119.30 111.96 1xgs s MET 207 Ca 0.38 0.81 -0.30 0.00 -1.25 0.00 0.00 55.69 55.33 1xgs s MET 207 Cb 0.06 0.13 -0.06 0.00 1.25 0.00 0.00 34.83 36.22 1xgs s MET 207 CO 0.15 -0.12 1.40 -0.47 1.05 0.00 0.00 175.02 177.03 1xgs s TYR 208 N 0.94 2.92 -0.03 4.11 5.04 -1.26 -0.71 117.35 128.35 1xgs s TYR 208 Ca -0.05 0.84 0.03 0.00 -2.44 0.00 0.00 57.07 55.44 1xgs s TYR 208 Cb -0.06 -3.67 -0.04 0.00 0.35 0.00 0.00 41.96 38.54 1xgs s TYR 208 CO -0.08 -2.46 0.01 1.33 -1.34 0.00 0.00 175.55 173.02 1xgs n VAL 209 N 4.51 0.23 -3.62 3.14 0.24 0.86 -4.71 118.33 118.98 1xgs n VAL 209 Ca 0.13 -0.15 -0.16 0.00 -2.04 0.00 0.00 64.34 62.13 1xgs n VAL 209 Cb 0.43 -0.87 -0.07 0.00 -1.47 0.00 0.00 33.84 31.86 1xgs n VAL 209 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1xgs s ARG 210 N -2.09 0.86 -0.72 7.34 3.52 -1.08 -5.05 118.95 121.73 1xgs s ARG 210 Ca -0.02 0.35 -0.26 0.00 -0.13 0.00 0.00 55.73 55.68 1xgs s ARG 210 Cb 0.01 0.41 0.04 0.00 -1.56 0.00 0.00 34.95 33.85 1xgs s ARG 210 CO 0.14 -0.22 1.19 0.34 -0.81 0.00 0.00 175.30 175.94 1xgs s ASP 211 N -0.72 6.17 0.09 -2.12 3.68 -1.26 -4.44 116.67 118.07 1xgs s ASP 211 Ca -0.08 -0.63 0.10 0.00 2.13 0.00 0.00 52.55 54.07 1xgs s ASP 211 Cb -0.02 -2.52 -0.03 0.00 -1.45 0.00 0.00 42.92 38.89 1xgs s ASP 211 CO 0.06 -1.72 -0.25 0.68 0.13 0.00 0.00 175.17 174.07 1xgs s VAL 212 N 5.23 2.09 -0.00 1.11 -7.23 -1.26 -5.11 120.40 115.23 1xgs s VAL 212 Ca 0.31 -1.57 -0.30 0.00 -1.81 0.00 0.00 61.98 58.61 1xgs s VAL 212 Cb -0.11 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 34.95 1xgs s VAL 212 CO 0.13 0.16 1.35 -2.16 -0.31 0.00 0.00 175.10 174.27 1xgs s PRO 213 N -1.71 4.31 -0.19 4.82 0.04 -1.26 -4.99 135.00 136.01 1xgs s PRO 213 Ca 0.12 1.90 -0.07 0.00 0.04 0.00 0.00 61.00 62.99 1xgs s PRO 213 Cb -0.10 -3.54 -0.04 0.00 0.04 0.00 0.00 34.50 30.87 1xgs s PRO 213 CO 0.04 -0.53 0.04 0.08 0.04 0.00 0.00 177.00 176.68 1xgs s VAL 214 N 2.21 4.51 0.12 -0.36 1.01 -1.26 -5.00 120.40 121.63 1xgs s VAL 214 Ca 0.62 -0.13 -0.08 0.00 0.00 0.00 0.00 61.98 62.39 1xgs s VAL 214 Cb -0.30 -3.04 -0.17 0.00 0.00 0.00 0.00 36.38 32.87 1xgs s VAL 214 CO 0.26 0.44 1.30 0.03 0.00 0.00 0.00 175.10 177.13 1xgs h ARG 215 N 7.03 0.59 -6.77 2.72 2.47 -1.98 -3.45 114.38 114.99 1xgs h ARG 215 Ca -0.36 -0.56 -0.49 0.00 -1.26 0.00 0.00 59.98 57.31 1xgs h ARG 215 Cb 1.17 0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.62 1xgs h ARG 215 CO 0.66 1.18 0.39 0.08 0.56 0.00 0.00 179.97 182.83 1xgs s VAL 216 N -3.49 3.91 0.05 2.04 1.01 -1.26 -5.01 120.40 117.65 1xgs s VAL 216 Ca -0.08 1.92 -0.18 0.00 0.00 0.00 0.00 61.98 63.64 1xgs s VAL 216 Cb 0.09 -4.22 -0.15 0.00 0.00 0.00 0.00 36.38 32.09 1xgs s VAL 216 CO 0.89 0.46 1.30 0.00 0.00 0.00 0.00 175.10 177.75 1xgs h ALA 217 N 4.06 0.25 -0.12 5.51 0.00 -1.98 -0.83 119.26 126.14 1xgs h ALA 217 Ca -0.45 -0.42 -0.12 0.00 0.00 0.00 0.00 54.91 53.92 1xgs h ALA 217 Cb 1.20 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1xgs h ALA 217 CO 0.68 0.28 -0.44 0.37 0.00 0.00 0.00 179.25 180.14 1xgs h GLN 218 N 0.11 0.29 -0.34 0.00 5.75 -1.98 -0.59 115.11 118.34 1xgs h GLN 218 Ca 0.00 -0.15 -0.07 0.00 -0.15 0.00 0.00 58.65 58.29 1xgs h GLN 218 Cb 0.91 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.45 1xgs h GLN 218 CO 0.07 0.68 -0.05 0.00 -2.65 0.00 0.00 178.83 176.88 1xgs h ALA 219 N 1.31 0.47 -0.75 3.38 0.00 -1.87 0.53 119.26 122.34 1xgs h ALA 219 Ca 0.02 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1xgs h ALA 219 Cb 0.87 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 1xgs h ALA 219 CO 0.07 0.28 0.30 -0.09 0.00 0.00 0.00 179.25 179.81 1xgs h ARG 220 N 0.44 1.11 -0.11 0.00 2.43 -0.91 0.13 114.38 117.47 1xgs h ARG 220 Ca 0.09 -0.19 -0.16 0.00 -0.81 0.00 0.00 59.98 58.91 1xgs h ARG 220 Cb 0.53 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1xgs h ARG 220 CO 0.03 0.90 -0.63 0.74 -1.51 0.00 0.00 179.97 179.49 1xgs h PHE 221 N 1.08 0.52 -0.29 2.20 0.05 -1.00 -1.84 116.94 117.67 1xgs h PHE 221 Ca 0.25 -0.21 -0.02 0.00 3.82 0.00 0.00 57.97 61.81 1xgs h PHE 221 Cb 0.20 -0.09 -0.01 0.00 2.00 0.00 0.00 35.95 38.05 1xgs h PHE 221 CO 0.02 0.92 0.09 1.25 -0.18 0.00 0.00 178.31 180.42 1xgs h LEU 222 N 0.30 0.42 -1.22 1.54 5.85 -0.32 -1.70 115.31 120.18 1xgs h LEU 222 Ca -0.01 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.47 1xgs h LEU 222 Cb 1.17 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 1xgs h LEU 222 CO 0.11 0.51 0.07 0.25 -0.34 0.00 0.00 178.44 179.04 1xgs h LEU 223 N 0.31 0.57 -1.00 2.25 5.85 -0.70 -0.64 115.31 121.94 1xgs h LEU 223 Ca 0.09 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1xgs h LEU 223 Cb 0.24 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 1xgs h LEU 223 CO -0.00 0.59 0.17 0.00 -0.34 0.00 0.00 178.44 178.85 1xgs h ALA 224 N 1.49 1.19 -0.12 1.25 0.00 -0.98 -0.68 119.26 121.41 1xgs h ALA 224 Ca 0.13 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1xgs h ALA 224 Cb 0.27 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1xgs h ALA 224 CO 0.00 0.56 -0.15 -0.22 0.00 0.00 0.00 179.25 179.44 1xgs h LYS 225 N 0.87 0.32 0.08 0.00 3.64 -0.30 -2.16 116.57 119.01 1xgs h LYS 225 Ca 0.19 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1xgs h LYS 225 Cb 0.27 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 1xgs h LYS 225 CO -0.01 0.74 -0.22 0.82 -2.27 0.00 0.00 179.45 178.52 1xgs h ILE 226 N -0.08 0.50 -0.60 2.00 2.04 -0.99 0.27 117.51 120.65 1xgs h ILE 226 Ca 0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.92 1xgs h ILE 226 Cb 0.70 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1xgs h ILE 226 CO 0.04 0.00 0.40 0.11 0.00 0.00 0.00 178.15 178.69 1xgs h LYS 227 N -0.39 0.64 0.01 2.37 1.57 -1.16 0.19 116.57 119.79 1xgs h LYS 227 Ca 0.04 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.58 1xgs h LYS 227 Cb 0.43 -0.14 0.02 0.00 0.08 0.00 0.00 32.23 32.62 1xgs h LYS 227 CO -0.15 0.42 -0.78 -0.09 -0.57 0.00 0.00 179.45 178.28 1xgs h ARG 228 N 0.66 0.51 0.00 3.15 2.43 -0.86 -3.15 114.38 117.13 1xgs h ARG 228 Ca 0.25 -0.56 -0.35 0.00 -0.81 0.00 0.00 59.98 58.51 1xgs h ARG 228 Cb 0.16 0.16 -0.06 0.00 -0.42 0.00 0.00 29.97 29.81 1xgs h ARG 228 CO -0.07 1.19 -2.30 0.39 -1.51 0.00 0.00 179.97 177.68 1xgs n GLU 229 N -4.08 0.68 -0.00 0.20 1.02 0.92 -4.68 120.64 114.70 1xgs n GLU 229 Ca -0.11 0.02 0.03 0.00 -0.02 0.00 0.00 57.16 57.08 1xgs n GLU 229 Cb 0.76 -1.55 -0.05 0.00 -0.02 0.00 0.00 31.44 30.58 1xgs n GLU 229 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1xgs n TYR 230 N -2.76 0.00 -1.34 -0.32 4.01 0.60 -5.07 117.16 112.28 1xgs n TYR 230 Ca -0.30 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.44 1xgs n TYR 230 Cb 1.12 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 40.01 1xgs n TYR 230 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xgs n GLY 231 N 2.15 3.31 1.08 2.72 0.00 -0.76 -2.10 105.19 111.59 1xgs n GLY 231 Ca -0.01 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.91 1xgs n GLY 231 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xgs n THR 232 N 0.00 1.02 -3.82 2.61 -2.24 -1.26 -4.41 114.28 106.18 1xgs n THR 232 Ca 0.00 -0.76 -0.32 0.00 -2.27 0.00 0.00 64.05 60.70 1xgs n THR 232 Cb 0.00 0.14 -0.05 0.00 -2.10 0.00 0.00 70.33 68.33 1xgs n THR 232 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1xgs s LEU 233 N -1.25 4.34 0.63 3.22 1.43 -0.89 -4.78 118.68 121.38 1xgs s LEU 233 Ca 0.35 0.42 -0.18 0.00 -1.03 0.00 0.00 54.13 53.69 1xgs s LEU 233 Cb 0.21 -2.96 -0.03 0.00 0.03 0.00 0.00 46.19 43.44 1xgs s LEU 233 CO 0.20 0.16 1.14 -2.65 0.23 0.00 0.00 176.35 175.43 1xgs n PRO 234 N 0.47 1.02 -4.20 1.29 -0.02 -1.25 -4.62 135.00 127.69 1xgs n PRO 234 Ca -0.06 0.40 -0.14 0.00 -2.02 0.00 0.00 63.50 61.68 1xgs n PRO 234 Cb 0.52 -2.36 -0.10 0.00 -0.02 0.00 0.00 33.50 31.53 1xgs n PRO 234 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1xgs s PHE 235 N -1.44 1.10 0.13 6.00 -0.12 0.63 -4.26 117.98 120.01 1xgs s PHE 235 Ca 0.79 -0.72 -0.07 0.00 -0.05 0.00 0.00 56.93 56.88 1xgs s PHE 235 Cb -0.40 -0.59 -0.06 0.00 -0.63 0.00 0.00 43.02 41.34 1xgs s PHE 235 CO 0.43 0.00 0.41 0.00 -0.05 0.00 0.00 175.22 176.01 1xgs s ALA 236 N -2.86 3.74 0.22 1.99 0.00 -1.26 -0.82 121.76 122.77 1xgs s ALA 236 Ca 0.10 -0.46 -0.08 0.00 0.00 0.00 0.00 51.96 51.51 1xgs s ALA 236 Cb -0.00 -2.22 0.18 0.00 0.00 0.00 0.00 23.12 21.08 1xgs s ALA 236 CO -0.01 0.61 1.86 -0.92 0.00 0.00 0.00 175.76 177.30 1xgs h TYR 237 N 3.11 1.12 -0.98 0.00 3.20 -1.48 -2.55 116.97 119.39 1xgs h TYR 237 Ca -0.47 -0.01 0.24 0.00 3.14 0.00 0.00 58.73 61.62 1xgs h TYR 237 Cb 1.18 -0.36 -0.12 0.00 1.54 0.00 0.00 36.73 38.96 1xgs h TYR 237 CO 0.63 0.76 0.54 -0.09 -1.64 0.00 0.00 178.16 178.37 1xgs h ARG 238 N 1.15 0.52 0.00 1.82 2.43 -1.80 -0.21 114.38 118.29 1xgs h ARG 238 Ca 0.30 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.44 1xgs h ARG 238 Cb -0.02 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1xgs h ARG 238 CO -0.05 0.35 0.00 0.91 -1.51 0.00 0.00 179.97 179.66 1xgs n TRP 239 N -4.92 0.78 0.40 2.20 8.01 -0.96 -2.49 117.44 120.46 1xgs n TRP 239 Ca 0.26 0.37 0.05 0.00 -1.31 0.00 0.00 57.50 56.86 1xgs n TRP 239 Cb 0.72 -1.09 0.03 0.00 -2.01 0.00 0.00 31.31 28.96 1xgs n TRP 239 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1xgs n LEU 240 N -2.27 1.59 0.00 -0.99 4.77 -0.10 -4.69 117.00 115.31 1xgs n LEU 240 Ca -0.00 -0.93 0.04 0.00 -0.03 0.00 0.00 56.01 55.09 1xgs n LEU 240 Cb 0.11 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.41 1xgs n LEU 240 CO 0.14 0.31 0.42 0.00 -1.33 0.00 0.00 177.39 176.92 1xgs n GLN 241 N 0.28 0.31 -0.01 3.23 6.02 -1.04 -2.16 117.38 124.02 1xgs n GLN 241 Ca 0.05 0.00 0.01 0.00 -0.01 0.00 0.00 57.00 57.05 1xgs n GLN 241 Cb 0.22 -1.36 -0.04 0.00 1.02 0.00 0.00 30.24 30.08 1xgs n GLN 241 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1xgs n ASN 242 N -0.86 3.76 0.22 1.08 3.02 -1.26 -4.60 115.26 116.62 1xgs n ASN 242 Ca 0.05 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.66 1xgs n ASN 242 Cb 0.02 1.08 0.50 0.00 -0.61 0.00 0.00 39.78 40.78 1xgs n ASN 242 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 1xgs h ASP 243 N 0.00 0.00 -4.93 6.41 3.45 -1.76 -3.45 116.42 116.13 1xgs h ASP 243 Ca -0.04 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.41 1xgs h ASP 243 Cb 0.53 0.00 -0.14 0.00 -0.56 0.00 0.00 39.33 39.16 1xgs h ASP 243 CO 0.00 0.20 0.25 0.00 -1.57 0.00 0.00 179.24 178.12 1xgs s MET 244 N -4.55 1.16 0.66 3.56 0.23 -1.25 -5.11 119.30 113.99 1xgs s MET 244 Ca -0.04 -0.27 -0.17 0.00 -1.03 0.00 0.00 55.69 54.17 1xgs s MET 244 Cb 0.15 0.54 -0.00 0.00 -1.53 0.00 0.00 34.83 33.99 1xgs s MET 244 CO 0.69 -0.48 1.27 -1.25 -2.03 0.00 0.00 175.02 173.23 1xgs s PRO 245 N -3.05 2.48 0.16 3.16 0.04 -1.26 -4.61 135.00 131.92 1xgs s PRO 245 Ca -0.01 2.00 -0.20 0.00 0.04 0.00 0.00 61.00 62.83 1xgs s PRO 245 Cb -0.01 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.76 1xgs s PRO 245 CO -0.07 -1.64 1.25 -1.91 0.04 0.00 0.00 177.00 174.68 1xgs n GLU 246 N -2.05 -0.27 -0.31 4.56 2.13 -1.26 -0.90 120.64 122.53 1xgs n GLU 246 Ca 0.15 1.24 0.01 0.00 0.66 0.00 0.00 57.16 59.22 1xgs n GLU 246 Cb 0.49 -1.83 0.15 0.00 0.27 0.00 0.00 31.44 30.52 1xgs n GLU 246 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1xgs h GLY 247 N 0.00 1.29 1.21 8.31 0.00 -1.99 0.21 103.07 112.09 1xgs h GLY 247 Ca 0.20 -0.37 -0.15 0.00 0.00 0.00 0.00 47.33 47.01 1xgs h GLY 247 CO -0.78 0.23 -0.38 -1.61 0.00 0.00 0.00 176.54 173.99 1xgs h GLN 248 N 0.92 0.87 -0.23 4.80 -0.00 -1.36 -2.72 115.11 117.39 1xgs h GLN 248 Ca 0.38 -0.45 -0.02 0.00 -0.00 0.00 0.00 58.65 58.56 1xgs h GLN 248 Cb 0.23 0.01 -0.01 0.00 0.00 0.00 0.00 27.48 27.71 1xgs h GLN 248 CO -0.19 1.10 0.07 1.25 0.00 0.00 0.00 178.83 181.05 1xgs h LEU 249 N 0.71 0.33 -0.03 -2.39 5.85 -0.27 -1.38 115.31 118.13 1xgs h LEU 249 Ca 0.06 -0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.58 1xgs h LEU 249 Cb 0.96 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1xgs h LEU 249 CO 0.09 0.45 -0.01 0.11 -0.34 0.00 0.00 178.44 178.75 1xgs h LYS 250 N 0.19 0.00 -0.70 1.25 1.57 -0.62 -1.00 116.57 117.26 1xgs h LYS 250 Ca 0.07 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1xgs h LYS 250 Cb 0.24 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1xgs h LYS 250 CO -0.00 0.00 0.22 -0.07 -0.57 0.00 0.00 179.45 179.03 1xgs h LEU 251 N 0.00 1.01 -0.71 2.94 3.38 -1.44 -0.66 115.31 119.83 1xgs h LEU 251 Ca 0.01 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 1xgs h LEU 251 Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1xgs h LEU 251 CO -0.03 0.94 -0.12 0.00 0.09 0.00 0.00 178.44 179.32 1xgs h ALA 252 N 1.19 0.90 -0.51 1.53 0.00 -1.09 -1.53 119.26 119.76 1xgs h ALA 252 Ca 0.23 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1xgs h ALA 252 Cb 0.29 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1xgs h ALA 252 CO -0.01 0.63 -0.10 -0.07 0.00 0.00 0.00 179.25 179.70 1xgs h LEU 253 N 0.78 0.98 -0.71 0.00 3.38 -0.82 -2.08 115.31 116.83 1xgs h LEU 253 Ca 0.13 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 1xgs h LEU 253 Cb 0.63 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1xgs h LEU 253 CO 0.04 1.10 0.14 0.11 0.09 0.00 0.00 178.44 179.92 1xgs h LYS 254 N 0.84 1.13 -0.66 1.13 6.56 -0.91 -1.03 116.57 123.63 1xgs h LYS 254 Ca 0.13 -0.29 -0.02 0.00 -1.06 0.00 0.00 60.65 59.42 1xgs h LYS 254 Cb 0.66 -0.14 -0.03 0.00 -0.57 0.00 0.00 32.23 32.15 1xgs h LYS 254 CO 0.05 1.01 0.34 1.15 -2.06 0.00 0.00 179.45 179.93 1xgs h THR 255 N 1.06 1.22 -0.41 -0.16 2.02 -1.16 0.37 112.91 115.85 1xgs h THR 255 Ca 0.21 -0.58 -0.11 0.00 0.77 0.00 0.00 66.41 66.71 1xgs h THR 255 Cb 0.41 0.39 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1xgs h THR 255 CO 0.01 0.24 -0.19 -0.07 0.37 0.00 0.00 175.52 175.88 1xgs h LEU 256 N 0.90 0.81 0.25 2.58 3.38 -1.12 -0.52 115.31 121.59 1xgs h LEU 256 Ca 0.23 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1xgs h LEU 256 Cb 0.08 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1xgs h LEU 256 CO -0.03 0.99 -0.12 -0.33 0.09 0.00 0.00 178.44 179.03 1xgs h GLU 257 N 0.71 -0.33 -0.57 1.13 5.08 -0.75 -0.29 114.58 119.56 1xgs h GLU 257 Ca 0.10 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1xgs h GLU 257 Cb 0.70 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 1xgs h GLU 257 CO 0.05 -0.09 0.38 0.87 -1.00 0.00 0.00 179.01 179.22 1xgs h LYS 258 N -0.51 0.75 0.00 2.33 1.57 -0.87 -0.26 116.57 119.58 1xgs h LYS 258 Ca -0.03 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1xgs h LYS 258 Cb 0.38 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1xgs h LYS 258 CO 0.06 0.50 0.00 0.00 -0.57 0.00 0.00 179.45 179.43 1xgs h ALA 259 N 1.64 1.00 0.00 3.86 0.00 -0.88 -3.46 119.26 121.42 1xgs h ALA 259 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1xgs h ALA 259 Cb -0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1xgs h ALA 259 CO -0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.61 1xgs n GLY 260 N -0.13 0.58 0.13 0.00 0.00 -0.11 -4.93 105.19 100.73 1xgs n GLY 260 Ca 0.00 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 1xgs n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xgs h ALA 261 N 0.00 -0.09 -2.15 4.61 0.00 -1.27 -3.37 119.26 116.99 1xgs h ALA 261 Ca 0.00 -0.74 -0.52 0.00 0.00 0.00 0.00 54.91 53.64 1xgs h ALA 261 Cb 0.00 0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.77 1xgs h ALA 261 CO 0.00 0.51 -0.72 0.96 0.00 0.00 0.00 179.25 180.00 1xgs s ILE 262 N -2.62 1.98 -0.03 0.00 -4.36 -1.20 -0.10 121.20 114.87 1xgs s ILE 262 Ca -0.12 -2.24 0.05 0.00 -0.26 0.00 0.00 60.65 58.08 1xgs s ILE 262 Cb 0.03 -2.29 -0.01 0.00 1.25 0.00 0.00 42.46 41.44 1xgs s ILE 262 CO 0.88 -0.42 -0.19 -0.47 0.24 0.00 0.00 174.94 174.98 1xgs s TYR 263 N -2.81 1.82 0.02 1.37 5.04 0.11 -4.41 117.35 118.49 1xgs s TYR 263 Ca 0.27 -0.44 -0.09 0.00 -2.44 0.00 0.00 57.07 54.37 1xgs s TYR 263 Cb -0.00 -1.19 -0.05 0.00 0.35 0.00 0.00 41.96 41.06 1xgs s TYR 263 CO 0.11 -0.10 0.34 0.20 -1.34 0.00 0.00 175.55 174.76 1xgs s GLY 264 N -0.23 2.32 -0.48 8.97 0.00 -1.26 -1.48 107.32 115.16 1xgs s GLY 264 Ca 0.02 -0.43 0.02 0.00 0.00 0.00 0.00 44.72 44.33 1xgs s GLY 264 CO 0.01 -0.19 0.23 -0.19 0.00 0.00 0.00 173.10 172.96 1xgs s TYR 265 N -1.27 3.41 1.02 1.90 2.02 -0.34 -5.00 117.35 119.08 1xgs s TYR 265 Ca 0.28 -2.98 -0.12 0.00 -0.37 0.00 0.00 57.07 53.88 1xgs s TYR 265 Cb -0.14 -2.95 0.20 0.00 -0.40 0.00 0.00 41.96 38.67 1xgs s TYR 265 CO 0.15 -0.83 1.08 -2.14 -1.57 0.00 0.00 175.55 172.24 1xgs s PRO 266 N 0.19 0.26 0.47 -1.71 0.02 -1.26 -4.15 135.00 128.82 1xgs s PRO 266 Ca 0.15 1.02 -0.24 0.00 0.02 0.00 0.00 61.00 61.94 1xgs s PRO 266 Cb -0.23 -1.68 -0.07 0.00 0.02 0.00 0.00 34.50 32.54 1xgs s PRO 266 CO -0.03 -2.98 1.31 0.08 -0.33 0.00 0.00 177.00 175.05 1xgs s VAL 267 N -2.66 2.45 -0.19 3.83 1.01 -0.75 -4.75 120.40 119.34 1xgs s VAL 267 Ca 0.66 0.37 -0.05 0.00 0.00 0.00 0.00 61.98 62.97 1xgs s VAL 267 Cb -0.22 -3.20 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 1xgs s VAL 267 CO 0.60 0.03 -0.00 -0.76 0.00 0.00 0.00 175.10 174.97 1xgs s LEU 268 N -2.94 3.30 0.02 3.92 1.43 -0.33 -0.74 118.68 123.34 1xgs s LEU 268 Ca 0.63 -0.16 0.06 0.00 -1.03 0.00 0.00 54.13 53.63 1xgs s LEU 268 Cb -0.38 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 1xgs s LEU 268 CO 0.47 0.10 -0.18 -0.75 0.23 0.00 0.00 176.35 176.22 1xgs s LYS 269 N 0.79 1.25 0.09 1.70 2.20 -0.38 -0.06 119.74 125.33 1xgs s LYS 269 Ca 0.00 -0.77 -0.31 0.00 -0.36 0.00 0.00 55.97 54.53 1xgs s LYS 269 Cb -0.14 -1.28 -0.08 0.00 -1.51 0.00 0.00 37.83 34.81 1xgs s LYS 269 CO 0.02 0.33 1.54 -2.00 -0.36 0.00 0.00 175.35 174.88 1xgs s GLU 270 N -0.89 4.24 0.36 4.03 -6.30 0.22 -0.79 118.70 119.57 1xgs s GLU 270 Ca 0.05 2.22 0.14 0.00 -2.50 0.00 0.00 54.97 54.89 1xgs s GLU 270 Cb -0.08 -3.43 1.00 0.00 0.00 0.00 0.00 34.13 31.62 1xgs s GLU 270 CO 0.01 -0.62 1.74 0.97 0.02 0.00 0.00 175.26 177.38 1xgs h ILE 271 N 4.55 0.51 -0.63 -3.70 2.10 -1.06 0.37 117.51 119.65 1xgs h ILE 271 Ca -0.42 -0.17 -0.28 0.00 1.08 0.00 0.00 64.86 65.08 1xgs h ILE 271 Cb 1.20 -0.01 -0.17 0.00 -1.09 0.00 0.00 36.82 36.75 1xgs h ILE 271 CO 0.91 0.09 0.24 0.54 -1.08 0.00 0.00 178.15 178.84 1xgs n ARG 272 N -4.78 2.44 -3.29 2.19 5.12 -1.26 -4.93 116.66 112.16 1xgs n ARG 272 Ca 0.27 -3.08 -0.23 0.00 -1.93 0.00 0.00 57.85 52.88 1xgs n ARG 272 Cb 0.83 -2.01 0.00 0.00 -1.16 0.00 0.00 32.46 30.11 1xgs n ARG 272 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1xgs n ASN 273 N -0.89 -3.98 -4.81 0.55 3.02 0.13 -4.86 115.26 104.41 1xgs n ASN 273 Ca 0.42 -0.35 -0.36 0.00 -0.03 0.00 0.00 54.58 54.26 1xgs n ASN 273 Cb 1.30 -3.29 -0.06 0.00 -0.61 0.00 0.00 39.78 37.12 1xgs n ASN 273 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1xgs s GLY 274 N -2.69 2.64 0.39 7.41 0.00 -1.26 -4.73 107.32 109.07 1xgs s GLY 274 Ca 0.37 0.23 -0.27 0.00 0.00 0.00 0.00 44.72 45.06 1xgs s GLY 274 CO 0.46 0.60 1.29 1.39 0.00 0.00 0.00 173.10 176.83 1xgs n ILE 275 N 0.64 2.31 -5.15 0.90 2.08 -1.26 -4.19 119.36 114.68 1xgs n ILE 275 Ca -0.01 -0.50 -0.30 0.00 0.56 0.00 0.00 62.75 62.50 1xgs n ILE 275 Cb 0.51 -1.59 -0.16 0.00 -0.75 0.00 0.00 39.64 37.64 1xgs n ILE 275 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1xgs s VAL 276 N -1.15 1.89 0.04 1.39 1.01 -0.35 -3.10 120.40 120.13 1xgs s VAL 276 Ca 0.58 -0.97 0.09 0.00 0.00 0.00 0.00 61.98 61.68 1xgs s VAL 276 Cb -0.53 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 1xgs s VAL 276 CO 0.60 0.53 -0.24 0.00 0.00 0.00 0.00 175.10 175.99 1xgs s ALA 277 N -0.08 2.35 -0.07 5.51 0.00 -0.27 -4.72 121.76 124.47 1xgs s ALA 277 Ca -0.04 -1.24 -0.07 0.00 0.00 0.00 0.00 51.96 50.61 1xgs s ALA 277 Cb -0.13 -0.56 0.02 0.00 0.00 0.00 0.00 23.12 22.45 1xgs s ALA 277 CO 0.04 0.54 0.20 -1.14 0.00 0.00 0.00 175.76 175.40 1xgs s GLN 278 N -1.26 0.23 0.03 0.00 0.74 -1.26 -0.96 119.66 117.17 1xgs s GLN 278 Ca 0.12 0.28 0.02 0.00 0.05 0.00 0.00 55.36 55.83 1xgs s GLN 278 Cb -0.10 0.10 -0.02 0.00 1.10 0.00 0.00 33.01 34.09 1xgs s GLN 278 CO 0.03 -0.03 -0.07 -0.06 -0.55 0.00 0.00 175.29 174.61 1xgs s PHE 279 N 0.14 0.58 -0.12 1.67 0.08 -1.15 -2.83 117.98 116.35 1xgs s PHE 279 Ca -0.00 -0.41 -0.24 0.00 0.12 0.00 0.00 56.93 56.39 1xgs s PHE 279 Cb -0.02 -0.36 0.06 0.00 -0.57 0.00 0.00 43.02 42.14 1xgs s PHE 279 CO 0.00 -0.07 0.60 -2.00 -0.10 0.00 0.00 175.22 173.64 1xgs s GLU 280 N -1.24 0.85 0.05 0.44 2.12 -0.45 -3.26 118.70 117.21 1xgs s GLU 280 Ca -0.08 0.46 -0.04 0.00 0.36 0.00 0.00 54.97 55.67 1xgs s GLU 280 Cb -0.08 0.41 -0.02 0.00 0.26 0.00 0.00 34.13 34.69 1xgs s GLU 280 CO 0.00 -0.20 0.06 -1.01 -0.54 0.00 0.00 175.26 173.57 1xgs s HIS 281 N -0.54 0.30 -0.10 5.30 3.76 -1.11 -1.94 115.29 120.95 1xgs s HIS 281 Ca -0.07 -0.70 -0.03 0.00 -0.15 0.00 0.00 55.06 54.11 1xgs s HIS 281 Cb -0.03 -0.21 -0.03 0.00 1.11 0.00 0.00 32.58 33.41 1xgs s HIS 281 CO 0.05 -0.38 0.03 0.99 -0.85 0.00 0.00 174.74 174.58 1xgs s THR 282 N -3.13 4.53 0.07 1.30 2.01 -1.18 -1.31 115.64 117.92 1xgs s THR 282 Ca -0.00 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 61.89 1xgs s THR 282 Cb 0.02 -2.93 -0.03 0.00 0.01 0.00 0.00 72.50 69.57 1xgs s THR 282 CO -0.07 0.59 -0.15 0.27 -0.69 0.00 0.00 174.62 174.58 1xgs s ILE 283 N -0.75 1.15 -0.19 1.82 -4.36 0.26 -1.61 121.20 117.51 1xgs s ILE 283 Ca 0.12 -1.32 -0.03 0.00 -0.26 0.00 0.00 60.65 59.16 1xgs s ILE 283 Cb -0.12 -1.10 -0.01 0.00 1.25 0.00 0.00 42.46 42.48 1xgs s ILE 283 CO 0.02 -0.22 -0.05 -0.63 0.24 0.00 0.00 174.94 174.30 1xgs s ILE 284 N -1.27 3.46 0.04 8.37 1.01 -0.11 -1.93 121.20 130.77 1xgs s ILE 284 Ca -0.01 -0.48 -0.30 0.00 0.00 0.00 0.00 60.65 59.85 1xgs s ILE 284 Cb -0.10 -2.54 -0.05 0.00 0.01 0.00 0.00 42.46 39.78 1xgs s ILE 284 CO 0.02 0.45 1.10 -0.69 0.00 0.00 0.00 174.94 175.83 1xgs s VAL 285 N 1.02 4.38 0.47 2.92 1.01 0.18 -1.01 120.40 129.38 1xgs s VAL 285 Ca 0.00 1.73 0.05 0.00 0.00 0.00 0.00 61.98 63.76 1xgs s VAL 285 Cb -0.15 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 1xgs s VAL 285 CO 0.00 0.15 0.13 -1.61 0.00 0.00 0.00 175.10 173.76 1xgs s GLU 286 N 0.94 2.17 0.16 2.72 2.02 0.02 -0.61 118.70 126.12 1xgs s GLU 286 Ca 0.55 -2.12 -0.18 0.00 0.02 0.00 0.00 54.97 53.24 1xgs s GLU 286 Cb -0.26 -1.78 0.07 0.00 0.10 0.00 0.00 34.13 32.26 1xgs s GLU 286 CO 0.29 -0.28 1.67 -0.22 0.02 0.00 0.00 175.26 176.74 1xgs h LYS 287 N 1.34 -0.00 0.00 1.61 1.63 -1.96 0.38 116.57 119.58 1xgs h LYS 287 Ca -0.42 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.38 1xgs h LYS 287 Cb 1.28 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.91 1xgs h LYS 287 CO 0.71 -0.00 0.00 -0.40 -3.45 0.00 0.00 179.45 176.31 1xgs n ASP 288 N -5.29 1.76 0.00 4.20 3.85 -1.26 -3.51 116.55 116.31 1xgs n ASP 288 Ca 0.01 -1.84 0.00 0.00 -0.71 0.00 0.00 54.79 52.25 1xgs n ASP 288 Cb 0.20 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 39.97 1xgs n ASP 288 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.20 175.95 1xgs n SER 289 N -0.42 0.00 -3.83 -1.12 2.88 -1.23 -4.91 113.62 104.99 1xgs n SER 289 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 1xgs n SER 289 Cb 0.25 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.62 1xgs n SER 289 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1xgs s VAL 290 N -2.58 0.09 -0.21 2.46 -7.23 -1.26 -0.80 120.40 110.87 1xgs s VAL 290 Ca 0.00 -0.77 -0.09 0.00 -1.81 0.00 0.00 61.98 59.32 1xgs s VAL 290 Cb 0.00 -0.76 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 1xgs s VAL 290 CO 0.00 -0.42 0.10 -0.63 -0.31 0.00 0.00 175.10 173.84 1xgs s ILE 291 N -2.11 5.03 -0.53 -0.62 1.01 -0.18 -4.92 121.20 118.88 1xgs s ILE 291 Ca -0.09 0.06 -0.18 0.00 0.00 0.00 0.00 60.65 60.44 1xgs s ILE 291 Cb -0.03 -3.30 0.08 0.00 0.01 0.00 0.00 42.46 39.22 1xgs s ILE 291 CO -0.01 0.41 0.58 -0.69 0.00 0.00 0.00 174.94 175.23 1xgs s VAL 292 N 0.68 4.98 0.28 2.92 1.01 -1.26 -0.93 120.40 128.08 1xgs s VAL 292 Ca 0.05 -0.90 0.25 0.00 0.00 0.00 0.00 61.98 61.39 1xgs s VAL 292 Cb -0.13 -4.32 0.26 0.00 0.00 0.00 0.00 36.38 32.19 1xgs s VAL 292 CO 0.01 -0.86 1.95 0.71 0.00 0.00 0.00 175.10 176.91 1xgs h THR 293 N 5.86 0.58 -0.62 3.92 1.35 -1.67 -3.24 112.91 119.08 1xgs h THR 293 Ca -0.29 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 1xgs h THR 293 Cb 1.10 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 1xgs h THR 293 CO 1.00 0.18 0.00 0.35 -0.25 0.00 0.00 175.52 176.79 1xgs n THR 294 N -3.52 2.30 0.90 6.82 -2.24 -1.25 -3.70 114.28 113.58 1xgs n THR 294 Ca -0.01 -1.30 0.11 0.00 -2.27 0.00 0.00 64.05 60.58 1xgs n THR 294 Cb 0.34 -0.07 0.09 0.00 -2.10 0.00 0.00 70.33 68.59 1xgs n THR 294 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66