#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lsj s ILE 13 N 0.00 5.35 -0.20 3.15 1.09 -1.26 -5.08 121.20 124.25 1lsj s ILE 13 Ca 0.00 -0.01 -0.19 0.00 -1.10 0.00 0.00 60.65 59.35 1lsj s ILE 13 Cb 0.00 -3.56 -0.03 0.00 -1.06 0.00 0.00 42.46 37.81 1lsj s ILE 13 CO 0.00 0.31 0.55 -0.63 -0.10 0.00 0.00 174.94 175.07 1lsj s ILE 14 N -1.35 5.08 -0.23 2.92 -1.09 -1.26 -4.88 121.20 120.40 1lsj s ILE 14 Ca 0.29 1.01 -0.29 0.00 -2.23 0.00 0.00 60.65 59.43 1lsj s ILE 14 Cb -0.13 -3.87 -0.04 0.00 -1.58 0.00 0.00 42.46 36.85 1lsj s ILE 14 CO 0.18 0.15 1.93 -0.69 -1.23 0.00 0.00 174.94 175.29 1lsj s VAL 15 N 1.75 3.30 -0.12 2.92 1.01 -1.26 -4.81 120.40 123.19 1lsj s VAL 15 Ca 0.25 0.32 -0.00 0.00 0.00 0.00 0.00 61.98 62.55 1lsj s VAL 15 Cb -0.16 -3.36 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 1lsj s VAL 15 CO 0.10 -0.19 -0.11 0.29 0.00 0.00 0.00 175.10 175.18 1lsj n LYS 16 N 8.29 0.29 -3.81 2.72 4.76 -1.26 -4.96 118.16 124.19 1lsj n LYS 16 Ca 0.24 0.08 -0.36 0.00 -2.87 0.00 0.00 58.31 55.40 1lsj n LYS 16 Cb 0.45 -1.19 -0.13 0.00 -1.84 0.00 0.00 35.03 32.32 1lsj n LYS 16 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1lsj s HIS 17 N -2.23 3.06 -0.10 2.13 2.46 -1.26 -1.42 115.29 117.92 1lsj s HIS 17 Ca -0.16 -0.75 -0.01 0.00 0.47 0.00 0.00 55.06 54.61 1lsj s HIS 17 Cb 0.05 -2.19 -0.03 0.00 -0.13 0.00 0.00 32.58 30.27 1lsj s HIS 17 CO 0.26 -0.48 -0.06 0.08 -2.47 0.00 0.00 174.74 172.07 1lsj s VAL 18 N 1.54 3.77 -0.32 0.89 1.01 0.41 -0.32 120.40 127.37 1lsj s VAL 18 Ca 0.05 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1lsj s VAL 18 Cb -0.15 -2.58 0.08 0.00 0.00 0.00 0.00 36.38 33.72 1lsj s VAL 18 CO 0.01 0.56 0.03 -0.89 0.00 0.00 0.00 175.10 174.81 1lsj s THR 19 N -0.38 2.71 -0.25 3.92 2.01 0.11 -1.62 115.64 122.13 1lsj s THR 19 Ca 0.06 -1.79 -0.15 0.00 0.31 0.00 0.00 61.69 60.11 1lsj s THR 19 Cb -0.12 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.63 1lsj s THR 19 CO 0.02 -0.32 0.39 -0.69 -0.69 0.00 0.00 174.62 173.34 1lsj s VAL 20 N 1.12 5.17 -0.44 3.82 1.01 -0.58 -1.47 120.40 129.04 1lsj s VAL 20 Ca 0.00 0.63 -0.12 0.00 0.00 0.00 0.00 61.98 62.49 1lsj s VAL 20 Cb -0.20 -3.72 0.07 0.00 0.00 0.00 0.00 36.38 32.53 1lsj s VAL 20 CO -0.04 0.18 0.31 -0.63 0.00 0.00 0.00 175.10 174.92 1lsj s ILE 21 N 1.86 4.72 0.00 2.22 1.01 0.29 -0.83 121.20 130.47 1lsj s ILE 21 Ca 0.17 -1.19 0.00 0.00 0.00 0.00 0.00 60.65 59.63 1lsj s ILE 21 Cb -0.15 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.49 1lsj s ILE 21 CO 0.09 -0.51 0.00 0.61 0.00 0.00 0.00 174.94 175.13 1lsj n GLY 22 N 5.05 3.64 1.47 6.18 0.00 -0.25 0.13 105.19 121.41 1lsj n GLY 22 Ca -0.11 -0.64 0.08 0.00 0.00 0.00 0.00 46.02 45.35 1lsj n GLY 22 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lsj n GLY 23 N 0.00 3.18 0.00 -0.02 0.00 -1.25 -3.68 105.19 103.42 1lsj n GLY 23 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1lsj n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lsj n GLY 24 N 0.48 -0.75 0.32 -0.02 0.00 -1.26 -4.50 105.19 99.45 1lsj n GLY 24 Ca 0.25 -1.72 -0.03 0.00 0.00 0.00 0.00 46.02 44.52 1lsj n GLY 24 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lsj h LEU 25 N 0.00 -0.98 0.57 0.99 5.85 -1.95 -0.72 115.31 119.06 1lsj h LEU 25 Ca 0.00 0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 1lsj h LEU 25 Cb 0.00 0.53 0.01 0.00 0.37 0.00 0.00 40.66 41.56 1lsj h LEU 25 CO 0.00 -0.28 -0.27 0.24 -0.34 0.00 0.00 178.44 177.79 1lsj h MET 26 N -0.11 -0.74 -0.49 1.25 2.86 -1.92 -2.49 114.93 113.30 1lsj h MET 26 Ca 0.27 0.05 0.09 0.00 -2.06 0.00 0.00 59.70 58.06 1lsj h MET 26 Cb 0.54 0.17 -0.10 0.00 0.06 0.00 0.00 31.60 32.26 1lsj h MET 26 CO -0.70 -0.49 -0.29 0.78 1.06 0.00 0.00 176.91 177.27 1lsj h GLY 27 N -1.11 -0.06 0.91 8.32 0.00 -1.68 0.23 103.07 109.68 1lsj h GLY 27 Ca -0.08 0.37 0.05 0.00 0.00 0.00 0.00 47.33 47.67 1lsj h GLY 27 CO 0.13 -0.21 0.59 0.00 0.00 0.00 0.00 176.54 177.04 1lsj h ALA 28 N 1.01 1.48 -0.14 3.60 0.00 -1.20 0.28 119.26 124.29 1lsj h ALA 28 Ca 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 1lsj h ALA 28 Cb 0.52 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1lsj h ALA 28 CO -0.59 0.40 0.02 0.78 0.00 0.00 0.00 179.25 179.86 1lsj h GLY 29 N 1.06 0.25 0.71 0.00 0.00 -0.46 0.83 103.07 105.45 1lsj h GLY 29 Ca 0.37 -0.17 0.04 0.00 0.00 0.00 0.00 47.33 47.58 1lsj h GLY 29 CO -0.13 0.15 0.18 -2.22 0.00 0.00 0.00 176.54 174.52 1lsj h ILE 30 N 0.01 0.92 -0.40 2.60 2.04 0.12 0.06 117.51 122.86 1lsj h ILE 30 Ca 0.04 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.80 1lsj h ILE 30 Cb 0.30 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 1lsj h ILE 30 CO 0.00 0.07 0.23 0.00 0.00 0.00 0.00 178.15 178.45 1lsj h ALA 31 N 1.24 0.50 0.13 1.87 0.00 -0.28 -1.32 119.26 121.41 1lsj h ALA 31 Ca 0.18 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1lsj h ALA 31 Cb 0.13 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1lsj h ALA 31 CO -0.16 -0.11 -0.18 0.37 0.00 0.00 0.00 179.25 179.16 1lsj h GLN 32 N 0.46 -0.35 -0.62 0.00 4.15 -0.06 -0.66 115.11 118.02 1lsj h GLN 32 Ca 0.16 0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.57 1lsj h GLN 32 Cb 0.03 0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 1lsj h GLN 32 CO -0.09 -0.24 0.22 0.28 -1.93 0.00 0.00 178.83 177.08 1lsj h VAL 33 N -0.37 1.22 -0.01 2.39 2.07 -0.89 -0.21 116.25 120.46 1lsj h VAL 33 Ca 0.02 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 1lsj h VAL 33 Cb 0.37 0.52 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1lsj h VAL 33 CO -0.08 0.29 0.00 0.00 0.02 0.00 0.00 177.57 177.80 1lsj h ALA 34 N 1.35 0.01 -0.49 1.67 0.00 -0.91 -2.54 119.26 118.34 1lsj h ALA 34 Ca 0.21 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1lsj h ALA 34 Cb 0.21 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1lsj h ALA 34 CO -0.01 -0.37 0.09 0.00 0.00 0.00 0.00 179.25 178.96 1lsj h ALA 35 N 0.76 1.23 0.00 0.00 0.00 -0.97 -1.07 119.26 119.21 1lsj h ALA 35 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1lsj h ALA 35 Cb 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1lsj h ALA 35 CO 0.00 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.77 1lsj h ALA 36 N 1.36 1.00 -0.63 0.00 0.00 -0.91 -2.59 119.26 117.49 1lsj h ALA 36 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.76 1lsj h ALA 36 Cb 0.32 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 17.92 1lsj h ALA 36 CO 0.00 0.00 0.24 0.25 0.00 0.00 0.00 179.25 179.74 1lsj n THR 37 N -2.88 2.83 -0.59 0.00 -2.24 -0.86 -4.94 114.28 105.60 1lsj n THR 37 Ca 0.00 -2.33 0.00 0.00 -2.27 0.00 0.00 64.05 59.45 1lsj n THR 37 Cb 0.25 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 1lsj n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lsj n GLY 38 N -1.06 1.43 3.79 3.38 0.00 -0.97 -4.95 105.19 106.81 1lsj n GLY 38 Ca 0.44 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.11 1lsj n GLY 38 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1lsj s HIS 39 N -3.45 3.54 -0.33 1.61 3.76 -0.46 -4.99 115.29 114.97 1lsj s HIS 39 Ca 0.00 1.72 -0.23 0.00 -0.15 0.00 0.00 55.06 56.40 1lsj s HIS 39 Cb 0.00 -2.91 0.00 0.00 1.11 0.00 0.00 32.58 30.79 1lsj s HIS 39 CO 0.00 0.07 0.78 0.99 -0.85 0.00 0.00 174.74 175.73 1lsj s THR 40 N -1.81 4.77 0.10 1.30 2.01 -0.51 -3.95 115.64 117.55 1lsj s THR 40 Ca 0.55 1.03 0.07 0.00 0.31 0.00 0.00 61.69 63.64 1lsj s THR 40 Cb -0.15 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.15 1lsj s THR 40 CO 0.20 -0.33 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.01 1lsj s VAL 41 N 3.01 3.37 -0.22 3.82 1.01 -0.24 -0.44 120.40 130.70 1lsj s VAL 41 Ca 0.32 -1.27 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 1lsj s VAL 41 Cb -0.14 -2.58 0.07 0.00 0.00 0.00 0.00 36.38 33.73 1lsj s VAL 41 CO 0.14 0.11 0.04 -0.69 0.00 0.00 0.00 175.10 174.70 1lsj s VAL 42 N -1.22 0.67 0.08 2.92 1.01 -0.64 -0.83 120.40 122.40 1lsj s VAL 42 Ca 0.21 -0.77 -0.23 0.00 0.00 0.00 0.00 61.98 61.20 1lsj s VAL 42 Cb -0.11 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.99 1lsj s VAL 42 CO 0.14 -0.28 0.69 -0.22 0.00 0.00 0.00 175.10 175.42 1lsj s LEU 43 N 1.78 4.51 -0.04 3.92 2.96 -0.70 -1.52 118.68 129.59 1lsj s LEU 43 Ca 0.00 1.42 0.03 0.00 -0.22 0.00 0.00 54.13 55.36 1lsj s LEU 43 Cb -0.17 -3.11 0.00 0.00 0.50 0.00 0.00 46.19 43.41 1lsj s LEU 43 CO -0.11 0.17 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.26 1lsj s VAL 44 N -0.73 1.17 0.31 1.68 1.01 -0.01 -1.75 120.40 122.08 1lsj s VAL 44 Ca 0.34 -0.57 -0.13 0.00 0.00 0.00 0.00 61.98 61.62 1lsj s VAL 44 Cb -0.21 -1.02 0.02 0.00 0.00 0.00 0.00 36.38 35.17 1lsj s VAL 44 CO 0.22 0.35 0.61 -0.62 0.00 0.00 0.00 175.10 175.66 1lsj s ASP 45 N 0.15 0.11 0.33 3.32 -1.08 -1.20 -1.09 116.67 117.22 1lsj s ASP 45 Ca -0.05 -1.04 0.08 0.00 -0.52 0.00 0.00 52.55 51.03 1lsj s ASP 45 Cb -0.11 0.70 0.59 0.00 -1.46 0.00 0.00 42.92 42.65 1lsj s ASP 45 CO 0.02 -1.36 1.79 1.56 0.52 0.00 0.00 175.17 177.70 1lsj h GLN 46 N 2.11 0.23 -5.24 4.34 4.20 -1.91 -3.38 115.11 115.46 1lsj h GLN 46 Ca -0.27 -0.08 -0.45 0.00 0.06 0.00 0.00 58.65 57.91 1lsj h GLN 46 Cb 1.25 -0.02 -0.14 0.00 0.30 0.00 0.00 27.48 28.87 1lsj h GLN 46 CO 0.35 0.51 -0.64 0.99 -0.67 0.00 0.00 178.83 179.37 1lsj s THR 47 N -4.38 1.22 0.04 -0.54 2.01 -1.26 -4.97 115.64 107.76 1lsj s THR 47 Ca -0.05 -2.04 0.09 0.00 0.31 0.00 0.00 61.69 60.01 1lsj s THR 47 Cb 0.14 -2.59 -0.13 0.00 0.01 0.00 0.00 72.50 69.93 1lsj s THR 47 CO 0.75 -0.15 1.33 -0.33 -0.69 0.00 0.00 174.62 175.53 1lsj h GLU 48 N 2.26 0.00 -0.28 4.92 5.08 -1.99 -2.55 114.58 122.02 1lsj h GLU 48 Ca -0.40 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.79 1lsj h GLU 48 Cb 1.24 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 1lsj h GLU 48 CO 0.67 0.86 -0.50 -0.44 -1.00 0.00 0.00 179.01 178.60 1lsj h ASP 49 N 0.00 0.86 0.05 1.42 3.32 -1.98 0.55 116.42 120.64 1lsj h ASP 49 Ca -0.01 -0.44 -0.00 0.00 0.02 0.00 0.00 57.03 56.60 1lsj h ASP 49 Cb 1.66 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.96 1lsj h ASP 49 CO 0.11 1.20 -0.02 0.40 -1.72 0.00 0.00 179.24 179.21 1lsj h ILE 50 N 0.61 1.01 0.34 0.35 1.08 -1.96 -0.50 117.51 118.44 1lsj h ILE 50 Ca 0.03 -0.20 -0.02 0.00 -0.39 0.00 0.00 64.86 64.28 1lsj h ILE 50 Cb 1.08 1.15 0.00 0.00 -3.07 0.00 0.00 36.82 35.98 1lsj h ILE 50 CO 0.11 0.05 -0.16 -0.07 -0.69 0.00 0.00 178.15 177.39 1lsj h LEU 51 N -0.16 -0.39 -0.94 1.44 3.38 -1.28 0.22 115.31 117.59 1lsj h LEU 51 Ca -0.01 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.02 1lsj h LEU 51 Cb 0.14 0.10 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 1lsj h LEU 51 CO 0.01 -0.25 0.59 0.00 0.09 0.00 0.00 178.44 178.89 1lsj h ALA 52 N 0.16 1.31 -0.44 1.53 0.00 0.12 0.18 119.26 122.12 1lsj h ALA 52 Ca -0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1lsj h ALA 52 Cb 0.37 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1lsj h ALA 52 CO 0.08 0.35 -0.03 -0.22 0.00 0.00 0.00 179.25 179.43 1lsj h LYS 53 N 1.07 0.79 -0.68 0.00 3.64 -0.85 -1.20 116.57 119.34 1lsj h LYS 53 Ca 0.41 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 1lsj h LYS 53 Cb 0.20 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1lsj h LYS 53 CO -0.18 0.87 0.38 0.77 -2.27 0.00 0.00 179.45 179.01 1lsj h SER 54 N 0.63 0.84 0.12 4.20 0.02 0.50 -2.06 113.55 117.79 1lsj h SER 54 Ca 0.12 -0.09 -0.09 0.00 -0.84 0.00 0.00 61.79 60.89 1lsj h SER 54 Cb 0.53 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1lsj h SER 54 CO 0.03 0.69 -0.31 0.50 -1.14 0.00 0.00 176.83 176.59 1lsj h LYS 55 N 0.92 0.30 -0.51 3.45 3.64 -0.53 -2.19 116.57 121.64 1lsj h LYS 55 Ca 0.24 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1lsj h LYS 55 Cb 0.03 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1lsj h LYS 55 CO -0.04 0.59 0.19 -0.22 -2.27 0.00 0.00 179.45 177.69 1lsj h LYS 56 N 0.26 0.78 -0.94 1.90 3.64 -0.76 -0.91 116.57 120.55 1lsj h LYS 56 Ca 0.04 -0.15 0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1lsj h LYS 56 Cb 0.69 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.33 1lsj h LYS 56 CO 0.05 0.71 0.61 0.78 -2.27 0.00 0.00 179.45 179.33 1lsj h GLY 57 N 0.69 1.36 0.93 5.01 0.00 -0.92 0.17 103.07 110.30 1lsj h GLY 57 Ca 0.17 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 1lsj h GLY 57 CO -0.01 0.39 0.04 -2.22 0.00 0.00 0.00 176.54 174.75 1lsj h ILE 58 N 1.17 1.08 -0.29 2.60 1.08 -0.80 0.19 117.51 122.55 1lsj h ILE 58 Ca 0.37 -0.22 0.02 0.00 -0.39 0.00 0.00 64.86 64.64 1lsj h ILE 58 Cb 0.02 1.09 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 1lsj h ILE 58 CO -0.12 0.07 0.13 -0.08 -0.69 0.00 0.00 178.15 177.47 1lsj h GLU 59 N 0.03 0.28 -0.11 2.37 4.81 -0.30 0.41 114.58 122.07 1lsj h GLU 59 Ca 0.03 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1lsj h GLU 59 Cb 0.07 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1lsj h GLU 59 CO -0.00 0.18 0.04 0.93 -0.73 0.00 0.00 179.01 179.43 1lsj h GLU 60 N 0.29 0.09 -0.66 1.92 5.08 -0.51 0.34 114.58 121.13 1lsj h GLU 60 Ca 0.12 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1lsj h GLU 60 Cb 0.05 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1lsj h GLU 60 CO -0.09 0.06 0.43 1.03 -1.00 0.00 0.00 179.01 179.45 1lsj h SER 61 N 0.10 0.75 -0.68 1.42 0.87 -0.59 -0.78 113.55 114.64 1lsj h SER 61 Ca 0.04 -0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.51 1lsj h SER 61 Cb 0.02 -0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 61.77 1lsj h SER 61 CO -0.04 0.54 0.14 -0.07 -0.53 0.00 0.00 176.83 176.87 1lsj h LEU 62 N 0.89 1.07 -0.98 2.23 3.38 0.28 -1.72 115.31 120.46 1lsj h LEU 62 Ca 0.24 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1lsj h LEU 62 Cb -0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.35 1lsj h LEU 62 CO -0.05 1.04 -0.31 0.03 0.09 0.00 0.00 178.44 179.23 1lsj h ARG 63 N 1.05 0.36 -0.38 1.13 3.08 0.07 0.13 114.38 119.82 1lsj h ARG 63 Ca 0.21 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 1lsj h ARG 63 Cb 0.41 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1lsj h ARG 63 CO 0.01 0.64 -0.05 -0.22 -1.07 0.00 0.00 179.97 179.27 1lsj h LYS 64 N 0.31 0.64 -0.12 0.04 3.64 -0.68 -1.99 116.57 118.41 1lsj h LYS 64 Ca 0.04 -0.17 -0.03 0.00 -1.27 0.00 0.00 60.65 59.22 1lsj h LYS 64 Cb 0.70 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1lsj h LYS 64 CO 0.05 0.69 -0.04 0.28 -2.27 0.00 0.00 179.45 178.16 1lsj h VAL 65 N 0.59 1.30 -0.11 2.00 2.07 -0.42 -3.01 116.25 118.69 1lsj h VAL 65 Ca 0.12 -1.03 0.03 0.00 0.82 0.00 0.00 66.70 66.63 1lsj h VAL 65 Cb 0.45 1.73 -0.06 0.00 -1.52 0.00 0.00 31.29 31.90 1lsj h VAL 65 CO 0.02 0.30 -0.52 0.00 0.02 0.00 0.00 177.57 177.38 1lsj h ALA 66 N 0.67 -0.89 -0.99 1.67 0.00 -0.31 -1.68 119.26 117.73 1lsj h ALA 66 Ca 0.03 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.03 1lsj h ALA 66 Cb 0.48 0.99 -0.09 0.00 0.00 0.00 0.00 17.79 19.17 1lsj h ALA 66 CO 0.02 -1.08 0.62 0.87 0.00 0.00 0.00 179.25 179.68 1lsj h LYS 67 N -0.58 0.84 -1.10 0.00 1.79 -1.45 1.25 116.57 117.33 1lsj h LYS 67 Ca 0.03 -0.05 -0.27 0.00 -2.18 0.00 0.00 60.65 58.18 1lsj h LYS 67 Cb 0.66 -0.19 -0.15 0.00 -1.58 0.00 0.00 32.23 30.97 1lsj h LYS 67 CO -0.41 0.56 0.34 1.63 -1.08 0.00 0.00 179.45 180.49 1lsj n LYS 68 N -4.66 1.65 0.00 3.15 5.02 -0.67 -2.73 118.16 119.93 1lsj n LYS 68 Ca 0.20 -1.50 0.00 0.00 -2.02 0.00 0.00 58.31 54.99 1lsj n LYS 68 Cb 0.45 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 1lsj n LYS 68 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1lsj n LYS 69 N -0.19 0.00 -1.07 1.97 4.81 -0.29 -4.92 118.16 118.47 1lsj n LYS 69 Ca 0.30 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.57 1lsj n LYS 69 Cb 0.98 -0.04 0.19 0.00 0.02 0.00 0.00 35.03 36.18 1lsj n LYS 69 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1lsj n PHE 70 N -2.14 2.27 0.10 5.64 3.01 0.41 -4.66 117.46 122.11 1lsj n PHE 70 Ca 0.00 -1.78 0.06 0.00 1.01 0.00 0.00 57.45 56.74 1lsj n PHE 70 Cb 0.00 -0.77 0.31 0.00 -0.01 0.00 0.00 39.48 39.01 1lsj n PHE 70 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1lsj n ALA 71 N -1.14 0.89 -0.17 4.37 0.00 -1.10 -0.61 120.51 122.74 1lsj n ALA 71 Ca 0.49 0.11 0.10 0.00 0.00 0.00 0.00 53.44 54.14 1lsj n ALA 71 Cb 1.40 -1.04 0.26 0.00 0.00 0.00 0.00 19.45 20.08 1lsj n ALA 71 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1lsj n GLU 72 N -1.89 2.65 -2.67 0.00 -0.58 -1.26 -4.69 120.64 112.20 1lsj n GLU 72 Ca -0.01 -2.43 -0.04 0.00 -0.42 0.00 0.00 57.16 54.26 1lsj n GLU 72 Cb 0.10 -1.49 0.06 0.00 -0.57 0.00 0.00 31.44 29.54 1lsj n GLU 72 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1lsj n ASN 73 N 1.38 -1.50 -0.28 1.62 2.85 0.22 -5.02 115.26 114.52 1lsj n ASN 73 Ca 0.21 -1.68 0.34 0.00 -0.11 0.00 0.00 54.58 53.34 1lsj n ASN 73 Cb 0.57 0.82 0.74 0.00 1.24 0.00 0.00 39.78 43.15 1lsj n ASN 73 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1lsj h PRO 74 N 3.55 0.00 -0.85 1.20 0.13 -1.81 0.65 132.00 134.87 1lsj h PRO 74 Ca -0.16 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.02 1lsj h PRO 74 Cb 1.18 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 1lsj h PRO 74 CO -0.13 0.00 0.56 -0.22 -0.23 0.00 0.00 178.00 177.98 1lsj h LYS 75 N 0.00 0.98 0.16 0.86 3.11 -1.95 0.16 116.57 119.88 1lsj h LYS 75 Ca 0.53 -0.06 -0.01 0.00 -2.81 0.00 0.00 60.65 58.30 1lsj h LYS 75 Cb 2.16 -0.22 0.00 0.00 -1.00 0.00 0.00 32.23 33.17 1lsj h LYS 75 CO -0.01 0.65 -0.08 0.00 -2.81 0.00 0.00 179.45 177.20 1lsj h ALA 76 N 1.52 -0.21 -1.10 5.00 0.00 -0.04 -2.89 119.26 121.54 1lsj h ALA 76 Ca 0.35 -0.23 0.30 0.00 0.00 0.00 0.00 54.91 55.33 1lsj h ALA 76 Cb 0.12 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 1lsj h ALA 76 CO -0.12 -0.32 0.75 0.78 0.00 0.00 0.00 179.25 180.34 1lsj h GLY 77 N -0.82 0.70 0.99 0.00 0.00 -1.10 0.21 103.07 103.04 1lsj h GLY 77 Ca -0.02 -0.11 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 1lsj h GLY 77 CO 0.04 -0.09 -0.25 -0.55 0.00 0.00 0.00 176.54 175.68 1lsj h ASP 78 N 0.21 0.78 -0.14 0.19 3.32 -0.63 -1.49 116.42 118.65 1lsj h ASP 78 Ca 0.58 -0.45 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1lsj h ASP 78 Cb 1.85 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 41.18 1lsj h ASP 78 CO -0.18 1.06 0.06 -0.33 -1.72 0.00 0.00 179.24 178.14 1lsj h GLU 79 N 0.51 0.21 -0.29 3.56 5.08 -0.46 -0.62 114.58 122.57 1lsj h GLU 79 Ca 0.06 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.45 1lsj h GLU 79 Cb 0.81 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.95 1lsj h GLU 79 CO 0.07 0.29 -0.24 0.35 -1.00 0.00 0.00 179.01 178.47 1lsj h PHE 80 N 0.09 -0.64 -0.40 4.33 3.04 -1.01 0.23 116.94 122.58 1lsj h PHE 80 Ca 0.05 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 61.98 1lsj h PHE 80 Cb 0.15 0.33 -0.02 0.00 2.56 0.00 0.00 35.95 38.97 1lsj h PHE 80 CO -0.02 -0.32 0.01 0.28 -2.02 0.00 0.00 178.31 176.24 1lsj h VAL 81 N -0.22 1.22 0.23 1.41 2.07 -1.02 -1.50 116.25 118.43 1lsj h VAL 81 Ca 0.15 -0.86 -0.33 0.00 0.82 0.00 0.00 66.70 66.48 1lsj h VAL 81 Cb 0.46 0.90 0.04 0.00 -1.52 0.00 0.00 31.29 31.17 1lsj h VAL 81 CO -0.42 0.30 -1.44 -0.08 0.02 0.00 0.00 177.57 175.94 1lsj h GLU 82 N 0.60 0.53 0.36 1.57 4.57 -0.51 -2.06 114.58 119.64 1lsj h GLU 82 Ca 0.13 -0.88 -0.02 0.00 -1.18 0.00 0.00 59.36 57.41 1lsj h GLU 82 Cb 0.37 0.32 0.00 0.00 -0.16 0.00 0.00 28.75 29.28 1lsj h GLU 82 CO 0.01 1.42 -0.17 -0.22 -1.18 0.00 0.00 179.01 178.87 1lsj h LYS 83 N 0.15 -0.47 -0.98 1.92 3.64 -0.53 0.30 116.57 120.61 1lsj h LYS 83 Ca -0.24 0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.18 1lsj h LYS 83 Cb 2.13 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 34.01 1lsj h LYS 83 CO 0.27 -0.30 0.65 1.15 -2.27 0.00 0.00 179.45 178.95 1lsj h THR 84 N -0.51 1.24 -0.25 1.00 2.02 -1.38 -2.69 112.91 112.34 1lsj h THR 84 Ca -0.05 -0.45 -0.14 0.00 0.77 0.00 0.00 66.41 66.54 1lsj h THR 84 Cb 0.38 -0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.60 1lsj h THR 84 CO 0.08 0.24 -0.41 0.25 0.37 0.00 0.00 175.52 176.05 1lsj h LEU 85 N 1.32 0.63 -1.37 2.58 5.85 -1.07 -3.13 115.31 120.13 1lsj h LEU 85 Ca 0.36 -0.29 -0.07 0.00 0.84 0.00 0.00 57.88 58.73 1lsj h LEU 85 Cb -0.14 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.70 1lsj h LEU 85 CO -0.08 0.97 -0.32 0.77 -0.34 0.00 0.00 178.44 179.44 1lsj h SER 86 N 0.49 0.00 -0.05 1.25 4.64 -0.08 -2.15 113.55 117.64 1lsj h SER 86 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1lsj h SER 86 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1lsj h SER 86 CO 0.08 0.32 0.00 0.35 -0.87 0.00 0.00 176.83 176.71 1lsj n THR 87 N -4.15 0.07 -3.35 2.95 -2.24 -1.13 -4.36 114.28 102.08 1lsj n THR 87 Ca -0.02 -0.07 -0.37 0.00 -2.27 0.00 0.00 64.05 61.32 1lsj n THR 87 Cb 0.36 0.01 -0.04 0.00 -2.10 0.00 0.00 70.33 68.57 1lsj n THR 87 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1lsj n ILE 88 N -0.38 3.82 -0.93 2.28 2.08 -0.81 -1.08 119.36 124.34 1lsj n ILE 88 Ca 0.03 -5.45 -0.28 0.00 0.56 0.00 0.00 62.75 57.61 1lsj n ILE 88 Cb 0.05 -2.24 0.21 0.00 -0.75 0.00 0.00 39.64 36.91 1lsj n ILE 88 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1lsj s ALA 89 N -2.10 0.33 0.01 -1.39 0.00 -0.01 -4.82 121.76 113.79 1lsj s ALA 89 Ca 0.32 -0.31 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 1lsj s ALA 89 Cb 0.02 -3.16 -0.01 0.00 0.00 0.00 0.00 23.12 19.97 1lsj s ALA 89 CO -0.02 -3.28 0.04 0.95 0.00 0.00 0.00 175.76 173.45 1lsj s THR 90 N -2.78 0.10 0.06 0.00 -4.23 -1.26 -1.73 115.64 105.80 1lsj s THR 90 Ca 0.67 -0.80 -0.21 0.00 -1.18 0.00 0.00 61.69 60.17 1lsj s THR 90 Cb -0.21 -0.32 0.05 0.00 1.34 0.00 0.00 72.50 73.36 1lsj s THR 90 CO 0.60 -0.44 0.48 -0.44 -0.54 0.00 0.00 174.62 174.29 1lsj s SER 91 N -1.39 -0.38 0.02 3.99 0.01 -0.72 -4.93 113.70 110.31 1lsj s SER 91 Ca -0.15 0.07 0.22 0.00 1.31 0.00 0.00 55.95 57.40 1lsj s SER 91 Cb -0.09 0.48 -0.25 0.00 0.21 0.00 0.00 66.02 66.37 1lsj s SER 91 CO -0.00 -0.73 0.64 0.35 0.41 0.00 0.00 173.24 173.91 1lsj n THR 92 N 0.33 0.12 -4.04 1.44 -2.24 -1.26 -3.21 114.28 105.42 1lsj n THR 92 Ca -0.18 -0.46 -0.31 0.00 -2.27 0.00 0.00 64.05 60.82 1lsj n THR 92 Cb 0.61 0.01 -0.15 0.00 -2.10 0.00 0.00 70.33 68.70 1lsj n THR 92 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1lsj s ASP 93 N -4.54 4.55 0.48 3.42 -1.08 -1.26 -4.57 116.67 113.67 1lsj s ASP 93 Ca -0.05 -1.72 0.15 0.00 -0.52 0.00 0.00 52.55 50.41 1lsj s ASP 93 Cb 0.13 -1.55 1.14 0.00 -1.46 0.00 0.00 42.92 41.18 1lsj s ASP 93 CO 0.88 -0.28 2.05 0.00 0.52 0.00 0.00 175.17 178.34 1lsj h ALA 94 N 7.71 2.05 -0.17 3.66 0.00 -1.96 -1.57 119.26 128.98 1lsj h ALA 94 Ca -0.12 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1lsj h ALA 94 Cb 1.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1lsj h ALA 94 CO 0.48 -0.12 0.32 0.00 0.00 0.00 0.00 179.25 179.93 1lsj h ALA 95 N 1.81 1.67 0.00 0.00 0.00 -1.96 -0.88 119.26 119.89 1lsj h ALA 95 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1lsj h ALA 95 Cb 0.35 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1lsj h ALA 95 CO -0.03 -0.41 0.00 0.66 0.00 0.00 0.00 179.25 179.47 1lsj h SER 96 N 0.00 0.00 0.00 0.00 4.64 -1.72 -3.36 113.55 113.11 1lsj h SER 96 Ca 0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 1lsj h SER 96 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1lsj h SER 96 CO -0.00 0.00 -0.04 1.33 -0.87 0.00 0.00 176.83 177.25 1lsj n VAL 97 N -2.33 0.00 0.28 0.95 0.24 -0.37 -4.76 118.33 112.34 1lsj n VAL 97 Ca 0.05 -0.36 0.16 0.00 -2.04 0.00 0.00 64.34 62.15 1lsj n VAL 97 Cb 0.39 0.97 0.77 0.00 -1.47 0.00 0.00 33.84 34.50 1lsj n VAL 97 CO 0.00 0.00 0.00 -0.37 -2.14 0.00 0.00 176.83 174.32 1lsj h VAL 98 N 0.00 0.30 0.00 3.34 -1.51 -1.62 -2.20 116.25 114.56 1lsj h VAL 98 Ca 0.00 -0.51 -0.00 0.00 -1.23 0.00 0.00 66.70 64.96 1lsj h VAL 98 Cb 0.00 1.38 -0.00 0.00 -2.13 0.00 0.00 31.29 30.54 1lsj h VAL 98 CO 0.00 0.08 -0.01 -0.74 -1.23 0.00 0.00 177.57 175.67 1lsj h HIS 99 N 0.00 0.00 0.00 5.19 6.17 -1.79 -2.61 115.15 122.11 1lsj h HIS 99 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 1lsj h HIS 99 Cb 0.38 0.00 0.00 0.00 2.52 0.00 0.00 27.41 30.31 1lsj h HIS 99 CO 0.00 0.01 -0.02 -1.13 0.71 0.00 0.00 177.93 177.50 1lsj n SER 100 N -3.21 1.78 -4.93 3.26 3.41 -0.84 -3.97 113.62 109.12 1lsj n SER 100 Ca -0.02 -2.18 -0.28 0.00 -0.26 0.00 0.00 58.87 56.12 1lsj n SER 100 Cb 0.12 -0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1lsj n SER 100 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1lsj s THR 101 N -1.34 5.27 -0.07 6.66 -1.32 -0.99 -4.91 115.64 118.94 1lsj s THR 101 Ca 0.08 -0.41 0.14 0.00 -1.21 0.00 0.00 61.69 60.29 1lsj s THR 101 Cb 0.07 -3.70 -0.23 0.00 -1.51 0.00 0.00 72.50 67.13 1lsj s THR 101 CO 0.01 -0.07 0.61 0.47 -2.21 0.00 0.00 174.62 173.42 1lsj n ASP 102 N -0.38 0.76 -3.79 8.08 8.00 0.56 -4.35 116.55 125.44 1lsj n ASP 102 Ca -0.05 0.36 -0.13 0.00 0.71 0.00 0.00 54.79 55.69 1lsj n ASP 102 Cb 0.53 0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.61 1lsj n ASP 102 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1lsj s LEU 103 N -5.98 1.03 -0.18 0.64 2.96 -1.01 -1.22 118.68 114.91 1lsj s LEU 103 Ca -0.05 0.35 -0.00 0.00 -0.22 0.00 0.00 54.13 54.21 1lsj s LEU 103 Cb 0.08 0.96 0.01 0.00 0.50 0.00 0.00 46.19 47.74 1lsj s LEU 103 CO 0.82 -0.20 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.81 1lsj s VAL 104 N -0.36 2.47 -0.30 1.68 1.01 -0.19 -0.71 120.40 124.00 1lsj s VAL 104 Ca -0.05 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 1lsj s VAL 104 Cb -0.03 -2.06 0.05 0.00 0.00 0.00 0.00 36.38 34.33 1lsj s VAL 104 CO 0.01 0.51 -0.00 -0.69 0.00 0.00 0.00 175.10 174.93 1lsj s VAL 105 N 1.25 2.97 -0.10 2.92 1.01 -0.54 -0.30 120.40 127.61 1lsj s VAL 105 Ca 0.03 -1.37 -0.17 0.00 0.00 0.00 0.00 61.98 60.47 1lsj s VAL 105 Cb -0.14 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 1lsj s VAL 105 CO -0.08 -0.09 0.44 -0.70 0.00 0.00 0.00 175.10 174.67 1lsj s GLU 106 N 1.25 4.25 -0.39 2.72 -6.30 -0.08 -0.55 118.70 119.61 1lsj s GLU 106 Ca -0.05 0.41 0.10 0.00 -2.50 0.00 0.00 54.97 52.92 1lsj s GLU 106 Cb -0.20 -3.39 0.33 0.00 0.00 0.00 0.00 34.13 30.87 1lsj s GLU 106 CO -0.01 0.28 0.78 0.00 0.02 0.00 0.00 175.26 176.32 1lsj n ALA 107 N 3.28 1.41 -3.19 6.30 0.00 0.34 -1.55 120.51 127.09 1lsj n ALA 107 Ca -0.09 -2.96 0.00 0.00 0.00 0.00 0.00 53.44 50.39 1lsj n ALA 107 Cb 0.52 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1lsj n ALA 107 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1lsj n ILE 108 N 0.51 0.00 -1.69 0.00 -5.35 -1.24 -4.37 119.36 107.22 1lsj n ILE 108 Ca 0.20 0.00 -0.44 0.00 -0.27 0.00 0.00 62.75 62.24 1lsj n ILE 108 Cb 0.65 -0.32 -0.03 0.00 -1.74 0.00 0.00 39.64 38.19 1lsj n ILE 108 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34 1lsj n VAL 109 N -0.17 0.19 -0.53 7.28 3.14 -1.26 -4.86 118.33 122.12 1lsj n VAL 109 Ca 0.00 -0.05 -0.30 0.00 -2.96 0.00 0.00 64.34 61.03 1lsj n VAL 109 Cb 0.00 -1.71 -0.06 0.00 -1.06 0.00 0.00 33.84 31.01 1lsj n VAL 109 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1lsj n GLN 110 N 3.34 0.56 -3.83 1.45 1.13 -1.26 -4.76 117.38 114.01 1lsj n GLN 110 Ca 0.15 -1.10 -0.29 0.00 -1.94 0.00 0.00 57.00 53.82 1lsj n GLN 110 Cb 0.32 -2.45 -0.16 0.00 0.11 0.00 0.00 30.24 28.06 1lsj n GLN 110 CO 0.00 0.00 0.00 1.21 -1.44 0.00 0.00 177.06 176.83 1lsj s ASN 111 N 5.62 3.63 0.28 1.08 3.84 -1.26 -5.02 114.94 123.11 1lsj s ASN 111 Ca 0.45 -1.21 0.02 0.00 0.21 0.00 0.00 52.86 52.32 1lsj s ASN 111 Cb 0.10 -0.94 0.67 0.00 -0.55 0.00 0.00 41.25 40.54 1lsj s ASN 111 CO 0.16 -0.31 1.70 0.25 -2.79 0.00 0.00 177.10 176.12 1lsj h LEU 112 N 8.06 0.32 0.17 3.21 5.85 -2.00 -1.17 115.31 129.76 1lsj h LEU 112 Ca -0.16 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1lsj h LEU 112 Cb 1.07 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1lsj h LEU 112 CO 0.41 0.03 -0.08 0.50 -0.34 0.00 0.00 178.44 178.95 1lsj h LYS 113 N 0.42 -0.23 -0.86 1.25 3.64 -1.97 -0.99 116.57 117.84 1lsj h LYS 113 Ca 0.53 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.91 1lsj h LYS 113 Cb 0.96 0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.79 1lsj h LYS 113 CO -0.50 -0.12 0.48 0.28 -2.27 0.00 0.00 179.45 177.32 1lsj h VAL 114 N -0.27 1.25 -0.27 2.00 2.07 -1.74 -0.97 116.25 118.32 1lsj h VAL 114 Ca -0.02 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 1lsj h VAL 114 Cb 0.21 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1lsj h VAL 114 CO 0.04 0.27 0.05 0.11 0.02 0.00 0.00 177.57 178.06 1lsj h LYS 115 N 1.19 0.44 -0.64 1.57 1.57 -1.10 -1.40 116.57 118.20 1lsj h LYS 115 Ca 0.30 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.91 1lsj h LYS 115 Cb 0.00 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1lsj h LYS 115 CO -0.05 0.55 0.16 -0.91 -0.57 0.00 0.00 179.45 178.63 1lsj h ASN 116 N 0.26 0.95 -0.35 0.86 2.35 -0.84 -0.34 115.58 118.47 1lsj h ASN 116 Ca 0.08 -0.19 -0.06 0.00 -0.55 0.00 0.00 56.30 55.59 1lsj h ASN 116 Cb 0.32 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 1lsj h ASN 116 CO 0.00 0.91 0.03 -0.08 -1.65 0.00 0.00 177.43 176.65 1lsj h GLU 117 N 0.96 0.70 0.52 0.81 4.81 -1.08 0.63 114.58 121.94 1lsj h GLU 117 Ca 0.21 -0.16 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1lsj h GLU 117 Cb 0.33 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.62 1lsj h GLU 117 CO -0.00 0.70 -0.25 1.25 -0.73 0.00 0.00 179.01 179.98 1lsj h LEU 118 N 0.67 -0.59 -2.24 1.64 5.85 -0.54 -3.01 115.31 117.09 1lsj h LEU 118 Ca 0.14 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 1lsj h LEU 118 Cb 0.37 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.55 1lsj h LEU 118 CO 0.01 -0.30 -0.00 -0.26 -0.34 0.00 0.00 178.44 177.55 1lsj h PHE 119 N -0.93 0.00 -0.25 1.25 0.04 -1.03 0.07 116.94 116.09 1lsj h PHE 119 Ca -0.07 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.65 1lsj h PHE 119 Cb 0.53 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.67 1lsj h PHE 119 CO 0.04 0.00 -0.03 -0.22 -0.60 0.00 0.00 178.31 177.50 1lsj h LYS 120 N 0.00 0.47 -0.25 1.51 3.64 -0.91 -0.37 116.57 120.66 1lsj h LYS 120 Ca -0.00 -0.17 -0.10 0.00 -1.27 0.00 0.00 60.65 59.11 1lsj h LYS 120 Cb 0.01 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1lsj h LYS 120 CO 0.00 0.67 -0.24 -0.09 -2.27 0.00 0.00 179.45 177.52 1lsj h ARG 121 N 0.23 0.61 0.00 1.90 2.43 -1.29 -2.98 114.38 115.28 1lsj h ARG 121 Ca 0.07 -0.31 -0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1lsj h ARG 121 Cb 0.47 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1lsj h ARG 121 CO 0.02 0.91 -0.02 -0.07 -1.51 0.00 0.00 179.97 179.30 1lsj h LEU 122 N 0.32 0.00 -1.01 3.80 3.38 -0.92 -1.69 115.31 119.19 1lsj h LEU 122 Ca 0.04 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1lsj h LEU 122 Cb 0.79 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 1lsj h LEU 122 CO 0.06 0.02 0.67 -0.78 0.09 0.00 0.00 178.44 178.49 1lsj h ASP 123 N 0.00 1.14 0.41 -0.43 3.58 -0.89 0.28 116.42 120.50 1lsj h ASP 123 Ca -0.00 -0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.34 1lsj h ASP 123 Cb 0.03 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 40.79 1lsj h ASP 123 CO 0.00 0.81 -0.42 0.11 -2.88 0.00 0.00 179.24 176.86 1lsj h LYS 124 N 1.34 0.02 0.12 0.28 1.57 -1.35 -3.29 116.57 115.26 1lsj h LYS 124 Ca 0.38 -0.01 -0.36 0.00 -1.87 0.00 0.00 60.65 58.79 1lsj h LYS 124 Cb -0.11 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 1lsj h LYS 124 CO -0.09 0.44 -1.99 1.19 -0.57 0.00 0.00 179.45 178.42 1lsj n PHE 125 N -4.04 1.23 -1.05 -1.35 3.01 -0.93 -4.99 117.46 109.35 1lsj n PHE 125 Ca -0.02 0.27 -0.35 0.00 1.01 0.00 0.00 57.45 58.36 1lsj n PHE 125 Cb 0.45 -1.16 0.08 0.00 -0.01 0.00 0.00 39.48 38.84 1lsj n PHE 125 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1lsj n ALA 126 N -2.98 -2.58 -1.51 4.37 0.00 0.04 -3.46 120.51 114.39 1lsj n ALA 126 Ca -0.31 -0.43 -0.30 0.00 0.00 0.00 0.00 53.44 52.40 1lsj n ALA 126 Cb 1.05 -1.70 0.19 0.00 0.00 0.00 0.00 19.45 18.98 1lsj n ALA 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lsj s ALA 127 N -2.10 1.52 0.25 0.00 0.00 -1.16 -4.77 121.76 115.49 1lsj s ALA 127 Ca 0.58 -0.91 0.08 0.00 0.00 0.00 0.00 51.96 51.71 1lsj s ALA 127 Cb -0.28 -2.89 0.27 0.00 0.00 0.00 0.00 23.12 20.22 1lsj s ALA 127 CO 0.66 -2.80 1.56 1.49 0.00 0.00 0.00 175.76 176.67 1lsj h GLU 128 N -1.93 0.08 0.09 0.00 4.57 -1.94 -3.23 114.58 112.22 1lsj h GLU 128 Ca -0.46 -0.06 -0.28 0.00 -1.18 0.00 0.00 59.36 57.37 1lsj h GLU 128 Cb 1.28 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.87 1lsj h GLU 128 CO 0.44 0.70 -1.38 1.12 -1.18 0.00 0.00 179.01 178.71 1lsj h HIS 129 N 0.06 0.35 -0.81 0.92 2.07 -1.93 -3.48 115.15 112.33 1lsj h HIS 129 Ca -0.01 -0.25 -0.62 0.00 -2.85 0.00 0.00 60.37 56.63 1lsj h HIS 129 Cb 1.16 -0.01 0.05 0.00 2.57 0.00 0.00 27.41 31.18 1lsj h HIS 129 CO 0.01 1.26 -0.02 2.41 -3.07 0.00 0.00 177.93 178.52 1lsj n THR 130 N -3.42 0.22 -4.14 6.12 -1.04 -1.22 -4.96 114.28 105.84 1lsj n THR 130 Ca -0.12 -0.06 -0.33 0.00 -2.04 0.00 0.00 64.05 61.51 1lsj n THR 130 Cb 1.02 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.46 1lsj n THR 130 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1lsj s ILE 131 N -0.11 4.63 -0.17 12.58 1.01 -0.36 -4.90 121.20 133.88 1lsj s ILE 131 Ca 0.70 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.93 1lsj s ILE 131 Cb -0.99 -3.10 -0.01 0.00 0.01 0.00 0.00 42.46 38.37 1lsj s ILE 131 CO 0.46 0.38 -0.09 -0.36 0.00 0.00 0.00 174.94 175.33 1lsj s PHE 132 N -1.15 2.89 0.04 3.97 0.40 0.55 -1.02 117.98 123.66 1lsj s PHE 132 Ca 0.21 -0.76 0.03 0.00 -0.60 0.00 0.00 56.93 55.81 1lsj s PHE 132 Cb -0.12 -1.96 -0.02 0.00 0.51 0.00 0.00 43.02 41.43 1lsj s PHE 132 CO 0.12 -0.34 -0.10 0.00 0.70 0.00 0.00 175.22 175.60 1lsj s ALA 133 N 0.81 0.76 -0.04 5.36 0.00 0.59 -1.04 121.76 128.20 1lsj s ALA 133 Ca -0.03 -0.76 0.05 0.00 0.00 0.00 0.00 51.96 51.22 1lsj s ALA 133 Cb -0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 1lsj s ALA 133 CO 0.01 0.07 -0.19 0.45 0.00 0.00 0.00 175.76 176.09 1lsj s SER 134 N -1.38 2.40 0.00 0.00 0.15 -1.01 -0.90 113.70 112.96 1lsj s SER 134 Ca -0.05 -0.39 0.18 0.00 0.70 0.00 0.00 55.95 56.39 1lsj s SER 134 Cb -0.09 -0.60 0.63 0.00 -1.71 0.00 0.00 66.02 64.25 1lsj s SER 134 CO 0.01 0.19 1.47 -3.20 1.20 0.00 0.00 173.24 172.91 1lsj n ASN 135 N 3.01 1.83 -4.39 5.45 5.15 -0.59 -1.91 115.26 123.81 1lsj n ASN 135 Ca -0.17 -1.80 -0.34 0.00 -0.60 0.00 0.00 54.58 51.67 1lsj n ASN 135 Cb 0.53 -0.15 0.10 0.00 -0.53 0.00 0.00 39.78 39.73 1lsj n ASN 135 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 1lsj n THR 136 N 0.45 0.36 0.00 -0.44 5.66 -1.26 -4.68 114.28 114.36 1lsj n THR 136 Ca 0.15 -0.26 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 1lsj n THR 136 Cb 0.34 -0.59 0.00 0.00 -1.55 0.00 0.00 70.33 68.53 1lsj n THR 136 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1lsj n SER 137 N -0.67 1.00 -0.09 1.09 7.64 -1.26 -4.80 113.62 116.53 1lsj n SER 137 Ca 0.07 -0.21 0.01 0.00 1.01 0.00 0.00 58.87 59.74 1lsj n SER 137 Cb 0.53 0.62 0.02 0.00 -1.01 0.00 0.00 64.21 64.37 1lsj n SER 137 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1lsj n SER 138 N -0.72 1.96 -4.23 6.43 3.41 -1.26 -4.44 113.62 114.76 1lsj n SER 138 Ca 0.00 -1.83 -0.21 0.00 -0.26 0.00 0.00 58.87 56.58 1lsj n SER 138 Cb 0.00 -0.03 -0.12 0.00 -0.26 0.00 0.00 64.21 63.80 1lsj n SER 138 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1lsj s LEU 139 N -0.84 2.30 -0.14 1.04 1.43 -1.26 -5.03 118.68 116.19 1lsj s LEU 139 Ca 0.03 -0.67 -0.29 0.00 -1.03 0.00 0.00 54.13 52.17 1lsj s LEU 139 Cb 0.02 -0.67 -0.01 0.00 0.03 0.00 0.00 46.19 45.56 1lsj s LEU 139 CO 0.02 -0.03 0.99 -1.10 0.23 0.00 0.00 176.35 176.46 1lsj s GLN 140 N -1.93 4.37 0.35 1.70 -0.21 -1.26 -4.90 119.66 117.77 1lsj s GLN 140 Ca 0.03 1.33 0.14 0.00 0.02 0.00 0.00 55.36 56.88 1lsj s GLN 140 Cb -0.09 -3.57 1.01 0.00 1.00 0.00 0.00 33.01 31.36 1lsj s GLN 140 CO 0.03 -0.38 1.72 0.82 -2.12 0.00 0.00 175.29 175.36 1lsj h ILE 141 N 5.18 0.46 -0.46 1.08 1.08 -1.97 -0.37 117.51 122.51 1lsj h ILE 141 Ca -0.28 -0.16 0.06 0.00 -0.39 0.00 0.00 64.86 64.09 1lsj h ILE 141 Cb 1.13 -0.04 -0.05 0.00 -3.07 0.00 0.00 36.82 34.79 1lsj h ILE 141 CO 0.88 0.08 0.17 0.74 -0.69 0.00 0.00 178.15 179.33 1lsj h THR 142 N 0.46 0.86 -0.86 -0.27 2.02 -1.93 -0.26 112.91 112.93 1lsj h THR 142 Ca 0.66 -0.12 0.11 0.00 0.77 0.00 0.00 66.41 67.83 1lsj h THR 142 Cb 1.45 0.49 -0.08 0.00 -1.74 0.00 0.00 68.15 68.27 1lsj h THR 142 CO -0.46 0.06 0.50 0.28 0.37 0.00 0.00 175.52 176.27 1lsj h SER 143 N 0.35 0.70 -0.18 4.18 0.02 -1.46 -2.06 113.55 115.10 1lsj h SER 143 Ca 0.21 0.06 -0.21 0.00 -0.84 0.00 0.00 61.79 61.01 1lsj h SER 143 Cb 0.20 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 62.67 1lsj h SER 143 CO -0.21 0.38 -0.69 0.40 -1.14 0.00 0.00 176.83 175.56 1lsj h ILE 144 N 0.80 1.29 -0.09 3.27 2.04 -1.35 -3.24 117.51 120.23 1lsj h ILE 144 Ca 0.43 -1.89 -0.03 0.00 1.00 0.00 0.00 64.86 64.37 1lsj h ILE 144 Cb 0.44 1.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 1lsj h ILE 144 CO -0.27 0.60 -0.07 0.00 0.00 0.00 0.00 178.15 178.41 1lsj h ALA 145 N 0.57 1.72 0.00 1.87 0.00 -0.54 -2.14 119.26 120.74 1lsj h ALA 145 Ca -0.04 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1lsj h ALA 145 Cb 1.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1lsj h ALA 145 CO 0.15 0.21 0.00 0.09 0.00 0.00 0.00 179.25 179.70 1lsj n ASN 146 N -4.38 0.00 0.04 0.00 3.02 -0.82 -1.54 115.26 111.58 1lsj n ASN 146 Ca -0.01 -1.55 0.12 0.00 -0.03 0.00 0.00 54.58 53.10 1lsj n ASN 146 Cb 0.19 0.00 0.11 0.00 -0.61 0.00 0.00 39.78 39.48 1lsj n ASN 146 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lsj n ALA 147 N -0.51 3.16 -4.04 5.41 0.00 -0.80 -4.90 120.51 118.84 1lsj n ALA 147 Ca 0.00 -0.32 -0.16 0.00 0.00 0.00 0.00 53.44 52.96 1lsj n ALA 147 Cb 0.00 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 1lsj n ALA 147 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1lsj n THR 148 N -2.01 0.00 -2.32 0.00 -2.24 -0.59 -4.39 114.28 102.74 1lsj n THR 148 Ca 0.03 -1.24 -0.08 0.00 -2.27 0.00 0.00 64.05 60.50 1lsj n THR 148 Cb 0.43 -0.01 0.06 0.00 -2.10 0.00 0.00 70.33 68.71 1lsj n THR 148 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1lsj n THR 149 N -0.96 1.70 -1.28 4.28 -2.24 -1.26 -4.63 114.28 109.90 1lsj n THR 149 Ca -0.06 -3.20 0.05 0.00 -2.27 0.00 0.00 64.05 58.57 1lsj n THR 149 Cb 0.34 0.14 0.06 0.00 -2.10 0.00 0.00 70.33 68.78 1lsj n THR 149 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1lsj n ARG 150 N -0.57 0.91 -0.50 -0.78 0.63 -1.26 -4.88 116.66 110.21 1lsj n ARG 150 Ca 0.22 -1.74 0.41 0.00 -0.92 0.00 0.00 57.85 55.83 1lsj n ARG 150 Cb 0.89 -1.01 0.73 0.00 0.45 0.00 0.00 32.46 33.52 1lsj n ARG 150 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1lsj h GLN 151 N 0.00 0.05 0.00 -0.14 7.50 -1.82 1.08 115.11 121.78 1lsj h GLN 151 Ca 0.00 -0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.11 1lsj h GLN 151 Cb 1.09 -0.01 -0.00 0.00 0.05 0.00 0.00 27.48 28.60 1lsj h GLN 151 CO 0.00 0.04 -0.16 0.38 -1.50 0.00 0.00 178.83 177.59 1lsj h ASP 152 N 0.06 0.00 -0.34 1.46 2.03 -1.90 -2.43 116.42 115.29 1lsj h ASP 152 Ca 0.78 0.00 -0.03 0.00 -0.73 0.00 0.00 57.03 57.05 1lsj h ASP 152 Cb 2.84 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 41.33 1lsj h ASP 152 CO -0.16 0.16 0.01 0.54 -1.03 0.00 0.00 179.24 178.76 1lsj n ARG 153 N -3.42 3.18 -5.04 4.15 1.74 0.37 -1.36 116.66 116.27 1lsj n ARG 153 Ca -0.01 -2.93 -0.32 0.00 -0.77 0.00 0.00 57.85 53.82 1lsj n ARG 153 Cb 0.34 -1.93 -0.15 0.00 -1.02 0.00 0.00 32.46 29.70 1lsj n ARG 153 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1lsj s PHE 154 N -2.87 2.59 0.19 -1.55 2.19 -0.91 -0.33 117.98 117.29 1lsj s PHE 154 Ca 0.45 -0.47 -0.24 0.00 0.33 0.00 0.00 56.93 57.01 1lsj s PHE 154 Cb 0.36 -1.64 0.05 0.00 -1.31 0.00 0.00 43.02 40.48 1lsj s PHE 154 CO 0.09 -0.05 0.89 0.00 1.83 0.00 0.00 175.22 177.99 1lsj s ALA 155 N -0.33 -1.52 0.10 11.12 0.00 -0.20 -4.43 121.76 126.49 1lsj s ALA 155 Ca 0.02 -0.02 -0.13 0.00 0.00 0.00 0.00 51.96 51.83 1lsj s ALA 155 Cb -0.13 0.70 -0.06 0.00 0.00 0.00 0.00 23.12 23.63 1lsj s ALA 155 CO 0.02 -1.04 0.48 0.20 0.00 0.00 0.00 175.76 175.42 1lsj s GLY 156 N -2.95 2.43 -0.34 0.00 0.00 -0.53 -2.39 107.32 103.53 1lsj s GLY 156 Ca 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 44.72 44.61 1lsj s GLY 156 CO 0.04 0.05 0.19 -2.27 0.00 0.00 0.00 173.10 171.11 1lsj s LEU 157 N -1.81 1.09 -0.29 0.66 2.96 -0.80 -0.43 118.68 120.06 1lsj s LEU 157 Ca 0.34 -1.98 -0.14 0.00 -0.22 0.00 0.00 54.13 52.13 1lsj s LEU 157 Cb -0.15 -0.47 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 1lsj s LEU 157 CO 0.18 -0.34 0.31 -2.28 -1.32 0.00 0.00 176.35 172.90 1lsj s HIS 158 N 1.28 3.23 0.44 5.38 2.46 -0.30 -3.70 115.29 124.08 1lsj s HIS 158 Ca 0.15 0.22 0.07 0.00 0.47 0.00 0.00 55.06 55.98 1lsj s HIS 158 Cb -0.21 -2.53 -0.02 0.00 -0.13 0.00 0.00 32.58 29.69 1lsj s HIS 158 CO -0.09 -0.25 0.34 -0.06 -2.47 0.00 0.00 174.74 172.21 1lsj s PHE 159 N 1.96 2.49 -0.01 3.88 0.40 -1.26 -1.06 117.98 124.38 1lsj s PHE 159 Ca 0.12 -0.58 0.06 0.00 -0.60 0.00 0.00 56.93 55.93 1lsj s PHE 159 Cb -0.16 -2.08 -0.02 0.00 0.51 0.00 0.00 43.02 41.27 1lsj s PHE 159 CO 0.11 -0.12 -0.19 -0.06 0.70 0.00 0.00 175.22 175.65 1lsj s PHE 160 N -2.55 1.68 0.17 0.36 0.40 -1.26 -5.01 117.98 111.76 1lsj s PHE 160 Ca 0.44 -0.32 -0.30 0.00 -0.60 0.00 0.00 56.93 56.15 1lsj s PHE 160 Cb -0.01 -1.07 -0.07 0.00 0.51 0.00 0.00 43.02 42.37 1lsj s PHE 160 CO 0.26 -0.01 1.01 1.21 0.70 0.00 0.00 175.22 178.38 1lsj s ASN 161 N -0.53 7.45 -0.40 1.36 2.47 -1.26 -0.90 114.94 123.11 1lsj s ASN 161 Ca 0.07 1.95 -0.24 0.00 0.42 0.00 0.00 52.86 55.06 1lsj s ASN 161 Cb -0.07 -2.60 0.02 0.00 -1.45 0.00 0.00 41.25 37.14 1lsj s ASN 161 CO -0.00 -0.07 0.85 -2.16 -3.72 0.00 0.00 177.10 172.00 1lsj s PRO 162 N -0.45 3.66 0.26 0.43 0.04 -1.26 -4.87 135.00 132.81 1lsj s PRO 162 Ca 0.46 0.27 -0.00 0.00 0.04 0.00 0.00 61.00 61.77 1lsj s PRO 162 Cb -0.26 -3.86 0.59 0.00 0.04 0.00 0.00 34.50 31.01 1lsj s PRO 162 CO 0.32 -1.01 1.33 0.28 0.04 0.00 0.00 177.00 177.97 1lsj n VAL 163 N 6.04 -0.36 0.32 -0.36 0.31 -0.08 0.11 118.33 124.31 1lsj n VAL 163 Ca 0.05 1.88 0.20 0.00 -0.01 0.00 0.00 64.34 66.46 1lsj n VAL 163 Cb 0.48 -2.72 1.08 0.00 -0.91 0.00 0.00 33.84 31.78 1lsj n VAL 163 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1lsj h PRO 164 N 0.00 0.00 0.00 5.55 0.11 -1.85 -3.23 132.00 132.58 1lsj h PRO 164 Ca 0.49 0.00 -0.40 0.00 0.11 0.00 0.00 66.00 66.20 1lsj h PRO 164 Cb 0.97 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.01 1lsj h PRO 164 CO -0.81 0.00 -2.40 0.28 -0.21 0.00 0.00 178.00 174.86 1lsj n VAL 165 N -3.31 1.39 -1.81 3.15 0.31 0.29 -4.93 118.33 113.42 1lsj n VAL 165 Ca -0.03 -0.44 -0.42 0.00 -0.01 0.00 0.00 64.34 63.45 1lsj n VAL 165 Cb 0.12 -1.61 -0.03 0.00 -0.91 0.00 0.00 33.84 31.41 1lsj n VAL 165 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1lsj s MET 166 N -2.47 4.04 0.47 5.55 -1.94 -0.78 -4.87 119.30 119.30 1lsj s MET 166 Ca -0.34 2.35 0.26 0.00 -1.71 0.00 0.00 55.69 56.25 1lsj s MET 166 Cb 0.11 -4.11 0.82 0.00 2.01 0.00 0.00 34.83 33.66 1lsj s MET 166 CO 0.50 -1.05 1.78 0.87 -0.01 0.00 0.00 175.02 177.11 1lsj h LYS 167 N 10.66 0.00 -7.01 2.03 1.79 -1.92 -3.46 116.57 118.66 1lsj h LYS 167 Ca -0.44 0.00 -0.45 0.00 -2.18 0.00 0.00 60.65 57.58 1lsj h LYS 167 Cb 1.21 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.84 1lsj h LYS 167 CO 0.95 0.10 0.32 -1.17 -1.08 0.00 0.00 179.45 178.57 1lsj s LEU 168 N -6.36 4.00 -0.19 2.94 2.96 -1.26 0.74 118.68 121.52 1lsj s LEU 168 Ca 0.03 1.67 -0.07 0.00 -0.22 0.00 0.00 54.13 55.54 1lsj s LEU 168 Cb 0.08 -4.43 0.08 0.00 0.50 0.00 0.00 46.19 42.42 1lsj s LEU 168 CO 0.62 -0.31 0.41 0.54 -1.32 0.00 0.00 176.35 176.29 1lsj s VAL 169 N -2.09 -0.49 -0.30 1.68 0.11 -0.95 -4.35 120.40 114.01 1lsj s VAL 169 Ca 0.60 0.16 -0.18 0.00 -2.93 0.00 0.00 61.98 59.63 1lsj s VAL 169 Cb -0.10 -0.64 -0.02 0.00 -1.53 0.00 0.00 36.38 34.09 1lsj s VAL 169 CO 0.15 0.07 0.50 -1.61 -3.33 0.00 0.00 175.10 170.87 1lsj s GLU 170 N 2.32 3.88 -0.41 1.54 2.02 -0.22 -1.88 118.70 125.95 1lsj s GLU 170 Ca -0.03 0.09 -0.20 0.00 0.02 0.00 0.00 54.97 54.85 1lsj s GLU 170 Cb -0.11 -3.72 0.02 0.00 0.10 0.00 0.00 34.13 30.42 1lsj s GLU 170 CO -0.12 -0.47 0.59 0.08 0.02 0.00 0.00 175.26 175.36 1lsj s VAL 171 N 2.33 4.91 -0.21 2.63 1.01 -0.13 -1.15 120.40 129.78 1lsj s VAL 171 Ca 0.20 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 62.16 1lsj s VAL 171 Cb -0.16 -4.12 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 1lsj s VAL 171 CO 0.11 -0.46 0.46 -0.63 0.00 0.00 0.00 175.10 174.58 1lsj s ILE 172 N 2.63 5.14 -0.30 2.22 -1.09 0.43 -3.05 121.20 127.18 1lsj s ILE 172 Ca 0.21 0.83 -0.08 0.00 -2.23 0.00 0.00 60.65 59.38 1lsj s ILE 172 Cb -0.15 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 1lsj s ILE 172 CO 0.17 0.19 0.10 -0.75 -1.23 0.00 0.00 174.94 173.42 1lsj s LYS 173 N 1.61 3.16 0.83 2.79 2.20 -0.96 -1.45 119.74 127.91 1lsj s LYS 173 Ca 0.21 -0.82 -0.12 0.00 -0.36 0.00 0.00 55.97 54.88 1lsj s LYS 173 Cb -0.15 -3.43 0.10 0.00 -1.51 0.00 0.00 37.83 32.84 1lsj s LYS 173 CO 0.09 -0.44 1.19 0.95 -0.36 0.00 0.00 175.35 176.79 1lsj s THR 174 N 1.53 2.01 0.21 3.43 -4.23 -1.26 -3.36 115.64 113.97 1lsj s THR 174 Ca 0.03 -0.01 0.34 0.00 -1.18 0.00 0.00 61.69 60.87 1lsj s THR 174 Cb -0.17 -3.00 0.35 0.00 1.34 0.00 0.00 72.50 71.02 1lsj s THR 174 CO 0.04 0.00 2.04 -0.65 -0.54 0.00 0.00 174.62 175.50 1lsj h PRO 175 N -1.13 0.00 0.00 3.99 0.11 -1.97 -2.70 132.00 130.30 1lsj h PRO 175 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1lsj h PRO 175 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1lsj h PRO 175 CO 0.62 0.00 -1.74 -1.33 -0.21 0.00 0.00 178.00 175.34 1lsj n MET 176 N -2.75 0.51 -1.67 1.05 2.81 -1.26 -4.97 117.12 110.85 1lsj n MET 176 Ca -0.02 -0.15 -0.47 0.00 -1.81 0.00 0.00 57.70 55.26 1lsj n MET 176 Cb 0.11 -1.51 -0.04 0.00 -0.71 0.00 0.00 33.22 31.07 1lsj n MET 176 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1lsj n THR 177 N -2.06 0.13 -1.35 2.03 -1.04 -1.02 -3.88 114.28 107.09 1lsj n THR 177 Ca -0.02 -0.02 -0.30 0.00 -2.04 0.00 0.00 64.05 61.67 1lsj n THR 177 Cb 0.50 -1.56 0.12 0.00 -1.82 0.00 0.00 70.33 67.57 1lsj n THR 177 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1lsj s SER 178 N 1.57 3.88 0.35 8.00 1.04 -0.46 -4.87 113.70 123.21 1lsj s SER 178 Ca 0.82 1.40 0.18 0.00 0.48 0.00 0.00 55.95 58.83 1lsj s SER 178 Cb -0.70 -2.10 0.55 0.00 0.10 0.00 0.00 66.02 63.87 1lsj s SER 178 CO 0.42 -2.37 1.67 -0.61 0.98 0.00 0.00 173.24 173.33 1lsj h GLN 179 N -1.36 0.00 -0.26 4.02 5.75 -1.92 -2.77 115.11 118.56 1lsj h GLN 179 Ca -0.48 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 57.89 1lsj h GLN 179 Cb 1.28 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.83 1lsj h GLN 179 CO 0.57 0.41 -0.32 -0.22 -2.65 0.00 0.00 178.83 176.62 1lsj h LYS 180 N 0.00 0.68 -0.40 1.69 3.64 -1.92 -2.12 116.57 118.14 1lsj h LYS 180 Ca -0.00 -0.38 -0.02 0.00 -1.27 0.00 0.00 60.65 58.98 1lsj h LYS 180 Cb 1.00 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 1lsj h LYS 180 CO 0.05 0.99 0.18 1.15 -2.27 0.00 0.00 179.45 179.56 1lsj h THR 181 N 0.41 1.18 0.12 1.00 2.02 -1.79 -2.31 112.91 113.55 1lsj h THR 181 Ca 0.03 -0.54 0.01 0.00 0.77 0.00 0.00 66.41 66.68 1lsj h THR 181 Cb 0.90 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1lsj h THR 181 CO 0.08 0.20 -0.17 0.15 0.37 0.00 0.00 175.52 176.15 1lsj h PHE 182 N 0.51 -0.44 -0.17 3.16 3.57 -1.44 -1.85 116.94 120.26 1lsj h PHE 182 Ca 0.14 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 1lsj h PHE 182 Cb 0.15 0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1lsj h PHE 182 CO -0.01 -0.25 0.06 0.93 -2.23 0.00 0.00 178.31 176.81 1lsj h GLU 183 N -0.34 0.24 0.14 1.11 5.08 -1.33 -0.78 114.58 118.69 1lsj h GLU 183 Ca 0.02 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1lsj h GLU 183 Cb 0.35 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1lsj h GLU 183 CO -0.08 0.21 -0.07 1.03 -1.00 0.00 0.00 179.01 179.11 1lsj h SER 184 N 0.24 -0.16 -0.31 1.42 0.87 -0.86 0.10 113.55 114.86 1lsj h SER 184 Ca 0.06 -0.18 -0.07 0.00 -1.23 0.00 0.00 61.79 60.37 1lsj h SER 184 Cb 0.07 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 1lsj h SER 184 CO -0.01 0.09 -0.05 -0.07 -0.53 0.00 0.00 176.83 176.26 1lsj h LEU 185 N -0.41 0.67 -0.39 2.23 3.38 -1.06 0.34 115.31 120.07 1lsj h LEU 185 Ca -0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1lsj h LEU 185 Cb 0.33 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1lsj h LEU 185 CO 0.03 0.77 0.21 0.58 0.09 0.00 0.00 178.44 180.12 1lsj h VAL 186 N 0.64 1.16 -0.50 1.22 2.07 -1.01 0.42 116.25 120.25 1lsj h VAL 186 Ca 0.12 -0.41 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 1lsj h VAL 186 Cb 0.48 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1lsj h VAL 186 CO 0.02 0.16 0.25 0.44 0.02 0.00 0.00 177.57 178.47 1lsj h ASP 187 N 0.49 0.64 -0.48 0.57 5.19 -0.27 -2.21 116.42 120.35 1lsj h ASP 187 Ca 0.14 -0.12 0.01 0.00 -0.62 0.00 0.00 57.03 56.44 1lsj h ASP 187 Cb 0.08 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 39.40 1lsj h ASP 187 CO -0.02 0.58 0.31 0.15 -3.12 0.00 0.00 179.24 177.13 1lsj h PHE 188 N 0.66 0.59 -0.71 4.55 3.57 0.22 -0.04 116.94 125.77 1lsj h PHE 188 Ca 0.17 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.78 1lsj h PHE 188 Cb 0.10 -0.20 -0.07 0.00 2.79 0.00 0.00 35.95 38.57 1lsj h PHE 188 CO -0.01 0.36 0.35 0.77 -2.23 0.00 0.00 178.31 177.55 1lsj h SER 189 N 0.63 0.46 0.48 0.41 0.02 0.16 0.11 113.55 115.81 1lsj h SER 189 Ca 0.18 0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 61.09 1lsj h SER 189 Cb -0.05 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1lsj h SER 189 CO -0.05 0.26 -0.48 0.11 -1.14 0.00 0.00 176.83 175.53 1lsj h LYS 190 N 0.60 0.00 0.00 3.45 1.57 -0.79 -0.86 116.57 120.54 1lsj h LYS 190 Ca 0.35 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.08 1lsj h LYS 190 Cb 0.38 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1lsj h LYS 190 CO -0.27 0.48 -0.22 0.00 -0.57 0.00 0.00 179.45 178.87 1lsj h ALA 191 N 1.52 1.13 -0.01 3.86 0.00 0.11 -0.65 119.26 125.22 1lsj h ALA 191 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1lsj h ALA 191 Cb 0.85 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1lsj h ALA 191 CO 0.06 0.28 -0.02 1.28 0.00 0.00 0.00 179.25 180.85 1lsj n LEU 192 N -3.55 0.97 -0.02 0.00 4.77 -0.28 -4.85 117.00 114.02 1lsj n LEU 192 Ca -0.01 -0.31 -0.00 0.00 -0.03 0.00 0.00 56.01 55.66 1lsj n LEU 192 Cb 0.37 -0.02 -0.00 0.00 -2.33 0.00 0.00 43.42 41.44 1lsj n LEU 192 CO 0.33 0.16 -0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1lsj n GLY 193 N 1.13 0.46 3.94 -0.72 0.00 -0.25 -4.98 105.19 104.77 1lsj n GLY 193 Ca 0.20 -0.55 -0.19 0.00 0.00 0.00 0.00 46.02 45.48 1lsj n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lsj s LYS 194 N -1.09 2.75 -0.31 1.61 1.02 -0.37 -4.98 119.74 118.38 1lsj s LYS 194 Ca 0.00 -1.32 -0.07 0.00 0.02 0.00 0.00 55.97 54.60 1lsj s LYS 194 Cb 0.00 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.72 1lsj s LYS 194 CO 0.00 -0.16 0.10 -1.58 -0.92 0.00 0.00 175.35 172.79 1lsj s HIS 195 N -2.36 3.17 0.28 3.18 5.65 0.23 -3.81 115.29 121.61 1lsj s HIS 195 Ca 0.50 -1.01 -0.12 0.00 0.25 0.00 0.00 55.06 54.68 1lsj s HIS 195 Cb -0.07 -2.27 -0.08 0.00 -1.18 0.00 0.00 32.58 28.98 1lsj s HIS 195 CO 0.30 -0.59 0.64 -1.25 -0.65 0.00 0.00 174.74 173.18 1lsj s PRO 196 N 1.50 3.87 0.17 2.88 0.04 -1.26 -2.24 135.00 139.96 1lsj s PRO 196 Ca 0.02 0.43 0.04 0.00 0.04 0.00 0.00 61.00 61.53 1lsj s PRO 196 Cb -0.18 -2.55 -0.05 0.00 0.04 0.00 0.00 34.50 31.77 1lsj s PRO 196 CO 0.03 0.23 -0.06 0.14 0.04 0.00 0.00 177.00 177.38 1lsj s VAL 197 N -1.92 1.01 0.00 -0.36 -7.23 -0.79 -4.96 120.40 106.15 1lsj s VAL 197 Ca 0.50 -2.03 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 1lsj s VAL 197 Cb -0.11 -2.01 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 1lsj s VAL 197 CO 0.21 -0.60 -0.06 -0.55 -0.31 0.00 0.00 175.10 173.78 1lsj s SER 198 N -3.20 4.65 -0.21 4.85 0.15 -1.26 -0.96 113.70 117.72 1lsj s SER 198 Ca 0.21 -0.14 -0.26 0.00 0.70 0.00 0.00 55.95 56.46 1lsj s SER 198 Cb 0.04 -1.09 0.07 0.00 -1.71 0.00 0.00 66.02 63.33 1lsj s SER 198 CO 0.03 0.28 0.70 0.00 1.20 0.00 0.00 173.24 175.45 1lsj s LYS 200 N -0.03 -0.74 -1.43 0.00 1.02 -1.26 -2.27 119.74 115.03 1lsj s LYS 200 Ca -0.03 0.15 -0.12 0.00 0.02 0.00 0.00 55.97 55.99 1lsj s LYS 200 Cb -0.04 -1.63 0.06 0.00 -0.52 0.00 0.00 37.83 35.70 1lsj s LYS 200 CO 0.03 -3.43 2.21 -3.47 -0.92 0.00 0.00 175.35 169.77 1lsj n ASP 201 N -4.60 4.68 -4.60 2.83 2.03 -1.21 -4.69 116.55 110.99 1lsj n ASP 201 Ca 0.10 -2.89 -0.31 0.00 0.52 0.00 0.00 54.79 52.21 1lsj n ASP 201 Cb 0.59 -1.60 -0.10 0.00 -0.72 0.00 0.00 41.12 39.29 1lsj n ASP 201 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1lsj s THR 202 N 2.32 3.59 0.07 5.18 -4.23 -1.26 -4.90 115.64 116.41 1lsj s THR 202 Ca 0.47 -0.97 -0.34 0.00 -1.18 0.00 0.00 61.69 59.67 1lsj s THR 202 Cb 0.13 -2.62 -0.13 0.00 1.34 0.00 0.00 72.50 71.23 1lsj s THR 202 CO -0.07 0.26 1.70 -0.81 -0.54 0.00 0.00 174.62 175.17 1lsj n PRO 203 N 1.15 2.21 0.00 3.99 -0.04 -1.26 -1.00 135.00 140.05 1lsj n PRO 203 Ca -0.14 0.80 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 1lsj n PRO 203 Cb 0.52 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.38 1lsj n PRO 203 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lsj n GLY 204 N 3.81 2.31 7.00 0.55 0.00 -1.26 -4.64 105.19 112.95 1lsj n GLY 204 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1lsj n GLY 204 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1lsj n PHE 205 N -2.00 0.00 0.00 1.61 3.72 -0.17 -1.91 117.46 118.71 1lsj n PHE 205 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1lsj n PHE 205 Cb 0.00 0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.55 1lsj n PHE 205 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1lsj n ILE 206 N 0.00 0.00 -0.01 4.37 2.08 -1.26 -4.22 119.36 120.32 1lsj n ILE 206 Ca 0.00 0.12 -0.01 0.00 0.56 0.00 0.00 62.75 63.43 1lsj n ILE 206 Cb 0.00 -0.67 -0.00 0.00 -0.75 0.00 0.00 39.64 38.22 1lsj n ILE 206 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 1lsj h VAL 207 N 0.00 0.00 -0.91 1.39 2.07 -1.99 -1.91 116.25 114.90 1lsj h VAL 207 Ca 0.00 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.66 1lsj h VAL 207 Cb 0.00 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.70 1lsj h VAL 207 CO 0.00 0.00 0.58 0.78 0.02 0.00 0.00 177.57 178.95 1lsj h ASN 208 N -0.01 0.69 0.04 0.57 2.35 -1.84 0.70 115.58 118.08 1lsj h ASN 208 Ca 0.00 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1lsj h ASN 208 Cb 0.02 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.30 1lsj h ASN 208 CO -0.03 0.35 -0.03 -0.09 -1.65 0.00 0.00 177.43 175.98 1lsj h ARG 209 N 0.73 0.00 0.00 0.81 9.65 -0.91 -1.28 114.38 123.38 1lsj h ARG 209 Ca 0.46 0.00 -0.05 0.00 -1.10 0.00 0.00 59.98 59.29 1lsj h ARG 209 Cb 0.70 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.27 1lsj h ARG 209 CO -0.22 0.03 -1.88 1.28 2.80 0.00 0.00 179.97 181.99 1lsj n LEU 210 N -4.26 0.00 -0.06 3.80 4.77 0.83 -4.46 117.00 117.62 1lsj n LEU 210 Ca -0.03 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 55.93 1lsj n LEU 210 Cb 0.11 0.07 -0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1lsj n LEU 210 CO 0.32 0.07 -0.18 0.25 -1.33 0.00 0.00 177.39 176.52 1lsj h LEU 211 N 0.00 0.00 -0.45 2.23 5.85 0.51 -3.37 115.31 120.09 1lsj h LEU 211 Ca -0.07 -0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.73 1lsj h LEU 211 Cb 1.02 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.95 1lsj h LEU 211 CO 0.00 0.64 -0.27 0.58 -0.34 0.00 0.00 178.44 179.05 1lsj h VAL 212 N -1.00 0.29 -0.64 1.05 2.07 -1.46 0.40 116.25 116.96 1lsj h VAL 212 Ca -0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1lsj h VAL 212 Cb 0.27 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 1lsj h VAL 212 CO -0.00 0.00 0.43 -0.65 0.02 0.00 0.00 177.57 177.37 1lsj h PRO 213 N -0.18 0.41 -0.10 1.57 0.11 -1.78 0.33 132.00 132.36 1lsj h PRO 213 Ca 0.20 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.26 1lsj h PRO 213 Cb 0.50 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 1lsj h PRO 213 CO -0.55 0.27 -0.06 -0.92 -0.21 0.00 0.00 178.00 176.54 1lsj h TYR 214 N 0.42 0.25 -0.60 0.65 3.20 -1.28 -2.00 116.97 117.61 1lsj h TYR 214 Ca 0.30 -0.06 0.09 0.00 3.14 0.00 0.00 58.73 62.20 1lsj h TYR 214 Cb 0.61 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.79 1lsj h TYR 214 CO -0.00 0.58 0.40 -0.07 -1.64 0.00 0.00 178.16 177.43 1lsj h LEU 215 N -0.16 0.38 -0.25 2.82 3.38 0.37 -1.13 115.31 120.72 1lsj h LEU 215 Ca 0.02 0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 1lsj h LEU 215 Cb 0.52 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1lsj h LEU 215 CO 0.02 0.23 -0.62 0.24 0.09 0.00 0.00 178.44 178.40 1lsj h MET 216 N 0.42 0.86 -0.58 1.13 2.86 -0.80 -2.85 114.93 115.98 1lsj h MET 216 Ca 0.27 -0.59 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 1lsj h MET 216 Cb 0.52 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.24 1lsj h MET 216 CO -0.08 1.22 0.38 0.93 1.06 0.00 0.00 176.91 180.42 1lsj h GLU 217 N 0.64 0.76 -0.51 1.72 4.39 -0.48 -0.63 114.58 120.47 1lsj h GLU 217 Ca -0.01 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.69 1lsj h GLU 217 Cb 1.24 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.68 1lsj h GLU 217 CO 0.14 0.51 0.26 0.00 -1.16 0.00 0.00 179.01 178.76 1lsj h ALA 218 N 1.21 0.65 -0.30 3.43 0.00 -1.30 0.84 119.26 123.77 1lsj h ALA 218 Ca 0.21 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1lsj h ALA 218 Cb -0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1lsj h ALA 218 CO -0.04 -0.08 0.12 0.82 0.00 0.00 0.00 179.25 180.07 1lsj h ILE 219 N 0.52 0.94 -0.68 0.00 2.04 -1.17 -2.19 117.51 116.97 1lsj h ILE 219 Ca 0.22 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 1lsj h ILE 219 Cb 0.12 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1lsj h ILE 219 CO -0.15 0.05 0.38 0.03 0.00 0.00 0.00 178.15 178.46 1lsj h ARG 220 N 0.26 0.93 -0.24 2.37 3.08 -0.17 0.47 114.38 121.08 1lsj h ARG 220 Ca 0.13 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 1lsj h ARG 220 Cb 0.09 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 1lsj h ARG 220 CO -0.12 0.67 -0.11 1.25 -1.07 0.00 0.00 179.97 180.59 1lsj h LEU 221 N 0.94 0.37 0.14 3.04 6.46 -0.38 -1.07 115.31 124.80 1lsj h LEU 221 Ca 0.24 -0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.91 1lsj h LEU 221 Cb 0.01 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 39.84 1lsj h LEU 221 CO -0.04 0.52 -0.07 0.22 -0.62 0.00 0.00 178.44 178.45 1lsj h TYR 222 N 0.36 -0.17 -0.76 1.25 3.20 -0.70 -2.12 116.97 118.03 1lsj h TYR 222 Ca 0.07 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.09 1lsj h TYR 222 Cb 0.43 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.70 1lsj h TYR 222 CO 0.01 0.30 0.51 0.93 -1.64 0.00 0.00 178.16 178.27 1lsj h GLU 223 N -0.79 0.40 0.00 1.82 5.08 -0.78 1.21 114.58 121.51 1lsj h GLU 223 Ca -0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1lsj h GLU 223 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1lsj h GLU 223 CO 0.03 0.26 0.00 -0.09 -1.00 0.00 0.00 179.01 178.22 1lsj h ARG 224 N 0.41 0.00 -0.14 2.33 2.43 -1.20 -3.46 114.38 114.76 1lsj h ARG 224 Ca 0.38 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.49 1lsj h ARG 224 Cb 0.87 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.40 1lsj h ARG 224 CO -0.12 0.00 -0.05 0.41 -1.51 0.00 0.00 179.97 178.69 1lsj n GLY 225 N -0.09 0.61 0.22 2.80 0.00 0.41 -4.92 105.19 104.23 1lsj n GLY 225 Ca 0.02 -0.82 0.11 0.00 0.00 0.00 0.00 46.02 45.33 1lsj n GLY 225 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1lsj h ASP 226 N 0.00 0.00 -4.85 1.61 3.32 -1.54 -3.47 116.42 111.49 1lsj h ASP 226 Ca -0.06 0.00 0.15 0.00 0.02 0.00 0.00 57.03 57.14 1lsj h ASP 226 Cb 0.21 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 39.63 1lsj h ASP 226 CO 0.09 0.20 0.54 0.00 -1.72 0.00 0.00 179.24 178.35 1lsj s ALA 227 N -3.56 -1.83 0.47 3.45 0.00 -1.25 -5.06 121.76 113.98 1lsj s ALA 227 Ca 0.01 0.82 -0.06 0.00 0.00 0.00 0.00 51.96 52.73 1lsj s ALA 227 Cb 0.09 0.42 -0.04 0.00 0.00 0.00 0.00 23.12 23.59 1lsj s ALA 227 CO 0.63 -0.79 0.79 -1.54 0.00 0.00 0.00 175.76 174.85 1lsj s SER 228 N -2.60 6.30 0.09 0.00 1.04 -1.26 -4.43 113.70 112.84 1lsj s SER 228 Ca 0.08 0.98 -0.23 0.00 0.48 0.00 0.00 55.95 57.26 1lsj s SER 228 Cb -0.01 -2.27 -0.14 0.00 0.10 0.00 0.00 66.02 63.70 1lsj s SER 228 CO -0.05 -0.56 1.73 0.11 0.98 0.00 0.00 173.24 175.45 1lsj h LYS 229 N 0.38 -0.03 -0.96 4.02 1.57 -1.98 0.81 116.57 120.37 1lsj h LYS 229 Ca -0.47 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.44 1lsj h LYS 229 Cb 1.20 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 33.43 1lsj h LYS 229 CO 0.62 -0.02 0.59 0.93 -0.57 0.00 0.00 179.45 181.00 1lsj h GLU 230 N -0.03 0.89 -0.02 3.15 3.07 -1.99 -0.37 114.58 119.27 1lsj h GLU 230 Ca 0.00 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 1lsj h GLU 230 Cb 0.04 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 27.75 1lsj h GLU 230 CO -0.01 0.59 -0.02 -0.44 -1.40 0.00 0.00 179.01 177.73 1lsj h ASP 231 N 0.92 0.06 -0.78 1.42 5.19 -1.83 -1.90 116.42 119.50 1lsj h ASP 231 Ca 0.49 -0.44 0.10 0.00 -0.62 0.00 0.00 57.03 56.56 1lsj h ASP 231 Cb 0.52 -0.02 -0.07 0.00 0.18 0.00 0.00 39.33 39.94 1lsj h ASP 231 CO -0.28 0.48 0.42 0.40 -3.12 0.00 0.00 179.24 177.14 1lsj h ILE 232 N -0.37 0.87 -0.86 0.35 1.08 -0.37 0.49 117.51 118.70 1lsj h ILE 232 Ca 0.01 -0.24 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 1lsj h ILE 232 Cb 0.46 0.11 -0.04 0.00 -3.07 0.00 0.00 36.82 34.28 1lsj h ILE 232 CO 0.00 0.13 0.48 0.44 -0.69 0.00 0.00 178.15 178.51 1lsj h ASP 233 N 0.70 1.08 -0.21 1.72 3.32 -1.03 -1.13 116.42 120.86 1lsj h ASP 233 Ca 0.38 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 57.20 1lsj h ASP 233 Cb 0.39 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1lsj h ASP 233 CO -0.27 0.86 -0.39 0.74 -1.72 0.00 0.00 179.24 178.46 1lsj h THR 234 N 1.20 1.32 -0.22 0.35 2.02 -0.32 -2.17 112.91 115.10 1lsj h THR 234 Ca 0.30 -1.61 0.04 0.00 0.77 0.00 0.00 66.41 65.91 1lsj h THR 234 Cb 0.02 1.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.21 1lsj h THR 234 CO -0.05 0.50 -0.01 0.00 0.37 0.00 0.00 175.52 176.33 1lsj h ALA 235 N 0.62 0.18 -0.01 6.16 0.00 0.24 -0.01 119.26 126.45 1lsj h ALA 235 Ca 0.01 0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1lsj h ALA 235 Cb 0.99 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1lsj h ALA 235 CO 0.09 -0.43 -0.67 0.52 0.00 0.00 0.00 179.25 178.75 1lsj h MET 236 N 0.06 0.03 -0.13 0.00 2.86 -1.24 0.26 114.93 116.78 1lsj h MET 236 Ca 0.10 -0.03 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 1lsj h MET 236 Cb 0.13 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1lsj h MET 236 CO -0.18 0.70 -0.33 0.87 1.06 0.00 0.00 176.91 179.03 1lsj h LYS 237 N 0.02 0.45 0.16 1.72 1.57 -1.10 -2.21 116.57 117.18 1lsj h LYS 237 Ca -0.01 -0.31 -0.36 0.00 -1.87 0.00 0.00 60.65 58.10 1lsj h LYS 237 Cb 1.20 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 1lsj h LYS 237 CO 0.09 0.92 -1.87 -0.07 -0.57 0.00 0.00 179.45 177.95 1lsj h LEU 238 N 0.04 0.52 0.00 2.94 3.38 -1.04 -1.21 115.31 119.94 1lsj h LEU 238 Ca -0.00 -0.95 0.00 0.00 0.09 0.00 0.00 57.88 57.01 1lsj h LEU 238 Cb 0.94 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1lsj h LEU 238 CO 0.07 1.83 -0.23 1.23 0.09 0.00 0.00 178.44 181.43 1lsj h GLY 239 N 0.87 0.00 0.00 0.83 0.00 -0.63 -3.36 103.07 100.78 1lsj h GLY 239 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.95 1lsj h GLY 239 CO 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 176.60 1lsj n ALA 240 N -1.84 1.33 -1.17 3.60 0.00 -0.87 -5.00 120.51 116.56 1lsj n ALA 240 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.43 1lsj n ALA 240 Cb 0.45 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 1lsj n ALA 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lsj n GLY 241 N 0.77 0.83 3.78 0.00 0.00 -0.46 -4.97 105.19 105.14 1lsj n GLY 241 Ca 0.00 -0.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.86 1lsj n GLY 241 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lsj s TYR 242 N -2.22 2.98 0.13 1.61 1.51 -1.03 -4.96 117.35 115.37 1lsj s TYR 242 Ca 0.00 1.57 -0.16 0.00 -1.01 0.00 0.00 57.07 57.47 1lsj s TYR 242 Cb 0.00 -3.29 -0.01 0.00 -0.11 0.00 0.00 41.96 38.55 1lsj s TYR 242 CO 0.00 -1.24 1.65 -1.35 -1.11 0.00 0.00 175.55 173.50 1lsj h PRO 243 N 2.10 0.61 -6.04 -1.71 0.11 -1.91 -3.40 132.00 121.76 1lsj h PRO 243 Ca -0.49 -0.13 -0.59 0.00 0.11 0.00 0.00 66.00 64.90 1lsj h PRO 243 Cb 1.24 -0.09 -0.27 0.00 0.11 0.00 0.00 31.00 31.99 1lsj h PRO 243 CO 0.60 0.62 -0.85 -1.64 -0.21 0.00 0.00 178.00 176.53 1lsj s MET 244 N -5.39 1.50 0.89 1.05 -1.94 -1.26 -5.02 119.30 109.13 1lsj s MET 244 Ca -0.13 -0.85 -0.11 0.00 -1.71 0.00 0.00 55.69 52.89 1lsj s MET 244 Cb 0.10 -1.54 0.13 0.00 2.01 0.00 0.00 34.83 35.53 1lsj s MET 244 CO 0.76 0.41 1.11 0.20 -0.01 0.00 0.00 175.02 177.49 1lsj s GLY 245 N -0.88 1.66 0.35 -0.03 0.00 -1.26 -4.74 107.32 102.42 1lsj s GLY 245 Ca 0.08 0.32 0.04 0.00 0.00 0.00 0.00 44.72 45.16 1lsj s GLY 245 CO 0.01 0.76 1.95 -0.56 0.00 0.00 0.00 173.10 175.25 1lsj h PRO 246 N -1.67 0.80 0.00 2.90 0.13 -1.85 -1.22 132.00 131.09 1lsj h PRO 246 Ca -0.46 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 1lsj h PRO 246 Cb 1.27 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 1lsj h PRO 246 CO 0.47 0.53 -0.26 0.74 -0.23 0.00 0.00 178.00 179.26 1lsj h PHE 247 N 0.83 0.00 0.03 1.56 -1.00 -1.90 -0.32 116.94 116.14 1lsj h PHE 247 Ca 0.33 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.89 1lsj h PHE 247 Cb 0.22 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.76 1lsj h PHE 247 CO -0.00 0.26 -1.02 0.93 -1.61 0.00 0.00 178.31 176.86 1lsj h GLU 248 N 0.00 0.09 -0.15 1.51 5.08 -1.77 -2.86 114.58 116.47 1lsj h GLU 248 Ca -0.00 -0.13 -0.21 0.00 -1.00 0.00 0.00 59.36 58.02 1lsj h GLU 248 Cb 1.12 0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.42 1lsj h GLU 248 CO 0.03 1.03 -0.71 1.25 -1.00 0.00 0.00 179.01 179.62 1lsj h LEU 249 N 0.03 0.89 -0.16 1.33 5.85 -1.02 -0.87 115.31 121.36 1lsj h LEU 249 Ca -0.04 -0.62 0.01 0.00 0.84 0.00 0.00 57.88 58.06 1lsj h LEU 249 Cb 1.75 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.51 1lsj h LEU 249 CO 0.15 1.37 0.08 -0.07 -0.34 0.00 0.00 178.44 179.62 1lsj h LEU 250 N 0.46 0.13 -1.44 2.25 3.38 -1.11 0.12 115.31 119.10 1lsj h LEU 250 Ca -0.04 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1lsj h LEU 250 Cb 1.34 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 1lsj h LEU 250 CO 0.15 0.10 -0.10 0.44 0.09 0.00 0.00 178.44 179.12 1lsj h ASP 251 N 0.17 0.23 0.22 -0.43 5.19 -1.48 -0.33 116.42 120.00 1lsj h ASP 251 Ca 0.06 -0.04 -0.21 0.00 -0.62 0.00 0.00 57.03 56.22 1lsj h ASP 251 Cb 0.01 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1lsj h ASP 251 CO -0.04 0.36 -0.82 0.22 -3.12 0.00 0.00 179.24 175.85 1lsj h TYR 252 N 0.24 0.66 0.00 4.55 3.20 -0.35 -0.66 116.97 124.62 1lsj h TYR 252 Ca 0.05 -0.32 0.00 0.00 3.14 0.00 0.00 58.73 61.60 1lsj h TYR 252 Cb 0.33 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.51 1lsj h TYR 252 CO 0.01 1.11 -0.67 1.33 -1.64 0.00 0.00 178.16 178.29 1lsj n VAL 253 N -3.82 0.06 0.00 1.81 0.24 0.33 -4.87 118.33 112.08 1lsj n VAL 253 Ca -0.06 -0.07 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 1lsj n VAL 253 Cb 0.76 0.32 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 1lsj n VAL 253 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1lsj n GLY 254 N 1.46 1.90 0.13 7.63 0.00 -0.15 -4.66 105.19 111.51 1lsj n GLY 254 Ca 0.04 -1.30 -0.08 0.00 0.00 0.00 0.00 46.02 44.69 1lsj n GLY 254 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1lsj h LEU 255 N 0.00 0.25 -0.12 0.99 3.38 -1.43 -2.29 115.31 116.08 1lsj h LEU 255 Ca 0.00 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 1lsj h LEU 255 Cb 0.00 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1lsj h LEU 255 CO 0.00 0.96 -0.08 -2.24 0.09 0.00 0.00 178.44 177.17 1lsj h ASP 256 N 0.12 0.28 -0.30 -0.43 2.03 -1.89 -1.06 116.42 115.17 1lsj h ASP 256 Ca -0.03 -0.44 0.06 0.00 -0.73 0.00 0.00 57.03 55.89 1lsj h ASP 256 Cb 1.42 -0.08 -0.06 0.00 -0.83 0.00 0.00 39.33 39.78 1lsj h ASP 256 CO 0.12 0.66 -0.11 0.74 -1.03 0.00 0.00 179.24 179.63 1lsj h THR 257 N -0.09 0.63 0.47 1.15 2.02 -1.82 -1.02 112.91 114.25 1lsj h THR 257 Ca 0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1lsj h THR 257 Cb 0.56 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1lsj h THR 257 CO 0.02 0.00 -0.27 0.74 0.37 0.00 0.00 175.52 176.38 1lsj h THR 258 N -0.05 0.44 -0.94 3.16 2.02 -1.35 -2.40 112.91 113.79 1lsj h THR 258 Ca 0.15 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.51 1lsj h THR 258 Cb 0.28 0.44 -0.08 0.00 -1.74 0.00 0.00 68.15 67.05 1lsj h THR 258 CO -0.34 0.00 0.60 0.50 0.37 0.00 0.00 175.52 176.65 1lsj h LYS 259 N -0.70 0.64 0.94 6.66 3.64 -0.98 -1.52 116.57 125.25 1lsj h LYS 259 Ca -0.06 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.24 1lsj h LYS 259 Cb 0.56 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1lsj h LYS 259 CO 0.07 0.42 -0.45 0.35 -2.27 0.00 0.00 179.45 177.57 1lsj h PHE 260 N 0.66 -1.17 -1.00 1.91 3.57 -0.72 0.25 116.94 120.44 1lsj h PHE 260 Ca 0.50 -0.03 0.12 0.00 3.53 0.00 0.00 57.97 62.10 1lsj h PHE 260 Cb 0.89 0.39 -0.08 0.00 2.79 0.00 0.00 35.95 39.94 1lsj h PHE 260 CO -0.00 -0.73 0.63 0.82 -2.23 0.00 0.00 178.31 176.79 1lsj h ILE 261 N -1.27 0.91 -0.15 1.41 5.03 -0.99 -2.00 117.51 120.45 1lsj h ILE 261 Ca -0.13 -0.33 -0.22 0.00 -0.12 0.00 0.00 64.86 64.06 1lsj h ILE 261 Cb 0.97 -0.14 0.01 0.00 -3.03 0.00 0.00 36.82 34.63 1lsj h ILE 261 CO 0.21 0.18 -0.77 0.58 -0.68 0.00 0.00 178.15 177.67 1lsj h VAL 262 N 0.96 1.29 -0.78 1.67 2.07 -0.98 -2.03 116.25 118.45 1lsj h VAL 262 Ca 0.50 -1.99 0.02 0.00 0.82 0.00 0.00 66.70 66.05 1lsj h VAL 262 Cb 0.52 1.99 -0.04 0.00 -1.52 0.00 0.00 31.29 32.24 1lsj h VAL 262 CO -0.27 0.63 0.52 0.44 0.02 0.00 0.00 177.57 178.91 1lsj h ASP 263 N 0.51 0.86 0.63 0.57 3.32 -0.10 0.77 116.42 122.98 1lsj h ASP 263 Ca -0.05 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1lsj h ASP 263 Cb 1.39 -0.21 0.01 0.00 0.22 0.00 0.00 39.33 40.74 1lsj h ASP 263 CO 0.16 0.61 -0.30 1.23 -1.72 0.00 0.00 179.24 179.21 1lsj h GLY 264 N 1.01 -0.88 0.73 2.75 0.00 -1.17 0.13 103.07 105.63 1lsj h GLY 264 Ca 0.30 0.33 0.06 0.00 0.00 0.00 0.00 47.33 48.02 1lsj h GLY 264 CO -0.08 -0.32 0.52 1.49 0.00 0.00 0.00 176.54 178.15 1lsj h TRP 265 N -0.88 0.96 -0.80 5.60 6.55 -1.00 -0.93 115.95 125.44 1lsj h TRP 265 Ca -0.09 0.03 -0.02 0.00 0.95 0.00 0.00 58.89 59.77 1lsj h TRP 265 Cb 0.66 -0.31 -0.04 0.00 -0.86 0.00 0.00 29.16 28.62 1lsj h TRP 265 CO -0.02 0.49 0.44 1.25 -1.05 0.00 0.00 178.44 179.54 1lsj h HIS 266 N 0.95 1.10 -0.34 0.49 2.76 -0.68 -2.57 115.15 116.85 1lsj h HIS 266 Ca 0.36 -0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.54 1lsj h HIS 266 Cb 0.16 -0.35 -0.03 0.00 1.55 0.00 0.00 27.41 28.74 1lsj h HIS 266 CO -0.04 0.77 0.15 1.49 -1.30 0.00 0.00 177.93 179.00 1lsj h GLU 267 N 1.11 0.30 -0.03 5.26 4.81 0.63 0.51 114.58 127.18 1lsj h GLU 267 Ca 0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1lsj h GLU 267 Cb 0.03 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1lsj h GLU 267 CO -0.05 0.20 0.00 0.00 -0.73 0.00 0.00 179.01 178.44 1lsj n MET 268 N -4.98 1.14 -2.70 1.92 0.00 -0.87 -4.04 117.12 107.59 1lsj n MET 268 Ca 0.01 -0.21 -0.07 0.00 0.00 0.00 0.00 57.70 57.43 1lsj n MET 268 Cb 0.10 -1.32 0.11 0.00 0.00 0.00 0.00 33.22 32.11 1lsj n MET 268 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1lsj n ASP 269 N -0.59 -1.84 -0.50 3.17 -0.08 -0.78 -5.01 116.55 110.92 1lsj n ASP 269 Ca 0.15 -2.39 0.39 0.00 -1.51 0.00 0.00 54.79 51.43 1lsj n ASP 269 Cb 0.12 1.02 0.62 0.00 2.34 0.00 0.00 41.12 45.22 1lsj n ASP 269 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1lsj n ALA 270 N -0.59 1.37 0.34 -1.67 0.00 0.17 -0.15 120.51 119.99 1lsj n ALA 270 Ca -0.05 0.60 0.12 0.00 0.00 0.00 0.00 53.44 54.11 1lsj n ALA 270 Cb 0.83 -0.90 0.18 0.00 0.00 0.00 0.00 19.45 19.56 1lsj n ALA 270 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1lsj h GLU 271 N 0.00 0.00 -6.52 0.00 3.07 -1.95 -3.46 114.58 105.72 1lsj h GLU 271 Ca 0.75 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 59.08 1lsj h GLU 271 Cb 2.77 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 30.71 1lsj h GLU 271 CO -0.16 0.00 0.93 1.21 -1.40 0.00 0.00 179.01 179.59 1lsj s ASN 272 N -5.36 6.61 0.33 1.42 3.84 0.79 -4.89 114.94 117.68 1lsj s ASN 272 Ca 0.06 2.52 0.10 0.00 0.21 0.00 0.00 52.86 55.75 1lsj s ASN 272 Cb 0.09 -2.58 0.58 0.00 -0.55 0.00 0.00 41.25 38.79 1lsj s ASN 272 CO 0.69 -0.84 1.76 1.55 -2.79 0.00 0.00 177.10 177.47 1lsj h PRO 273 N 7.61 0.11 0.00 0.43 0.13 -1.89 -3.00 132.00 135.39 1lsj h PRO 273 Ca -0.42 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1lsj h PRO 273 Cb 1.20 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1lsj h PRO 273 CO 0.92 0.49 0.08 1.28 -0.23 0.00 0.00 178.00 180.54 1lsj n LEU 274 N -4.05 0.40 -0.03 1.56 4.77 -1.26 -2.29 117.00 116.10 1lsj n LEU 274 Ca -0.02 0.65 0.02 0.00 -0.03 0.00 0.00 56.01 56.64 1lsj n LEU 274 Cb 0.45 -0.68 0.03 0.00 -2.33 0.00 0.00 43.42 40.88 1lsj n LEU 274 CO 0.40 -0.79 0.48 1.41 -1.33 0.00 0.00 177.39 177.56 1lsj n HIS 275 N -2.05 0.00 -1.77 -1.77 8.25 -1.13 -4.85 115.22 111.90 1lsj n HIS 275 Ca -0.01 -0.54 -0.41 0.00 -0.26 0.00 0.00 57.72 56.51 1lsj n HIS 275 Cb 0.10 -0.06 0.01 0.00 1.12 0.00 0.00 29.99 31.15 1lsj n HIS 275 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1lsj n GLN 276 N -0.62 2.50 -1.84 -0.41 1.13 -0.97 -4.54 117.38 112.63 1lsj n GLN 276 Ca 0.03 0.88 -0.33 0.00 -1.94 0.00 0.00 57.00 55.64 1lsj n GLN 276 Cb 0.36 -2.64 0.03 0.00 0.11 0.00 0.00 30.24 28.10 1lsj n GLN 276 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1lsj s PRO 277 N -2.22 2.98 -0.23 -1.09 0.04 -1.26 -5.04 135.00 128.18 1lsj s PRO 277 Ca 0.56 1.29 -0.09 0.00 0.04 0.00 0.00 61.00 62.81 1lsj s PRO 277 Cb -0.47 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1lsj s PRO 277 CO 0.61 -1.09 0.10 0.45 0.04 0.00 0.00 177.00 177.12 1lsj s SER 278 N -2.74 5.64 0.25 6.66 0.15 -1.26 -5.00 113.70 117.40 1lsj s SER 278 Ca 0.65 -0.01 -0.04 0.00 0.70 0.00 0.00 55.95 57.24 1lsj s SER 278 Cb -0.18 -2.00 0.35 0.00 -1.71 0.00 0.00 66.02 62.47 1lsj s SER 278 CO 0.41 0.06 1.87 -0.65 1.20 0.00 0.00 173.24 176.13 1lsj h PRO 279 N 7.57 1.07 -0.23 5.44 0.11 -1.99 -0.72 132.00 143.25 1lsj h PRO 279 Ca -0.37 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 1lsj h PRO 279 Cb 1.17 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 1lsj h PRO 279 CO 0.63 0.71 -0.03 0.77 -0.21 0.00 0.00 178.00 179.87 1lsj h SER 280 N 1.10 0.43 -0.51 -2.05 0.02 -1.98 -0.29 113.55 110.28 1lsj h SER 280 Ca 0.40 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.97 1lsj h SER 280 Cb 0.13 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 1lsj h SER 280 CO -0.16 0.67 0.18 0.25 -1.14 0.00 0.00 176.83 176.63 1lsj h LEU 281 N 0.19 0.76 0.21 5.07 5.85 -1.91 -1.38 115.31 124.09 1lsj h LEU 281 Ca 0.06 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1lsj h LEU 281 Cb 0.46 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1lsj h LEU 281 CO 0.02 0.72 -0.10 0.78 -0.34 0.00 0.00 178.44 179.51 1lsj h ASN 282 N 0.81 -0.24 -0.10 1.25 2.35 -0.99 -1.98 115.58 116.68 1lsj h ASN 282 Ca 0.19 -0.23 0.04 0.00 -0.55 0.00 0.00 56.30 55.74 1lsj h ASN 282 Cb 0.22 0.06 -0.06 0.00 0.05 0.00 0.00 38.32 38.59 1lsj h ASN 282 CO -0.01 0.13 -0.33 0.50 -1.65 0.00 0.00 177.43 176.07 1lsj h LYS 283 N -0.63 -0.41 -0.61 0.81 3.64 -0.91 0.57 116.57 119.02 1lsj h LYS 283 Ca -0.03 0.03 0.10 0.00 -1.27 0.00 0.00 60.65 59.48 1lsj h LYS 283 Cb 0.46 0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 32.29 1lsj h LYS 283 CO 0.05 -0.27 0.21 -0.07 -2.27 0.00 0.00 179.45 177.09 1lsj h LEU 284 N -0.43 0.18 -0.78 5.20 3.38 -1.30 0.24 115.31 121.79 1lsj h LEU 284 Ca 0.09 0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 1lsj h LEU 284 Cb 0.56 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1lsj h LEU 284 CO -0.34 0.10 -0.04 0.58 0.09 0.00 0.00 178.44 178.84 1lsj h VAL 285 N 0.37 1.26 0.00 1.22 2.07 -0.44 -0.67 116.25 120.06 1lsj h VAL 285 Ca 0.31 -1.11 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 1lsj h VAL 285 Cb 0.41 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1lsj h VAL 285 CO -0.33 0.39 -0.20 0.00 0.02 0.00 0.00 177.57 177.45 1lsj h ALA 286 N 1.14 1.20 -0.18 1.67 0.00 0.11 -2.05 119.26 121.15 1lsj h ALA 286 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1lsj h ALA 286 Cb 0.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1lsj h ALA 286 CO 0.03 0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.92 1lsj n GLU 287 N -3.62 1.74 -1.08 0.00 1.02 -0.02 -4.92 120.64 113.76 1lsj n GLU 287 Ca -0.01 -1.12 -0.03 0.00 -0.02 0.00 0.00 57.16 55.98 1lsj n GLU 287 Cb 0.34 -1.39 -0.01 0.00 -0.02 0.00 0.00 31.44 30.36 1lsj n GLU 287 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1lsj n ASN 288 N 0.35 -4.04 -4.44 1.62 2.85 -0.77 -4.94 115.26 105.89 1lsj n ASN 288 Ca 0.16 0.07 -0.44 0.00 -0.11 0.00 0.00 54.58 54.25 1lsj n ASN 288 Cb 0.33 -1.78 -0.02 0.00 1.24 0.00 0.00 39.78 39.55 1lsj n ASN 288 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1lsj s LYS 289 N -1.42 3.76 0.00 1.20 1.02 -0.36 -4.83 119.74 119.11 1lsj s LYS 289 Ca 0.00 -2.10 0.19 0.00 0.02 0.00 0.00 55.97 54.07 1lsj s LYS 289 Cb 0.00 -4.90 0.57 0.00 -0.52 0.00 0.00 37.83 32.98 1lsj s LYS 289 CO 0.00 -1.71 1.45 1.19 -0.92 0.00 0.00 175.35 175.36 1lsj n PHE 290 N 5.92 0.38 0.00 3.18 3.72 -0.85 -4.31 117.46 125.49 1lsj n PHE 290 Ca 0.26 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 1lsj n PHE 290 Cb 0.47 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 1lsj n PHE 290 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1lsj n GLY 291 N 1.21 -0.95 0.40 1.37 0.00 0.22 -1.87 105.19 105.57 1lsj n GLY 291 Ca 0.16 -1.93 0.28 0.00 0.00 0.00 0.00 46.02 44.53 1lsj n GLY 291 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1lsj h LYS 292 N 0.00 0.25 -0.42 1.61 1.57 -1.38 0.02 116.57 118.22 1lsj h LYS 292 Ca 0.00 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1lsj h LYS 292 Cb 0.00 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.19 1lsj h LYS 292 CO 0.00 0.16 0.03 0.87 -0.57 0.00 0.00 179.45 179.94 1lsj h LYS 293 N 0.26 0.14 -0.54 3.15 1.57 -1.79 -2.28 116.57 117.07 1lsj h LYS 293 Ca 0.73 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.50 1lsj h LYS 293 Cb 1.95 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.23 1lsj h LYS 293 CO -0.46 0.09 0.00 0.25 -0.57 0.00 0.00 179.45 178.76 1lsj n THR 294 N -5.17 2.64 -0.84 -0.16 -2.24 -0.10 -4.92 114.28 103.48 1lsj n THR 294 Ca 0.03 -1.45 0.00 0.00 -2.27 0.00 0.00 64.05 60.36 1lsj n THR 294 Cb 0.21 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.21 1lsj n THR 294 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lsj n GLY 295 N 0.53 0.56 3.64 3.38 0.00 -0.69 -4.87 105.19 107.74 1lsj n GLY 295 Ca 0.27 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.22 1lsj n GLY 295 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1lsj s GLU 296 N -0.45 0.46 0.00 1.61 2.12 -0.61 -1.02 118.70 120.82 1lsj s GLU 296 Ca 0.00 0.63 0.00 0.00 0.36 0.00 0.00 54.97 55.96 1lsj s GLU 296 Cb 0.00 0.19 0.00 0.00 0.26 0.00 0.00 34.13 34.58 1lsj s GLU 296 CO 0.00 -0.07 0.00 0.41 -0.54 0.00 0.00 175.26 175.06 1lsj n GLY 297 N 2.73 2.69 0.16 -1.50 0.00 -1.26 0.71 105.19 108.72 1lsj n GLY 297 Ca -0.14 -0.34 0.07 0.00 0.00 0.00 0.00 46.02 45.60 1lsj n GLY 297 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1lsj h PHE 298 N 0.00 0.00 -2.62 1.61 -1.00 -1.87 -3.45 116.94 109.61 1lsj h PHE 298 Ca 0.00 0.00 -0.50 0.00 2.81 0.00 0.00 57.97 60.28 1lsj h PHE 298 Cb 0.00 0.00 -0.14 0.00 3.61 0.00 0.00 35.95 39.42 1lsj h PHE 298 CO 0.00 0.26 -0.69 0.71 -1.61 0.00 0.00 178.31 176.98 1lsj s TYR 299 N -3.10 1.95 0.21 -0.55 2.02 -1.26 -5.15 117.35 111.48 1lsj s TYR 299 Ca 0.04 -0.64 0.01 0.00 -0.37 0.00 0.00 57.07 56.10 1lsj s TYR 299 Cb 0.07 -1.06 -0.04 0.00 -0.40 0.00 0.00 41.96 40.53 1lsj s TYR 299 CO 0.73 0.34 0.39 0.15 -1.57 0.00 0.00 175.55 175.59 1lsj s LYS 300 N -3.69 3.50 0.22 -0.62 1.02 -1.26 -4.35 119.74 114.55 1lsj s LYS 300 Ca 0.28 -0.43 0.02 0.00 0.02 0.00 0.00 55.97 55.87 1lsj s LYS 300 Cb 0.02 -2.84 -0.05 0.00 -0.52 0.00 0.00 37.83 34.44 1lsj s LYS 300 CO 0.11 0.39 0.04 0.71 -0.92 0.00 0.00 175.35 175.69 1lsj s TYR 301 N -1.91 1.41 -2.00 3.18 1.51 -0.19 -4.94 117.35 114.41 1lsj s TYR 301 Ca 0.38 -1.07 0.17 0.00 -1.01 0.00 0.00 57.07 55.54 1lsj s TYR 301 Cb -0.11 -0.82 1.03 0.00 -0.11 0.00 0.00 41.96 41.95 1lsj s TYR 301 CO 0.30 -0.23 1.43 1.17 -1.11 0.00 0.00 175.55 177.11