#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eul s ALA 2 N 0.00 1.82 -0.00 3.04 0.00 -1.26 -5.10 121.76 120.26 2eul s ALA 2 Ca 0.00 -2.31 0.04 0.00 0.00 0.00 0.00 51.96 49.69 2eul s ALA 2 Cb 0.00 -1.79 -0.01 0.00 0.00 0.00 0.00 23.12 21.32 2eul s ALA 2 CO 0.00 -2.01 -0.13 1.03 0.00 0.00 0.00 175.76 174.65 2eul s ARG 3 N 0.69 0.99 0.15 0.00 0.52 -1.26 -5.14 118.95 114.90 2eul s ARG 3 Ca 0.16 -0.50 -0.18 0.00 -0.52 0.00 0.00 55.73 54.69 2eul s ARG 3 Cb -0.23 -0.96 -0.07 0.00 0.52 0.00 0.00 34.95 34.20 2eul s ARG 3 CO -0.03 0.26 0.62 -1.83 0.02 0.00 0.00 175.30 174.34 2eul s GLU 4 N -0.46 4.17 -0.21 3.54 -1.05 -1.26 -4.85 118.70 118.58 2eul s GLU 4 Ca 0.04 0.72 0.01 0.00 -0.15 0.00 0.00 54.97 55.60 2eul s GLU 4 Cb -0.05 -3.04 0.03 0.00 -0.44 0.00 0.00 34.13 30.63 2eul s GLU 4 CO -0.00 0.51 -0.17 0.08 0.95 0.00 0.00 175.26 176.63 2eul s VAL 5 N -1.35 2.15 0.18 1.83 1.01 -0.76 -5.00 120.40 118.46 2eul s VAL 5 Ca 0.36 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 2eul s VAL 5 Cb -0.17 -2.02 -0.07 0.00 0.00 0.00 0.00 36.38 34.11 2eul s VAL 5 CO 0.20 0.36 0.97 -0.54 0.00 0.00 0.00 175.10 176.10 2eul s LYS 6 N 1.24 4.76 0.03 2.72 1.02 -1.26 -0.77 119.74 127.48 2eul s LYS 6 Ca 0.01 1.51 -0.09 0.00 0.02 0.00 0.00 55.97 57.42 2eul s LYS 6 Cb -0.15 -3.32 0.00 0.00 -0.52 0.00 0.00 37.83 33.84 2eul s LYS 6 CO -0.10 0.33 0.18 -0.51 -0.92 0.00 0.00 175.35 174.33 2eul s LEU 7 N -0.60 1.42 0.41 3.17 1.43 -1.10 -4.37 118.68 119.03 2eul s LEU 7 Ca 0.44 -0.32 -0.02 0.00 -1.03 0.00 0.00 54.13 53.21 2eul s LEU 7 Cb -0.25 0.88 -0.03 0.00 0.03 0.00 0.00 46.19 46.81 2eul s LEU 7 CO 0.32 -0.50 0.65 0.42 0.23 0.00 0.00 176.35 177.47 2eul s THR 8 N -2.22 4.95 0.26 5.49 -4.23 -0.82 -1.43 115.64 117.63 2eul s THR 8 Ca -0.08 -0.20 -0.01 0.00 -1.18 0.00 0.00 61.69 60.22 2eul s THR 8 Cb -0.03 -3.84 0.26 0.00 1.34 0.00 0.00 72.50 70.23 2eul s THR 8 CO -0.02 -0.66 1.69 0.07 -0.54 0.00 0.00 174.62 175.16 2eul h LYS 9 N 0.51 0.33 -0.74 3.99 -0.00 -1.92 0.24 116.57 118.98 2eul h LYS 9 Ca -0.48 -0.02 -0.06 0.00 -0.00 0.00 0.00 60.65 60.08 2eul h LYS 9 Cb 1.22 -0.07 -0.03 0.00 -0.00 0.00 0.00 32.23 33.34 2eul h LYS 9 CO 0.61 0.22 0.22 0.00 -0.00 0.00 0.00 179.45 180.50 2eul h ALA 10 N 1.65 0.99 -0.63 0.07 0.00 -1.94 -1.26 119.26 118.13 2eul h ALA 10 Ca 0.47 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 2eul h ALA 10 Cb 0.84 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2eul h ALA 10 CO -0.51 0.67 0.19 0.78 0.00 0.00 0.00 179.25 180.38 2eul h GLY 11 N 1.11 1.07 0.96 0.00 0.00 -0.85 -0.62 103.07 104.74 2eul h GLY 11 Ca 0.24 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.87 2eul h GLY 11 CO -0.01 0.60 0.04 -1.82 0.00 0.00 0.00 176.54 175.36 2eul h TYR 12 N 0.92 0.79 -0.79 5.60 3.20 -0.71 -2.27 116.97 123.70 2eul h TYR 12 Ca 0.20 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2eul h TYR 12 Cb 0.31 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 2eul h TYR 12 CO 0.02 0.77 0.44 0.93 -1.64 0.00 0.00 178.16 178.68 2eul h GLU 13 N 0.59 1.09 -0.43 1.82 5.08 -0.94 -1.71 114.58 120.09 2eul h GLU 13 Ca 0.13 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 2eul h GLU 13 Cb 0.42 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2eul h GLU 13 CO 0.01 0.80 -0.09 0.00 -1.00 0.00 0.00 179.01 178.73 2eul h ARG 14 N 1.10 0.76 -0.00 2.33 3.08 -0.76 -1.01 114.38 119.88 2eul h ARG 14 Ca 0.28 -0.24 -0.16 0.00 0.07 0.00 0.00 59.98 59.94 2eul h ARG 14 Cb 0.01 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2eul h ARG 14 CO -0.05 0.83 -0.74 -0.07 -1.07 0.00 0.00 179.97 178.86 2eul h LEU 15 N 0.69 0.01 -0.28 3.04 3.38 -1.08 -0.57 115.31 120.51 2eul h LEU 15 Ca 0.12 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2eul h LEU 15 Cb 0.55 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2eul h LEU 15 CO 0.03 0.75 -0.03 0.24 0.09 0.00 0.00 178.44 179.52 2eul h MET 16 N 0.00 0.52 -0.76 1.13 2.86 -1.07 0.11 114.93 117.71 2eul h MET 16 Ca -0.01 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.46 2eul h MET 16 Cb 1.32 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.90 2eul h MET 16 CO 0.10 0.70 0.50 1.96 1.06 0.00 0.00 176.91 181.22 2eul h GLN 17 N 0.29 1.01 -0.29 1.72 4.20 -1.00 0.17 115.11 121.21 2eul h GLN 17 Ca 0.08 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.60 2eul h GLN 17 Cb 0.48 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2eul h GLN 17 CO 0.02 0.67 -0.34 0.37 -0.67 0.00 0.00 178.83 178.89 2eul h GLN 18 N 1.04 0.64 -0.31 1.46 5.75 -0.74 -2.52 115.11 120.43 2eul h GLN 18 Ca 0.28 -0.29 -0.02 0.00 -0.15 0.00 0.00 58.65 58.46 2eul h GLN 18 Cb -0.11 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 2eul h GLN 18 CO -0.06 0.88 0.09 1.25 -2.65 0.00 0.00 178.83 178.35 2eul h LEU 19 N 0.54 0.45 -0.41 -2.39 5.85 0.81 -2.02 115.31 118.13 2eul h LEU 19 Ca 0.06 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.63 2eul h LEU 19 Cb 0.84 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 2eul h LEU 19 CO 0.07 0.53 0.12 -0.08 -0.34 0.00 0.00 178.44 178.74 2eul h GLU 20 N 0.34 0.25 -0.53 1.25 4.81 -0.92 -1.19 114.58 118.59 2eul h GLU 20 Ca 0.10 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 2eul h GLU 20 Cb 0.25 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 2eul h GLU 20 CO -0.00 0.17 0.32 -0.09 -0.73 0.00 0.00 179.01 178.68 2eul h ARG 21 N 0.26 0.63 -0.21 1.92 2.43 -1.32 -1.82 114.38 116.26 2eul h ARG 21 Ca 0.20 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 2eul h ARG 21 Cb 0.21 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2eul h ARG 21 CO -0.23 0.41 -0.21 0.93 -1.51 0.00 0.00 179.97 179.37 2eul h GLU 22 N 0.65 0.38 -0.48 0.20 4.39 -0.83 -1.20 114.58 117.68 2eul h GLU 22 Ca 0.21 -0.12 -0.13 0.00 0.34 0.00 0.00 59.36 59.65 2eul h GLU 22 Cb -0.00 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2eul h GLU 22 CO -0.08 0.58 -0.22 0.00 -1.16 0.00 0.00 179.01 178.13 2eul h ARG 23 N 0.35 1.00 -0.06 2.33 3.08 -0.80 -1.39 114.38 118.88 2eul h ARG 23 Ca 0.06 -0.43 0.03 0.00 0.07 0.00 0.00 59.98 59.72 2eul h ARG 23 Cb 0.57 -0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.54 2eul h ARG 23 CO 0.04 1.10 -0.18 0.93 -1.07 0.00 0.00 179.97 180.79 2eul h GLU 24 N 0.86 -0.26 0.00 0.04 4.39 -0.79 -0.41 114.58 118.41 2eul h GLU 24 Ca 0.11 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 2eul h GLU 24 Cb 0.80 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.51 2eul h GLU 24 CO 0.07 -0.17 -0.05 0.00 -1.16 0.00 0.00 179.01 177.69 2eul h ARG 25 N -0.27 0.00 0.02 2.33 3.08 -1.06 -0.73 114.38 117.76 2eul h ARG 25 Ca 0.07 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.91 2eul h ARG 25 Cb 0.37 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.41 2eul h ARG 25 CO -0.21 0.05 -0.97 1.25 -1.07 0.00 0.00 179.97 179.02 2eul h LEU 26 N 0.00 0.15 0.34 3.04 5.85 0.02 -0.95 115.31 123.76 2eul h LEU 26 Ca -0.00 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 2eul h LEU 26 Cb 0.18 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2eul h LEU 26 CO 0.01 1.03 -0.16 1.56 -0.34 0.00 0.00 178.44 180.53 2eul h GLN 27 N 0.04 -0.44 -0.85 1.25 4.20 0.13 0.11 115.11 119.55 2eul h GLN 27 Ca -0.04 0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.73 2eul h GLN 27 Cb 1.66 0.10 -0.05 0.00 0.30 0.00 0.00 27.48 29.49 2eul h GLN 27 CO 0.14 -0.16 0.55 1.49 -0.67 0.00 0.00 178.83 180.18 2eul h GLU 28 N -0.72 1.03 -0.20 1.46 4.57 -1.43 -0.73 114.58 118.56 2eul h GLU 28 Ca -0.05 -0.06 -0.15 0.00 -1.18 0.00 0.00 59.36 57.92 2eul h GLU 28 Cb 0.49 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 2eul h GLU 28 CO 0.08 0.68 -0.50 0.00 -1.18 0.00 0.00 179.01 178.09 2eul h ALA 29 N 1.36 0.75 0.33 2.92 0.00 -1.14 -2.07 119.26 121.41 2eul h ALA 29 Ca 0.34 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2eul h ALA 29 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2eul h ALA 29 CO -0.12 0.67 -0.16 1.15 0.00 0.00 0.00 179.25 180.80 2eul h THR 30 N 0.44 0.68 -0.65 0.00 2.02 -0.36 -2.24 112.91 112.81 2eul h THR 30 Ca 0.02 -0.49 0.07 0.00 0.77 0.00 0.00 66.41 66.78 2eul h THR 30 Cb 1.03 0.93 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 2eul h THR 30 CO 0.09 0.10 0.43 0.07 0.37 0.00 0.00 175.52 176.58 2eul h LYS 31 N -0.72 0.58 -0.07 6.66 2.10 -1.18 -2.65 116.57 121.30 2eul h LYS 31 Ca -0.04 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.55 2eul h LYS 31 Cb 0.49 -0.13 -0.00 0.00 -0.90 0.00 0.00 32.23 31.69 2eul h LYS 31 CO 0.07 0.39 -0.05 0.82 -2.00 0.00 0.00 179.45 178.68 2eul h ILE 32 N 0.60 1.35 0.00 0.07 2.04 -1.28 -2.59 117.51 117.70 2eul h ILE 32 Ca 0.29 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.00 2eul h ILE 32 Cb 0.35 1.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.39 2eul h ILE 32 CO -0.09 0.31 -0.05 0.25 0.00 0.00 0.00 178.15 178.57 2eul h LEU 33 N -0.26 0.00 0.09 1.44 6.46 -1.13 0.84 115.31 122.75 2eul h LEU 33 Ca 0.01 0.00 -0.27 0.00 -0.12 0.00 0.00 57.88 57.50 2eul h LEU 33 Cb 0.52 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.46 2eul h LEU 33 CO 0.01 0.05 -1.22 1.56 -0.62 0.00 0.00 178.44 178.23 2eul h GLN 34 N 0.00 0.31 -0.26 1.25 1.08 -1.41 -2.53 115.11 113.55 2eul h GLN 34 Ca -0.00 -0.49 -0.15 0.00 -1.45 0.00 0.00 58.65 56.55 2eul h GLN 34 Cb 0.25 0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 2eul h GLN 34 CO 0.01 1.22 -0.47 0.93 -0.95 0.00 0.00 178.83 179.57 2eul h GLU 35 N 0.10 0.68 0.00 1.46 5.08 -0.93 -2.42 114.58 118.55 2eul h GLU 35 Ca -0.13 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 2eul h GLU 35 Cb 1.93 0.03 0.00 0.00 0.50 0.00 0.00 28.75 31.21 2eul h GLU 35 CO 0.20 1.00 0.00 -0.11 -1.00 0.00 0.00 179.01 179.10 2eul n LEU 36 N -4.01 0.00 -0.10 1.33 7.94 0.21 -2.72 117.00 119.65 2eul n LEU 36 Ca -0.03 0.06 -0.16 0.00 -1.11 0.00 0.00 56.01 54.78 2eul n LEU 36 Cb 0.57 -0.06 -0.13 0.00 0.53 0.00 0.00 43.42 44.32 2eul n LEU 36 CO 0.47 -0.01 -1.19 0.80 -1.11 0.00 0.00 177.39 176.35 2eul n MET 37 N -1.06 0.67 0.10 1.96 1.56 -0.93 -4.22 117.12 115.20 2eul n MET 37 Ca 0.18 0.12 -0.02 0.00 -0.27 0.00 0.00 57.70 57.71 2eul n MET 37 Cb 0.12 -1.56 -0.03 0.00 2.15 0.00 0.00 33.22 33.90 2eul n MET 37 CO 0.00 0.00 0.00 1.05 -0.73 0.00 0.00 175.97 176.29 2eul h GLU 38 N 0.01 0.00 0.00 2.12 4.11 -1.43 -3.39 114.58 116.00 2eul h GLU 38 Ca -0.54 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.89 2eul h GLU 38 Cb 2.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 2eul h GLU 38 CO -0.03 0.74 0.00 -1.13 0.07 0.00 0.00 179.01 178.67 2eul n SER 39 N -3.31 0.00 -4.33 3.06 3.41 -1.10 -4.51 113.62 106.83 2eul n SER 39 Ca 0.01 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.29 2eul n SER 39 Cb 0.82 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.72 2eul n SER 39 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2eul n SER 40 N 0.00 3.05 -0.28 4.04 7.64 -1.26 -4.77 113.62 122.05 2eul n SER 40 Ca 0.00 -2.71 0.16 0.00 1.01 0.00 0.00 58.87 57.33 2eul n SER 40 Cb 0.00 -1.58 0.30 0.00 -1.01 0.00 0.00 64.21 61.92 2eul n SER 40 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2eul n ASP 41 N 12.26 0.01 -4.55 6.43 10.43 -1.26 -3.95 116.55 135.91 2eul n ASP 41 Ca 0.46 1.37 -0.37 0.00 2.57 0.00 0.00 54.79 58.82 2eul n ASP 41 Cb 0.45 -0.54 -0.03 0.00 1.84 0.00 0.00 41.12 42.83 2eul n ASP 41 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 2eul s ASP 42 N -4.90 4.62 0.00 -2.24 -0.00 -1.26 -4.79 116.67 108.10 2eul s ASP 42 Ca -0.10 1.06 0.21 0.00 -0.00 0.00 0.00 52.55 53.73 2eul s ASP 42 Cb 0.25 -2.50 0.97 0.00 -0.00 0.00 0.00 42.92 41.64 2eul s ASP 42 CO 0.63 -2.75 1.69 0.00 -0.00 0.00 0.00 175.17 174.74 2eul n TYR 43 N 15.19 0.00 1.41 4.23 0.18 -1.25 -3.39 117.16 133.53 2eul n TYR 43 Ca 0.34 0.00 0.02 0.00 1.88 0.00 0.00 57.90 60.14 2eul n TYR 43 Cb 0.54 -0.43 0.12 0.00 -0.38 0.00 0.00 39.34 39.19 2eul n TYR 43 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 2eul n ASP 44 N -1.43 0.00 -4.85 9.48 5.75 -1.26 -4.51 116.55 119.74 2eul n ASP 44 Ca 0.07 -1.28 -0.35 0.00 -0.01 0.00 0.00 54.79 53.22 2eul n ASP 44 Cb 0.22 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.25 2eul n ASP 44 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 2eul s ASP 45 N -1.42 6.80 0.00 -1.12 1.47 -1.22 -4.95 116.67 116.23 2eul s ASP 45 Ca 0.06 1.08 0.01 0.00 1.18 0.00 0.00 52.55 54.89 2eul s ASP 45 Cb 0.03 -2.29 0.07 0.00 -0.34 0.00 0.00 42.92 40.39 2eul s ASP 45 CO 0.05 0.05 0.47 -1.54 0.68 0.00 0.00 175.17 174.87 2eul n SER 46 N 0.56 0.00 -0.10 2.11 3.41 -1.26 -3.12 113.62 115.22 2eul n SER 46 Ca -0.04 -0.06 -0.17 0.00 -0.26 0.00 0.00 58.87 58.35 2eul n SER 46 Cb 0.52 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.40 2eul n SER 46 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eul n GLY 47 N -0.81 -0.73 0.29 5.00 0.00 -1.26 -3.64 105.19 104.03 2eul n GLY 47 Ca 0.01 -0.09 0.05 0.00 0.00 0.00 0.00 46.02 45.98 2eul n GLY 47 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2eul h LEU 48 N -1.00 0.33 0.00 0.99 6.46 -1.82 -1.32 115.31 118.95 2eul h LEU 48 Ca -0.28 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 2eul h LEU 48 Cb 1.11 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 40.96 2eul h LEU 48 CO -0.17 0.26 -0.19 -0.33 -0.62 0.00 0.00 178.44 177.39 2eul h GLU 49 N 0.38 0.00 0.00 1.25 4.39 -1.78 0.16 114.58 118.99 2eul h GLU 49 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2eul h GLU 49 Cb -0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2eul h GLU 49 CO -0.02 0.00 -0.43 0.00 -1.16 0.00 0.00 179.01 177.40 2eul n ALA 50 N -1.97 2.89 -0.00 3.43 0.00 -0.78 -2.23 120.51 121.85 2eul n ALA 50 Ca 0.04 -0.22 -0.00 0.00 0.00 0.00 0.00 53.44 53.26 2eul n ALA 50 Cb 0.49 -1.24 -0.00 0.00 0.00 0.00 0.00 19.45 18.69 2eul n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2eul h ALA 51 N 2.67 0.00 -0.80 0.00 0.00 -0.84 -3.04 119.26 117.25 2eul h ALA 51 Ca 0.00 -0.23 0.19 0.00 0.00 0.00 0.00 54.91 54.87 2eul h ALA 51 Cb 0.66 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.32 2eul h ALA 51 CO 0.00 0.01 0.01 0.87 0.00 0.00 0.00 179.25 180.14 2eul h LYS 52 N -0.02 0.09 -0.76 0.00 1.57 -0.83 0.22 116.57 116.85 2eul h LYS 52 Ca 0.00 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.94 2eul h LYS 52 Cb 0.01 -0.02 -0.14 0.00 0.08 0.00 0.00 32.23 32.16 2eul h LYS 52 CO 0.00 0.06 -0.09 0.37 -0.57 0.00 0.00 179.45 179.22 2eul h GLN 53 N 0.09 0.04 -0.25 3.15 -0.00 -1.62 0.13 115.11 116.65 2eul h GLN 53 Ca 0.45 -0.00 0.03 0.00 -0.00 0.00 0.00 58.65 59.12 2eul h GLN 53 Cb 0.81 -0.01 -0.03 0.00 0.00 0.00 0.00 27.48 28.25 2eul h GLN 53 CO -0.71 0.03 0.08 1.49 0.00 0.00 0.00 178.83 179.72 2eul h GLU 54 N 0.04 0.19 -0.92 1.69 4.57 -0.47 0.15 114.58 119.83 2eul h GLU 54 Ca 0.39 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.56 2eul h GLU 54 Cb 0.66 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 29.16 2eul h GLU 54 CO -0.73 0.13 0.58 -0.22 -1.18 0.00 0.00 179.01 177.58 2eul h LYS 55 N 0.20 1.24 -0.27 1.92 3.64 -0.05 -0.02 116.57 123.23 2eul h LYS 55 Ca 0.11 -0.10 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2eul h LYS 55 Cb 0.08 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 2eul h LYS 55 CO -0.12 0.85 0.07 0.00 -2.27 0.00 0.00 179.45 177.97 2eul h ALA 56 N 1.32 0.36 -0.25 5.00 0.00 -0.62 -0.33 119.26 124.74 2eul h ALA 56 Ca 0.33 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.14 2eul h ALA 56 Cb -0.09 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.53 2eul h ALA 56 CO -0.07 0.02 -0.17 -0.09 0.00 0.00 0.00 179.25 178.94 2eul h ARG 57 N 0.27 -0.15 -0.45 0.00 1.12 -0.05 -1.53 114.38 113.58 2eul h ARG 57 Ca 0.09 0.01 0.02 0.00 -1.11 0.00 0.00 59.98 58.99 2eul h ARG 57 Cb 0.29 0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.25 2eul h ARG 57 CO 0.00 -0.10 0.26 0.82 -3.11 0.00 0.00 179.97 177.84 2eul h ILE 58 N -0.16 1.04 -0.34 1.20 2.04 -0.77 -1.65 117.51 118.87 2eul h ILE 58 Ca 0.14 -0.18 0.03 0.00 1.00 0.00 0.00 64.86 65.84 2eul h ILE 58 Cb 0.37 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2eul h ILE 58 CO -0.34 0.10 0.23 -0.33 0.00 0.00 0.00 178.15 177.80 2eul h GLU 59 N 0.53 0.34 -0.10 2.37 5.08 -0.37 -0.89 114.58 121.54 2eul h GLU 59 Ca 0.18 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.36 2eul h GLU 59 Cb 0.02 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.21 2eul h GLU 59 CO -0.09 0.22 -0.57 0.00 -1.00 0.00 0.00 179.01 177.57 2eul h ALA 60 N 1.81 0.21 -0.62 3.43 0.00 -0.55 -1.09 119.26 122.44 2eul h ALA 60 Ca 0.14 -0.53 0.02 0.00 0.00 0.00 0.00 54.91 54.53 2eul h ALA 60 Cb 0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2eul h ALA 60 CO -0.03 0.44 0.40 0.00 0.00 0.00 0.00 179.25 180.06 2eul h ARG 61 N 0.19 0.78 0.74 0.00 2.47 -0.82 -0.17 114.38 117.56 2eul h ARG 61 Ca -0.04 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.59 2eul h ARG 61 Cb 1.22 -0.18 0.01 0.00 -1.65 0.00 0.00 29.97 29.37 2eul h ARG 61 CO 0.12 0.51 -0.35 0.82 0.56 0.00 0.00 179.97 181.63 2eul h ILE 62 N 0.80 0.22 -0.54 2.04 2.04 -1.13 -1.36 117.51 119.58 2eul h ILE 62 Ca 0.24 -0.12 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2eul h ILE 62 Cb -0.05 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 36.26 2eul h ILE 62 CO -0.07 0.01 0.32 0.44 0.00 0.00 0.00 178.15 178.85 2eul h ASP 63 N -1.08 0.64 -0.59 1.72 3.32 -1.12 0.30 116.42 119.60 2eul h ASP 63 Ca -0.10 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 56.84 2eul h ASP 63 Cb 0.78 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 2eul h ASP 63 CO 0.17 0.49 0.08 -1.28 -1.72 0.00 0.00 179.24 176.98 2eul h SER 64 N 0.74 0.98 -0.45 6.45 0.87 -0.97 -1.20 113.55 119.98 2eul h SER 64 Ca 0.19 -0.24 -0.04 0.00 -1.23 0.00 0.00 61.79 60.48 2eul h SER 64 Cb -0.03 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.66 2eul h SER 64 CO -0.04 0.99 0.11 -0.07 -0.53 0.00 0.00 176.83 177.30 2eul h LEU 65 N 0.95 0.68 -1.19 2.23 3.38 -0.04 -2.33 115.31 118.99 2eul h LEU 65 Ca 0.19 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2eul h LEU 65 Cb 0.45 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2eul h LEU 65 CO 0.02 0.73 0.22 -0.33 0.09 0.00 0.00 178.44 179.16 2eul h GLU 66 N 0.59 0.79 -0.09 1.13 5.08 -0.65 -1.29 114.58 120.14 2eul h GLU 66 Ca 0.14 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2eul h GLU 66 Cb 0.31 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2eul h GLU 66 CO 0.00 0.65 0.04 0.22 -1.00 0.00 0.00 179.01 178.92 2eul h ASP 67 N 0.78 0.12 -0.46 1.42 3.58 -0.96 -1.77 116.42 119.12 2eul h ASP 67 Ca 0.19 -0.15 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 2eul h ASP 67 Cb 0.15 -0.03 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 2eul h ASP 67 CO -0.02 0.24 0.24 0.40 -2.88 0.00 0.00 179.24 177.22 2eul h ILE 68 N -0.00 1.18 -0.19 2.25 2.04 -1.02 -2.56 117.51 119.20 2eul h ILE 68 Ca 0.03 -0.48 -0.04 0.00 1.00 0.00 0.00 64.86 65.37 2eul h ILE 68 Cb 0.16 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 2eul h ILE 68 CO -0.00 0.19 -0.08 -0.07 0.00 0.00 0.00 178.15 178.19 2eul h LEU 69 N 0.61 0.27 -1.90 1.44 3.38 -1.19 -1.51 115.31 116.41 2eul h LEU 69 Ca 0.16 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2eul h LEU 69 Cb 0.09 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2eul h LEU 69 CO -0.02 0.39 -0.12 0.77 0.09 0.00 0.00 178.44 179.55 2eul h SER 70 N 0.28 0.00 -0.19 -0.43 4.64 -0.90 -1.81 113.55 115.13 2eul h SER 70 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2eul h SER 70 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2eul h SER 70 CO 0.02 0.12 0.00 0.54 -0.87 0.00 0.00 176.83 176.64 2eul n ARG 71 N -3.66 2.13 -1.65 4.77 1.74 -0.63 -5.00 116.66 114.36 2eul n ARG 71 Ca -0.02 -1.96 -0.44 0.00 -0.77 0.00 0.00 57.85 54.66 2eul n ARG 71 Cb 0.24 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.23 2eul n ARG 71 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2eul n ALA 72 N 1.24 0.68 -3.75 7.54 0.00 -0.68 -1.83 120.51 123.70 2eul n ALA 72 Ca 0.15 0.39 -0.30 0.00 0.00 0.00 0.00 53.44 53.68 2eul n ALA 72 Cb 0.54 -2.17 -0.15 0.00 0.00 0.00 0.00 19.45 17.66 2eul n ALA 72 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2eul s VAL 73 N -0.83 0.92 0.06 0.00 1.01 0.05 -4.83 120.40 116.77 2eul s VAL 73 Ca 0.60 -1.34 -0.31 0.00 0.00 0.00 0.00 61.98 60.93 2eul s VAL 73 Cb -0.64 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.02 2eul s VAL 73 CO 0.59 -0.60 1.54 -0.63 0.00 0.00 0.00 175.10 175.99 2eul s ILE 74 N 1.60 3.26 0.50 2.22 -1.09 -1.26 -2.71 121.20 123.72 2eul s ILE 74 Ca 0.08 0.73 -0.10 0.00 -2.23 0.00 0.00 60.65 59.13 2eul s ILE 74 Cb -0.17 -3.47 -0.05 0.00 -1.58 0.00 0.00 42.46 37.19 2eul s ILE 74 CO -0.22 0.01 0.88 -0.76 -1.23 0.00 0.00 174.94 173.61 2eul s LEU 75 N 2.32 3.58 0.38 2.97 1.43 -0.52 -4.95 118.68 123.89 2eul s LEU 75 Ca 0.69 1.22 -0.27 0.00 -1.03 0.00 0.00 54.13 54.74 2eul s LEU 75 Cb -0.37 -4.17 -0.10 0.00 0.03 0.00 0.00 46.19 41.58 2eul s LEU 75 CO 0.30 -0.61 1.40 -1.61 0.23 0.00 0.00 176.35 176.07 2eul s GLU 76 N -4.50 4.08 0.00 1.70 0.41 -1.26 -4.61 118.70 114.52 2eul s GLU 76 Ca 0.52 2.39 0.00 0.00 -0.41 0.00 0.00 54.97 57.47 2eul s GLU 76 Cb -0.10 -2.91 0.00 0.00 -1.78 0.00 0.00 34.13 29.34 2eul s GLU 76 CO 0.41 -0.49 0.59 0.39 -0.49 0.00 0.00 175.26 175.68 2eul n GLU 77 N 0.38 0.00 -2.64 1.61 1.02 -1.26 -3.42 120.64 116.33 2eul n GLU 77 Ca 0.02 0.52 -0.42 0.00 -0.02 0.00 0.00 57.16 57.26 2eul n GLU 77 Cb 0.41 -1.09 -0.03 0.00 -0.02 0.00 0.00 31.44 30.71 2eul n GLU 77 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2eul s GLY 78 N -0.18 1.28 0.09 0.62 0.00 -1.26 -4.94 107.32 102.93 2eul s GLY 78 Ca 0.00 -2.08 -0.05 0.00 0.00 0.00 0.00 44.72 42.59 2eul s GLY 78 CO 0.00 2.52 0.11 -1.35 0.00 0.00 0.00 173.10 174.38 2eul s SER 79 N 4.34 0.25 0.36 1.64 1.04 -1.22 -5.13 113.70 115.00 2eul s SER 79 Ca 0.39 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.98 2eul s SER 79 Cb -0.04 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2eul s SER 79 CO -0.02 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.11 2eul n GLY 80 N -0.02 -1.97 0.00 7.32 0.00 -1.26 -4.83 105.19 104.42 2eul n GLY 80 Ca -0.13 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.01 2eul n GLY 80 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2eul n GLU 81 N -3.78 -0.75 -4.19 1.61 -0.58 -1.26 -5.00 120.64 106.69 2eul n GLU 81 Ca -0.02 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.59 2eul n GLU 81 Cb 0.65 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 31.41 2eul n GLU 81 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2eul s VAL 82 N -0.99 0.88 -0.23 2.62 1.01 -1.26 -4.55 120.40 117.87 2eul s VAL 82 Ca 0.00 -1.87 -0.25 0.00 0.00 0.00 0.00 61.98 59.86 2eul s VAL 82 Cb 0.00 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.76 2eul s VAL 82 CO 0.00 -0.75 0.85 -0.63 0.00 0.00 0.00 175.10 174.57 2eul s ILE 83 N -3.18 4.83 0.00 2.22 1.01 0.22 -4.94 121.20 121.36 2eul s ILE 83 Ca 0.11 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.38 2eul s ILE 83 Cb 0.02 -4.14 -0.00 0.00 0.01 0.00 0.00 42.46 38.35 2eul s ILE 83 CO -0.02 -0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.47 2eul n GLY 84 N 3.66 4.06 3.76 6.18 0.00 -1.26 -0.40 105.19 121.19 2eul n GLY 84 Ca 0.06 -1.76 -0.41 0.00 0.00 0.00 0.00 46.02 43.91 2eul n GLY 84 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2eul s LEU 85 N 0.00 4.42 0.00 0.99 0.20 -1.26 -1.99 118.68 121.03 2eul s LEU 85 Ca 0.00 2.63 0.00 0.00 0.69 0.00 0.00 54.13 57.45 2eul s LEU 85 Cb 0.00 -3.64 0.00 0.00 -0.43 0.00 0.00 46.19 42.12 2eul s LEU 85 CO 0.00 -0.57 0.00 0.61 -0.29 0.00 0.00 176.35 176.10 2eul n GLY 86 N 1.42 1.37 3.74 7.98 0.00 0.40 -5.00 105.19 115.09 2eul n GLY 86 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 2eul n GLY 86 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eul s SER 87 N -3.15 7.43 -0.20 1.61 0.01 -0.84 -4.81 113.70 113.74 2eul s SER 87 Ca 0.00 1.70 -0.17 0.00 1.31 0.00 0.00 55.95 58.80 2eul s SER 87 Cb 0.00 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 2eul s SER 87 CO 0.00 -0.01 0.44 -0.69 0.41 0.00 0.00 173.24 173.38 2eul s VAL 88 N -0.16 5.17 -0.09 3.43 1.01 -1.25 -2.34 120.40 126.17 2eul s VAL 88 Ca 0.44 0.78 0.04 0.00 0.00 0.00 0.00 61.98 63.24 2eul s VAL 88 Cb -0.23 -3.76 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 2eul s VAL 88 CO 0.28 0.23 -0.23 -0.69 0.00 0.00 0.00 175.10 174.69 2eul s VAL 89 N 1.42 1.93 -0.16 2.92 1.01 0.86 -2.07 120.40 126.31 2eul s VAL 89 Ca 0.21 -0.95 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 2eul s VAL 89 Cb -0.15 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.53 2eul s VAL 89 CO 0.09 0.53 0.03 -1.83 0.00 0.00 0.00 175.10 173.91 2eul s GLU 90 N 0.28 3.73 0.14 2.72 -1.05 -0.55 -1.17 118.70 122.80 2eul s GLU 90 Ca -0.15 -0.39 0.08 0.00 -0.15 0.00 0.00 54.97 54.35 2eul s GLU 90 Cb -0.17 -3.07 -0.04 0.00 -0.44 0.00 0.00 34.13 30.42 2eul s GLU 90 CO 0.07 0.35 -0.19 -0.51 0.95 0.00 0.00 175.26 175.93 2eul s LEU 91 N 0.13 2.39 -0.02 1.83 1.43 0.39 -1.71 118.68 123.12 2eul s LEU 91 Ca 0.03 -0.80 0.03 0.00 -1.03 0.00 0.00 54.13 52.36 2eul s LEU 91 Cb -0.13 -0.83 -0.00 0.00 0.03 0.00 0.00 46.19 45.26 2eul s LEU 91 CO 0.01 -0.01 -0.10 -0.70 0.23 0.00 0.00 176.35 175.79 2eul s GLU 92 N -2.47 0.98 -0.62 1.70 2.12 -0.70 -0.06 118.70 119.65 2eul s GLU 92 Ca 0.12 -0.34 -0.21 0.00 0.36 0.00 0.00 54.97 54.90 2eul s GLU 92 Cb -0.07 -0.92 0.08 0.00 0.26 0.00 0.00 34.13 33.48 2eul s GLU 92 CO 0.06 0.15 0.84 0.34 -0.54 0.00 0.00 175.26 176.11 2eul s ASP 93 N 0.06 6.19 0.20 -1.70 2.15 0.90 -0.84 116.67 123.63 2eul s ASP 93 Ca -0.01 -1.10 0.03 0.00 0.43 0.00 0.00 52.55 51.90 2eul s ASP 93 Cb -0.07 -2.37 0.53 0.00 -0.30 0.00 0.00 42.92 40.70 2eul s ASP 93 CO 0.00 -1.27 0.96 -2.65 -0.17 0.00 0.00 175.17 172.05 2eul n PRO 94 N 7.09 -0.05 0.00 4.34 -0.02 -1.26 0.15 135.00 145.25 2eul n PRO 94 Ca -0.06 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.33 2eul n PRO 94 Cb 0.44 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 2eul n PRO 94 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2eul n LEU 95 N -4.73 0.41 0.00 2.45 4.77 -1.26 -3.93 117.00 114.71 2eul n LEU 95 Ca 0.16 0.63 0.11 0.00 -0.03 0.00 0.00 56.01 56.87 2eul n LEU 95 Cb 0.52 -0.29 0.51 0.00 -2.33 0.00 0.00 43.42 41.84 2eul n LEU 95 CO -0.04 -0.29 0.85 -1.54 -1.33 0.00 0.00 177.39 175.04 2eul n SER 96 N -1.36 0.00 -0.71 -1.43 3.41 -0.95 -4.87 113.62 107.72 2eul n SER 96 Ca 0.00 0.24 -0.09 0.00 -0.26 0.00 0.00 58.87 58.76 2eul n SER 96 Cb 0.00 -0.40 -0.04 0.00 -0.26 0.00 0.00 64.21 63.52 2eul n SER 96 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eul n GLY 97 N 0.66 1.00 3.77 5.00 0.00 0.39 -4.94 105.19 111.07 2eul n GLY 97 Ca 0.08 -0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2eul n GLY 97 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2eul s GLU 98 N -2.56 4.27 -0.16 1.61 2.12 -1.22 -4.65 118.70 118.11 2eul s GLU 98 Ca 0.00 2.20 -0.04 0.00 0.36 0.00 0.00 54.97 57.49 2eul s GLU 98 Cb 0.00 -3.00 -0.03 0.00 0.26 0.00 0.00 34.13 31.36 2eul s GLU 98 CO 0.00 -0.25 -0.03 1.03 -0.54 0.00 0.00 175.26 175.47 2eul s ARG 99 N -1.90 3.69 -0.03 4.30 3.00 -1.26 -0.07 118.95 126.69 2eul s ARG 99 Ca 0.51 -0.51 0.04 0.00 0.00 0.00 0.00 55.73 55.77 2eul s ARG 99 Cb -0.39 -2.96 -0.00 0.00 0.00 0.00 0.00 34.95 31.60 2eul s ARG 99 CO 0.52 0.22 -0.14 -1.17 0.00 0.00 0.00 175.30 174.72 2eul s LEU 100 N 0.44 1.91 -0.07 2.53 2.96 0.92 -4.96 118.68 122.40 2eul s LEU 100 Ca -0.03 -0.28 0.04 0.00 -0.22 0.00 0.00 54.13 53.63 2eul s LEU 100 Cb -0.14 -0.80 0.00 0.00 0.50 0.00 0.00 46.19 45.75 2eul s LEU 100 CO 0.03 0.14 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.45 2eul s SER 101 N -0.04 2.50 0.06 3.68 0.15 -1.26 0.15 113.70 118.94 2eul s SER 101 Ca -0.01 -0.43 -0.13 0.00 0.70 0.00 0.00 55.95 56.08 2eul s SER 101 Cb -0.09 -1.01 0.02 0.00 -1.71 0.00 0.00 66.02 63.23 2eul s SER 101 CO 0.01 0.13 0.29 -0.69 1.20 0.00 0.00 173.24 174.18 2eul s VAL 102 N 0.32 0.09 -0.12 4.45 1.01 -0.32 -4.23 120.40 121.60 2eul s VAL 102 Ca -0.13 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2eul s VAL 102 Cb -0.16 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.23 2eul s VAL 102 CO 0.05 -0.41 -0.16 -1.58 0.00 0.00 0.00 175.10 173.00 2eul s GLN 103 N -2.83 2.33 -0.28 2.72 0.74 -0.09 -0.10 119.66 122.16 2eul s GLN 103 Ca -0.03 -0.59 -0.29 0.00 0.05 0.00 0.00 55.36 54.50 2eul s GLN 103 Cb 0.00 -2.01 0.01 0.00 1.10 0.00 0.00 33.01 32.11 2eul s GLN 103 CO -0.05 -0.11 1.12 0.08 -0.55 0.00 0.00 175.29 175.78 2eul s VAL 104 N 1.11 4.48 0.18 1.34 1.01 -0.99 0.20 120.40 127.73 2eul s VAL 104 Ca -0.03 1.73 0.03 0.00 0.00 0.00 0.00 61.98 63.70 2eul s VAL 104 Cb -0.14 -4.31 -0.01 0.00 0.00 0.00 0.00 36.38 31.92 2eul s VAL 104 CO -0.04 -0.37 0.09 1.33 0.00 0.00 0.00 175.10 176.11 2eul n VAL 105 N 5.73 0.00 -2.57 2.92 0.24 0.24 0.15 118.33 125.04 2eul n VAL 105 Ca 0.13 -1.14 -0.34 0.00 -2.04 0.00 0.00 64.34 60.95 2eul n VAL 105 Cb 0.46 0.47 -0.04 0.00 -1.47 0.00 0.00 33.84 33.27 2eul n VAL 105 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2eul s SER 106 N -2.15 6.41 0.46 -1.34 0.01 -1.26 0.58 113.70 116.40 2eul s SER 106 Ca 0.13 1.89 0.32 0.00 1.31 0.00 0.00 55.95 59.60 2eul s SER 106 Cb 0.01 -2.56 1.45 0.00 0.21 0.00 0.00 66.02 65.13 2eul s SER 106 CO 0.09 -0.73 1.63 -0.65 0.41 0.00 0.00 173.24 174.00 2eul h PRO 107 N 1.57 0.08 0.00 12.44 0.11 -1.90 0.63 132.00 144.93 2eul h PRO 107 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2eul h PRO 107 Cb 1.21 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2eul h PRO 107 CO 0.59 0.06 -0.23 0.00 -0.21 0.00 0.00 178.00 178.20 2eul n ALA 108 N -2.58 2.62 0.72 -0.75 0.00 -1.26 -3.26 120.51 116.01 2eul n ALA 108 Ca 0.37 -0.14 0.12 0.00 0.00 0.00 0.00 53.44 53.79 2eul n ALA 108 Cb 1.46 -1.35 0.15 0.00 0.00 0.00 0.00 19.45 19.72 2eul n ALA 108 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2eul n GLU 109 N -1.98 0.19 -1.66 0.00 1.02 0.22 -4.93 120.64 113.49 2eul n GLU 109 Ca 0.05 0.03 -0.49 0.00 -0.02 0.00 0.00 57.16 56.74 2eul n GLU 109 Cb 0.40 -1.59 -0.05 0.00 -0.02 0.00 0.00 31.44 30.18 2eul n GLU 109 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2eul n ALA 110 N -1.71 0.63 -3.63 0.62 0.00 -1.03 -4.84 120.51 110.55 2eul n ALA 110 Ca 0.04 0.41 -0.04 0.00 0.00 0.00 0.00 53.44 53.85 2eul n ALA 110 Cb 0.40 -2.32 -0.06 0.00 0.00 0.00 0.00 19.45 17.47 2eul n ALA 110 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2eul s ASN 111 N 1.89 -0.74 0.51 0.00 3.84 -0.45 -4.97 114.94 115.02 2eul s ASN 111 Ca 0.85 1.27 0.30 0.00 0.21 0.00 0.00 52.86 55.49 2eul s ASN 111 Cb -0.77 1.86 1.12 0.00 -0.55 0.00 0.00 41.25 42.91 2eul s ASN 111 CO 0.46 -0.23 1.90 0.58 -2.79 0.00 0.00 177.10 177.02 2eul h VAL 112 N 6.08 0.14 0.00 -5.21 2.07 -1.94 0.15 116.25 117.55 2eul h VAL 112 Ca -0.17 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.58 2eul h VAL 112 Cb 1.11 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 2eul h VAL 112 CO 0.12 0.06 -0.54 -0.07 0.02 0.00 0.00 177.57 177.16 2eul h LEU 113 N 0.00 0.00-10.02 2.57 4.07 -1.95 -3.43 115.31 106.54 2eul h LEU 113 Ca -0.00 0.00 -0.53 0.00 0.08 0.00 0.00 57.88 57.43 2eul h LEU 113 Cb 0.64 0.00 0.10 0.00 1.08 0.00 0.00 40.66 42.48 2eul h LEU 113 CO 0.01 0.14 0.55 -1.81 -1.08 0.00 0.00 178.44 176.26 2eul s ASP 114 N -5.95 5.76 0.00 -0.43 1.11 -1.22 -4.95 116.67 111.00 2eul s ASP 114 Ca 0.03 2.55 0.00 0.00 0.18 0.00 0.00 52.55 55.31 2eul s ASP 114 Cb 0.07 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.44 2eul s ASP 114 CO 0.73 -1.22 0.00 0.41 1.18 0.00 0.00 175.17 176.28 2eul n THR 115 N -0.69 0.00 -2.10 -1.27 -1.04 -1.26 -1.74 114.28 106.18 2eul n THR 115 Ca 0.08 0.14 -0.42 0.00 -2.04 0.00 0.00 64.05 61.81 2eul n THR 115 Cb 0.46 -0.63 -0.03 0.00 -1.82 0.00 0.00 70.33 68.32 2eul n THR 115 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2eul s PRO 116 N 0.00 3.27 0.18 -2.82 0.02 -1.26 -4.82 135.00 129.57 2eul s PRO 116 Ca 0.00 1.14 -0.26 0.00 0.02 0.00 0.00 61.00 61.90 2eul s PRO 116 Cb 0.00 -4.19 -0.16 0.00 0.02 0.00 0.00 34.50 30.17 2eul s PRO 116 CO 0.00 -1.94 0.50 -1.33 -0.33 0.00 0.00 177.00 173.91 2eul n MET 117 N 8.48 0.00 -3.13 5.54 2.81 -0.71 -4.17 117.12 125.94 2eul n MET 117 Ca 0.21 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.69 2eul n MET 117 Cb 0.48 -0.95 -0.07 0.00 -0.71 0.00 0.00 33.22 31.97 2eul n MET 117 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2eul s LYS 118 N -0.89 3.89 -0.17 0.03 1.02 0.54 -0.91 119.74 123.25 2eul s LYS 118 Ca 0.61 0.27 -0.07 0.00 0.02 0.00 0.00 55.97 56.79 2eul s LYS 118 Cb -0.88 -3.73 -0.04 0.00 -0.52 0.00 0.00 37.83 32.66 2eul s LYS 118 CO 0.52 -0.56 0.07 0.42 -0.92 0.00 0.00 175.35 174.88 2eul s ILE 119 N 2.57 4.89 0.56 2.17 -1.09 0.13 -1.34 121.20 129.10 2eul s ILE 119 Ca 0.24 -0.00 -0.19 0.00 -2.23 0.00 0.00 60.65 58.47 2eul s ILE 119 Cb -0.15 -3.19 -0.07 0.00 -1.58 0.00 0.00 42.46 37.47 2eul s ILE 119 CO 0.12 0.49 0.83 -0.24 -1.23 0.00 0.00 174.94 174.90 2eul n SER 120 N 3.21 0.25 -0.06 3.58 2.88 -1.26 -0.59 113.62 121.63 2eul n SER 120 Ca -0.17 0.82 -0.12 0.00 -1.33 0.00 0.00 58.87 58.08 2eul n SER 120 Cb 0.53 -1.31 -0.06 0.00 -0.75 0.00 0.00 64.21 62.62 2eul n SER 120 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2eul h ASP 121 N 0.59 0.31 -0.32 -3.46 3.04 -0.10 -2.93 116.42 113.54 2eul h ASP 121 Ca -0.47 -0.32 0.00 0.00 -3.24 0.00 0.00 57.03 53.01 2eul h ASP 121 Cb 1.37 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 39.58 2eul h ASP 121 CO 0.51 0.55 0.00 0.00 -2.04 0.00 0.00 179.24 178.26 2eul n ALA 122 N -2.32 2.98 -1.91 4.15 0.00 -1.26 -3.42 120.51 118.73 2eul n ALA 122 Ca -0.05 -0.88 -0.29 0.00 0.00 0.00 0.00 53.44 52.22 2eul n ALA 122 Cb 0.23 -1.04 0.10 0.00 0.00 0.00 0.00 19.45 18.74 2eul n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2eul s SER 123 N -0.58 4.37 0.03 0.00 1.04 -1.11 -4.80 113.70 112.65 2eul s SER 123 Ca 0.27 0.66 -0.14 0.00 0.48 0.00 0.00 55.95 57.22 2eul s SER 123 Cb 0.19 -1.12 -0.07 0.00 0.10 0.00 0.00 66.02 65.12 2eul s SER 123 CO 0.11 -1.97 1.21 -0.65 0.98 0.00 0.00 173.24 172.92 2eul h PRO 124 N -1.06 -0.41 -0.74 4.02 0.11 -1.91 0.10 132.00 132.11 2eul h PRO 124 Ca -0.45 0.03 0.09 0.00 0.11 0.00 0.00 66.00 65.77 2eul h PRO 124 Cb 1.32 0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.47 2eul h PRO 124 CO 0.62 -0.28 0.49 1.98 -0.21 0.00 0.00 178.00 180.60 2eul h MET 125 N -0.43 0.64 -0.11 1.05 1.85 -1.95 -1.67 114.93 114.31 2eul h MET 125 Ca -0.03 -0.04 -0.01 0.00 -0.61 0.00 0.00 59.70 59.00 2eul h MET 125 Cb 0.35 -0.14 -0.00 0.00 0.43 0.00 0.00 31.60 32.23 2eul h MET 125 CO 0.01 0.42 0.02 0.78 -0.40 0.00 0.00 176.91 177.75 2eul h GLY 126 N 0.66 0.20 0.57 1.39 0.00 -1.71 -1.63 103.07 102.56 2eul h GLY 126 Ca 0.34 -0.14 0.02 0.00 0.00 0.00 0.00 47.33 47.55 2eul h GLY 126 CO -0.12 0.13 -0.21 1.70 0.00 0.00 0.00 176.54 178.03 2eul h LYS 127 N -0.04 -0.36 -0.85 4.80 3.11 -0.13 -1.57 116.57 121.52 2eul h LYS 127 Ca 0.03 0.02 0.20 0.00 -2.81 0.00 0.00 60.65 58.10 2eul h LYS 127 Cb 0.30 0.08 -0.12 0.00 -1.00 0.00 0.00 32.23 31.49 2eul h LYS 127 CO 0.00 -0.24 0.33 0.00 -2.81 0.00 0.00 179.45 176.73 2eul h ALA 128 N 0.45 1.29 -0.01 5.00 0.00 -1.20 -3.00 119.26 121.79 2eul h ALA 128 Ca 0.04 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2eul h ALA 128 Cb 0.42 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2eul h ALA 128 CO -0.15 -0.32 -0.09 -0.07 0.00 0.00 0.00 179.25 178.61 2eul h LEU 129 N 0.38 0.09 -9.04 0.00 3.38 -0.87 -3.46 115.31 105.78 2eul h LEU 129 Ca 0.51 -0.74 -0.81 0.00 0.09 0.00 0.00 57.88 56.93 2eul h LEU 129 Cb 0.94 -0.03 0.03 0.00 0.09 0.00 0.00 40.66 41.69 2eul h LEU 129 CO -0.52 0.82 0.51 0.18 0.09 0.00 0.00 178.44 179.52 2eul n LEU 130 N -4.65 1.05 0.00 1.67 4.32 -0.63 -1.86 117.00 116.90 2eul n LEU 130 Ca -0.09 1.16 0.00 0.00 -0.02 0.00 0.00 56.01 57.06 2eul n LEU 130 Cb 0.41 -0.96 0.00 0.00 -1.62 0.00 0.00 43.42 41.25 2eul n LEU 130 CO 0.36 -1.12 0.00 0.61 -1.22 0.00 0.00 177.39 176.02 2eul n GLY 131 N 3.15 0.78 3.84 -0.72 0.00 0.46 -4.99 105.19 107.71 2eul n GLY 131 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.06 2eul n GLY 131 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2eul s HIS 132 N -2.23 2.74 0.42 1.61 3.76 -0.78 -4.75 115.29 116.05 2eul s HIS 132 Ca 0.00 -0.46 0.04 0.00 -0.15 0.00 0.00 55.06 54.49 2eul s HIS 132 Cb 0.00 -2.03 -0.02 0.00 1.11 0.00 0.00 32.58 31.64 2eul s HIS 132 CO 0.00 0.01 0.15 -0.98 -0.85 0.00 0.00 174.74 173.07 2eul s ARG 133 N -4.05 1.96 0.21 1.40 1.70 -1.26 0.70 118.95 119.61 2eul s ARG 133 Ca 0.45 -2.20 -0.31 0.00 -0.47 0.00 0.00 55.73 53.20 2eul s ARG 133 Cb -0.03 -0.53 -0.10 0.00 -0.57 0.00 0.00 34.95 33.72 2eul s ARG 133 CO 0.27 -0.52 1.55 0.08 -1.08 0.00 0.00 175.30 175.59 2eul s VAL 134 N -3.20 2.49 0.00 4.99 1.01 -1.26 -2.38 120.40 122.05 2eul s VAL 134 Ca 0.23 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.59 2eul s VAL 134 Cb 0.02 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2eul s VAL 134 CO 0.15 0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.91 2eul n GLY 135 N 3.05 2.08 3.73 4.51 0.00 -0.71 -4.62 105.19 113.23 2eul n GLY 135 Ca 0.11 -0.55 -0.35 0.00 0.00 0.00 0.00 46.02 45.23 2eul n GLY 135 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2eul s ASP 136 N -0.25 4.43 -0.09 1.61 1.01 -1.00 -1.95 116.67 120.44 2eul s ASP 136 Ca 0.00 2.38 0.03 0.00 0.71 0.00 0.00 52.55 55.67 2eul s ASP 136 Cb 0.00 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.34 2eul s ASP 136 CO 0.00 -2.10 -0.19 -0.69 0.21 0.00 0.00 175.17 172.39 2eul s VAL 137 N -1.87 1.69 -0.03 -1.27 1.01 -1.26 -1.45 120.40 117.23 2eul s VAL 137 Ca 0.75 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.98 2eul s VAL 137 Cb -0.30 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 2eul s VAL 137 CO 0.43 0.48 -0.17 -0.76 0.00 0.00 0.00 175.10 175.08 2eul s LEU 138 N 0.47 1.97 -0.18 3.92 1.43 0.45 -4.87 118.68 121.87 2eul s LEU 138 Ca -0.17 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.37 2eul s LEU 138 Cb -0.17 -0.89 -0.02 0.00 0.03 0.00 0.00 46.19 45.14 2eul s LEU 138 CO 0.07 0.18 0.78 -0.55 0.23 0.00 0.00 176.35 177.06 2eul s SER 139 N -0.19 6.88 -0.16 2.29 0.15 -1.26 -0.90 113.70 120.52 2eul s SER 139 Ca 0.02 1.08 -0.01 0.00 0.70 0.00 0.00 55.95 57.74 2eul s SER 139 Cb -0.09 -2.43 -0.01 0.00 -1.71 0.00 0.00 66.02 61.79 2eul s SER 139 CO 0.01 -0.37 -0.13 -0.76 1.20 0.00 0.00 173.24 173.19 2eul s LEU 140 N 2.11 2.64 0.32 3.45 1.43 0.74 -4.97 118.68 124.40 2eul s LEU 140 Ca 0.36 -0.40 -0.27 0.00 -1.03 0.00 0.00 54.13 52.78 2eul s LEU 140 Cb -0.16 -1.61 -0.13 0.00 0.03 0.00 0.00 46.19 44.31 2eul s LEU 140 CO 0.12 0.10 1.05 -0.67 0.23 0.00 0.00 176.35 177.17 2eul n ASP 141 N 3.99 1.50 -3.73 2.29 4.64 -1.26 -2.59 116.55 121.40 2eul n ASP 141 Ca -0.19 1.16 -0.13 0.00 -1.38 0.00 0.00 54.79 54.25 2eul n ASP 141 Cb 0.52 -1.33 -0.10 0.00 -1.04 0.00 0.00 41.12 39.17 2eul n ASP 141 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 2eul s THR 142 N -1.11 0.00 0.21 5.18 2.01 -1.26 -4.87 115.64 115.80 2eul s THR 142 Ca 0.59 -0.02 -0.09 0.00 0.31 0.00 0.00 61.69 62.48 2eul s THR 142 Cb -0.65 -0.59 0.15 0.00 0.01 0.00 0.00 72.50 71.42 2eul s THR 142 CO 0.60 -0.01 1.80 -0.65 -0.69 0.00 0.00 174.62 175.66 2eul h PRO 143 N 5.39 1.13 0.00 4.92 0.11 -2.03 -2.74 132.00 138.78 2eul h PRO 143 Ca -0.27 -0.17 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2eul h PRO 143 Cb 1.18 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2eul h PRO 143 CO 0.25 0.88 -0.36 1.57 -0.21 0.00 0.00 178.00 180.13 2eul h LYS 144 N 1.10 0.00 0.00 1.05 -0.00 -2.01 -3.46 116.57 113.25 2eul h LYS 144 Ca 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.92 2eul h LYS 144 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.37 2eul h LYS 144 CO -0.03 0.36 0.00 0.41 -0.00 0.00 0.00 179.45 180.19 2eul n GLY 145 N 0.07 2.90 3.60 0.07 0.00 -1.03 -5.07 105.19 105.72 2eul n GLY 145 Ca -0.01 0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 2eul n GLY 145 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2eul n ARG 146 N 0.00 2.02 -3.77 1.61 0.63 -1.26 -4.25 116.66 111.64 2eul n ARG 146 Ca 0.00 0.60 -0.21 0.00 -0.92 0.00 0.00 57.85 57.32 2eul n ARG 146 Cb 0.00 -3.10 -0.03 0.00 0.45 0.00 0.00 32.46 29.79 2eul n ARG 146 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2eul s ARG 147 N 5.95 2.91 -0.09 -0.14 0.52 -1.07 -4.89 118.95 122.14 2eul s ARG 147 Ca 1.00 -1.15 0.02 0.00 -0.52 0.00 0.00 55.73 55.08 2eul s ARG 147 Cb -0.42 -2.61 -0.02 0.00 0.52 0.00 0.00 34.95 32.42 2eul s ARG 147 CO 0.38 0.15 -0.16 -1.21 0.02 0.00 0.00 175.30 174.49 2eul s GLU 148 N -4.02 2.97 0.19 3.54 2.02 -1.26 -0.19 118.70 121.96 2eul s GLU 148 Ca 0.40 -0.73 0.11 0.00 0.02 0.00 0.00 54.97 54.78 2eul s GLU 148 Cb -0.07 -2.47 -0.04 0.00 0.10 0.00 0.00 34.13 31.65 2eul s GLU 148 CO 0.28 0.37 -0.22 -0.06 0.02 0.00 0.00 175.26 175.65 2eul s PHE 149 N -0.07 2.36 -0.10 1.61 0.40 -0.08 -4.20 117.98 117.90 2eul s PHE 149 Ca -0.03 -0.34 -0.00 0.00 -0.60 0.00 0.00 56.93 55.96 2eul s PHE 149 Cb -0.14 -1.16 -0.03 0.00 0.51 0.00 0.00 43.02 42.20 2eul s PHE 149 CO 0.04 0.51 -0.07 0.50 0.70 0.00 0.00 175.22 176.89 2eul s ARG 150 N -2.72 3.05 -0.62 0.44 3.52 -0.02 -0.41 118.95 122.18 2eul s ARG 150 Ca 0.22 -0.57 -0.28 0.00 -0.13 0.00 0.00 55.73 54.97 2eul s ARG 150 Cb -0.08 -2.66 0.03 0.00 -1.56 0.00 0.00 34.95 30.67 2eul s ARG 150 CO 0.11 0.50 1.26 0.08 -0.81 0.00 0.00 175.30 176.44 2eul s VAL 151 N -0.36 3.89 0.09 7.11 1.01 -0.53 -1.73 120.40 129.89 2eul s VAL 151 Ca 0.05 0.73 -0.04 0.00 0.00 0.00 0.00 61.98 62.73 2eul s VAL 151 Cb -0.12 -4.72 -0.26 0.00 0.00 0.00 0.00 36.38 31.27 2eul s VAL 151 CO 0.02 -1.44 1.17 0.58 0.00 0.00 0.00 175.10 175.44 2eul h VAL 152 N 6.17 1.50 -1.34 2.92 2.07 -1.67 -1.88 116.25 124.02 2eul h VAL 152 Ca -0.26 -3.00 0.19 0.00 0.82 0.00 0.00 66.70 64.45 2eul h VAL 152 Cb 1.06 2.87 -0.24 0.00 -1.52 0.00 0.00 31.29 33.46 2eul h VAL 152 CO 1.21 0.88 0.78 0.00 0.02 0.00 0.00 177.57 180.45 2eul s ALA 153 N -2.75 -2.04 -0.71 1.67 0.00 -1.23 -4.86 121.76 111.85 2eul s ALA 153 Ca -0.04 1.71 0.05 0.00 0.00 0.00 0.00 51.96 53.68 2eul s ALA 153 Cb 0.07 -0.91 0.20 0.00 0.00 0.00 0.00 23.12 22.48 2eul s ALA 153 CO 0.88 -0.35 0.60 -0.89 0.00 0.00 0.00 175.76 175.99 2eul n ILE 154 N 0.44 1.98 0.29 0.00 5.41 -1.26 -1.49 119.36 124.74 2eul n ILE 154 Ca -0.04 -5.00 0.17 0.00 1.00 0.00 0.00 62.75 58.89 2eul n ILE 154 Cb 0.58 -2.18 0.85 0.00 -0.71 0.00 0.00 39.64 38.18 2eul n ILE 154 CO 0.00 0.00 0.00 -0.74 0.00 0.00 0.00 176.55 175.81 2eul h HIS 155 N 5.11 0.00 -0.01 1.39 2.76 -1.82 -3.45 115.15 119.13 2eul h HIS 155 Ca 0.16 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2eul h HIS 155 Cb 0.73 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.69 2eul h HIS 155 CO 0.70 0.00 0.00 0.41 -1.30 0.00 0.00 177.93 177.74