#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axx n LYS 2 N 0.00 0.00 -0.70 -0.67 5.02 -1.26 -5.05 118.16 115.50 2axx n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2axx n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2axx n LYS 2 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2axx n ASP 3 N -1.67 -1.72 0.00 4.39 2.03 -1.26 -5.10 116.55 113.22 2axx n ASP 3 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2axx n ASP 3 Cb 0.00 -0.86 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 2axx n ASP 3 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2axx n VAL 4 N 0.42 0.00 -2.94 5.18 0.31 -1.26 -4.96 118.33 115.09 2axx n VAL 4 Ca 0.00 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.20 2axx n VAL 4 Cb 0.00 -0.02 0.03 0.00 -0.91 0.00 0.00 33.84 32.94 2axx n VAL 4 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2axx n LYS 5 N 0.00 0.95 -2.25 5.55 5.02 -1.26 -5.01 118.16 121.16 2axx n LYS 5 Ca 0.00 -2.54 -0.42 0.00 -2.02 0.00 0.00 58.31 53.33 2axx n LYS 5 Cb 0.00 -1.34 -0.02 0.00 -0.02 0.00 0.00 35.03 33.65 2axx n LYS 5 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2axx s TYR 6 N -0.78 2.16 -0.07 2.13 2.02 -1.26 -0.70 117.35 120.85 2axx s TYR 6 Ca 0.31 0.62 -0.01 0.00 -0.37 0.00 0.00 57.07 57.62 2axx s TYR 6 Cb 0.29 -4.27 -0.03 0.00 -0.40 0.00 0.00 41.96 37.55 2axx s TYR 6 CO -0.09 -2.24 0.00 0.71 -1.57 0.00 0.00 175.55 172.37 2axx s TYR 7 N 6.29 3.15 0.53 2.71 2.02 0.31 -4.68 117.35 127.67 2axx s TYR 7 Ca 0.64 0.17 -0.09 0.00 -0.37 0.00 0.00 57.07 57.42 2axx s TYR 7 Cb -0.15 -1.77 -0.04 0.00 -0.40 0.00 0.00 41.96 39.60 2axx s TYR 7 CO 0.30 0.47 0.89 0.95 -1.57 0.00 0.00 175.55 176.59 2axx s THR 8 N -0.92 4.79 0.12 -0.71 -4.23 -1.26 -0.44 115.64 112.99 2axx s THR 8 Ca 0.14 0.58 -0.26 0.00 -1.18 0.00 0.00 61.69 60.97 2axx s THR 8 Cb -0.11 -3.84 -0.07 0.00 1.34 0.00 0.00 72.50 69.82 2axx s THR 8 CO 0.04 -0.91 1.64 -0.07 -0.54 0.00 0.00 174.62 174.77 2axx h LEU 9 N 0.19 -0.72 -0.58 4.79 -0.00 -1.99 -0.61 115.31 116.40 2axx h LEU 9 Ca -0.46 0.09 0.08 0.00 -0.00 0.00 0.00 57.88 57.59 2axx h LEU 9 Cb 1.20 0.28 -0.06 0.00 -0.00 0.00 0.00 40.66 42.07 2axx h LEU 9 CO 0.62 -0.33 0.24 -0.08 -0.00 0.00 0.00 178.44 178.89 2axx h GLU 10 N -0.42 0.42 0.47 1.13 4.81 -1.97 0.27 114.58 119.29 2axx h GLU 10 Ca 0.04 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 2axx h GLU 10 Cb 0.47 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.76 2axx h GLU 10 CO -0.18 0.28 -0.23 1.49 -0.73 0.00 0.00 179.01 179.64 2axx h GLU 11 N 0.44 -0.61 -0.92 1.92 4.81 -1.85 -1.08 114.58 117.28 2axx h GLU 11 Ca 0.28 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.59 2axx h GLU 11 Cb 0.31 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.77 2axx h GLU 11 CO -0.26 -0.37 0.60 0.82 -0.73 0.00 0.00 179.01 179.06 2axx h ILE 12 N -0.71 1.15 0.00 2.32 2.04 -0.71 0.14 117.51 121.73 2axx h ILE 12 Ca -0.07 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 2axx h ILE 12 Cb 0.53 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2axx h ILE 12 CO 0.11 0.21 -0.04 -0.61 0.00 0.00 0.00 178.15 177.81 2axx h GLN 13 N 1.15 0.00 -0.26 2.37 4.15 -0.27 0.25 115.11 122.50 2axx h GLN 13 Ca 0.37 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.66 2axx h GLN 13 Cb 0.01 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 2axx h GLN 13 CO -0.12 0.04 -0.37 -0.22 -1.93 0.00 0.00 178.83 176.23 2axx h LYS 14 N 0.00 0.59 -2.68 1.69 1.63 0.37 -3.23 116.57 114.95 2axx h LYS 14 Ca -0.00 -0.28 -0.35 0.00 -0.85 0.00 0.00 60.65 59.16 2axx h LYS 14 Cb 0.13 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 2axx h LYS 14 CO 0.01 0.87 1.56 0.72 -3.45 0.00 0.00 179.45 179.15 2axx n HIS 15 N -4.05 0.99 -3.20 1.91 8.25 0.08 -4.33 115.22 114.87 2axx n HIS 15 Ca -0.01 -1.93 -0.23 0.00 -0.26 0.00 0.00 57.72 55.28 2axx n HIS 15 Cb 0.50 -1.77 -0.06 0.00 1.12 0.00 0.00 29.99 29.78 2axx n HIS 15 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2axx n LYS 16 N 3.21 1.53 -3.59 -0.41 4.81 -1.22 -2.92 118.16 119.57 2axx n LYS 16 Ca 0.50 -3.80 -0.11 0.00 -0.87 0.00 0.00 58.31 54.03 2axx n LYS 16 Cb 0.47 -1.72 -0.01 0.00 0.02 0.00 0.00 35.03 33.80 2axx n LYS 16 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2axx n ASP 17 N 0.73 -1.49 -1.96 3.14 -0.08 -1.26 -4.98 116.55 110.64 2axx n ASP 17 Ca 0.25 -2.57 -0.07 0.00 -1.51 0.00 0.00 54.79 50.89 2axx n ASP 17 Cb 0.52 2.64 -0.10 0.00 2.34 0.00 0.00 41.12 46.51 2axx n ASP 17 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 2axx n SER 18 N -1.60 4.32 -2.75 1.67 2.88 -1.26 -4.25 113.62 112.63 2axx n SER 18 Ca -0.02 -2.27 -0.08 0.00 -1.33 0.00 0.00 58.87 55.17 2axx n SER 18 Cb 0.52 -1.11 0.05 0.00 -0.75 0.00 0.00 64.21 62.92 2axx n SER 18 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2axx n LYS 19 N 2.34 0.76 -0.41 -1.46 0.00 -1.26 -5.08 118.16 113.05 2axx n LYS 19 Ca 0.26 -1.74 0.00 0.00 0.00 0.00 0.00 58.31 56.83 2axx n LYS 19 Cb 0.67 -1.46 0.00 0.00 0.00 0.00 0.00 35.03 34.24 2axx n LYS 19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2axx n SER 20 N 1.72 -1.31 -4.29 3.14 2.88 -1.26 -4.95 113.62 109.55 2axx n SER 20 Ca 0.09 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.19 2axx n SER 20 Cb 0.63 -0.66 -0.07 0.00 -0.75 0.00 0.00 64.21 63.37 2axx n SER 20 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2axx s THR 21 N 0.00 4.89 0.21 2.46 2.01 -1.26 -4.58 115.64 119.37 2axx s THR 21 Ca 0.00 -1.51 -0.02 0.00 0.31 0.00 0.00 61.69 60.47 2axx s THR 21 Cb 0.00 -4.12 -0.05 0.00 0.01 0.00 0.00 72.50 68.35 2axx s THR 21 CO 0.00 -0.78 0.42 0.26 -0.69 0.00 0.00 174.62 173.83 2axx s TRP 22 N 1.53 3.48 -0.03 4.92 0.52 -1.24 -3.06 118.94 125.06 2axx s TRP 22 Ca 0.04 0.42 -0.18 0.00 0.02 0.00 0.00 56.10 56.40 2axx s TRP 22 Cb -0.28 -1.91 0.03 0.00 -1.15 0.00 0.00 33.47 30.16 2axx s TRP 22 CO 0.02 0.35 0.39 0.14 0.02 0.00 0.00 176.95 177.87 2axx s VAL 23 N -1.89 0.04 -0.17 4.03 -7.23 -1.01 -0.42 120.40 113.76 2axx s VAL 23 Ca 0.40 -0.35 0.01 0.00 -1.81 0.00 0.00 61.98 60.22 2axx s VAL 23 Cb -0.11 -0.69 0.01 0.00 0.56 0.00 0.00 36.38 36.15 2axx s VAL 23 CO 0.29 -0.19 -0.18 0.27 -0.31 0.00 0.00 175.10 174.97 2axx s ILE 24 N -1.20 2.31 -0.30 -0.62 -5.25 -1.26 -0.83 121.20 114.05 2axx s ILE 24 Ca -0.12 -0.87 0.02 0.00 -0.99 0.00 0.00 60.65 58.68 2axx s ILE 24 Cb -0.04 -1.97 0.09 0.00 2.95 0.00 0.00 42.46 43.49 2axx s ILE 24 CO 0.05 0.53 0.03 -0.76 -1.79 0.00 0.00 174.94 173.00 2axx s LEU 25 N 1.10 3.33 -0.72 0.37 1.43 -0.64 -2.57 118.68 120.98 2axx s LEU 25 Ca -0.00 -1.70 -0.03 0.00 -1.03 0.00 0.00 54.13 51.37 2axx s LEU 25 Cb -0.14 -1.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.78 2axx s LEU 25 CO -0.07 -0.34 0.64 1.41 0.23 0.00 0.00 176.35 178.22 2axx n HIS 26 N 4.56 -1.99 -3.84 0.29 8.25 -1.26 -3.88 115.22 117.34 2axx n HIS 26 Ca -0.03 0.72 -0.24 0.00 -0.26 0.00 0.00 57.72 57.91 2axx n HIS 26 Cb 0.43 -3.65 0.00 0.00 1.12 0.00 0.00 29.99 27.89 2axx n HIS 26 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2axx n HIS 27 N -2.41 -1.77 -3.66 4.41 8.25 -1.26 -4.97 115.22 113.82 2axx n HIS 27 Ca -0.04 0.79 -0.05 0.00 -0.26 0.00 0.00 57.72 58.16 2axx n HIS 27 Cb 0.56 -4.03 -0.07 0.00 1.12 0.00 0.00 29.99 27.58 2axx n HIS 27 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2axx s LYS 28 N -6.30 0.51 -0.20 -0.41 2.47 -1.25 -4.14 119.74 110.41 2axx s LYS 28 Ca 0.01 1.23 -0.16 0.00 -1.56 0.00 0.00 55.97 55.49 2axx s LYS 28 Cb -0.01 0.50 -0.04 0.00 -1.46 0.00 0.00 37.83 36.83 2axx s LYS 28 CO 0.85 -0.20 0.40 0.08 0.16 0.00 0.00 175.35 176.65 2axx s VAL 29 N 2.45 5.20 -0.12 4.02 1.01 0.18 -1.62 120.40 131.52 2axx s VAL 29 Ca -0.06 0.72 0.02 0.00 0.00 0.00 0.00 61.98 62.66 2axx s VAL 29 Cb -0.10 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 2axx s VAL 29 CO -0.17 0.25 -0.18 -0.31 0.00 0.00 0.00 175.10 174.69 2axx s TYR 30 N 1.29 2.69 -0.43 5.22 2.02 -0.01 -1.78 117.35 126.36 2axx s TYR 30 Ca 0.19 -0.90 -0.20 0.00 -0.37 0.00 0.00 57.07 55.79 2axx s TYR 30 Cb -0.15 -1.79 0.02 0.00 -0.40 0.00 0.00 41.96 39.64 2axx s TYR 30 CO 0.08 -0.35 0.63 0.34 -1.57 0.00 0.00 175.55 174.68 2axx s ASP 31 N 0.42 6.33 0.00 2.29 2.15 -0.83 -2.41 116.67 124.61 2axx s ASP 31 Ca -0.14 -0.29 0.00 0.00 0.43 0.00 0.00 52.55 52.55 2axx s ASP 31 Cb -0.17 -2.31 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 2axx s ASP 31 CO 0.06 -0.74 0.00 0.18 -0.17 0.00 0.00 175.17 174.50 2axx n LEU 32 N 6.19 0.36 0.00 -1.34 4.77 -1.17 -4.82 117.00 120.99 2axx n LEU 32 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2axx n LEU 32 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2axx n LEU 32 CO 0.52 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.99 2axx n THR 33 N -0.21 0.00 1.61 -5.08 -1.04 -1.24 -3.02 114.28 105.29 2axx n THR 33 Ca 0.00 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.15 2axx n THR 33 Cb 0.00 0.00 0.78 0.00 -1.82 0.00 0.00 70.33 69.29 2axx n THR 33 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2axx n LYS 34 N 0.00 0.75 -0.00 -2.82 5.02 -1.26 -2.75 118.16 117.10 2axx n LYS 34 Ca 0.00 0.01 0.09 0.00 -2.02 0.00 0.00 58.31 56.38 2axx n LYS 34 Cb 0.00 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.41 2axx n LYS 34 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2axx n PHE 35 N -1.06 0.00 -0.21 2.13 7.35 -1.17 -4.63 117.46 119.87 2axx n PHE 35 Ca 0.19 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.88 2axx n PHE 35 Cb 0.12 -0.01 0.08 0.00 0.35 0.00 0.00 39.48 40.02 2axx n PHE 35 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2axx h LEU 36 N 0.00 -0.49 -0.15 -2.13 3.38 -1.80 0.13 115.31 114.24 2axx h LEU 36 Ca 0.00 0.18 -0.10 0.00 0.09 0.00 0.00 57.88 58.05 2axx h LEU 36 Cb 0.43 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2axx h LEU 36 CO 0.00 -0.18 -0.29 -0.33 0.09 0.00 0.00 178.44 177.73 2axx h GLU 37 N 0.03 0.46 -0.58 1.13 5.08 -1.84 -2.52 114.58 116.35 2axx h GLU 37 Ca 0.31 -0.29 0.08 0.00 -1.00 0.00 0.00 59.36 58.46 2axx h GLU 37 Cb 0.49 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.70 2axx h GLU 37 CO -0.61 0.90 0.22 0.93 -1.00 0.00 0.00 179.01 179.45 2axx h GLU 38 N 0.08 0.40 -5.76 2.33 5.08 -1.43 -3.43 114.58 111.85 2axx h GLU 38 Ca 0.01 -0.02 -0.70 0.00 -1.00 0.00 0.00 59.36 57.65 2axx h GLU 38 Cb 0.88 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.99 2axx h GLU 38 CO 0.06 0.26 1.43 1.58 -1.00 0.00 0.00 179.01 181.35 2axx n HIS 39 N -4.99 1.05 -1.93 4.33 -0.00 0.31 -4.75 115.22 109.23 2axx n HIS 39 Ca 0.08 0.64 -0.33 0.00 0.46 0.00 0.00 57.72 58.57 2axx n HIS 39 Cb 0.25 -2.33 -0.05 0.00 -0.12 0.00 0.00 29.99 27.74 2axx n HIS 39 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2axx n PRO 40 N 7.80 1.78 0.00 1.57 -0.04 -1.26 -0.58 135.00 144.27 2axx n PRO 40 Ca 0.57 -2.44 0.00 0.00 -0.04 0.00 0.00 63.50 61.59 2axx n PRO 40 Cb -0.00 -3.53 0.00 0.00 -0.04 0.00 0.00 33.50 29.92 2axx n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2axx n GLY 41 N 5.45 1.25 0.00 0.55 0.00 -1.26 -5.17 105.19 106.01 2axx n GLY 41 Ca 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.39 2axx n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2axx n GLY 42 N 0.00 3.35 0.12 -0.02 0.00 0.25 -4.83 105.19 104.06 2axx n GLY 42 Ca 0.00 -1.77 -0.08 0.00 0.00 0.00 0.00 46.02 44.17 2axx n GLY 42 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2axx h GLU 43 N 0.00 -0.18 -0.07 1.61 4.22 -1.72 -3.34 114.58 115.10 2axx h GLU 43 Ca 0.00 0.01 0.04 0.00 0.08 0.00 0.00 59.36 59.49 2axx h GLU 43 Cb 0.00 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.24 2axx h GLU 43 CO 0.00 0.18 -0.25 1.49 -2.18 0.00 0.00 179.01 178.24 2axx h GLU 44 N -0.97 -0.34 -0.99 1.92 4.81 -1.91 0.27 114.58 117.37 2axx h GLU 44 Ca -0.02 0.02 0.20 0.00 -0.13 0.00 0.00 59.36 59.44 2axx h GLU 44 Cb 0.44 0.08 -0.10 0.00 0.63 0.00 0.00 28.75 29.80 2axx h GLU 44 CO 0.03 -0.23 0.62 -0.39 -0.73 0.00 0.00 179.01 178.31 2axx h VAL 45 N -0.35 0.67 -0.09 0.32 -1.51 -1.88 0.65 116.25 114.06 2axx h VAL 45 Ca 0.08 -0.22 -0.04 0.00 -1.23 0.00 0.00 66.70 65.30 2axx h VAL 45 Cb 0.47 -0.01 -0.00 0.00 -2.13 0.00 0.00 31.29 29.62 2axx h VAL 45 CO -0.27 0.11 -0.11 0.25 -1.23 0.00 0.00 177.57 176.32 2axx h LEU 46 N 0.63 0.24 -1.93 4.19 7.12 -0.73 -3.22 115.31 121.61 2axx h LEU 46 Ca 0.56 -0.51 -0.01 0.00 0.13 0.00 0.00 57.88 58.04 2axx h LEU 46 Cb 1.06 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 41.11 2axx h LEU 46 CO -0.32 0.71 0.02 -1.14 -0.13 0.00 0.00 178.44 177.57 2axx n ARG 47 N -4.65 2.25 -0.02 1.25 0.00 0.36 -3.67 116.66 112.19 2axx n ARG 47 Ca -0.07 -1.06 -0.17 0.00 -0.00 0.00 0.00 57.85 56.54 2axx n ARG 47 Cb 0.34 -1.73 -0.14 0.00 0.00 0.00 0.00 32.46 30.93 2axx n ARG 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2axx h GLU 48 N 1.27 0.14 0.00 -0.14 4.39 -0.96 -3.42 114.58 115.85 2axx h GLU 48 Ca 0.02 -0.23 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 2axx h GLU 48 Cb 1.06 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 29.79 2axx h GLU 48 CO 0.18 1.11 -1.06 1.04 -1.16 0.00 0.00 179.01 179.12 2axx n GLN 49 N -4.38 0.53 0.00 2.33 1.13 -1.26 -5.08 117.38 110.66 2axx n GLN 49 Ca -0.13 0.23 0.00 0.00 -1.94 0.00 0.00 57.00 55.16 2axx n GLN 49 Cb 0.64 -1.44 0.00 0.00 0.11 0.00 0.00 30.24 29.55 2axx n GLN 49 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2axx n ALA 50 N -4.41 0.00 -1.68 -1.58 0.00 -1.24 -4.81 120.51 106.79 2axx n ALA 50 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.14 2axx n ALA 50 Cb 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 2axx n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2axx n GLY 51 N 0.00 0.84 3.27 0.00 0.00 0.44 -0.85 105.19 108.89 2axx n GLY 51 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2axx n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2axx n GLY 52 N -0.41 -0.31 2.75 -0.02 0.00 -1.12 -3.25 105.19 102.82 2axx n GLY 52 Ca -0.15 0.06 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 2axx n GLY 52 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2axx n ASP 53 N -2.97 0.20 0.01 1.61 5.68 -0.03 -4.58 116.55 116.48 2axx n ASP 53 Ca -0.26 -2.21 0.11 0.00 -0.50 0.00 0.00 54.79 51.93 2axx n ASP 53 Cb 0.66 0.05 -0.08 0.00 -1.14 0.00 0.00 41.12 40.61 2axx n ASP 53 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2axx n ALA 54 N -0.86 3.50 -0.18 2.12 0.00 -1.24 -4.60 120.51 119.24 2axx n ALA 54 Ca -0.02 -0.48 -0.04 0.00 0.00 0.00 0.00 53.44 52.89 2axx n ALA 54 Cb 0.83 -0.86 0.02 0.00 0.00 0.00 0.00 19.45 19.44 2axx n ALA 54 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2axx h THR 55 N 0.00 0.25 -0.76 0.00 2.02 -1.86 0.18 112.91 112.74 2axx h THR 55 Ca 0.00 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.31 2axx h THR 55 Cb 0.77 0.25 -0.14 0.00 -1.74 0.00 0.00 68.15 67.30 2axx h THR 55 CO 0.00 0.00 -0.33 -0.33 0.37 0.00 0.00 175.52 175.23 2axx h GLU 56 N -0.14 -0.08 -0.18 6.66 3.07 -1.91 0.54 114.58 122.55 2axx h GLU 56 Ca 0.24 0.01 -0.15 0.00 -0.50 0.00 0.00 59.36 58.95 2axx h GLU 56 Cb 0.52 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 2axx h GLU 56 CO -0.62 -0.05 -0.47 -0.97 -1.40 0.00 0.00 179.01 175.49 2axx h ASN 57 N -0.08 0.73 -0.61 1.42 -0.73 -1.14 0.16 115.58 115.33 2axx h ASN 57 Ca 0.30 -0.58 0.06 0.00 1.87 0.00 0.00 56.30 57.95 2axx h ASN 57 Cb 0.58 -0.21 -0.05 0.00 0.27 0.00 0.00 38.32 38.90 2axx h ASN 57 CO -0.81 1.17 0.32 0.15 -0.37 0.00 0.00 177.43 177.89 2axx h PHE 58 N 0.31 0.58 0.00 0.67 3.57 -0.34 -2.97 116.94 118.76 2axx h PHE 58 Ca -0.01 0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.32 2axx h PHE 58 Cb 1.09 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.63 2axx h PHE 58 CO 0.09 0.27 -0.94 0.93 -2.23 0.00 0.00 178.31 176.44 2axx h GLU 59 N 0.59 0.00 -0.87 1.11 4.39 -0.74 0.25 114.58 119.31 2axx h GLU 59 Ca 0.27 0.00 0.23 0.00 0.34 0.00 0.00 59.36 60.20 2axx h GLU 59 Cb 0.19 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 28.70 2axx h GLU 59 CO -0.19 0.94 0.22 0.22 -1.16 0.00 0.00 179.01 179.04 2axx h ASP 60 N 0.00 -0.03 0.22 1.42 3.58 -0.53 -1.26 116.42 119.82 2axx h ASP 60 Ca -0.01 0.20 -0.35 0.00 0.42 0.00 0.00 57.03 57.29 2axx h ASP 60 Cb 1.71 0.27 0.01 0.00 1.72 0.00 0.00 39.33 43.05 2axx h ASP 60 CO 0.12 -0.16 -1.71 0.58 -2.88 0.00 0.00 179.24 175.20 2axx h VAL 61 N 0.20 0.99 0.00 2.25 2.07 -1.49 -3.43 116.25 116.84 2axx h VAL 61 Ca 0.54 -2.56 0.00 0.00 0.82 0.00 0.00 66.70 65.50 2axx h VAL 61 Cb 1.08 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 33.65 2axx h VAL 61 CO -0.66 0.85 0.00 0.61 0.02 0.00 0.00 177.57 178.39 2axx n GLY 62 N 1.83 2.88 1.08 2.17 0.00 0.87 -4.96 105.19 109.06 2axx n GLY 62 Ca -0.23 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2axx n GLY 62 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2axx n HIS 63 N 0.00 -2.97 -1.67 1.61 8.25 -1.26 -4.71 115.22 114.47 2axx n HIS 63 Ca 0.00 1.59 -0.29 0.00 -0.26 0.00 0.00 57.72 58.76 2axx n HIS 63 Cb 0.00 -2.68 0.13 0.00 1.12 0.00 0.00 29.99 28.56 2axx n HIS 63 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2axx s SER 64 N -3.53 3.68 0.23 0.41 0.01 -1.26 -4.90 113.70 108.33 2axx s SER 64 Ca 0.00 0.83 -0.07 0.00 1.31 0.00 0.00 55.95 58.02 2axx s SER 64 Cb 0.00 -1.31 0.29 0.00 0.21 0.00 0.00 66.02 65.21 2axx s SER 64 CO 0.00 -2.43 1.83 0.00 0.41 0.00 0.00 173.24 173.05 2axx h THR 65 N -1.42 1.00 -0.85 1.44 1.03 -1.99 -2.50 112.91 109.63 2axx h THR 65 Ca -0.48 -0.28 0.12 0.00 -0.01 0.00 0.00 66.41 65.75 2axx h THR 65 Cb 1.32 0.10 -0.13 0.00 -1.07 0.00 0.00 68.15 68.37 2axx h THR 65 CO 0.60 0.15 -0.43 0.44 -0.01 0.00 0.00 175.52 176.27 2axx h ASP 66 N 0.83 -1.56 0.44 0.00 5.19 -1.98 0.23 116.42 119.55 2axx h ASP 66 Ca 0.34 0.29 -0.01 0.00 -0.62 0.00 0.00 57.03 57.03 2axx h ASP 66 Cb 0.18 0.76 -0.02 0.00 0.18 0.00 0.00 39.33 40.43 2axx h ASP 66 CO -0.18 -0.29 -0.39 0.00 -3.12 0.00 0.00 179.24 175.26 2axx h ALA 67 N 0.98 -0.87 -0.87 3.45 0.00 -1.83 0.11 119.26 120.23 2axx h ALA 67 Ca 0.26 -0.15 0.18 0.00 0.00 0.00 0.00 54.91 55.20 2axx h ALA 67 Cb 0.55 0.54 -0.11 0.00 0.00 0.00 0.00 17.79 18.77 2axx h ALA 67 CO -0.87 -1.02 0.43 0.00 0.00 0.00 0.00 179.25 177.78 2axx h ARG 68 N -0.83 0.53 -0.19 0.00 3.08 -0.64 0.25 114.38 116.58 2axx h ARG 68 Ca -0.04 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 2axx h ARG 68 Cb 0.72 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 2axx h ARG 68 CO -0.03 0.35 -0.19 0.93 -1.07 0.00 0.00 179.97 179.96 2axx h GLU 69 N 0.55 0.46 -0.99 0.04 5.08 -0.49 -3.08 114.58 116.15 2axx h GLU 69 Ca 0.50 -0.24 0.06 0.00 -1.00 0.00 0.00 59.36 58.67 2axx h GLU 69 Cb 0.81 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.01 2axx h GLU 69 CO -0.42 0.82 0.64 1.25 -1.00 0.00 0.00 179.01 180.29 2axx h LEU 70 N 0.13 1.04 -0.87 1.33 7.12 0.12 -0.96 115.31 123.22 2axx h LEU 70 Ca 0.03 0.00 0.21 0.00 0.13 0.00 0.00 57.88 58.25 2axx h LEU 70 Cb 0.73 -0.22 -0.12 0.00 -0.53 0.00 0.00 40.66 40.52 2axx h LEU 70 CO 0.05 0.68 0.34 0.28 -0.13 0.00 0.00 178.44 179.66 2axx h SER 71 N 1.19 0.26 -0.72 1.25 0.02 -0.52 -0.07 113.55 114.97 2axx h SER 71 Ca 0.42 0.15 0.07 0.00 -0.84 0.00 0.00 61.79 61.59 2axx h SER 71 Cb 0.11 0.15 -0.06 0.00 0.14 0.00 0.00 62.40 62.74 2axx h SER 71 CO -0.16 -0.01 0.39 0.11 -1.14 0.00 0.00 176.83 176.02 2axx h LYS 72 N 0.37 0.68 -0.08 3.45 1.57 -1.14 0.26 116.57 121.68 2axx h LYS 72 Ca 0.53 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.29 2axx h LYS 72 Cb 0.98 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 2axx h LYS 72 CO -0.53 0.45 0.21 1.15 -0.57 0.00 0.00 179.45 180.16 2axx h THR 73 N 0.70 0.18 -0.26 -0.16 2.02 -1.00 -1.04 112.91 113.35 2axx h THR 73 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.51 2axx h THR 73 Cb 0.26 0.81 0.00 0.00 -1.74 0.00 0.00 68.15 67.48 2axx h THR 73 CO -0.21 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.46 2axx n TYR 74 N -3.29 0.33 -2.02 3.16 4.01 0.80 -4.99 117.16 115.16 2axx n TYR 74 Ca -0.01 -0.22 -0.43 0.00 -0.16 0.00 0.00 57.90 57.09 2axx n TYR 74 Cb 0.29 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.29 2axx n TYR 74 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 2axx s ILE 75 N -1.27 3.54 -0.13 -0.72 -1.16 -0.40 -1.97 121.20 119.08 2axx s ILE 75 Ca 0.28 0.58 -0.07 0.00 -0.51 0.00 0.00 60.65 60.93 2axx s ILE 75 Cb 0.17 -3.61 -0.26 0.00 0.61 0.00 0.00 42.46 39.37 2axx s ILE 75 CO 0.24 -0.32 0.33 2.30 -2.81 0.00 0.00 174.94 174.68 2axx n ILE 76 N 6.88 1.77 -3.46 2.00 -5.35 -0.73 -4.94 119.36 115.52 2axx n ILE 76 Ca 0.21 -0.63 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 2axx n ILE 76 Cb 0.46 -1.73 0.00 0.00 -1.74 0.00 0.00 39.64 36.62 2axx n ILE 76 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2axx n GLY 77 N 1.99 0.70 3.48 3.28 0.00 -1.17 -4.54 105.19 108.93 2axx n GLY 77 Ca -0.33 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 2axx n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2axx s GLU 78 N -0.63 1.79 -0.00 1.61 2.02 0.12 -0.64 118.70 122.97 2axx s GLU 78 Ca 0.00 -2.05 -0.24 0.00 0.02 0.00 0.00 54.97 52.70 2axx s GLU 78 Cb 0.00 -0.70 -0.05 0.00 0.10 0.00 0.00 34.13 33.48 2axx s GLU 78 CO 0.00 -0.35 0.71 -1.17 0.02 0.00 0.00 175.26 174.47 2axx s LEU 79 N -3.55 4.40 0.11 1.80 0.20 -1.26 -0.53 118.68 119.84 2axx s LEU 79 Ca 0.29 1.31 -0.36 0.00 0.69 0.00 0.00 54.13 56.06 2axx s LEU 79 Cb 0.05 -3.13 -0.17 0.00 -0.43 0.00 0.00 46.19 42.52 2axx s LEU 79 CO 0.14 -0.02 1.29 1.57 -0.29 0.00 0.00 176.35 179.04 2axx n HIS 80 N 3.15 1.43 0.57 5.38 -0.00 0.42 -4.75 115.22 121.42 2axx n HIS 80 Ca -0.03 0.66 0.05 0.00 -0.00 0.00 0.00 57.72 58.40 2axx n HIS 80 Cb 0.51 -2.31 0.28 0.00 -0.00 0.00 0.00 29.99 28.47 2axx n HIS 80 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 2axx n PRO 81 N 2.29 0.26 -0.23 1.57 -0.04 -1.26 -2.09 135.00 135.50 2axx n PRO 81 Ca 0.18 0.06 -0.08 0.00 -0.04 0.00 0.00 63.50 63.61 2axx n PRO 81 Cb 0.20 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.20 2axx n PRO 81 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 2axx h ASP 82 N 0.00 1.06 -0.10 3.54 3.58 -1.99 -3.31 116.42 119.20 2axx h ASP 82 Ca 0.00 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.18 2axx h ASP 82 Cb 0.03 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 40.79 2axx h ASP 82 CO 0.00 1.06 -0.01 -0.67 -2.88 0.00 0.00 179.24 176.74 2axx n ASP 83 N -4.22 2.87 0.11 2.28 -0.08 -0.89 -4.61 116.55 112.01 2axx n ASP 83 Ca 0.04 -3.10 -0.04 0.00 -1.51 0.00 0.00 54.79 50.18 2axx n ASP 83 Cb 0.30 -0.48 0.10 0.00 2.34 0.00 0.00 41.12 43.38 2axx n ASP 83 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 2axx h ARG 84 N 0.67 0.07 -0.98 -0.67 0.11 -1.65 -3.32 114.38 108.61 2axx h ARG 84 Ca 0.00 -0.06 -0.66 0.00 0.10 0.00 0.00 59.98 59.37 2axx h ARG 84 Cb 1.17 0.01 -0.30 0.00 1.11 0.00 0.00 29.97 31.96 2axx h ARG 84 CO 0.08 0.74 0.74 0.45 0.10 0.00 0.00 179.97 182.09 2axx n SER 85 N -3.74 7.23 0.00 0.08 2.88 -1.26 -4.33 113.62 114.48 2axx n SER 85 Ca -0.02 -3.78 0.00 0.00 -1.33 0.00 0.00 58.87 53.75 2axx n SER 85 Cb 0.68 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 63.22 2axx n SER 85 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2axx n LYS 86 N -0.92 0.00 -1.61 -1.46 4.81 -1.25 -5.05 118.16 112.69 2axx n LYS 86 Ca 0.61 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.62 2axx n LYS 86 Cb 0.75 -0.24 -0.03 0.00 0.02 0.00 0.00 35.03 35.53 2axx n LYS 86 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 2axx n ILE 87 N -2.37 0.42 -2.15 3.15 2.08 -1.26 -4.97 119.36 114.27 2axx n ILE 87 Ca 0.00 -0.40 -0.27 0.00 0.56 0.00 0.00 62.75 62.64 2axx n ILE 87 Cb 0.10 -2.50 0.12 0.00 -0.75 0.00 0.00 39.64 36.61 2axx n ILE 87 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2axx s ALA 88 N 7.56 2.90 -0.15 -1.39 0.00 -1.26 -4.99 121.76 124.43 2axx s ALA 88 Ca 0.99 -1.12 -0.30 0.00 0.00 0.00 0.00 51.96 51.53 2axx s ALA 88 Cb -0.37 -2.59 -0.07 0.00 0.00 0.00 0.00 23.12 20.09 2axx s ALA 88 CO 0.37 -1.73 2.13 1.17 0.00 0.00 0.00 175.76 177.69 2axx n LYS 89 N -3.22 2.16 -2.36 0.00 0.00 -1.26 -4.94 118.16 108.54 2axx n LYS 89 Ca 0.12 0.68 -0.40 0.00 0.00 0.00 0.00 58.31 58.70 2axx n LYS 89 Cb 0.60 -3.07 -0.03 0.00 0.00 0.00 0.00 35.03 32.53 2axx n LYS 89 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2axx s PRO 90 N 5.67 4.44 -0.09 1.64 0.04 -1.26 -4.95 135.00 140.48 2axx s PRO 90 Ca 0.98 1.90 -0.30 0.00 0.04 0.00 0.00 61.00 63.62 2axx s PRO 90 Cb -0.43 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 2axx s PRO 90 CO 0.39 -0.00 1.56 0.45 0.04 0.00 0.00 177.00 179.44 2axx s SER 91 N -0.87 6.72 0.47 6.66 0.15 -1.26 -5.01 113.70 120.57 2axx s SER 91 Ca 0.49 2.08 -0.14 0.00 0.70 0.00 0.00 55.95 59.07 2axx s SER 91 Cb -0.33 -2.53 -0.07 0.00 -1.71 0.00 0.00 66.02 61.37 2axx s SER 91 CO 0.43 -0.90 0.90 -1.61 1.20 0.00 0.00 173.24 173.25 2axx s GLU 92 N 3.93 3.87 0.09 5.44 8.01 -1.26 -4.94 118.70 133.84 2axx s GLU 92 Ca 0.69 0.75 -0.04 0.00 0.01 0.00 0.00 54.97 56.38 2axx s GLU 92 Cb -0.30 -2.24 -0.03 0.00 -4.31 0.00 0.00 34.13 27.25 2axx s GLU 92 CO 0.26 -0.18 0.07 -0.08 0.01 0.00 0.00 175.26 175.34 2axx s THR 93 N -2.53 0.16 0.00 3.63 -1.32 -1.26 -5.09 115.64 109.23 2axx s THR 93 Ca 0.56 -1.64 0.00 0.00 -1.21 0.00 0.00 61.69 59.40 2axx s THR 93 Cb -0.10 -1.62 0.00 0.00 -1.51 0.00 0.00 72.50 69.27 2axx s THR 93 CO 0.32 -0.73 0.00 -0.11 -2.21 0.00 0.00 174.62 171.88