#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axx s LYS 2 N 0.00 2.03 0.00 -1.24 1.02 -1.26 -4.93 119.74 115.35 2axx s LYS 2 Ca 0.00 -0.53 0.00 0.00 0.02 0.00 0.00 55.97 55.46 2axx s LYS 2 Cb 0.00 -5.07 0.00 0.00 -0.52 0.00 0.00 37.83 32.24 2axx s LYS 2 CO 0.00 -4.32 0.00 -3.47 -0.92 0.00 0.00 175.35 166.64 2axx n ASP 3 N 16.34 0.00 0.00 2.83 -0.08 -1.26 -5.10 116.55 129.29 2axx n ASP 3 Ca 0.43 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.71 2axx n ASP 3 Cb 0.46 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.92 2axx n ASP 3 CO 0.00 0.00 0.00 0.52 0.12 0.00 0.00 177.20 177.84 2axx n VAL 4 N 0.00 0.00 -2.80 5.18 0.31 -1.26 -5.04 118.33 114.71 2axx n VAL 4 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.23 2axx n VAL 4 Cb 0.00 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.00 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 1.00 -2.78 5.55 4.01 -1.26 -4.93 118.16 119.76 2axx n LYS 5 Ca 0.00 -2.16 -0.43 0.00 -0.51 0.00 0.00 58.31 55.22 2axx n LYS 5 Cb 0.00 -1.15 -0.04 0.00 -0.51 0.00 0.00 35.03 33.33 2axx n LYS 5 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 2axx s TYR 6 N -0.14 2.98 0.01 2.13 2.02 -1.26 -1.44 117.35 121.65 2axx s TYR 6 Ca 0.25 0.63 0.05 0.00 -0.37 0.00 0.00 57.07 57.62 2axx s TYR 6 Cb 0.30 -3.89 -0.01 0.00 -0.40 0.00 0.00 41.96 37.95 2axx s TYR 6 CO -0.06 -1.00 -0.14 0.71 -1.57 0.00 0.00 175.55 173.49 2axx s TYR 7 N 3.73 1.26 0.77 2.71 2.02 -1.10 -4.82 117.35 121.92 2axx s TYR 7 Ca 0.39 -0.27 -0.10 0.00 -0.37 0.00 0.00 57.07 56.72 2axx s TYR 7 Cb -0.10 -0.79 0.07 0.00 -0.40 0.00 0.00 41.96 40.73 2axx s TYR 7 CO 0.23 -0.00 1.12 0.95 -1.57 0.00 0.00 175.55 176.28 2axx s THR 8 N -0.50 2.23 0.08 -0.71 -4.23 -1.26 -0.89 115.64 110.36 2axx s THR 8 Ca 0.04 -0.04 -0.36 0.00 -1.18 0.00 0.00 61.69 60.15 2axx s THR 8 Cb -0.06 -3.05 -0.18 0.00 1.34 0.00 0.00 72.50 70.55 2axx s THR 8 CO 0.00 -0.06 1.57 -0.07 -0.54 0.00 0.00 174.62 175.53 2axx h LEU 9 N -0.87 -1.26 -0.78 4.79 -0.00 -1.98 -0.28 115.31 114.92 2axx h LEU 9 Ca -0.45 0.09 0.14 0.00 -0.00 0.00 0.00 57.88 57.65 2axx h LEU 9 Cb 1.32 0.39 -0.09 0.00 -0.00 0.00 0.00 40.66 42.28 2axx h LEU 9 CO 0.64 -0.69 0.35 1.05 -0.00 0.00 0.00 178.44 179.79 2axx h GLU 10 N -1.07 0.49 0.39 1.13 4.11 -1.97 0.86 114.58 118.54 2axx h GLU 10 Ca -0.08 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.30 2axx h GLU 10 Cb 0.89 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.03 2axx h GLU 10 CO 0.02 0.33 -0.19 1.49 0.07 0.00 0.00 179.01 180.73 2axx h GLU 11 N 0.51 -0.51 -0.98 1.06 4.57 -1.85 -2.36 114.58 115.02 2axx h GLU 11 Ca 0.43 0.03 0.13 0.00 -1.18 0.00 0.00 59.36 58.78 2axx h GLU 11 Cb 0.63 0.12 -0.08 0.00 -0.16 0.00 0.00 28.75 29.25 2axx h GLU 11 CO -0.38 -0.28 0.62 0.82 -1.18 0.00 0.00 179.01 178.60 2axx h ILE 12 N -0.63 0.88 0.00 2.32 2.04 -0.48 0.22 117.51 121.86 2axx h ILE 12 Ca -0.05 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.50 2axx h ILE 12 Cb 0.46 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 2axx h ILE 12 CO 0.09 0.16 0.09 1.67 0.00 0.00 0.00 178.15 180.17 2axx n GLN 13 N -4.62 0.09 0.09 2.37 7.27 0.25 -0.68 117.38 122.14 2axx n GLN 13 Ca 0.19 0.57 -0.04 0.00 0.07 0.00 0.00 57.00 57.80 2axx n GLN 13 Cb 0.41 -1.90 -0.07 0.00 2.41 0.00 0.00 30.24 31.09 2axx n GLN 13 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 2axx h LYS 14 N 0.00 0.00 -3.05 3.69 1.79 -0.81 -3.39 116.57 114.80 2axx h LYS 14 Ca 0.00 0.00 -0.68 0.00 -2.18 0.00 0.00 60.65 57.79 2axx h LYS 14 Cb 0.19 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.85 2axx h LYS 14 CO 0.00 0.81 3.68 0.72 -1.08 0.00 0.00 179.45 183.58 2axx n HIS 15 N -3.29 2.53 -2.94 -1.35 8.25 0.14 -4.41 115.22 114.15 2axx n HIS 15 Ca 0.00 -3.07 -0.10 0.00 -0.26 0.00 0.00 57.72 54.30 2axx n HIS 15 Cb 0.87 -2.45 -0.02 0.00 1.12 0.00 0.00 29.99 29.51 2axx n HIS 15 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 2axx s LYS 16 N 1.97 1.02 0.00 -0.41 2.20 -1.19 -2.16 119.74 121.17 2axx s LYS 16 Ca 0.67 -1.32 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 2axx s LYS 16 Cb 0.18 -0.41 0.00 0.00 -1.51 0.00 0.00 37.83 36.09 2axx s LYS 16 CO -0.06 -1.34 0.00 -3.47 -0.36 0.00 0.00 175.35 170.11 2axx n ASP 17 N 2.96 0.00 -3.56 1.43 -0.08 -1.24 -4.96 116.55 111.11 2axx n ASP 17 Ca 0.21 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 53.38 2axx n ASP 17 Cb 0.54 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.95 2axx n ASP 17 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 2axx s SER 18 N -2.64 -0.41 -1.15 1.67 0.01 -1.26 -4.94 113.70 104.98 2axx s SER 18 Ca 0.00 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.63 2axx s SER 18 Cb 0.00 0.35 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2axx s SER 18 CO 0.00 -0.43 0.00 0.29 0.41 0.00 0.00 173.24 173.51 2axx n LYS 19 N 0.57 -2.03 -2.99 12.44 4.01 -1.26 -4.86 118.16 124.03 2axx n LYS 19 Ca -0.11 0.65 0.02 0.00 -0.51 0.00 0.00 58.31 58.36 2axx n LYS 19 Cb 0.59 -5.19 -0.00 0.00 -0.51 0.00 0.00 35.03 29.91 2axx n LYS 19 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 2axx s SER 20 N -2.04 -0.81 -0.58 4.39 0.01 -1.26 -5.01 113.70 108.40 2axx s SER 20 Ca 0.00 -0.27 0.02 0.00 1.31 0.00 0.00 55.95 57.01 2axx s SER 20 Cb 0.00 1.15 0.14 0.00 0.21 0.00 0.00 66.02 67.53 2axx s SER 20 CO 0.00 -0.11 0.35 -0.89 0.41 0.00 0.00 173.24 173.00 2axx s THR 21 N 2.18 2.99 0.31 1.44 2.01 -1.26 -3.15 115.64 120.17 2axx s THR 21 Ca 0.17 -3.32 -0.09 0.00 0.31 0.00 0.00 61.69 58.75 2axx s THR 21 Cb -0.01 -3.01 -0.07 0.00 0.01 0.00 0.00 72.50 69.42 2axx s THR 21 CO -0.15 -0.85 0.64 0.26 -0.69 0.00 0.00 174.62 173.84 2axx s TRP 22 N -0.36 3.44 -0.04 4.92 0.52 -0.95 -3.49 118.94 122.98 2axx s TRP 22 Ca 0.18 0.91 -0.12 0.00 0.02 0.00 0.00 56.10 57.10 2axx s TRP 22 Cb -0.22 -2.31 0.02 0.00 -1.15 0.00 0.00 33.47 29.80 2axx s TRP 22 CO -0.02 0.11 0.27 0.14 0.02 0.00 0.00 176.95 177.46 2axx s VAL 23 N -2.07 0.04 -0.23 4.03 -7.23 -0.92 0.18 120.40 114.20 2axx s VAL 23 Ca 0.49 -0.37 -0.01 0.00 -1.81 0.00 0.00 61.98 60.28 2axx s VAL 23 Cb -0.11 -0.51 0.02 0.00 0.56 0.00 0.00 36.38 36.34 2axx s VAL 23 CO 0.26 -0.20 -0.10 0.27 -0.31 0.00 0.00 175.10 175.02 2axx s ILE 24 N -0.86 2.67 -0.28 -0.62 -4.36 -1.26 -0.83 121.20 115.65 2axx s ILE 24 Ca -0.09 -0.97 0.03 0.00 -0.26 0.00 0.00 60.65 59.36 2axx s ILE 24 Cb -0.05 -2.29 0.07 0.00 1.25 0.00 0.00 42.46 41.45 2axx s ILE 24 CO 0.02 0.31 -0.04 -0.76 0.24 0.00 0.00 174.94 174.72 2axx s LEU 25 N 1.32 3.58 -0.96 0.37 1.43 -1.05 -2.17 118.68 121.21 2axx s LEU 25 Ca 0.02 -1.59 -0.05 0.00 -1.03 0.00 0.00 54.13 51.48 2axx s LEU 25 Cb -0.15 -1.46 -0.04 0.00 0.03 0.00 0.00 46.19 44.56 2axx s LEU 25 CO -0.07 -0.27 0.84 1.41 0.23 0.00 0.00 176.35 178.50 2axx n HIS 26 N 4.45 -2.58 -3.76 0.29 8.25 -1.26 -3.79 115.22 116.82 2axx n HIS 26 Ca -0.08 0.91 -0.28 0.00 -0.26 0.00 0.00 57.72 58.02 2axx n HIS 26 Cb 0.42 -4.06 0.02 0.00 1.12 0.00 0.00 29.99 27.50 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 -2.86 -1.83 -3.66 4.41 8.25 -1.26 -5.00 115.22 113.27 2axx n HIS 27 Ca -0.05 0.59 -0.07 0.00 -0.26 0.00 0.00 57.72 57.92 2axx n HIS 27 Cb 0.58 -3.66 -0.08 0.00 1.12 0.00 0.00 29.99 27.95 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 -6.14 0.59 -0.20 -0.41 2.47 -1.25 -4.36 119.74 110.44 2axx s LYS 28 Ca 0.27 1.12 -0.19 0.00 -1.56 0.00 0.00 55.97 55.61 2axx s LYS 28 Cb -0.09 0.18 -0.03 0.00 -1.46 0.00 0.00 37.83 36.43 2axx s LYS 28 CO 0.86 -0.16 0.54 0.08 0.16 0.00 0.00 175.35 176.83 2axx s VAL 29 N 1.76 5.09 -0.23 4.02 1.01 -0.37 -2.52 120.40 129.16 2axx s VAL 29 Ca -0.09 1.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.87 2axx s VAL 29 Cb -0.07 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.46 2axx s VAL 29 CO -0.18 0.16 -0.07 -0.31 0.00 0.00 0.00 175.10 174.71 2axx s TYR 30 N 1.69 2.98 -0.46 5.22 2.02 -0.01 -1.88 117.35 126.92 2axx s TYR 30 Ca 0.25 -1.30 -0.26 0.00 -0.37 0.00 0.00 57.07 55.39 2axx s TYR 30 Cb -0.16 -2.06 0.03 0.00 -0.40 0.00 0.00 41.96 39.37 2axx s TYR 30 CO 0.10 -0.66 0.93 0.34 -1.57 0.00 0.00 175.55 174.69 2axx s ASP 31 N 1.39 6.50 0.00 2.29 2.15 -1.14 -2.17 116.67 125.68 2axx s ASP 31 Ca 0.03 0.12 0.00 0.00 0.43 0.00 0.00 52.55 53.14 2axx s ASP 31 Cb -0.15 -2.45 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2axx s ASP 31 CO -0.05 -1.06 0.00 0.18 -0.17 0.00 0.00 175.17 174.07 2axx n LEU 32 N 7.20 0.00 0.00 -1.34 4.77 -1.23 -4.88 117.00 121.52 2axx n LEU 32 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2axx n LEU 32 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2axx n LEU 32 CO 0.64 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 177.11 2axx n THR 33 N 0.00 0.00 1.87 -5.08 -1.04 -1.24 -3.77 114.28 105.02 2axx n THR 33 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.05 2axx n THR 33 Cb 0.00 0.00 0.22 0.00 -1.82 0.00 0.00 70.33 68.73 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 1.10 0.00 -2.82 5.02 -1.26 -2.63 118.16 117.57 2axx n LYS 34 Ca 0.00 -0.16 0.05 0.00 -2.02 0.00 0.00 58.31 56.18 2axx n LYS 34 Cb 0.00 -1.14 -0.03 0.00 -0.02 0.00 0.00 35.03 33.84 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 -0.47 0.00 -0.17 2.13 7.35 -1.25 -4.71 117.46 120.34 2axx n PHE 35 Ca 0.06 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.74 2axx n PHE 35 Cb 0.06 0.00 0.07 0.00 0.35 0.00 0.00 39.48 39.96 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 0.40 -0.25 -0.07 -2.13 3.38 -1.82 0.21 115.31 115.03 2axx h LEU 36 Ca 0.00 0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 2axx h LEU 36 Cb 0.26 0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.25 2axx h LEU 36 CO 0.00 -0.09 -0.48 -0.08 0.09 0.00 0.00 178.44 177.88 2axx h GLU 37 N 0.11 0.45 -0.80 1.13 4.22 -1.85 -2.49 114.58 115.35 2axx h GLU 37 Ca 0.27 -0.39 0.03 0.00 0.08 0.00 0.00 59.36 59.35 2axx h GLU 37 Cb 0.41 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2axx h GLU 37 CO -0.45 1.03 0.53 0.93 -2.18 0.00 0.00 179.01 178.87 2axx h GLU 38 N 0.00 0.98 -6.00 1.92 5.08 -1.66 -3.44 114.58 111.47 2axx h GLU 38 Ca -0.04 -0.06 -0.72 0.00 -1.00 0.00 0.00 59.36 57.54 2axx h GLU 38 Cb 1.14 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 30.14 2axx h GLU 38 CO 0.10 0.65 1.34 1.58 -1.00 0.00 0.00 179.01 181.68 2axx n HIS 39 N -4.44 1.43 -2.08 4.33 -0.00 0.68 -4.78 115.22 110.36 2axx n HIS 39 Ca 0.10 0.52 -0.31 0.00 0.46 0.00 0.00 57.72 58.49 2axx n HIS 39 Cb 0.10 -2.42 -0.05 0.00 -0.12 0.00 0.00 29.99 27.50 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 7.72 1.83 0.00 1.57 -0.04 -1.26 -0.54 135.00 144.28 2axx n PRO 40 Ca 0.47 -2.55 0.00 0.00 -0.04 0.00 0.00 63.50 61.38 2axx n PRO 40 Cb 0.10 -3.65 0.00 0.00 -0.04 0.00 0.00 33.50 29.91 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 5.64 0.88 0.00 0.55 0.00 -1.26 -5.17 105.19 105.83 2axx n GLY 41 Ca 0.46 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.43 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 2.78 0.08 -0.02 0.00 0.30 -4.80 105.19 103.54 2axx n GLY 42 Ca 0.00 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.07 0.23 1.61 4.22 -1.72 -3.33 114.58 115.52 2axx h GLU 43 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 59.36 59.45 2axx h GLU 43 Cb 0.00 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 2axx h GLU 43 CO 0.00 0.49 -0.38 1.49 -2.18 0.00 0.00 179.01 178.43 2axx h GLU 44 N -0.94 -0.66 -1.01 1.92 4.81 -1.90 0.29 114.58 117.09 2axx h GLU 44 Ca -0.01 0.05 0.21 0.00 -0.13 0.00 0.00 59.36 59.48 2axx h GLU 44 Cb 0.58 0.15 -0.11 0.00 0.63 0.00 0.00 28.75 30.00 2axx h GLU 44 CO 0.01 -0.44 0.61 -0.39 -0.73 0.00 0.00 179.01 178.07 2axx h VAL 45 N -0.69 0.65 -0.31 0.32 -1.51 -1.87 0.11 116.25 112.96 2axx h VAL 45 Ca 0.00 -0.24 -0.14 0.00 -1.23 0.00 0.00 66.70 65.09 2axx h VAL 45 Cb 0.67 -0.12 -0.00 0.00 -2.13 0.00 0.00 31.29 29.71 2axx h VAL 45 CO -0.15 0.13 -0.36 0.25 -1.23 0.00 0.00 177.57 176.21 2axx h LEU 46 N 0.71 0.85 -0.02 4.19 7.12 -1.01 -3.15 115.31 123.99 2axx h LEU 46 Ca 0.60 -0.48 0.00 0.00 0.13 0.00 0.00 57.88 58.13 2axx h LEU 46 Cb 1.00 -0.24 0.00 0.00 -0.53 0.00 0.00 40.66 40.89 2axx h LEU 46 CO -0.41 1.16 -0.02 -1.14 -0.13 0.00 0.00 178.44 177.90 2axx n ARG 47 N -4.17 0.41 -0.03 1.25 0.63 0.80 -4.21 116.66 111.33 2axx n ARG 47 Ca -0.04 -0.02 -0.13 0.00 -0.92 0.00 0.00 57.85 56.74 2axx n ARG 47 Cb 0.52 -1.50 -0.07 0.00 0.45 0.00 0.00 32.46 31.86 2axx n ARG 47 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2axx h GLU 48 N 0.06 -0.47 0.00 -0.14 4.39 -0.85 -3.33 114.58 114.25 2axx h GLU 48 Ca 0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2axx h GLU 48 Cb 0.32 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 2axx h GLU 48 CO 0.00 -0.31 0.00 1.04 -1.16 0.00 0.00 179.01 178.58 2axx n GLN 49 N -5.43 0.00 -1.29 2.33 1.13 -1.26 -5.09 117.38 107.77 2axx n GLN 49 Ca -0.04 0.29 0.11 0.00 -1.94 0.00 0.00 57.00 55.42 2axx n GLN 49 Cb 0.37 -0.77 -0.06 0.00 0.11 0.00 0.00 30.24 29.89 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 -1.84 -2.90 -3.19 -1.58 0.00 -1.25 -4.91 120.51 104.83 2axx n ALA 50 Ca 0.00 0.66 -0.15 0.00 0.00 0.00 0.00 53.44 53.96 2axx n ALA 50 Cb 0.00 -1.34 0.07 0.00 0.00 0.00 0.00 19.45 18.18 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 -3.75 -0.21 5.10 0.00 0.00 0.13 -4.74 105.19 101.72 2axx n GLY 51 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.22 -1.48 3.90 -0.02 0.00 0.07 -3.31 105.19 103.13 2axx n GLY 52 Ca -0.19 -1.48 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 2axx n GLY 52 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2axx n ASP 53 N 0.07 -1.47 0.00 1.61 2.03 -1.26 -4.50 116.55 113.03 2axx n ASP 53 Ca 0.00 -0.92 0.00 0.00 0.52 0.00 0.00 54.79 54.39 2axx n ASP 53 Cb 0.00 -3.45 0.00 0.00 -0.72 0.00 0.00 41.12 36.95 2axx n ASP 53 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2axx n ALA 54 N -4.40 2.29 0.18 -1.67 0.00 -1.23 -4.76 120.51 110.92 2axx n ALA 54 Ca -0.22 -0.43 -0.16 0.00 0.00 0.00 0.00 53.44 52.63 2axx n ALA 54 Cb 0.64 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.01 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 0.06 0.13 -0.64 0.00 2.02 -1.77 0.14 112.91 112.84 2axx h THR 55 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 2axx h THR 55 Cb 0.03 0.13 -0.12 0.00 -1.74 0.00 0.00 68.15 66.44 2axx h THR 55 CO 0.00 0.00 -0.24 -0.33 0.37 0.00 0.00 175.52 175.32 2axx h GLU 56 N -0.77 -0.07 -0.34 6.66 3.07 -1.90 0.25 114.58 121.48 2axx h GLU 56 Ca -0.01 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.82 2axx h GLU 56 Cb 0.74 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.65 2axx h GLU 56 CO -0.17 -0.05 0.08 -0.97 -1.40 0.00 0.00 179.01 176.51 2axx h ASN 57 N -0.07 0.52 -0.55 1.42 -0.73 -1.79 0.17 115.58 114.55 2axx h ASN 57 Ca 0.29 -0.23 0.01 0.00 1.87 0.00 0.00 56.30 58.23 2axx h ASN 57 Cb 0.53 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 38.95 2axx h ASN 57 CO -0.69 0.61 0.36 0.15 -0.37 0.00 0.00 177.43 177.49 2axx h PHE 58 N 0.40 0.69 0.09 0.67 3.04 0.29 -2.77 116.94 119.34 2axx h PHE 58 Ca 0.11 0.02 -0.26 0.00 3.98 0.00 0.00 57.97 61.81 2axx h PHE 58 Cb 0.30 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.57 2axx h PHE 58 CO 0.02 0.43 -1.24 0.93 -2.02 0.00 0.00 178.31 176.43 2axx h GLU 59 N 0.74 0.19 -0.47 1.11 4.39 -0.14 -2.34 114.58 118.07 2axx h GLU 59 Ca 0.20 -0.33 0.09 0.00 0.34 0.00 0.00 59.36 59.66 2axx h GLU 59 Cb -0.08 0.12 -0.08 0.00 -0.10 0.00 0.00 28.75 28.61 2axx h GLU 59 CO -0.04 1.13 -0.07 0.22 -1.16 0.00 0.00 179.01 179.08 2axx h ASP 60 N 0.05 -0.35 0.33 1.42 3.58 -0.38 0.14 116.42 121.21 2axx h ASP 60 Ca -0.12 0.13 -0.10 0.00 0.42 0.00 0.00 57.03 57.35 2axx h ASP 60 Cb 1.93 0.26 -0.01 0.00 1.72 0.00 0.00 39.33 43.22 2axx h ASP 60 CO 0.18 -0.12 -0.44 -0.37 -2.88 0.00 0.00 179.24 175.60 2axx h VAL 61 N 0.04 1.32 -4.81 2.25 -1.51 -1.62 -3.48 116.25 108.44 2axx h VAL 61 Ca 0.23 -1.56 -0.22 0.00 -1.23 0.00 0.00 66.70 63.92 2axx h VAL 61 Cb 0.35 1.77 0.14 0.00 -2.13 0.00 0.00 31.29 31.42 2axx h VAL 61 CO -0.45 0.46 -0.62 0.61 -1.23 0.00 0.00 177.57 176.34 2axx n GLY 62 N -0.18 -0.45 3.50 5.19 0.00 0.49 -4.85 105.19 108.89 2axx n GLY 62 Ca -0.02 0.20 -0.49 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.05 0.52 -0.85 1.61 8.25 -1.20 -4.95 115.22 115.55 2axx n HIS 63 Ca -0.12 0.84 -0.33 0.00 -0.26 0.00 0.00 57.72 57.85 2axx n HIS 63 Cb 0.61 -2.13 0.13 0.00 1.12 0.00 0.00 29.99 29.72 2axx n HIS 63 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2axx n SER 64 N 1.75 -0.73 -0.28 0.41 7.64 -1.26 -4.70 113.62 116.45 2axx n SER 64 Ca 0.15 0.42 0.02 0.00 1.01 0.00 0.00 58.87 60.47 2axx n SER 64 Cb 0.25 -1.34 0.23 0.00 -1.01 0.00 0.00 64.21 62.33 2axx n SER 64 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2axx h THR 65 N -1.46 1.15 -0.31 0.44 2.02 -1.99 -1.33 112.91 111.44 2axx h THR 65 Ca -0.44 -0.37 0.06 0.00 0.77 0.00 0.00 66.41 66.43 2axx h THR 65 Cb 1.29 -0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 67.60 2axx h THR 65 CO 0.39 0.20 -0.45 -0.78 0.37 0.00 0.00 175.52 175.25 2axx h ASP 66 N 1.07 -1.47 -0.54 4.18 1.82 -2.00 -1.07 116.42 118.41 2axx h ASP 66 Ca 0.34 0.21 0.03 0.00 -0.39 0.00 0.00 57.03 57.21 2axx h ASP 66 Cb 0.01 0.62 -0.04 0.00 0.68 0.00 0.00 39.33 40.60 2axx h ASP 66 CO -0.10 -0.40 0.31 0.00 -1.61 0.00 0.00 179.24 177.45 2axx h ALA 67 N 0.23 0.70 -0.50 -0.78 0.00 -1.66 -0.18 119.26 117.07 2axx h ALA 67 Ca 0.10 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.11 2axx h ALA 67 Cb 0.61 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 2axx h ALA 67 CO -0.52 0.01 0.00 0.00 0.00 0.00 0.00 179.25 178.75 2axx h ARG 68 N 0.62 0.12 -0.48 0.00 2.47 -0.21 0.23 114.38 117.13 2axx h ARG 68 Ca 0.22 -0.01 -0.12 0.00 -1.26 0.00 0.00 59.98 58.81 2axx h ARG 68 Cb 0.06 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 2axx h ARG 68 CO -0.11 0.08 -0.19 1.05 0.56 0.00 0.00 179.97 181.36 2axx h GLU 69 N 0.12 0.97 -0.94 0.04 4.11 -0.87 -3.11 114.58 114.90 2axx h GLU 69 Ca 0.25 -0.40 0.10 0.00 0.07 0.00 0.00 59.36 59.38 2axx h GLU 69 Cb 0.38 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.52 2axx h GLU 69 CO -0.42 1.07 0.60 1.25 0.07 0.00 0.00 179.01 181.59 2axx h LEU 70 N 0.82 0.87 -0.52 3.06 5.85 0.43 0.24 115.31 126.04 2axx h LEU 70 Ca 0.11 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.96 2axx h LEU 70 Cb 0.76 -0.15 -0.10 0.00 0.37 0.00 0.00 40.66 41.54 2axx h LEU 70 CO 0.06 0.51 -0.13 0.28 -0.34 0.00 0.00 178.44 178.82 2axx h SER 71 N 0.95 -0.48 -0.77 1.25 0.02 -0.53 -1.41 113.55 112.57 2axx h SER 71 Ca 0.44 0.16 0.10 0.00 -0.84 0.00 0.00 61.79 61.64 2axx h SER 71 Cb 0.39 0.32 -0.07 0.00 0.14 0.00 0.00 62.40 63.18 2axx h SER 71 CO -0.20 -0.17 0.41 0.50 -1.14 0.00 0.00 176.83 176.24 2axx h LYS 72 N 0.00 0.66 -0.08 3.45 3.64 -0.54 0.18 116.57 123.88 2axx h LYS 72 Ca 0.25 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.62 2axx h LYS 72 Cb 0.38 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2axx h LYS 72 CO -0.53 0.44 0.24 1.15 -2.27 0.00 0.00 179.45 178.47 2axx h THR 73 N 0.68 0.15 -0.41 1.00 2.02 -0.88 -0.05 112.91 115.41 2axx h THR 73 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.56 2axx h THR 73 Cb 0.40 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.59 2axx h THR 73 CO -0.27 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.40 2axx n TYR 74 N -3.23 0.54 -1.99 3.16 4.01 0.60 -5.00 117.16 115.25 2axx n TYR 74 Ca -0.00 -0.35 -0.42 0.00 -0.16 0.00 0.00 57.90 56.97 2axx n TYR 74 Cb 0.32 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.32 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 -1.17 3.38 -0.27 -0.72 -1.16 -0.04 -2.91 121.20 118.32 2axx s ILE 75 Ca 0.34 0.65 -0.15 0.00 -0.51 0.00 0.00 60.65 60.98 2axx s ILE 75 Cb 0.19 -3.42 -0.14 0.00 0.61 0.00 0.00 42.46 39.71 2axx s ILE 75 CO 0.25 -0.03 -0.25 2.30 -2.81 0.00 0.00 174.94 174.40 2axx n ILE 76 N 5.12 1.53 -0.84 2.00 -5.35 -0.79 -4.95 119.36 116.09 2axx n ILE 76 Ca 0.16 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 2axx n ILE 76 Cb 0.42 -1.89 0.00 0.00 -1.74 0.00 0.00 39.64 36.43 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 1.33 2.72 3.41 3.28 0.00 -1.18 -4.19 105.19 110.54 2axx n GLY 77 Ca -0.51 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 2axx n GLY 77 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2axx s GLU 78 N 3.08 1.27 0.13 1.61 -1.05 -0.52 -1.24 118.70 121.98 2axx s GLU 78 Ca 0.00 -1.19 -0.31 0.00 -0.15 0.00 0.00 54.97 53.32 2axx s GLU 78 Cb 0.00 0.41 -0.10 0.00 -0.44 0.00 0.00 34.13 34.00 2axx s GLU 78 CO 0.00 -0.49 1.72 -1.17 0.95 0.00 0.00 175.26 176.27 2axx s LEU 79 N -2.98 4.38 -0.01 1.83 1.98 -1.26 -2.71 118.68 119.91 2axx s LEU 79 Ca 0.19 2.68 -0.39 0.00 -2.89 0.00 0.00 54.13 53.72 2axx s LEU 79 Cb 0.02 -3.58 -0.18 0.00 0.66 0.00 0.00 46.19 43.11 2axx s LEU 79 CO 0.02 -0.94 1.26 1.57 -1.89 0.00 0.00 176.35 176.37 2axx n HIS 80 N 5.09 1.17 0.27 5.38 -0.00 -0.07 -4.79 115.22 122.27 2axx n HIS 80 Ca 0.16 0.85 0.17 0.00 -0.00 0.00 0.00 57.72 58.90 2axx n HIS 80 Cb 0.38 -2.23 0.90 0.00 -0.00 0.00 0.00 29.99 29.04 2axx n HIS 80 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2axx h PRO 81 N 4.04 0.00 0.71 1.57 0.13 -1.91 -1.89 132.00 134.64 2axx h PRO 81 Ca -0.49 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.61 2axx h PRO 81 Cb 1.38 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.52 2axx h PRO 81 CO 0.74 0.00 -0.34 0.22 -0.23 0.00 0.00 178.00 178.39 2axx h ASP 82 N 0.00 -0.80 0.00 1.44 1.82 -1.99 -3.20 116.42 113.68 2axx h ASP 82 Ca 0.00 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 2axx h ASP 82 Cb 0.05 0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.27 2axx h ASP 82 CO 0.00 -0.44 0.00 0.47 -1.61 0.00 0.00 179.24 177.66 2axx n ASP 83 N -5.42 0.00 0.17 2.28 8.00 -0.71 -3.87 116.55 117.00 2axx n ASP 83 Ca -0.12 -0.78 -0.14 0.00 0.71 0.00 0.00 54.79 54.45 2axx n ASP 83 Cb 0.38 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.41 2axx n ASP 83 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 2axx h ARG 84 N 0.00 -0.42 -2.17 -1.24 2.43 -1.54 -2.61 114.38 108.83 2axx h ARG 84 Ca 0.00 0.03 -0.60 0.00 -0.81 0.00 0.00 59.98 58.59 2axx h ARG 84 Cb 0.00 0.10 -0.18 0.00 -0.42 0.00 0.00 29.97 29.47 2axx h ARG 84 CO 0.00 -0.28 1.00 0.45 -1.51 0.00 0.00 179.97 179.63 2axx n SER 85 N -5.31 7.02 0.00 -3.80 2.88 -1.25 -3.99 113.62 109.18 2axx n SER 85 Ca -0.09 -3.28 0.00 0.00 -1.33 0.00 0.00 58.87 54.17 2axx n SER 85 Cb 0.22 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.44 2axx n SER 85 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2axx n LYS 86 N 0.88 0.35 -1.67 -1.46 5.02 -0.99 -5.07 118.16 115.23 2axx n LYS 86 Ca 0.53 0.00 -0.49 0.00 -2.02 0.00 0.00 58.31 56.33 2axx n LYS 86 Cb 0.43 -0.69 -0.05 0.00 -0.02 0.00 0.00 35.03 34.70 2axx n LYS 86 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2axx n ILE 87 N -1.68 0.26 -3.83 -0.18 2.08 -1.24 -4.91 119.36 109.86 2axx n ILE 87 Ca 0.00 -0.05 -0.04 0.00 0.56 0.00 0.00 62.75 63.22 2axx n ILE 87 Cb 0.19 -1.55 0.01 0.00 -0.75 0.00 0.00 39.64 37.54 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 2.40 -1.52 -0.69 -1.39 0.00 -1.26 -5.10 121.76 114.20 2axx s ALA 88 Ca 0.87 -0.22 -0.35 0.00 0.00 0.00 0.00 51.96 52.25 2axx s ALA 88 Cb -0.76 0.71 -0.18 0.00 0.00 0.00 0.00 23.12 22.89 2axx s ALA 88 CO 0.47 -1.05 2.41 1.17 0.00 0.00 0.00 175.76 178.77 2axx n LYS 89 N -0.60 0.26 -1.73 0.00 0.00 -1.26 -4.90 118.16 109.94 2axx n LYS 89 Ca -0.05 0.04 -0.29 0.00 0.00 0.00 0.00 58.31 58.01 2axx n LYS 89 Cb 0.60 -1.83 0.16 0.00 0.00 0.00 0.00 35.03 33.96 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 7.52 0.86 0.87 1.64 0.04 -1.26 -5.07 135.00 139.59 2axx s PRO 90 Ca 1.23 -0.08 -0.13 0.00 0.04 0.00 0.00 61.00 62.07 2axx s PRO 90 Cb -1.18 -1.84 0.12 0.00 0.04 0.00 0.00 34.50 31.64 2axx s PRO 90 CO 0.52 -2.32 1.18 -1.12 0.04 0.00 0.00 177.00 175.30 2axx s SER 91 N -4.49 3.91 0.57 6.66 0.01 -1.26 -5.04 113.70 114.07 2axx s SER 91 Ca 0.68 0.77 -0.19 0.00 1.31 0.00 0.00 55.95 58.52 2axx s SER 91 Cb -0.09 -1.23 -0.06 0.00 0.21 0.00 0.00 66.02 64.85 2axx s SER 91 CO 0.52 -2.28 1.01 -0.62 0.41 0.00 0.00 173.24 172.28 2axx n GLU 92 N -3.56 1.03 -4.42 12.44 1.02 -1.26 -5.05 120.64 120.84 2axx n GLU 92 Ca 0.09 0.39 -0.21 0.00 -0.02 0.00 0.00 57.16 57.40 2axx n GLU 92 Cb 0.60 -2.19 -0.09 0.00 -0.02 0.00 0.00 31.44 29.74 2axx n GLU 92 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2axx s THR 93 N -1.46 0.61 -2.00 2.62 -1.32 -1.26 -5.34 115.64 107.48 2axx s THR 93 Ca 0.74 -2.00 0.16 0.00 -1.21 0.00 0.00 61.69 59.37 2axx s THR 93 Cb -0.43 -2.52 0.44 0.00 -1.51 0.00 0.00 72.50 68.48 2axx s THR 93 CO 0.49 0.00 1.34 0.18 -2.21 0.00 0.00 174.62 174.41