#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 1.15 0.00 -1.24 1.02 -1.26 -5.08 119.74 114.33 2axx s LYS 2 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 55.88 2axx s LYS 2 Cb 0.00 -1.34 0.00 0.00 -0.52 0.00 0.00 37.83 35.97 2axx s LYS 2 CO 0.00 -0.28 0.32 -0.25 -0.92 0.00 0.00 175.35 174.22 2axx n ASP 3 N 5.03 0.00 -0.73 2.83 8.00 -1.26 -4.96 116.55 125.46 2axx n ASP 3 Ca -0.10 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.79 2axx n ASP 3 Cb 0.50 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 2axx n ASP 3 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2axx n VAL 4 N -0.90 0.00 -2.72 2.53 0.31 -1.26 -5.07 118.33 111.22 2axx n VAL 4 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 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 1.17 -1.32 0.00 0.00 176.83 176.68 2axx n LYS 5 N 0.00 0.60 -1.63 5.55 4.81 -1.25 -4.91 118.16 121.33 2axx n LYS 5 Ca 0.00 -1.42 -0.49 0.00 -0.87 0.00 0.00 58.31 55.53 2axx n LYS 5 Cb 0.00 -1.00 -0.05 0.00 0.02 0.00 0.00 35.03 34.00 2axx n LYS 5 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2axx n TYR 6 N 1.36 1.89 -4.56 5.64 4.01 -1.26 -2.79 117.16 121.45 2axx n TYR 6 Ca 0.06 0.46 -0.22 0.00 -0.16 0.00 0.00 57.90 58.03 2axx n TYR 6 Cb 0.67 -2.43 -0.14 0.00 -0.31 0.00 0.00 39.34 37.12 2axx n TYR 6 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2axx s TYR 7 N 0.65 1.42 0.41 -0.72 2.02 0.49 -4.85 117.35 116.77 2axx s TYR 7 Ca 0.81 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 57.16 2axx s TYR 7 Cb -0.81 -0.87 -0.04 0.00 -0.40 0.00 0.00 41.96 39.84 2axx s TYR 7 CO 0.43 0.03 0.67 0.95 -1.57 0.00 0.00 175.55 176.06 2axx s THR 8 N -0.65 4.99 0.11 -0.71 -4.23 -1.26 -0.45 115.64 113.44 2axx s THR 8 Ca 0.05 -0.06 -0.21 0.00 -1.18 0.00 0.00 61.69 60.29 2axx s THR 8 Cb -0.07 -3.85 -0.07 0.00 1.34 0.00 0.00 72.50 69.84 2axx s THR 8 CO 0.01 -0.68 1.72 -0.07 -0.54 0.00 0.00 174.62 175.06 2axx h LEU 9 N 0.59 -0.08 -0.48 4.79 -0.00 -1.98 0.18 115.31 118.33 2axx h LEU 9 Ca -0.48 0.03 0.09 0.00 -0.00 0.00 0.00 57.88 57.53 2axx h LEU 9 Cb 1.21 0.06 -0.08 0.00 -0.00 0.00 0.00 40.66 41.85 2axx h LEU 9 CO 0.62 -0.02 -0.03 1.05 -0.00 0.00 0.00 178.44 180.06 2axx h GLU 10 N 0.03 0.08 0.57 1.13 4.11 -1.99 0.89 114.58 119.40 2axx h GLU 10 Ca 0.06 -0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.46 2axx h GLU 10 Cb 0.08 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.32 2axx h GLU 10 CO -0.12 0.05 -0.27 1.49 0.07 0.00 0.00 179.01 180.23 2axx h GLU 11 N 0.08 -0.74 -0.88 1.06 4.57 -1.80 -2.64 114.58 114.23 2axx h GLU 11 Ca 0.24 0.05 0.20 0.00 -1.18 0.00 0.00 59.36 58.67 2axx h GLU 11 Cb 0.36 0.17 -0.12 0.00 -0.16 0.00 0.00 28.75 29.00 2axx h GLU 11 CO -0.42 -0.49 0.39 0.82 -1.18 0.00 0.00 179.01 178.13 2axx h ILE 12 N -0.77 0.52 -0.00 2.32 2.04 -0.59 0.10 117.51 121.14 2axx h ILE 12 Ca -0.08 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.63 2axx h ILE 12 Cb 0.59 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 2axx h ILE 12 CO 0.13 0.08 0.00 -0.61 0.00 0.00 0.00 178.15 177.75 2axx h GLN 13 N 0.43 0.00 -0.13 2.37 4.15 -0.46 -2.16 115.11 119.33 2axx h GLN 13 Ca 0.54 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.90 2axx h GLN 13 Cb 0.97 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.66 2axx h GLN 13 CO -0.50 0.00 -0.13 0.87 -1.93 0.00 0.00 178.83 177.14 2axx h LYS 14 N 0.00 0.31 -4.56 1.69 1.79 -0.72 -3.38 116.57 111.70 2axx h LYS 14 Ca 0.00 -0.16 -0.63 0.00 -2.18 0.00 0.00 60.65 57.68 2axx h LYS 14 Cb 0.01 0.01 0.02 0.00 -1.58 0.00 0.00 32.23 30.68 2axx h LYS 14 CO -0.00 0.71 2.30 0.72 -1.08 0.00 0.00 179.45 182.10 2axx n HIS 15 N -4.59 2.37 -0.30 -1.35 8.25 -0.81 -4.28 115.22 114.51 2axx n HIS 15 Ca -0.06 -2.01 0.00 0.00 -0.26 0.00 0.00 57.72 55.38 2axx n HIS 15 Cb 0.35 -2.00 0.00 0.00 1.12 0.00 0.00 29.99 29.46 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 7.05 1.81 -0.52 -0.41 4.81 -1.07 -3.26 118.16 126.57 2axx n LYS 16 Ca 0.49 -1.11 -0.29 0.00 -0.87 0.00 0.00 58.31 56.53 2axx n LYS 16 Cb 0.41 -0.85 0.24 0.00 0.02 0.00 0.00 35.03 34.85 2axx n LYS 16 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2axx n ASP 17 N -0.31 -1.81 0.04 3.14 8.00 -0.86 -4.80 116.55 119.94 2axx n ASP 17 Ca 0.00 -0.14 -0.14 0.00 0.71 0.00 0.00 54.79 55.23 2axx n ASP 17 Cb 0.30 -1.21 -0.07 0.00 -0.02 0.00 0.00 41.12 40.11 2axx n ASP 17 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 2axx h SER 18 N -2.56 -1.40 0.02 -2.24 0.87 -1.99 -2.98 113.55 103.29 2axx h SER 18 Ca -0.60 0.17 -0.08 0.00 -1.23 0.00 0.00 61.79 60.05 2axx h SER 18 Cb 1.34 0.55 0.01 0.00 -0.44 0.00 0.00 62.40 63.85 2axx h SER 18 CO 0.47 -0.47 -0.34 0.11 -0.53 0.00 0.00 176.83 176.07 2axx h LYS 19 N -0.57 0.19 -4.47 2.24 6.56 -1.94 -3.39 116.57 115.19 2axx h LYS 19 Ca 0.05 -0.23 -0.65 0.00 -1.06 0.00 0.00 60.65 58.75 2axx h LYS 19 Cb 0.66 0.07 0.05 0.00 -0.57 0.00 0.00 32.23 32.45 2axx h LYS 19 CO -0.36 1.01 2.30 0.45 -2.06 0.00 0.00 179.45 180.79 2axx n SER 20 N -4.43 2.52 -4.41 0.86 2.88 -1.12 -4.22 113.62 105.70 2axx n SER 20 Ca -0.11 -2.68 -0.45 0.00 -1.33 0.00 0.00 58.87 54.31 2axx n SER 20 Cb 0.57 -1.11 -0.02 0.00 -0.75 0.00 0.00 64.21 62.90 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 4.99 5.05 0.36 2.46 2.01 -1.24 -2.04 115.64 127.23 2axx s THR 21 Ca 0.57 -1.94 -0.08 0.00 0.31 0.00 0.00 61.69 60.55 2axx s THR 21 Cb 0.14 -4.68 -0.06 0.00 0.01 0.00 0.00 72.50 67.92 2axx s THR 21 CO 0.12 -1.35 0.68 0.26 -0.69 0.00 0.00 174.62 173.64 2axx s TRP 22 N 1.75 3.47 0.03 4.92 0.52 -1.20 -2.24 118.94 126.19 2axx s TRP 22 Ca 0.28 0.87 -0.17 0.00 0.02 0.00 0.00 56.10 57.10 2axx s TRP 22 Cb -0.06 -2.30 0.03 0.00 -1.15 0.00 0.00 33.47 29.99 2axx s TRP 22 CO -0.09 0.00 0.38 0.14 0.02 0.00 0.00 176.95 177.41 2axx s VAL 23 N -2.26 0.06 -0.28 4.03 -7.23 -0.80 0.03 120.40 113.94 2axx s VAL 23 Ca 0.48 -0.49 -0.02 0.00 -1.81 0.00 0.00 61.98 60.13 2axx s VAL 23 Cb -0.10 -0.90 0.04 0.00 0.56 0.00 0.00 36.38 35.97 2axx s VAL 23 CO 0.31 -0.27 -0.01 -0.63 -0.31 0.00 0.00 175.10 174.19 2axx s ILE 24 N -2.29 3.09 -0.79 -0.62 -1.09 -1.18 -1.14 121.20 117.18 2axx s ILE 24 Ca -0.07 -1.18 -0.01 0.00 -2.23 0.00 0.00 60.65 57.16 2axx s ILE 24 Cb -0.01 -2.69 0.20 0.00 -1.58 0.00 0.00 42.46 38.38 2axx s ILE 24 CO -0.01 0.01 0.65 -0.76 -1.23 0.00 0.00 174.94 173.60 2axx s LEU 25 N 1.31 5.39 -0.29 2.97 1.43 -1.16 -1.21 118.68 127.11 2axx s LEU 25 Ca -0.02 -3.47 -0.04 0.00 -1.03 0.00 0.00 54.13 49.57 2axx s LEU 25 Cb -0.18 -1.87 0.00 0.00 0.03 0.00 0.00 46.19 44.17 2axx s LEU 25 CO -0.02 -0.23 0.32 1.41 0.23 0.00 0.00 176.35 178.06 2axx n HIS 26 N 2.65 -1.59 -3.80 0.29 8.25 -1.26 -4.39 115.22 115.37 2axx n HIS 26 Ca 0.17 0.63 -0.25 0.00 -0.26 0.00 0.00 57.72 58.00 2axx n HIS 26 Cb 0.37 -2.78 0.03 0.00 1.12 0.00 0.00 29.99 28.72 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 -0.90 -2.09 -3.67 4.41 8.25 -1.26 -4.98 115.22 114.97 2axx n HIS 27 Ca 0.03 0.87 -0.14 0.00 -0.26 0.00 0.00 57.72 58.22 2axx n HIS 27 Cb 0.37 -4.20 -0.08 0.00 1.12 0.00 0.00 29.99 27.20 2axx n HIS 27 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2axx s LYS 28 N -6.29 0.70 -0.31 -0.41 1.02 -1.26 -4.02 119.74 109.17 2axx s LYS 28 Ca 0.30 0.79 -0.11 0.00 0.02 0.00 0.00 55.97 56.97 2axx s LYS 28 Cb -0.15 0.34 -0.03 0.00 -0.52 0.00 0.00 37.83 37.47 2axx s LYS 28 CO 0.82 -0.09 0.20 0.08 -0.92 0.00 0.00 175.35 175.44 2axx s VAL 29 N 0.25 5.10 -0.19 3.17 1.01 -0.21 -3.01 120.40 126.51 2axx s VAL 29 Ca -0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 2axx s VAL 29 Cb -0.04 -3.54 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2axx s VAL 29 CO 0.01 0.11 0.03 -0.31 0.00 0.00 0.00 175.10 174.94 2axx s TYR 30 N 1.71 3.15 -0.20 5.22 2.02 -0.29 -1.52 117.35 127.43 2axx s TYR 30 Ca 0.06 -0.13 -0.16 0.00 -0.37 0.00 0.00 57.07 56.47 2axx s TYR 30 Cb -0.17 -2.07 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 2axx s TYR 30 CO 0.09 0.00 0.40 0.34 -1.57 0.00 0.00 175.55 174.82 2axx s ASP 31 N 0.59 6.45 -0.13 2.29 -1.08 -0.89 -1.91 116.67 122.00 2axx s ASP 31 Ca 0.01 0.53 0.15 0.00 -0.52 0.00 0.00 52.55 52.73 2axx s ASP 31 Cb -0.13 -2.23 0.30 0.00 -1.46 0.00 0.00 42.92 39.39 2axx s ASP 31 CO 0.02 -0.07 1.15 0.18 0.52 0.00 0.00 175.17 176.97 2axx n LEU 32 N 4.41 2.08 -0.22 -1.34 4.77 -0.95 -4.81 117.00 120.94 2axx n LEU 32 Ca -0.08 -2.99 -0.02 0.00 -0.03 0.00 0.00 56.01 52.89 2axx n LEU 32 Cb 0.51 -0.38 0.09 0.00 -2.33 0.00 0.00 43.42 41.31 2axx n LEU 32 CO 0.40 0.82 1.08 0.74 -1.33 0.00 0.00 177.39 179.10 2axx h THR 33 N 1.50 0.96 -0.53 -5.08 2.02 -1.73 0.58 112.91 110.62 2axx h THR 33 Ca -0.01 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 66.94 2axx h THR 33 Cb 1.10 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.76 2axx h THR 33 CO 0.01 0.12 0.00 0.29 0.37 0.00 0.00 175.52 176.30 2axx n LYS 34 N -4.81 4.06 0.00 6.66 4.76 -1.26 -4.03 118.16 123.54 2axx n LYS 34 Ca 0.08 -2.69 0.02 0.00 -2.87 0.00 0.00 58.31 52.85 2axx n LYS 34 Cb 0.17 -2.05 -0.01 0.00 -1.84 0.00 0.00 35.03 31.30 2axx n LYS 34 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2axx n PHE 35 N 0.72 0.00 -0.01 2.13 7.35 0.11 -4.74 117.46 123.02 2axx n PHE 35 Ca 0.24 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.91 2axx n PHE 35 Cb 0.98 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.80 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 0.22 -0.17 -0.51 -2.13 3.38 -1.46 0.21 115.31 114.85 2axx h LEU 36 Ca 0.00 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 2axx h LEU 36 Cb 0.12 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2axx h LEU 36 CO 0.00 -0.05 -0.09 -0.33 0.09 0.00 0.00 178.44 178.07 2axx h GLU 37 N -0.05 0.96 -0.96 1.13 5.08 -1.89 -2.81 114.58 116.04 2axx h GLU 37 Ca 0.00 -0.35 0.14 0.00 -1.00 0.00 0.00 59.36 58.16 2axx h GLU 37 Cb 0.06 -0.06 -0.09 0.00 0.50 0.00 0.00 28.75 29.16 2axx h GLU 37 CO -0.05 1.02 0.58 0.93 -1.00 0.00 0.00 179.01 180.49 2axx h GLU 38 N 0.82 0.82 -6.03 2.33 5.08 -1.77 -3.43 114.58 112.40 2axx h GLU 38 Ca 0.13 -0.05 -0.73 0.00 -1.00 0.00 0.00 59.36 57.71 2axx h GLU 38 Cb 0.64 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2axx h GLU 38 CO 0.04 0.54 1.21 1.58 -1.00 0.00 0.00 179.01 181.39 2axx n HIS 39 N -4.72 1.59 -2.01 4.33 -0.00 0.70 -4.77 115.22 110.34 2axx n HIS 39 Ca 0.19 0.55 -0.30 0.00 0.46 0.00 0.00 57.72 58.63 2axx n HIS 39 Cb 0.42 -2.42 -0.06 0.00 -0.12 0.00 0.00 29.99 27.82 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 7.00 1.67 0.00 1.57 -0.04 -1.26 -0.56 135.00 143.37 2axx n PRO 40 Ca 0.41 -2.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.41 2axx n PRO 40 Cb 0.10 -3.66 0.00 0.00 -0.04 0.00 0.00 33.50 29.90 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 5.66 1.10 0.00 0.55 0.00 -1.26 -5.16 105.19 106.08 2axx n GLY 41 Ca 0.45 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 3.63 0.14 -0.02 0.00 0.27 -4.90 105.19 104.31 2axx n GLY 42 Ca 0.00 -1.72 -0.23 0.00 0.00 0.00 0.00 46.02 44.07 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 0.45 0.60 1.61 4.22 -1.76 -3.38 114.58 116.31 2axx h GLU 43 Ca 0.00 -0.76 -0.03 0.00 0.08 0.00 0.00 59.36 58.65 2axx h GLU 43 Cb 0.00 0.28 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2axx h GLU 43 CO 0.00 1.37 -0.30 1.49 -2.18 0.00 0.00 179.01 179.38 2axx h GLU 44 N -0.06 -0.79 -0.73 1.92 4.81 -1.91 0.17 114.58 117.99 2axx h GLU 44 Ca -0.21 0.05 0.16 0.00 -0.13 0.00 0.00 59.36 59.23 2axx h GLU 44 Cb 1.96 0.18 -0.05 0.00 0.63 0.00 0.00 28.75 31.47 2axx h GLU 44 CO 0.23 -0.53 0.50 -0.24 -0.73 0.00 0.00 179.01 178.24 2axx h VAL 45 N -0.82 0.77 -0.03 0.32 3.04 -1.91 0.43 116.25 118.05 2axx h VAL 45 Ca -0.08 -0.11 -0.00 0.00 -1.01 0.00 0.00 66.70 65.49 2axx h VAL 45 Cb 0.64 0.41 -0.00 0.00 -2.01 0.00 0.00 31.29 30.33 2axx h VAL 45 CO 0.12 0.06 -0.00 -0.07 -1.01 0.00 0.00 177.57 176.67 2axx h LEU 46 N 0.33 0.05 -0.25 3.16 -0.00 -1.28 -3.26 115.31 114.06 2axx h LEU 46 Ca 0.36 -0.31 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 2axx h LEU 46 Cb 0.93 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.58 2axx h LEU 46 CO -0.10 0.35 -0.03 -1.14 -0.00 0.00 0.00 178.44 177.52 2axx n ARG 47 N -4.90 0.98 0.15 1.13 0.00 0.45 -3.84 116.66 110.63 2axx n ARG 47 Ca -0.07 -0.25 -0.08 0.00 -0.00 0.00 0.00 57.85 57.44 2axx n ARG 47 Cb 0.18 -1.49 -0.04 0.00 0.00 0.00 0.00 32.46 31.10 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 0.62 -0.46 0.00 -0.14 4.39 -0.29 -3.40 114.58 115.30 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 0.23 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 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 -3.67 0.00 -1.22 2.33 3.00 -1.26 -5.09 117.38 111.48 2axx n GLN 49 Ca -0.06 0.29 0.14 0.00 -0.01 0.00 0.00 57.00 57.36 2axx n GLN 49 Cb 0.21 -0.78 -0.05 0.00 0.00 0.00 0.00 30.24 29.62 2axx n GLN 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2axx n ALA 50 N -2.13 -3.36 -4.12 -1.58 0.00 -1.25 -4.87 120.51 103.21 2axx n ALA 50 Ca 0.00 0.53 -0.45 0.00 0.00 0.00 0.00 53.44 53.52 2axx n ALA 50 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.24 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 -3.72 -0.73 0.00 0.00 0.00 0.10 -4.83 105.19 96.01 2axx n GLY 51 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.30 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 -2.18 2.00 3.69 -0.02 0.00 -1.26 -4.34 105.19 103.08 2axx n GLY 52 Ca -0.14 -0.98 -0.44 0.00 0.00 0.00 0.00 46.02 44.45 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 0.00 3.34 -0.15 1.61 5.75 -1.26 -3.12 116.55 122.73 2axx n ASP 53 Ca 0.00 1.10 0.01 0.00 -0.01 0.00 0.00 54.79 55.89 2axx n ASP 53 Cb 0.00 -1.49 0.03 0.00 -1.03 0.00 0.00 41.12 38.63 2axx n ASP 53 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2axx n ALA 54 N 3.02 2.21 -0.29 2.12 0.00 -0.35 -4.78 120.51 122.45 2axx n ALA 54 Ca 0.14 -0.85 0.10 0.00 0.00 0.00 0.00 53.44 52.83 2axx n ALA 54 Cb 0.32 -0.11 0.23 0.00 0.00 0.00 0.00 19.45 19.89 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 0.54 0.27 -0.46 0.00 2.02 -1.80 -0.05 112.91 113.43 2axx h THR 55 Ca 0.00 -0.04 0.08 0.00 0.77 0.00 0.00 66.41 67.21 2axx h THR 55 Cb 0.40 0.13 -0.10 0.00 -1.74 0.00 0.00 68.15 66.85 2axx h THR 55 CO 0.00 0.02 -0.40 -0.33 0.37 0.00 0.00 175.52 175.18 2axx h GLU 56 N 0.13 -0.27 -0.14 6.66 3.07 -1.90 0.26 114.58 122.38 2axx h GLU 56 Ca 0.50 0.02 -0.21 0.00 -0.50 0.00 0.00 59.36 59.16 2axx h GLU 56 Cb 0.96 0.06 0.01 0.00 -0.84 0.00 0.00 28.75 28.94 2axx h GLU 56 CO -0.71 -0.18 -0.76 -0.97 -1.40 0.00 0.00 179.01 175.00 2axx h ASN 57 N -0.28 0.85 -0.44 1.42 -0.73 -1.55 0.15 115.58 115.00 2axx h ASN 57 Ca 0.16 -0.55 0.03 0.00 1.87 0.00 0.00 56.30 57.81 2axx h ASN 57 Cb 0.57 -0.25 -0.03 0.00 0.27 0.00 0.00 38.32 38.88 2axx h ASN 57 CO -0.60 1.34 0.24 0.15 -0.37 0.00 0.00 177.43 178.19 2axx h PHE 58 N 0.49 0.45 0.00 0.67 3.57 -0.67 -3.00 116.94 118.45 2axx h PHE 58 Ca -0.04 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.30 2axx h PHE 58 Cb 1.37 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 2axx h PHE 58 CO 0.08 0.25 -0.83 0.93 -2.23 0.00 0.00 178.31 176.50 2axx h GLU 59 N 0.49 0.02 -0.86 1.11 4.39 -0.37 0.38 114.58 119.74 2axx h GLU 59 Ca 0.18 -0.03 0.22 0.00 0.34 0.00 0.00 59.36 60.08 2axx h GLU 59 Cb 0.05 0.01 -0.14 0.00 -0.10 0.00 0.00 28.75 28.57 2axx h GLU 59 CO -0.10 0.84 0.21 0.22 -1.16 0.00 0.00 179.01 179.02 2axx h ASP 60 N 0.01 -0.03 0.69 1.42 1.82 -0.56 -0.50 116.42 119.28 2axx h ASP 60 Ca -0.01 0.19 -0.20 0.00 -0.39 0.00 0.00 57.03 56.62 2axx h ASP 60 Cb 1.47 0.27 -0.03 0.00 0.68 0.00 0.00 39.33 41.71 2axx h ASP 60 CO 0.11 -0.14 -1.44 0.58 -1.61 0.00 0.00 179.24 176.73 2axx h VAL 61 N 0.21 0.64 0.00 2.25 2.07 -1.44 -3.45 116.25 116.53 2axx h VAL 61 Ca 0.53 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.81 2axx h VAL 61 Cb 1.04 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 2axx h VAL 61 CO -0.64 0.36 0.00 0.61 0.02 0.00 0.00 177.57 177.92 2axx n GLY 62 N 1.43 1.82 0.76 2.17 0.00 0.13 -4.88 105.19 106.63 2axx n GLY 62 Ca -0.11 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.05 -1.93 1.61 8.25 -1.26 -4.73 115.22 115.11 2axx n HIS 63 Ca 0.00 1.13 -0.31 0.00 -0.26 0.00 0.00 57.72 58.27 2axx n HIS 63 Cb 0.00 -1.86 0.01 0.00 1.12 0.00 0.00 29.99 29.25 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 -5.78 6.14 0.19 0.41 0.01 -1.26 -4.99 113.70 108.42 2axx s SER 64 Ca 0.00 1.50 -0.15 0.00 1.31 0.00 0.00 55.95 58.61 2axx s SER 64 Cb 0.00 -2.49 0.16 0.00 0.21 0.00 0.00 66.02 63.91 2axx s SER 64 CO 0.00 -0.93 1.65 0.74 0.41 0.00 0.00 173.24 175.11 2axx h THR 65 N -0.10 0.48 -0.80 1.44 2.02 -2.02 -2.04 112.91 111.89 2axx h THR 65 Ca -0.45 0.00 0.17 0.00 0.77 0.00 0.00 66.41 66.91 2axx h THR 65 Cb 1.19 0.48 -0.15 0.00 -1.74 0.00 0.00 68.15 67.93 2axx h THR 65 CO 0.61 0.00 -0.11 0.44 0.37 0.00 0.00 175.52 176.83 2axx h ASP 66 N -0.01 -0.58 -0.92 4.18 5.19 -2.00 0.29 116.42 122.57 2axx h ASP 66 Ca 0.24 0.23 0.15 0.00 -0.62 0.00 0.00 57.03 57.03 2axx h ASP 66 Cb 0.38 0.44 -0.09 0.00 0.18 0.00 0.00 39.33 40.24 2axx h ASP 66 CO -0.53 -0.24 0.53 0.00 -3.12 0.00 0.00 179.24 175.87 2axx h ALA 67 N 1.78 1.43 -0.15 3.45 0.00 -1.75 0.11 119.26 124.13 2axx h ALA 67 Ca 0.41 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.40 2axx h ALA 67 Cb 0.70 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2axx h ALA 67 CO -0.78 -0.01 0.07 0.00 0.00 0.00 0.00 179.25 178.53 2axx h ARG 68 N 0.74 0.14 -0.70 0.00 3.08 -0.43 0.38 114.38 117.59 2axx h ARG 68 Ca 0.50 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.53 2axx h ARG 68 Cb 0.68 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.66 2axx h ARG 68 CO -0.34 0.09 0.40 0.93 -1.07 0.00 0.00 179.97 179.98 2axx h GLU 69 N 0.15 0.97 -0.88 0.04 4.39 -1.19 -1.39 114.58 116.65 2axx h GLU 69 Ca 0.06 -0.10 0.04 0.00 0.34 0.00 0.00 59.36 59.70 2axx h GLU 69 Cb 0.02 -0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 28.42 2axx h GLU 69 CO -0.05 0.71 0.58 1.25 -1.16 0.00 0.00 179.01 180.34 2axx h LEU 70 N 0.96 0.94 -0.52 1.33 5.85 -0.46 -0.10 115.31 123.31 2axx h LEU 70 Ca 0.25 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.05 2axx h LEU 70 Cb 0.02 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 40.76 2axx h LEU 70 CO -0.04 0.64 0.13 0.28 -0.34 0.00 0.00 178.44 179.11 2axx h SER 71 N 1.09 0.06 -0.67 1.25 0.02 0.74 -1.57 113.55 114.47 2axx h SER 71 Ca 0.36 0.08 0.12 0.00 -0.84 0.00 0.00 61.79 61.51 2axx h SER 71 Cb 0.05 0.10 -0.09 0.00 0.14 0.00 0.00 62.40 62.60 2axx h SER 71 CO -0.11 0.06 0.21 0.50 -1.14 0.00 0.00 176.83 176.35 2axx h LYS 72 N 0.28 0.34 -0.10 3.45 3.64 -0.02 0.26 116.57 124.42 2axx h LYS 72 Ca 0.26 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.65 2axx h LYS 72 Cb 0.34 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2axx h LYS 72 CO -0.32 0.23 0.17 1.15 -2.27 0.00 0.00 179.45 178.41 2axx h THR 73 N 0.35 0.28 -0.30 1.00 2.02 -0.83 -1.10 112.91 114.32 2axx h THR 73 Ca 0.36 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.54 2axx h THR 73 Cb 0.52 0.85 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2axx h THR 73 CO -0.39 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.28 2axx n TYR 74 N -3.46 0.38 -2.14 3.16 4.01 0.82 -4.97 117.16 114.96 2axx n TYR 74 Ca -0.00 -0.22 -0.42 0.00 -0.16 0.00 0.00 57.90 57.10 2axx n TYR 74 Cb 0.27 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.27 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 -1.42 3.52 -0.17 -0.72 2.07 -0.42 -2.09 121.20 121.97 2axx s ILE 75 Ca 0.33 0.93 0.16 0.00 -1.41 0.00 0.00 60.65 60.66 2axx s ILE 75 Cb 0.20 -3.60 -0.22 0.00 0.13 0.00 0.00 42.46 38.97 2axx s ILE 75 CO 0.28 -0.00 0.06 2.30 -1.91 0.00 0.00 174.94 175.67 2axx n ILE 76 N 4.66 1.20 -3.91 2.00 -5.35 -0.58 -4.91 119.36 112.48 2axx n ILE 76 Ca 0.14 -0.75 -0.03 0.00 -0.27 0.00 0.00 62.75 61.84 2axx n ILE 76 Cb 0.43 -0.53 0.02 0.00 -1.74 0.00 0.00 39.64 37.82 2axx n ILE 76 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2axx s GLY 77 N -5.16 0.14 0.20 3.28 0.00 -1.13 -3.88 107.32 100.76 2axx s GLY 77 Ca -0.09 -0.37 0.03 0.00 0.00 0.00 0.00 44.72 44.29 2axx s GLY 77 CO 0.72 2.97 -0.02 -0.54 0.00 0.00 0.00 173.10 176.23 2axx s GLU 78 N -2.06 1.21 0.16 2.90 2.02 -1.12 -1.05 118.70 120.76 2axx s GLU 78 Ca 0.23 -1.59 -0.31 0.00 0.02 0.00 0.00 54.97 53.33 2axx s GLU 78 Cb -0.03 -0.51 -0.08 0.00 0.10 0.00 0.00 34.13 33.61 2axx s GLU 78 CO 0.05 -0.07 1.37 -1.17 0.02 0.00 0.00 175.26 175.46 2axx s LEU 79 N -3.24 4.39 0.13 1.80 1.98 -1.26 -0.38 118.68 122.11 2axx s LEU 79 Ca 0.25 2.39 -0.35 0.00 -2.89 0.00 0.00 54.13 53.53 2axx s LEU 79 Cb 0.05 -3.60 -0.17 0.00 0.66 0.00 0.00 46.19 43.14 2axx s LEU 79 CO 0.06 -0.61 1.18 1.57 -1.89 0.00 0.00 176.35 176.66 2axx n HIS 80 N 3.31 1.22 -0.13 5.38 -0.00 0.40 -4.76 115.22 120.65 2axx n HIS 80 Ca 0.09 0.72 0.05 0.00 -0.00 0.00 0.00 57.72 58.58 2axx n HIS 80 Cb 0.42 -2.26 0.36 0.00 -0.00 0.00 0.00 29.99 28.51 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 3.61 0.72 -0.34 1.57 0.13 -1.91 -2.62 132.00 133.16 2axx h PRO 81 Ca -0.45 -0.04 0.07 0.00 -0.87 0.00 0.00 66.00 64.71 2axx h PRO 81 Cb 1.35 -0.16 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 2axx h PRO 81 CO 0.71 0.47 -0.15 0.22 -0.23 0.00 0.00 178.00 179.03 2axx h ASP 82 N 0.74 -0.52 -0.17 1.44 3.58 -2.00 -0.43 116.42 119.06 2axx h ASP 82 Ca 0.26 0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.84 2axx h ASP 82 Cb 0.11 0.29 0.00 0.00 1.72 0.00 0.00 39.33 41.45 2axx h ASP 82 CO -0.07 -0.19 0.00 0.47 -2.88 0.00 0.00 179.24 176.57 2axx n ASP 83 N -5.33 0.95 0.30 2.28 8.00 -1.00 -4.37 116.55 117.38 2axx n ASP 83 Ca 0.01 -2.01 -0.12 0.00 0.71 0.00 0.00 54.79 53.39 2axx n ASP 83 Cb 0.25 -0.13 -0.06 0.00 -0.02 0.00 0.00 41.12 41.16 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 1.00 -0.73 -2.46 -1.24 1.12 -0.93 -2.98 114.38 108.15 2axx h ARG 84 Ca 0.00 0.05 -0.52 0.00 -1.11 0.00 0.00 59.98 58.40 2axx h ARG 84 Cb 0.25 0.17 -0.07 0.00 -0.01 0.00 0.00 29.97 30.31 2axx h ARG 84 CO 0.00 -0.49 1.74 -1.13 -3.11 0.00 0.00 179.97 176.99 2axx n SER 85 N -4.16 7.21 0.00 -3.80 3.41 -1.26 -3.81 113.62 111.21 2axx n SER 85 Ca -0.09 -2.77 0.00 0.00 -0.26 0.00 0.00 58.87 55.75 2axx n SER 85 Cb 0.30 -1.42 0.00 0.00 -0.26 0.00 0.00 64.21 62.83 2axx n SER 85 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2axx n LYS 86 N 2.42 0.00 -1.69 4.33 0.00 -1.13 -5.09 118.16 117.01 2axx n LYS 86 Ca 0.60 0.00 -0.42 0.00 0.00 0.00 0.00 58.31 58.49 2axx n LYS 86 Cb 0.49 -0.42 -0.00 0.00 0.00 0.00 0.00 35.03 35.10 2axx n LYS 86 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2axx n ILE 87 N -2.05 2.14 -2.83 3.15 2.08 -1.24 -4.99 119.36 115.63 2axx n ILE 87 Ca 0.00 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.81 2axx n ILE 87 Cb 0.11 -1.54 0.00 0.00 -0.75 0.00 0.00 39.64 37.45 2axx n ILE 87 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2axx n ALA 88 N 0.18 0.00 -2.47 -1.39 0.00 -1.26 -5.08 120.51 110.49 2axx n ALA 88 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.44 2axx n ALA 88 Cb 0.37 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.82 2axx n ALA 88 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2axx n LYS 89 N 0.00 -1.87 -1.54 0.00 4.81 -1.26 -5.01 118.16 113.30 2axx n LYS 89 Ca 0.00 1.76 -0.32 0.00 -0.87 0.00 0.00 58.31 58.88 2axx n LYS 89 Cb 0.00 -4.49 0.07 0.00 0.02 0.00 0.00 35.03 30.63 2axx n LYS 89 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2axx s PRO 90 N -2.01 2.52 -0.18 1.64 0.04 -1.26 -4.99 135.00 130.76 2axx s PRO 90 Ca 0.15 1.35 -0.01 0.00 0.04 0.00 0.00 61.00 62.53 2axx s PRO 90 Cb -0.04 -1.92 -0.22 0.00 0.04 0.00 0.00 34.50 32.36 2axx s PRO 90 CO 0.56 -1.46 0.13 0.45 0.04 0.00 0.00 177.00 176.72 2axx n SER 91 N -2.86 1.90 -3.72 6.66 2.88 -1.26 -5.01 113.62 112.20 2axx n SER 91 Ca 0.10 0.07 -0.13 0.00 -1.33 0.00 0.00 58.87 57.58 2axx n SER 91 Cb 0.52 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.44 2axx n SER 91 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2axx n GLU 92 N -3.33 -0.84 -3.57 -1.46 0.28 -1.26 -4.91 120.64 105.55 2axx n GLU 92 Ca -0.37 -0.31 -0.21 0.00 -0.16 0.00 0.00 57.16 56.11 2axx n GLU 92 Cb 1.03 -0.16 -0.01 0.00 1.43 0.00 0.00 31.44 33.73 2axx n GLU 92 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2axx s THR 93 N -4.41 4.77 0.00 3.84 2.01 -1.26 -5.15 115.64 115.43 2axx s THR 93 Ca 0.12 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.33 2axx s THR 93 Cb -0.07 -3.70 0.00 0.00 0.01 0.00 0.00 72.50 68.74 2axx s THR 93 CO 0.28 -0.35 0.00 -0.11 -0.69 0.00 0.00 174.62 173.75