#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 -1.61 0.00 -1.24 2.85 -1.26 -4.73 118.16 112.17 2axx n LYS 2 Ca 0.00 0.21 0.00 0.00 -1.05 0.00 0.00 58.31 57.47 2axx n LYS 2 Cb 0.00 -3.77 0.00 0.00 -0.65 0.00 0.00 35.03 30.61 2axx n LYS 2 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2axx n ASP 3 N -2.81 0.00 0.14 -5.58 8.00 -1.26 -4.95 116.55 110.09 2axx n ASP 3 Ca -0.28 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.25 2axx n ASP 3 Cb 0.67 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.80 2axx n ASP 3 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2axx h VAL 4 N 0.00 0.79 -5.04 2.53 2.07 -1.95 -3.48 116.25 111.17 2axx h VAL 4 Ca 0.00 -2.12 -0.14 0.00 0.82 0.00 0.00 66.70 65.26 2axx h VAL 4 Cb 0.00 2.38 0.11 0.00 -1.52 0.00 0.00 31.29 32.26 2axx h VAL 4 CO 0.00 0.45 -0.48 0.29 0.02 0.00 0.00 177.57 177.85 2axx n LYS 5 N -3.20 -1.63 -3.14 1.57 4.01 -1.26 -4.22 118.16 110.29 2axx n LYS 5 Ca 0.02 0.93 -0.41 0.00 -0.51 0.00 0.00 58.31 58.35 2axx n LYS 5 Cb 0.72 -5.13 -0.07 0.00 -0.51 0.00 0.00 35.03 30.05 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 -3.22 3.26 -0.01 2.13 2.02 -1.26 -0.15 117.35 120.12 2axx s TYR 6 Ca 0.26 0.73 0.07 0.00 -0.37 0.00 0.00 57.07 57.76 2axx s TYR 6 Cb -0.03 -2.84 -0.02 0.00 -0.40 0.00 0.00 41.96 38.67 2axx s TYR 6 CO 0.62 -0.34 -0.23 0.71 -1.57 0.00 0.00 175.55 174.74 2axx s TYR 7 N 2.48 2.05 0.53 2.71 1.51 -0.78 -4.84 117.35 121.00 2axx s TYR 7 Ca 0.25 -0.39 -0.10 0.00 -1.01 0.00 0.00 57.07 55.82 2axx s TYR 7 Cb -0.15 -1.30 -0.05 0.00 -0.11 0.00 0.00 41.96 40.35 2axx s TYR 7 CO 0.09 -0.01 0.90 0.95 -1.11 0.00 0.00 175.55 176.38 2axx s THR 8 N -0.58 4.76 0.13 -0.71 -4.23 -1.26 -0.52 115.64 113.23 2axx s THR 8 Ca 0.09 0.67 -0.26 0.00 -1.18 0.00 0.00 61.69 61.01 2axx s THR 8 Cb -0.09 -3.82 -0.04 0.00 1.34 0.00 0.00 72.50 69.89 2axx s THR 8 CO -0.00 -0.89 1.62 -0.07 -0.54 0.00 0.00 174.62 174.74 2axx h LEU 9 N 0.28 -0.89 -0.77 4.79 -0.00 -1.99 -0.24 115.31 116.50 2axx h LEU 9 Ca -0.46 0.12 -0.01 0.00 -0.00 0.00 0.00 57.88 57.53 2axx h LEU 9 Cb 1.19 0.37 -0.04 0.00 -0.00 0.00 0.00 40.66 42.19 2axx h LEU 9 CO 0.62 -0.35 0.43 -0.08 -0.00 0.00 0.00 178.44 179.06 2axx h GLU 10 N -0.41 1.07 -0.06 1.13 4.22 -1.96 0.90 114.58 119.47 2axx h GLU 10 Ca 0.08 -0.12 0.04 0.00 0.08 0.00 0.00 59.36 59.43 2axx h GLU 10 Cb 0.52 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 2axx h GLU 10 CO -0.28 0.79 -0.21 1.49 -2.18 0.00 0.00 179.01 178.62 2axx h GLU 11 N 1.06 -0.29 -0.39 1.92 4.57 -1.79 -1.14 114.58 118.53 2axx h GLU 11 Ca 0.27 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.45 2axx h GLU 11 Cb 0.02 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 2axx h GLU 11 CO -0.04 -0.19 0.17 0.82 -1.18 0.00 0.00 179.01 178.58 2axx h ILE 12 N -0.30 1.14 0.00 2.32 2.04 -0.41 0.16 117.51 122.47 2axx h ILE 12 Ca 0.08 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2axx h ILE 12 Cb 0.41 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2axx h ILE 12 CO -0.24 0.17 0.00 1.67 0.00 0.00 0.00 178.15 179.75 2axx n GLN 13 N -4.40 0.22 -0.14 2.37 7.27 0.25 -0.59 117.38 122.37 2axx n GLN 13 Ca 0.03 0.00 0.04 0.00 0.07 0.00 0.00 57.00 57.14 2axx n GLN 13 Cb 0.13 -1.46 0.11 0.00 2.41 0.00 0.00 30.24 31.43 2axx n GLN 13 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2axx n LYS 14 N -0.96 2.83 -3.36 3.69 4.76 0.57 -4.83 118.16 120.85 2axx n LYS 14 Ca 0.05 -1.98 -0.39 0.00 -2.87 0.00 0.00 58.31 53.12 2axx n LYS 14 Cb 0.02 -1.25 -0.03 0.00 -1.84 0.00 0.00 35.03 31.93 2axx n LYS 14 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 2axx n HIS 15 N -0.03 3.89 -2.41 2.13 8.25 0.25 -4.62 115.22 122.67 2axx n HIS 15 Ca 0.09 -3.66 0.01 0.00 -0.26 0.00 0.00 57.72 53.90 2axx n HIS 15 Cb 0.43 -1.24 0.00 0.00 1.12 0.00 0.00 29.99 30.30 2axx n HIS 15 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 2axx n LYS 16 N 1.94 0.20 -0.29 -0.41 -0.00 -1.18 -3.34 118.16 115.08 2axx n LYS 16 Ca 0.25 -1.87 -0.07 0.00 -0.00 0.00 0.00 58.31 56.62 2axx n LYS 16 Cb 0.37 -0.01 0.06 0.00 -0.00 0.00 0.00 35.03 35.45 2axx n LYS 16 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2axx n ASP 17 N 0.21 -1.02 -4.64 -5.58 -0.08 -1.09 -4.89 116.55 99.46 2axx n ASP 17 Ca -0.03 -0.75 -0.43 0.00 -1.51 0.00 0.00 54.79 52.08 2axx n ASP 17 Cb 1.00 -0.24 -0.03 0.00 2.34 0.00 0.00 41.12 44.19 2axx n ASP 17 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2axx s SER 18 N -2.21 6.35 -1.16 1.67 0.15 -1.26 -3.17 113.70 114.07 2axx s SER 18 Ca 0.17 1.86 -0.05 0.00 0.70 0.00 0.00 55.95 58.64 2axx s SER 18 Cb -0.01 -2.53 0.01 0.00 -1.71 0.00 0.00 66.02 61.77 2axx s SER 18 CO 0.13 -1.25 1.00 1.17 1.20 0.00 0.00 173.24 175.49 2axx n LYS 19 N 7.66 -6.68 -2.88 5.44 4.81 -1.26 -4.96 118.16 120.28 2axx n LYS 19 Ca 0.20 0.75 -0.12 0.00 -0.87 0.00 0.00 58.31 58.28 2axx n LYS 19 Cb 0.44 -5.54 0.01 0.00 0.02 0.00 0.00 35.03 29.96 2axx n LYS 19 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2axx n SER 20 N -2.72 -2.28 -4.33 3.14 7.64 -1.19 -4.94 113.62 108.94 2axx n SER 20 Ca -0.11 -3.04 -0.38 0.00 1.01 0.00 0.00 58.87 56.36 2axx n SER 20 Cb 0.60 1.18 -0.12 0.00 -1.01 0.00 0.00 64.21 64.85 2axx n SER 20 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2axx s THR 21 N 0.34 4.09 0.29 0.44 2.01 -1.26 -2.68 115.64 118.87 2axx s THR 21 Ca 0.32 -0.87 0.08 0.00 0.31 0.00 0.00 61.69 61.53 2axx s THR 21 Cb 0.15 -3.22 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 2axx s THR 21 CO -0.18 -0.09 0.17 0.26 -0.69 0.00 0.00 174.62 174.09 2axx s TRP 22 N 1.48 2.89 -0.22 4.92 0.52 -1.21 -2.35 118.94 124.97 2axx s TRP 22 Ca 0.01 -0.24 -0.18 0.00 0.02 0.00 0.00 56.10 55.71 2axx s TRP 22 Cb -0.18 -1.50 0.06 0.00 -1.15 0.00 0.00 33.47 30.69 2axx s TRP 22 CO 0.04 0.42 0.58 0.14 0.02 0.00 0.00 176.95 178.15 2axx s VAL 23 N -2.28 -0.00 -0.98 4.03 -7.23 -0.74 0.19 120.40 113.40 2axx s VAL 23 Ca 0.35 0.01 -0.03 0.00 -1.81 0.00 0.00 61.98 60.51 2axx s VAL 23 Cb -0.06 -0.82 0.27 0.00 0.56 0.00 0.00 36.38 36.33 2axx s VAL 23 CO 0.24 0.00 1.09 2.30 -0.31 0.00 0.00 175.10 178.42 2axx n ILE 24 N 3.21 4.06 -2.29 -0.62 -5.35 -0.80 -0.90 119.36 116.67 2axx n ILE 24 Ca -0.16 -5.46 -0.42 0.00 -0.27 0.00 0.00 62.75 56.43 2axx n ILE 24 Cb 0.56 -2.30 -0.03 0.00 -1.74 0.00 0.00 39.64 36.14 2axx n ILE 24 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2axx s LEU 25 N -1.97 4.30 0.00 7.28 1.43 -0.78 -4.27 118.68 124.66 2axx s LEU 25 Ca 0.31 2.02 0.00 0.00 -1.03 0.00 0.00 54.13 55.43 2axx s LEU 25 Cb -0.01 -3.56 0.00 0.00 0.03 0.00 0.00 46.19 42.65 2axx s LEU 25 CO -0.03 -0.69 0.00 1.41 0.23 0.00 0.00 176.35 177.28 2axx n HIS 26 N 5.41 0.00 -2.42 0.29 8.25 -1.26 -1.55 115.22 123.95 2axx n HIS 26 Ca 0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2axx n HIS 26 Cb 0.44 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.56 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 0.00 0.04 -4.14 4.41 8.25 -1.26 -5.05 115.22 117.47 2axx n HIS 27 Ca 0.00 -0.74 -0.17 0.00 -0.26 0.00 0.00 57.72 56.55 2axx n HIS 27 Cb 0.00 0.09 -0.15 0.00 1.12 0.00 0.00 29.99 31.05 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 -0.41 0.50 -0.34 -0.41 -0.14 -0.59 -3.28 119.74 115.06 2axx s LYS 28 Ca 0.23 -0.14 -0.19 0.00 -1.36 0.00 0.00 55.97 54.52 2axx s LYS 28 Cb 0.28 -0.51 -0.00 0.00 -1.68 0.00 0.00 37.83 35.92 2axx s LYS 28 CO -0.11 0.04 0.54 0.08 -0.76 0.00 0.00 175.35 175.14 2axx s VAL 29 N 0.24 4.99 -0.11 3.17 1.01 0.13 -1.87 120.40 127.97 2axx s VAL 29 Ca -0.03 0.45 -0.01 0.00 0.00 0.00 0.00 61.98 62.39 2axx s VAL 29 Cb -0.06 -3.98 -0.03 0.00 0.00 0.00 0.00 36.38 32.31 2axx s VAL 29 CO -0.00 -0.21 -0.04 -0.31 0.00 0.00 0.00 175.10 174.54 2axx s TYR 30 N 2.46 3.02 -0.25 5.22 2.02 -0.08 -1.53 117.35 128.21 2axx s TYR 30 Ca 0.20 -0.06 -0.10 0.00 -0.37 0.00 0.00 57.07 56.74 2axx s TYR 30 Cb -0.15 -1.82 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 2axx s TYR 30 CO 0.13 0.22 0.14 0.34 -1.57 0.00 0.00 175.55 174.81 2axx s ASP 31 N -0.38 5.76 -0.15 2.29 -1.08 -1.04 -1.79 116.67 120.29 2axx s ASP 31 Ca 0.06 -0.03 0.17 0.00 -0.52 0.00 0.00 52.55 52.23 2axx s ASP 31 Cb -0.12 -2.05 0.32 0.00 -1.46 0.00 0.00 42.92 39.61 2axx s ASP 31 CO 0.02 -0.00 1.17 0.18 0.52 0.00 0.00 175.17 177.06 2axx n LEU 32 N 4.73 2.47 -0.06 -1.34 4.77 -0.99 -4.80 117.00 121.78 2axx n LEU 32 Ca -0.15 -3.25 -0.07 0.00 -0.03 0.00 0.00 56.01 52.51 2axx n LEU 32 Cb 0.52 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2axx n LEU 32 CO 0.33 0.84 0.77 0.74 -1.33 0.00 0.00 177.39 178.75 2axx h THR 33 N 0.24 0.61 -0.29 -5.08 2.02 -1.91 0.13 112.91 108.62 2axx h THR 33 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2axx h THR 33 Cb 1.02 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 2axx h THR 33 CO 0.01 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.19 2axx n LYS 34 N -5.29 2.77 0.00 6.66 5.02 -1.26 -3.66 118.16 122.40 2axx n LYS 34 Ca -0.00 -1.50 0.00 0.00 -2.02 0.00 0.00 58.31 54.78 2axx n LYS 34 Cb 0.21 -1.80 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 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 0.33 0.00 0.04 2.13 7.35 0.33 -4.61 117.46 123.03 2axx n PHE 35 Ca 0.13 0.00 -0.15 0.00 -0.76 0.00 0.00 57.45 56.67 2axx n PHE 35 Cb 0.66 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.40 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 -1.65 0.04 -2.13 3.38 -1.30 0.17 115.31 113.82 2axx h LEU 36 Ca 0.00 0.19 -0.16 0.00 0.09 0.00 0.00 57.88 58.00 2axx h LEU 36 Cb 0.02 0.63 0.01 0.00 0.09 0.00 0.00 40.66 41.41 2axx h LEU 36 CO 0.00 -0.51 -0.64 -0.33 0.09 0.00 0.00 178.44 177.05 2axx h GLU 37 N -0.64 0.37 -0.95 1.13 5.08 -1.87 -2.19 114.58 115.50 2axx h GLU 37 Ca 0.02 -0.45 0.18 0.00 -1.00 0.00 0.00 59.36 58.12 2axx h GLU 37 Cb 0.71 0.14 -0.08 0.00 0.50 0.00 0.00 28.75 30.02 2axx h GLU 37 CO -0.38 1.13 0.60 0.93 -1.00 0.00 0.00 179.01 180.30 2axx h GLU 38 N -0.19 0.60 -6.10 2.33 4.39 -1.77 -3.42 114.58 110.42 2axx h GLU 38 Ca -0.09 -0.04 -0.72 0.00 0.34 0.00 0.00 59.36 58.85 2axx h GLU 38 Cb 1.39 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2axx h GLU 38 CO 0.12 0.40 1.08 1.58 -1.16 0.00 0.00 179.01 181.04 2axx n HIS 39 N -4.61 1.87 -1.86 4.33 -0.00 0.58 -4.81 115.22 110.72 2axx n HIS 39 Ca 0.20 0.47 -0.34 0.00 0.46 0.00 0.00 57.72 58.51 2axx n HIS 39 Cb 0.59 -2.47 -0.05 0.00 -0.12 0.00 0.00 29.99 27.94 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 6.36 1.75 0.00 1.57 -0.04 -1.26 -0.96 135.00 142.43 2axx n PRO 40 Ca 0.33 -2.38 0.00 0.00 -0.04 0.00 0.00 63.50 61.40 2axx n PRO 40 Cb 0.15 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.12 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 5.37 0.64 0.00 0.55 0.00 -1.26 -5.17 105.19 105.33 2axx n GLY 41 Ca 0.47 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.44 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 1.59 0.13 -0.02 0.00 -0.13 -4.90 105.19 101.86 2axx n GLY 42 Ca 0.00 -2.09 -0.22 0.00 0.00 0.00 0.00 46.02 43.70 2axx n GLY 42 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2axx n GLU 43 N -1.45 0.66 -0.08 1.61 0.00 -0.82 -4.34 120.64 116.22 2axx n GLU 43 Ca 0.00 0.33 -0.07 0.00 0.00 0.00 0.00 57.16 57.41 2axx n GLU 43 Cb 0.00 -1.65 -0.00 0.00 0.00 0.00 0.00 31.44 29.79 2axx n GLU 43 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2axx h GLU 44 N -0.41 0.18 -0.98 5.31 4.81 -1.92 0.55 114.58 122.12 2axx h GLU 44 Ca -0.48 -0.01 0.24 0.00 -0.13 0.00 0.00 59.36 58.97 2axx h GLU 44 Cb 1.74 -0.04 -0.08 0.00 0.63 0.00 0.00 28.75 31.00 2axx h GLU 44 CO -0.12 0.12 0.64 -0.39 -0.73 0.00 0.00 179.01 178.54 2axx h VAL 45 N 0.18 0.60 -0.03 0.32 -1.51 -1.90 0.42 116.25 114.32 2axx h VAL 45 Ca 0.14 -0.13 -0.26 0.00 -1.23 0.00 0.00 66.70 65.21 2axx h VAL 45 Cb 0.14 0.17 0.02 0.00 -2.13 0.00 0.00 31.29 29.48 2axx h VAL 45 CO -0.17 0.07 -0.99 -0.07 -1.23 0.00 0.00 177.57 175.18 2axx h LEU 46 N 0.39 0.92 -0.93 4.19 -0.00 -0.27 -3.30 115.31 116.32 2axx h LEU 46 Ca 0.53 -0.71 0.00 0.00 -0.00 0.00 0.00 57.88 57.71 2axx h LEU 46 Cb 1.37 -0.28 0.00 0.00 -0.00 0.00 0.00 40.66 41.75 2axx h LEU 46 CO -0.23 1.51 0.00 -1.14 -0.00 0.00 0.00 178.44 178.58 2axx n ARG 47 N -3.87 1.61 0.41 1.13 0.00 0.69 -3.84 116.66 112.79 2axx n ARG 47 Ca -0.10 -0.91 -0.18 0.00 -0.00 0.00 0.00 57.85 56.65 2axx n ARG 47 Cb 0.86 -1.36 -0.09 0.00 0.00 0.00 0.00 32.46 31.86 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 1.82 -0.99 0.00 -0.14 4.39 -0.36 -3.39 114.58 115.91 2axx h GLU 48 Ca 0.00 0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.77 2axx h GLU 48 Cb 0.40 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 2axx h GLU 48 CO 0.00 -0.65 -0.53 1.04 -1.16 0.00 0.00 179.01 177.71 2axx n GLN 49 N -5.52 0.28 -1.29 2.33 1.13 -1.26 -5.11 117.38 107.94 2axx n GLN 49 Ca -0.14 0.11 0.16 0.00 -1.94 0.00 0.00 57.00 55.19 2axx n GLN 49 Cb 0.41 -0.98 -0.05 0.00 0.11 0.00 0.00 30.24 29.73 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 -3.60 -3.52 -3.90 -1.58 0.00 -1.25 -4.87 120.51 101.79 2axx n ALA 50 Ca -0.07 0.55 -0.31 0.00 0.00 0.00 0.00 53.44 53.60 2axx n ALA 50 Cb 0.28 -1.28 0.01 0.00 0.00 0.00 0.00 19.45 18.46 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 -3.88 -0.66 0.00 0.00 0.00 0.13 -4.80 105.19 95.98 2axx n GLY 51 Ca -0.02 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -1.70 0.39 3.56 -0.02 0.00 -1.26 -3.52 105.19 102.64 2axx n GLY 52 Ca -0.11 -1.10 -0.27 0.00 0.00 0.00 0.00 46.02 44.54 2axx n GLY 52 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2axx s ASP 53 N 0.00 5.15 0.00 1.61 -1.08 -1.26 -1.90 116.67 119.19 2axx s ASP 53 Ca 0.00 -0.85 0.21 0.00 -0.52 0.00 0.00 52.55 51.39 2axx s ASP 53 Cb 0.00 -2.56 1.27 0.00 -1.46 0.00 0.00 42.92 40.16 2axx s ASP 53 CO 0.00 -2.77 1.81 0.00 0.52 0.00 0.00 175.17 174.72 2axx n ALA 54 N 13.94 2.61 -0.36 3.66 0.00 -1.26 -3.90 120.51 135.21 2axx n ALA 54 Ca 0.41 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.78 2axx n ALA 54 Cb 0.47 -1.34 0.23 0.00 0.00 0.00 0.00 19.45 18.80 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 0.93 -0.60 0.00 2.02 -1.86 -0.35 112.91 113.06 2axx h THR 55 Ca 0.00 -0.34 0.08 0.00 0.77 0.00 0.00 66.41 66.92 2axx h THR 55 Cb 0.00 -0.15 -0.10 0.00 -1.74 0.00 0.00 68.15 66.15 2axx h THR 55 CO 0.00 0.18 -0.47 -0.08 0.37 0.00 0.00 175.52 175.52 2axx h GLU 56 N 1.00 -0.23 -0.02 6.66 4.22 -1.98 0.29 114.58 124.51 2axx h GLU 56 Ca 0.49 0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.94 2axx h GLU 56 Cb 0.46 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 2axx h GLU 56 CO -0.26 -0.15 0.00 -0.91 -2.18 0.00 0.00 179.01 175.51 2axx h ASN 57 N -0.23 0.04 -0.74 1.04 4.21 -1.75 0.14 115.58 118.30 2axx h ASN 57 Ca 0.16 -0.30 0.13 0.00 1.21 0.00 0.00 56.30 57.50 2axx h ASN 57 Cb 0.56 -0.01 -0.09 0.00 -1.12 0.00 0.00 38.32 37.66 2axx h ASN 57 CO -0.70 0.33 0.31 0.15 -1.29 0.00 0.00 177.43 176.23 2axx h PHE 58 N -0.25 0.55 0.00 1.19 3.57 -0.19 -1.84 116.94 119.97 2axx h PHE 58 Ca 0.01 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.32 2axx h PHE 58 Cb 0.31 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 2axx h PHE 58 CO 0.03 0.11 -1.11 0.93 -2.23 0.00 0.00 178.31 176.04 2axx h GLU 59 N 0.49 0.01 -0.95 1.11 4.39 -0.45 0.24 114.58 119.42 2axx h GLU 59 Ca 0.39 -0.01 0.22 0.00 0.34 0.00 0.00 59.36 60.30 2axx h GLU 59 Cb 0.54 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.08 2axx h GLU 59 CO -0.36 0.93 0.50 0.22 -1.16 0.00 0.00 179.01 179.14 2axx h ASP 60 N 0.00 0.54 0.47 1.42 3.58 0.13 -0.87 116.42 121.69 2axx h ASP 60 Ca -0.06 0.13 -0.30 0.00 0.42 0.00 0.00 57.03 57.23 2axx h ASP 60 Cb 1.81 0.06 -0.04 0.00 1.72 0.00 0.00 39.33 42.88 2axx h ASP 60 CO 0.12 0.09 -1.69 0.58 -2.88 0.00 0.00 179.24 175.47 2axx h VAL 61 N 0.54 0.89 0.00 2.25 2.07 -1.46 -3.49 116.25 117.05 2axx h VAL 61 Ca 0.59 -2.70 0.00 0.00 0.82 0.00 0.00 66.70 65.40 2axx h VAL 61 Cb 1.07 2.49 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 2axx h VAL 61 CO -0.47 0.61 0.00 0.61 0.02 0.00 0.00 177.57 178.33 2axx n GLY 62 N 1.62 2.43 0.94 2.17 0.00 0.85 -4.92 105.19 108.28 2axx n GLY 62 Ca -0.18 -0.50 0.07 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.56 -1.80 1.61 8.25 -1.25 -4.67 115.22 114.81 2axx n HIS 63 Ca 0.00 1.40 -0.31 0.00 -0.26 0.00 0.00 57.72 58.55 2axx n HIS 63 Cb 0.00 -2.32 0.02 0.00 1.12 0.00 0.00 29.99 28.81 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 -5.47 5.94 0.41 0.41 0.01 -1.26 -4.93 113.70 108.81 2axx s SER 64 Ca 0.00 1.44 0.09 0.00 1.31 0.00 0.00 55.95 58.79 2axx s SER 64 Cb 0.00 -2.42 0.91 0.00 0.21 0.00 0.00 66.02 64.72 2axx s SER 64 CO 0.00 -1.06 2.02 0.74 0.41 0.00 0.00 173.24 175.35 2axx h THR 65 N -0.45 1.02 -0.65 1.44 2.02 -1.99 -0.83 112.91 113.47 2axx h THR 65 Ca -0.44 -0.18 0.12 0.00 0.77 0.00 0.00 66.41 66.68 2axx h THR 65 Cb 1.20 0.45 -0.09 0.00 -1.74 0.00 0.00 68.15 67.97 2axx h THR 65 CO 0.61 0.10 0.19 -0.78 0.37 0.00 0.00 175.52 176.01 2axx h ASP 66 N 0.52 0.12 -0.36 4.18 3.58 -2.00 -1.14 116.42 121.32 2axx h ASP 66 Ca 0.21 0.11 -0.15 0.00 0.42 0.00 0.00 57.03 57.62 2axx h ASP 66 Cb 0.19 0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 2axx h ASP 66 CO -0.06 0.05 -0.38 0.00 -2.88 0.00 0.00 179.24 175.98 2axx h ALA 67 N 1.50 0.53 0.03 -0.78 0.00 -1.55 -2.54 119.26 116.44 2axx h ALA 67 Ca 0.35 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2axx h ALA 67 Cb 0.51 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.14 2axx h ALA 67 CO -0.39 0.62 -0.50 0.00 0.00 0.00 0.00 179.25 178.98 2axx h ARG 68 N 0.69 -0.64 -0.10 0.00 2.47 -0.65 0.10 114.38 116.25 2axx h ARG 68 Ca 0.05 0.04 -0.05 0.00 -1.26 0.00 0.00 59.98 58.77 2axx h ARG 68 Cb 0.97 0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 29.42 2axx h ARG 68 CO 0.09 -0.43 -0.16 1.05 0.56 0.00 0.00 179.97 181.09 2axx h GLU 69 N -0.66 0.15 -1.01 0.04 4.11 -1.34 -1.47 114.58 114.40 2axx h GLU 69 Ca 0.02 -0.03 0.03 0.00 0.07 0.00 0.00 59.36 59.44 2axx h GLU 69 Cb 0.71 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.89 2axx h GLU 69 CO -0.33 0.32 0.66 1.25 0.07 0.00 0.00 179.01 180.98 2axx h LEU 70 N 0.14 1.12 -0.71 3.06 7.12 -0.89 -1.72 115.31 123.44 2axx h LEU 70 Ca 0.03 -0.02 0.16 0.00 0.13 0.00 0.00 57.88 58.18 2axx h LEU 70 Cb 0.37 -0.26 -0.12 0.00 -0.53 0.00 0.00 40.66 40.12 2axx h LEU 70 CO 0.02 0.78 0.03 0.77 -0.13 0.00 0.00 178.44 179.91 2axx h SER 71 N 1.31 -0.27 -0.67 1.25 4.64 0.30 -0.36 113.55 119.74 2axx h SER 71 Ca 0.39 0.17 0.10 0.00 -0.47 0.00 0.00 61.79 61.98 2axx h SER 71 Cb -0.05 0.30 -0.07 0.00 -0.31 0.00 0.00 62.40 62.26 2axx h SER 71 CO -0.11 -0.14 0.29 0.11 -0.87 0.00 0.00 176.83 176.11 2axx h LYS 72 N 0.13 0.48 -0.05 4.77 1.57 -1.35 0.34 116.57 122.47 2axx h LYS 72 Ca 0.38 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 59.15 2axx h LYS 72 Cb 0.66 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 2axx h LYS 72 CO -0.60 0.32 0.09 1.15 -0.57 0.00 0.00 179.45 179.84 2axx h THR 73 N 0.50 0.33 -0.35 -0.16 2.02 -1.02 -1.37 112.91 112.86 2axx h THR 73 Ca 0.34 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.52 2axx h THR 73 Cb 0.40 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2axx h THR 73 CO -0.30 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.37 2axx n TYR 74 N -3.56 0.46 -2.05 3.16 4.02 0.11 -4.96 117.16 114.34 2axx n TYR 74 Ca -0.02 -0.31 -0.42 0.00 -0.01 0.00 0.00 57.90 57.14 2axx n TYR 74 Cb 0.18 -0.01 -0.03 0.00 -0.02 0.00 0.00 39.34 39.46 2axx n TYR 74 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 2axx s ILE 75 N -1.18 3.27 -0.15 -0.72 2.07 -0.33 -2.49 121.20 121.67 2axx s ILE 75 Ca 0.31 0.73 0.09 0.00 -1.41 0.00 0.00 60.65 60.36 2axx s ILE 75 Cb 0.18 -3.47 -0.15 0.00 0.13 0.00 0.00 42.46 39.15 2axx s ILE 75 CO 0.24 0.00 -0.02 2.30 -1.91 0.00 0.00 174.94 175.55 2axx n ILE 76 N 4.61 0.97 -3.29 2.00 -5.35 -0.58 -4.92 119.36 112.80 2axx n ILE 76 Ca 0.14 -0.52 -0.03 0.00 -0.27 0.00 0.00 62.75 62.08 2axx n ILE 76 Cb 0.42 -0.80 0.01 0.00 -1.74 0.00 0.00 39.64 37.53 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 2.32 1.60 3.10 3.28 0.00 -0.86 -4.60 105.19 110.02 2axx n GLY 77 Ca -0.25 -1.07 -0.09 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.03 0.57 0.25 1.61 -1.05 0.78 -0.69 118.70 118.14 2axx s GLU 78 Ca 0.05 -0.84 -0.31 0.00 -0.15 0.00 0.00 54.97 53.72 2axx s GLU 78 Cb -0.01 0.22 -0.11 0.00 -0.44 0.00 0.00 34.13 33.78 2axx s GLU 78 CO 0.03 -0.13 1.64 -0.51 0.95 0.00 0.00 175.26 177.24 2axx s LEU 79 N -2.24 4.36 0.12 1.83 1.43 -1.21 -1.87 118.68 121.10 2axx s LEU 79 Ca -0.03 2.88 -0.34 0.00 -1.03 0.00 0.00 54.13 55.61 2axx s LEU 79 Cb -0.00 -3.62 -0.17 0.00 0.03 0.00 0.00 46.19 42.43 2axx s LEU 79 CO -0.06 -0.92 0.97 1.57 0.23 0.00 0.00 176.35 178.14 2axx n HIS 80 N 3.04 0.63 -0.02 0.29 -0.00 0.33 -4.61 115.22 114.88 2axx n HIS 80 Ca 0.12 0.88 -0.06 0.00 -0.00 0.00 0.00 57.72 58.65 2axx n HIS 80 Cb 0.37 -2.14 0.13 0.00 -0.00 0.00 0.00 29.99 28.35 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 2.67 0.59 -0.98 1.57 0.13 -1.91 0.91 132.00 134.98 2axx h PRO 81 Ca -0.42 -0.26 0.17 0.00 -0.87 0.00 0.00 66.00 64.61 2axx h PRO 81 Cb 1.40 -0.02 -0.10 0.00 0.13 0.00 0.00 31.00 32.41 2axx h PRO 81 CO 0.65 0.84 0.59 0.22 -0.23 0.00 0.00 178.00 180.07 2axx h ASP 82 N 0.51 0.79 0.21 1.44 1.82 -1.99 0.30 116.42 119.50 2axx h ASP 82 Ca 0.06 0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.77 2axx h ASP 82 Cb 0.79 -0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.75 2axx h ASP 82 CO 0.06 0.32 -0.10 0.44 -1.61 0.00 0.00 179.24 178.36 2axx h ASP 83 N 0.81 -0.24 -0.21 2.28 3.32 -1.75 -3.30 116.42 117.33 2axx h ASP 83 Ca 0.54 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.63 2axx h ASP 83 Cb 0.76 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.34 2axx h ASP 83 CO -0.35 0.23 -0.02 -0.09 -1.72 0.00 0.00 179.24 177.28 2axx h ARG 84 N -1.08 0.04 -1.01 3.56 1.12 -0.27 0.45 114.38 117.19 2axx h ARG 84 Ca -0.03 -0.00 0.24 0.00 -1.11 0.00 0.00 59.98 59.08 2axx h ARG 84 Cb 0.22 -0.01 -0.10 0.00 -0.01 0.00 0.00 29.97 30.08 2axx h ARG 84 CO 0.05 0.02 0.63 0.77 -3.11 0.00 0.00 179.97 178.34 2axx h SER 85 N 0.04 0.56 -2.08 -3.80 0.02 -0.61 -3.14 113.55 104.54 2axx h SER 85 Ca 0.10 0.09 -0.55 0.00 -0.84 0.00 0.00 61.79 60.59 2axx h SER 85 Cb 0.14 -0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.27 2axx h SER 85 CO -0.19 0.14 -0.97 1.17 -1.14 0.00 0.00 176.83 175.85 2axx n LYS 86 N -4.69 1.50 -1.36 3.45 4.81 -0.25 -5.08 118.16 116.55 2axx n LYS 86 Ca 0.24 -3.79 -0.38 0.00 -0.87 0.00 0.00 58.31 53.52 2axx n LYS 86 Cb 0.76 -1.70 -0.14 0.00 0.02 0.00 0.00 35.03 33.97 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 0.75 0.00 -3.26 3.15 5.41 -0.01 -4.80 119.36 120.59 2axx n ILE 87 Ca 0.25 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.62 2axx n ILE 87 Cb 0.52 -0.45 -0.06 0.00 -0.71 0.00 0.00 39.64 38.94 2axx n ILE 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2axx s ALA 88 N 8.11 3.58 -0.18 -1.39 0.00 -1.26 -5.00 121.76 125.61 2axx s ALA 88 Ca 1.23 0.04 -0.29 0.00 0.00 0.00 0.00 51.96 52.94 2axx s ALA 88 Cb -1.15 -2.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.28 2axx s ALA 88 CO 0.45 0.38 1.77 0.21 0.00 0.00 0.00 175.76 178.57 2axx s LYS 89 N -1.05 3.73 0.56 0.00 2.36 -1.26 -4.95 119.74 119.12 2axx s LYS 89 Ca 0.29 1.86 -0.19 0.00 -2.55 0.00 0.00 55.97 55.38 2axx s LYS 89 Cb -0.20 -4.11 -0.05 0.00 -1.05 0.00 0.00 37.83 32.42 2axx s LYS 89 CO 0.19 -1.39 1.16 -1.25 1.55 0.00 0.00 175.35 175.61 2axx s PRO 90 N 4.94 3.23 0.50 4.03 0.04 -1.26 -5.01 135.00 141.47 2axx s PRO 90 Ca 0.79 1.71 -0.18 0.00 0.04 0.00 0.00 61.00 63.36 2axx s PRO 90 Cb -0.29 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.17 2axx s PRO 90 CO 0.32 -0.97 0.99 0.45 0.04 0.00 0.00 177.00 177.83 2axx s SER 91 N -1.67 6.55 0.22 6.66 0.15 -1.26 -5.08 113.70 119.27 2axx s SER 91 Ca 0.74 1.68 -0.17 0.00 0.70 0.00 0.00 55.95 58.90 2axx s SER 91 Cb -0.27 -2.53 0.02 0.00 -1.71 0.00 0.00 66.02 61.53 2axx s SER 91 CO 0.30 -0.63 0.55 -1.61 1.20 0.00 0.00 173.24 173.04 2axx s GLU 92 N -3.73 1.48 0.00 5.44 2.02 -1.26 -5.12 118.70 117.53 2axx s GLU 92 Ca 0.61 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.64 2axx s GLU 92 Cb -0.11 0.53 0.00 0.00 0.10 0.00 0.00 34.13 34.64 2axx s GLU 92 CO 0.26 -0.63 0.00 2.41 0.02 0.00 0.00 175.26 177.31 2axx n THR 93 N -0.37 0.01 -1.55 3.63 -1.04 -1.26 -5.33 114.28 108.36 2axx n THR 93 Ca -0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 2axx n THR 93 Cb 0.62 -0.46 0.00 0.00 -1.82 0.00 0.00 70.33 68.66 2axx n THR 93 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32