#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bod s LYS 1 N 0.00 1.87 -0.21 0.03 1.02 -1.26 -5.14 119.74 116.06 1bod s LYS 1 Ca 0.00 -2.13 -0.36 0.00 0.02 0.00 0.00 55.97 53.50 1bod s LYS 1 Cb 0.00 -0.59 0.15 0.00 -0.52 0.00 0.00 37.83 36.88 1bod s LYS 1 CO 0.00 -0.45 1.41 -1.54 -0.92 0.00 0.00 175.35 173.85 1bod s SER 2 N -3.57 -0.01 0.45 2.83 1.04 -1.26 -4.99 113.70 108.19 1bod s SER 2 Ca 0.26 -0.00 0.31 0.00 0.48 0.00 0.00 55.95 57.00 1bod s SER 2 Cb 0.03 0.01 1.46 0.00 0.10 0.00 0.00 66.02 67.62 1bod s SER 2 CO 0.15 -0.02 1.93 1.55 0.98 0.00 0.00 173.24 177.83 1bod h PRO 3 N 2.00 0.00 -0.00 4.02 0.13 -2.03 -1.36 132.00 134.75 1bod h PRO 3 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 1bod h PRO 3 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1bod h PRO 3 CO 0.23 0.00 -0.04 -1.91 -0.23 0.00 0.00 178.00 176.05 1bod n GLU 4 N -2.69 0.62 0.00 0.86 2.13 -1.26 -3.25 120.64 117.04 1bod n GLU 4 Ca -0.00 -0.10 0.09 0.00 0.66 0.00 0.00 57.16 57.81 1bod n GLU 4 Cb 0.18 -1.50 0.50 0.00 0.27 0.00 0.00 31.44 30.90 1bod n GLU 4 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1bod n GLU 5 N -1.11 0.41 0.11 5.31 2.13 -0.51 -2.25 120.64 124.73 1bod n GLU 5 Ca 0.16 0.06 -0.02 0.00 0.66 0.00 0.00 57.16 58.02 1bod n GLU 5 Cb 0.24 -1.50 0.01 0.00 0.27 0.00 0.00 31.44 30.46 1bod n GLU 5 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1bod h LEU 6 N 0.00 0.00 -1.84 4.31 -0.00 -1.78 -2.95 115.31 113.05 1bod h LEU 6 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.86 1bod h LEU 6 Cb 0.09 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.75 1bod h LEU 6 CO 0.00 0.75 -0.10 0.50 -0.00 0.00 0.00 178.44 179.58 1bod h LYS 7 N 0.00 0.00 0.00 1.13 3.11 -1.72 -1.36 116.57 117.73 1bod h LYS 7 Ca -0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 1bod h LYS 7 Cb 1.47 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.70 1bod h LYS 7 CO 0.10 0.10 0.00 0.41 -2.81 0.00 0.00 179.45 177.25 1bod n GLY 8 N -1.18 -0.59 0.00 5.01 0.00 -1.11 -3.01 105.19 104.31 1bod n GLY 8 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1bod n GLY 8 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1bod n ILE 9 N -1.43 0.00 0.00 -0.61 3.06 -0.52 -4.55 119.36 115.31 1bod n ILE 9 Ca 0.02 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.27 1bod n ILE 9 Cb 0.05 -0.39 0.00 0.00 0.54 0.00 0.00 39.64 39.84 1bod n ILE 9 CO 0.00 0.00 0.00 0.33 -2.50 0.00 0.00 176.55 174.38 1bod n PHE 10 N -0.51 0.00 -0.33 9.51 -0.00 -1.17 -0.11 117.46 124.85 1bod n PHE 10 Ca 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 57.45 57.72 1bod n PHE 10 Cb 0.00 -0.42 0.51 0.00 -0.00 0.00 0.00 39.48 39.56 1bod n PHE 10 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 1bod h GLU 11 N 0.00 0.02 -0.35 -4.13 4.39 -1.75 1.11 114.58 113.87 1bod h GLU 11 Ca 0.00 -0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1bod h GLU 11 Cb 0.00 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1bod h GLU 11 CO 0.00 0.02 -0.10 1.57 -1.16 0.00 0.00 179.01 179.34 1bod h LYS 12 N 0.02 0.69 0.00 2.33 5.09 -0.54 -2.21 116.57 121.95 1bod h LYS 12 Ca 0.78 -0.27 0.00 0.00 0.09 0.00 0.00 60.65 61.25 1bod h LYS 12 Cb 1.96 -0.04 0.00 0.00 0.10 0.00 0.00 32.23 34.26 1bod h LYS 12 CO -0.80 0.86 0.00 0.66 -2.09 0.00 0.00 179.45 178.08 1bod n TYR 13 N -4.39 0.00 -1.20 0.07 4.01 0.37 -3.48 117.16 112.53 1bod n TYR 13 Ca -0.02 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.52 1bod n TYR 13 Cb 0.35 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.32 1bod n TYR 13 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1bod n ASP 15 N -0.75 6.10 -3.99 7.72 -0.08 -0.39 -4.74 116.55 120.41 1bod n ASP 15 Ca 0.08 -2.96 -0.42 0.00 -1.51 0.00 0.00 54.79 49.98 1bod n ASP 15 Cb 0.03 -1.24 -0.01 0.00 2.34 0.00 0.00 41.12 42.25 1bod n ASP 15 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1bod n LYS 16 N 1.21 2.75 0.00 -0.67 5.02 -1.23 -3.84 118.16 121.40 1bod n LYS 16 Ca 0.41 -2.70 0.00 0.00 -2.02 0.00 0.00 58.31 54.00 1bod n LYS 16 Cb 0.64 -3.33 0.00 0.00 -0.02 0.00 0.00 35.03 32.32 1bod n LYS 16 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1bod n GLU 17 N 6.93 0.00 0.00 1.97 2.13 -1.26 -4.98 120.64 125.43 1bod n GLU 17 Ca 0.51 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.33 1bod n GLU 17 Cb 0.41 -0.38 0.00 0.00 0.27 0.00 0.00 31.44 31.75 1bod n GLU 17 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1bod n GLY 18 N 0.73 1.97 0.77 8.31 0.00 -1.25 -5.02 105.19 110.71 1bod n GLY 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1bod n GLY 18 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1bod n ASP 19 N 0.00 0.98 0.00 1.61 5.75 -1.26 -5.06 116.55 118.57 1bod n ASP 19 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1bod n ASP 19 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1bod n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1bod n GLY 20 N 2.39 1.25 0.62 6.12 0.00 -1.26 -5.12 105.19 109.18 1bod n GLY 20 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1bod n GLY 20 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bod n GLN 22 N 0.00 1.13 -3.98 1.61 -0.00 -1.26 -4.24 117.38 110.63 1bod n GLN 22 Ca 0.00 -0.64 -0.34 0.00 -0.00 0.00 0.00 57.00 56.02 1bod n GLN 22 Cb 0.00 0.29 -0.15 0.00 -0.00 0.00 0.00 30.24 30.39 1bod n GLN 22 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1bod s LEU 23 N 0.00 2.88 0.51 2.61 1.43 -0.08 -4.85 118.68 121.18 1bod s LEU 23 Ca 0.03 -0.70 -0.17 0.00 -1.03 0.00 0.00 54.13 52.26 1bod s LEU 23 Cb 0.00 -1.64 -0.08 0.00 0.03 0.00 0.00 46.19 44.50 1bod s LEU 23 CO 0.02 -0.07 0.99 -0.55 0.23 0.00 0.00 176.35 176.97 1bod s SER 24 N 1.36 6.60 0.66 2.29 0.15 -1.26 -3.31 113.70 120.18 1bod s SER 24 Ca 0.03 1.59 0.16 0.00 0.70 0.00 0.00 55.95 58.44 1bod s SER 24 Cb -0.15 -2.51 0.90 0.00 -1.71 0.00 0.00 66.02 62.54 1bod s SER 24 CO -0.06 -0.60 1.50 0.11 1.20 0.00 0.00 173.24 175.39 1bod h LYS 25 N 0.96 0.00 -0.50 5.44 1.79 -1.98 0.17 116.57 122.46 1bod h LYS 25 Ca -0.47 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.09 1bod h LYS 25 Cb 1.19 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.76 1bod h LYS 25 CO 0.61 0.00 0.05 0.93 -1.08 0.00 0.00 179.45 179.96 1bod h GLU 26 N 0.00 0.17 0.00 3.15 5.08 -2.00 -0.41 114.58 120.57 1bod h GLU 26 Ca 0.00 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1bod h GLU 26 Cb 1.26 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1bod h GLU 26 CO 0.00 0.11 -0.64 0.93 -1.00 0.00 0.00 179.01 178.41 1bod h GLU 27 N 0.18 0.00 0.00 2.33 4.39 -0.95 -3.37 114.58 117.15 1bod h GLU 27 Ca 0.25 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.95 1bod h GLU 27 Cb 0.37 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1bod h GLU 27 CO -0.38 0.23 -0.05 1.25 -1.16 0.00 0.00 179.01 178.90 1bod h LEU 28 N 0.00 0.00 0.00 1.33 5.85 -1.10 -3.06 115.31 118.33 1bod h LEU 28 Ca -0.03 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1bod h LEU 28 Cb 1.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1bod h LEU 28 CO 0.03 0.70 0.06 2.29 -0.34 0.00 0.00 178.44 181.19 1bod n LYS 29 N -4.71 0.00 -0.07 1.25 2.85 -0.24 -0.34 118.16 116.90 1bod n LYS 29 Ca -0.04 0.17 -0.05 0.00 -1.05 0.00 0.00 58.31 57.33 1bod n LYS 29 Cb 0.19 -1.56 -0.12 0.00 -0.65 0.00 0.00 35.03 32.88 1bod n LYS 29 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1bod n LEU 30 N -1.09 0.00 -0.02 -5.58 4.77 -1.24 -4.52 117.00 109.33 1bod n LEU 30 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 1bod n LEU 30 Cb 0.06 0.33 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 1bod n LEU 30 CO 0.00 0.33 0.29 0.25 -1.33 0.00 0.00 177.39 176.93 1bod h LEU 31 N 0.00 0.88 -0.80 2.23 6.46 -0.57 -3.26 115.31 120.25 1bod h LEU 31 Ca -0.36 -0.57 0.16 0.00 -0.12 0.00 0.00 57.88 56.99 1bod h LEU 31 Cb 1.78 -0.26 -0.10 0.00 -0.73 0.00 0.00 40.66 41.35 1bod h LEU 31 CO 0.02 1.36 0.33 0.17 -0.62 0.00 0.00 178.44 179.71 1bod h LEU 32 N 0.51 0.31 -9.83 2.25 -0.00 -1.71 -3.22 115.31 103.62 1bod h LEU 32 Ca -0.04 0.12 -0.51 0.00 -0.00 0.00 0.00 57.88 57.45 1bod h LEU 32 Cb 1.38 0.09 -0.03 0.00 -0.00 0.00 0.00 40.66 42.10 1bod h LEU 32 CO 0.15 0.09 0.19 0.00 -0.00 0.00 0.00 178.44 178.87 1bod s GLN 33 N -5.98 4.43 0.00 0.17 -2.07 -1.23 -1.44 119.66 113.54 1bod s GLN 33 Ca -0.12 1.07 0.00 0.00 -1.82 0.00 0.00 55.36 54.49 1bod s GLN 33 Cb 0.22 -2.97 0.00 0.00 -1.09 0.00 0.00 33.01 29.17 1bod s GLN 33 CO 0.77 0.41 0.00 -2.37 -1.32 0.00 0.00 175.29 172.78 1bod n THR 34 N 0.92 0.00 0.00 3.63 5.66 -1.26 -4.59 114.28 118.64 1bod n THR 34 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 1bod n THR 34 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 1bod n THR 34 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1bod n GLU 35 N -2.00 0.00 -3.67 1.09 -0.58 -1.25 -4.99 120.64 109.24 1bod n GLU 35 Ca 0.00 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.39 1bod n GLU 35 Cb 0.00 -0.13 -0.07 0.00 -0.57 0.00 0.00 31.44 30.67 1bod n GLU 35 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1bod s PHE 36 N -1.62 3.82 -0.03 -0.32 0.40 -0.52 -4.88 117.98 114.84 1bod s PHE 36 Ca 0.00 -3.04 -0.24 0.00 -0.60 0.00 0.00 56.93 53.06 1bod s PHE 36 Cb 0.00 -3.19 -0.18 0.00 0.51 0.00 0.00 43.02 40.17 1bod s PHE 36 CO 0.00 -0.73 1.11 -1.00 0.70 0.00 0.00 175.22 175.31 1bod h PRO 37 N 6.04 -0.18 -1.61 0.24 0.13 -1.88 -3.17 132.00 131.57 1bod h PRO 37 Ca 0.14 0.01 0.51 0.00 -0.87 0.00 0.00 66.00 65.79 1bod h PRO 37 Cb 0.82 0.04 -0.11 0.00 0.13 0.00 0.00 31.00 31.88 1bod h PRO 37 CO 0.83 0.24 1.10 0.45 -0.23 0.00 0.00 178.00 180.39 1bod n SER 38 N -4.95 0.12 0.14 1.44 2.88 -1.26 0.10 113.62 112.09 1bod n SER 38 Ca -0.08 1.19 -0.14 0.00 -1.33 0.00 0.00 58.87 58.50 1bod n SER 38 Cb 0.26 -0.59 -0.08 0.00 -0.75 0.00 0.00 64.21 63.05 1bod n SER 38 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1bod h LEU 39 N 0.00 -0.29 -4.61 2.46 3.38 -1.87 -3.21 115.31 111.17 1bod h LEU 39 Ca 0.89 -0.12 -0.67 0.00 0.09 0.00 0.00 57.88 58.06 1bod h LEU 39 Cb 3.18 0.07 -0.34 0.00 0.09 0.00 0.00 40.66 43.66 1bod h LEU 39 CO -0.26 -0.05 0.21 0.00 0.09 0.00 0.00 178.44 178.43 1bod n LEU 40 N -5.16 6.27 -2.58 1.67 -0.00 0.28 -4.63 117.00 112.85 1bod n LEU 40 Ca -0.09 -4.92 -0.09 0.00 -0.00 0.00 0.00 56.01 50.90 1bod n LEU 40 Cb 0.21 -0.77 0.04 0.00 -0.00 0.00 0.00 43.42 42.90 1bod n LEU 40 CO 0.33 1.94 0.03 1.17 -0.00 0.00 0.00 177.39 180.87 1bod n LYS 41 N -0.57 2.22 0.00 1.47 3.00 0.30 -4.97 118.16 119.61 1bod n LYS 41 Ca 0.48 -3.70 0.00 0.00 -0.00 0.00 0.00 58.31 55.09 1bod n LYS 41 Cb 0.50 -1.76 0.00 0.00 0.00 0.00 0.00 35.03 33.77 1bod n LYS 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1bod n GLY 42 N -0.53 -0.01 0.00 3.14 0.00 -1.26 -4.90 105.19 101.63 1bod n GLY 42 Ca 0.19 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.76 1bod n GLY 42 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1bod n MET 43 N 0.00 0.00 -3.47 1.61 0.00 -1.26 -4.94 117.12 109.05 1bod n MET 43 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.60 1bod n MET 43 Cb 0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 33.22 32.90 1bod n MET 43 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 1bod s SER 44 N -2.83 -0.44 0.00 3.17 0.01 -1.26 -5.14 113.70 107.21 1bod s SER 44 Ca 0.00 -0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.26 1bod s SER 44 Cb 0.00 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.69 1bod s SER 44 CO 0.00 -0.75 0.00 1.07 0.41 0.00 0.00 173.24 173.97 1bod n THR 45 N -0.29 0.00 0.00 1.44 5.66 -1.26 -4.72 114.28 115.11 1bod n THR 45 Ca -0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 1bod n THR 45 Cb 0.63 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 1bod n THR 45 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1bod n LEU 46 N 0.00 0.00 -3.52 1.09 4.32 -1.26 -1.80 117.00 115.84 1bod n LEU 46 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 56.01 55.59 1bod n LEU 46 Cb 0.00 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1bod n LEU 46 CO 0.00 0.00 2.39 0.47 -1.22 0.00 0.00 177.39 179.03 1bod n ASP 47 N 7.07 7.76 0.07 -1.43 8.00 -1.26 -4.15 116.55 132.61 1bod n ASP 47 Ca 0.00 -3.12 0.00 0.00 0.71 0.00 0.00 54.79 52.38 1bod n ASP 47 Cb 0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 39.72 1bod n ASP 47 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1bod n GLU 48 N 2.03 0.00 0.24 -1.24 0.00 -0.74 -4.40 120.64 116.52 1bod n GLU 48 Ca 0.61 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.88 1bod n GLU 48 Cb 0.26 -0.07 0.56 0.00 0.00 0.00 0.00 31.44 32.18 1bod n GLU 48 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.13 177.06 1bod h LEU 49 N 0.00 0.00 0.00 4.31 3.38 -1.80 1.18 115.31 122.38 1bod h LEU 49 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1bod h LEU 49 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1bod h LEU 49 CO 0.00 0.19 -0.11 0.15 0.09 0.00 0.00 178.44 178.76 1bod h PHE 50 N 0.00 0.00 0.00 1.13 3.57 -1.86 -3.19 116.94 116.59 1bod h PHE 50 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1bod h PHE 50 Cb 0.61 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.35 1bod h PHE 50 CO 0.00 0.75 0.00 -0.85 -2.23 0.00 0.00 178.31 175.98 1bod n GLU 51 N -4.64 0.00 0.23 1.11 -0.00 -1.12 0.72 120.64 116.94 1bod n GLU 51 Ca -0.09 0.31 0.09 0.00 -0.00 0.00 0.00 57.16 57.47 1bod n GLU 51 Cb 0.36 -1.50 0.53 0.00 -0.00 0.00 0.00 31.44 30.83 1bod n GLU 51 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1bod h GLU 52 N 0.00 0.00 0.00 3.44 4.39 0.14 -3.23 114.58 119.32 1bod h GLU 52 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1bod h GLU 52 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 1bod h GLU 52 CO 0.00 0.23 0.00 -0.11 -1.16 0.00 0.00 179.01 177.97 1bod n LEU 53 N -3.64 0.13 0.00 1.33 -0.00 -0.79 -4.74 117.00 109.29 1bod n LEU 53 Ca -0.01 -0.13 0.11 0.00 -0.00 0.00 0.00 56.01 55.98 1bod n LEU 53 Cb 0.36 0.00 0.60 0.00 -0.00 0.00 0.00 43.42 44.38 1bod n LEU 53 CO 0.33 0.03 0.86 -0.67 -0.00 0.00 0.00 177.39 177.95 1bod n ASP 54 N -0.03 0.00 0.02 1.96 2.03 0.22 0.33 116.55 121.08 1bod n ASP 54 Ca 0.00 -0.24 -0.01 0.00 0.52 0.00 0.00 54.79 55.06 1bod n ASP 54 Cb 0.40 -0.20 -0.00 0.00 -0.72 0.00 0.00 41.12 40.59 1bod n ASP 54 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1bod h LYS 55 N 0.00 -0.05 0.00 -0.67 1.79 -1.82 -2.55 116.57 113.28 1bod h LYS 55 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1bod h LYS 55 Cb 0.15 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1bod h LYS 55 CO 0.00 -0.03 -1.31 0.09 -1.08 0.00 0.00 179.45 177.12 1bod n ASN 56 N -2.31 0.51 -2.76 0.86 5.03 -1.24 -3.34 115.26 112.00 1bod n ASN 56 Ca -0.01 -0.04 -0.34 0.00 0.87 0.00 0.00 54.58 55.07 1bod n ASN 56 Cb 0.02 1.07 -0.01 0.00 -1.02 0.00 0.00 39.78 39.84 1bod n ASN 56 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bod n GLY 57 N 1.29 4.97 1.27 7.41 0.00 0.15 -4.69 105.19 115.60 1bod n GLY 57 Ca -0.00 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.83 1bod n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1bod n ASP 58 N 0.25 3.97 0.00 1.61 2.03 -0.96 -3.53 116.55 119.92 1bod n ASP 58 Ca 0.52 -2.12 0.00 0.00 0.52 0.00 0.00 54.79 53.71 1bod n ASP 58 Cb 0.39 -0.78 0.00 0.00 -0.72 0.00 0.00 41.12 40.01 1bod n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1bod n GLY 59 N 1.04 -0.12 3.28 0.27 0.00 -1.26 -5.00 105.19 103.40 1bod n GLY 59 Ca 0.00 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 1bod n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bod s GLU 60 N -1.41 0.67 -0.91 1.61 0.41 -1.23 -4.97 118.70 112.87 1bod s GLU 60 Ca 0.00 -0.02 -0.04 0.00 -0.41 0.00 0.00 54.97 54.50 1bod s GLU 60 Cb 0.00 0.31 0.23 0.00 -1.78 0.00 0.00 34.13 32.88 1bod s GLU 60 CO 0.00 -0.18 0.82 0.08 -0.49 0.00 0.00 175.26 175.49 1bod s VAL 61 N -1.06 4.67 0.00 2.63 1.01 -1.21 -4.73 120.40 121.72 1bod s VAL 61 Ca -0.11 -3.68 0.00 0.00 0.00 0.00 0.00 61.98 58.19 1bod s VAL 61 Cb -0.04 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1bod s VAL 61 CO 0.04 -1.09 0.00 -1.54 0.00 0.00 0.00 175.10 172.51 1bod n SER 62 N 2.53 -0.28 0.00 3.32 3.41 -1.26 -0.90 113.62 120.44 1bod n SER 62 Ca 0.21 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 1bod n SER 62 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 1bod n SER 62 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1bod n PHE 63 N -1.14 0.00 -0.38 7.33 7.35 -1.26 -2.30 117.46 127.05 1bod n PHE 63 Ca 0.00 0.00 0.32 0.00 -0.76 0.00 0.00 57.45 57.01 1bod n PHE 63 Cb 0.00 -0.21 0.53 0.00 0.35 0.00 0.00 39.48 40.15 1bod n PHE 63 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1bod n GLU 64 N -1.14 -0.03 0.09 -4.13 1.02 -1.26 0.30 120.64 115.49 1bod n GLU 64 Ca 0.00 0.95 -0.23 0.00 -0.02 0.00 0.00 57.16 57.87 1bod n GLU 64 Cb 0.00 -1.90 -0.15 0.00 -0.02 0.00 0.00 31.44 29.37 1bod n GLU 64 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1bod h GLU 65 N 0.00 0.41 -0.14 3.49 4.11 -1.94 -3.33 114.58 117.18 1bod h GLU 65 Ca 0.68 -0.69 -0.19 0.00 0.07 0.00 0.00 59.36 59.23 1bod h GLU 65 Cb 2.24 0.26 0.01 0.00 0.50 0.00 0.00 28.75 31.76 1bod h GLU 65 CO -0.33 1.33 -0.65 0.35 0.07 0.00 0.00 179.01 179.78 1bod h PHE 66 N -0.08 0.91 0.00 2.06 3.04 0.21 -3.12 116.94 119.96 1bod h PHE 66 Ca -0.25 -0.40 0.00 0.00 3.98 0.00 0.00 57.97 61.30 1bod h PHE 66 Cb 1.95 -0.14 0.00 0.00 2.56 0.00 0.00 35.95 40.31 1bod h PHE 66 CO 0.15 1.21 0.05 -0.56 -2.02 0.00 0.00 178.31 177.13 1bod h GLN 67 N 0.36 0.00 0.01 1.11 -0.00 0.44 2.33 115.11 119.36 1bod h GLN 67 Ca -0.04 0.00 -0.28 0.00 -0.00 0.00 0.00 58.65 58.32 1bod h GLN 67 Cb 1.29 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.72 1bod h GLN 67 CO 0.13 0.00 -1.61 0.28 -0.00 0.00 0.00 178.83 177.64 1bod h VAL 68 N 0.00 0.98 -0.73 1.86 2.07 -1.65 -3.35 116.25 115.42 1bod h VAL 68 Ca 0.00 -2.80 0.09 0.00 0.82 0.00 0.00 66.70 64.82 1bod h VAL 68 Cb 0.09 2.50 -0.10 0.00 -1.52 0.00 0.00 31.29 32.26 1bod h VAL 68 CO 0.00 0.60 -0.35 -0.11 0.02 0.00 0.00 177.57 177.73 1bod n LEU 69 N -3.14 -0.61 -0.21 2.57 7.94 0.78 0.85 117.00 125.19 1bod n LEU 69 Ca -0.15 1.29 0.01 0.00 -1.11 0.00 0.00 56.01 56.04 1bod n LEU 69 Cb 1.03 -0.24 0.09 0.00 0.53 0.00 0.00 43.42 44.83 1bod n LEU 69 CO 0.45 -1.11 0.78 -0.37 -1.11 0.00 0.00 177.39 176.04 1bod h VAL 70 N 0.00 0.41 -0.20 1.96 -1.51 -1.66 0.87 116.25 116.13 1bod h VAL 70 Ca 0.19 -0.02 -0.03 0.00 -1.23 0.00 0.00 66.70 65.62 1bod h VAL 70 Cb 0.38 0.36 -0.01 0.00 -2.13 0.00 0.00 31.29 29.88 1bod h VAL 70 CO -0.71 0.01 0.00 0.11 -1.23 0.00 0.00 177.57 175.75 1bod h LYS 71 N 0.05 0.29 0.00 5.19 1.57 0.23 -0.12 116.57 123.78 1bod h LYS 71 Ca 0.32 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1bod h LYS 71 Cb 0.51 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1bod h LYS 71 CO -0.60 0.32 -0.16 1.17 -0.57 0.00 0.00 179.45 179.60 1bod n LYS 72 N -4.37 0.00 -0.93 3.15 3.00 0.21 -3.85 118.16 115.37 1bod n LYS 72 Ca -0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.17 1bod n LYS 72 Cb 0.18 -1.50 -0.02 0.00 0.00 0.00 0.00 35.03 33.69 1bod n LYS 72 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1bod n ILE 73 N -1.51 2.73 -1.57 3.15 5.41 0.24 -4.57 119.36 123.25 1bod n ILE 73 Ca 0.06 -1.61 -0.33 0.00 1.00 0.00 0.00 62.75 61.88 1bod n ILE 73 Cb 0.34 -1.53 0.02 0.00 -0.71 0.00 0.00 39.64 37.76 1bod n ILE 73 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1bod n SER 74 N 1.07 7.14 0.00 4.38 2.88 -1.25 -4.84 113.62 122.99 1bod n SER 74 Ca 0.28 -3.56 0.06 0.00 -1.33 0.00 0.00 58.87 54.33 1bod n SER 74 Cb 0.61 -1.10 0.35 0.00 -0.75 0.00 0.00 64.21 63.32 1bod n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81