#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 0.38 -0.22 3.17 -2.85 -1.26 -5.18 119.74 113.78 1bod s LYS 1 Ca 0.00 0.01 -0.31 0.00 -1.00 0.00 0.00 55.97 54.67 1bod s LYS 1 Cb 0.00 0.18 0.16 0.00 -2.06 0.00 0.00 37.83 36.11 1bod s LYS 1 CO 0.00 -0.14 1.21 -1.54 0.10 0.00 0.00 175.35 174.99 1bod s SER 2 N -1.44 -0.16 0.53 0.03 1.04 -1.26 -5.00 113.70 107.44 1bod s SER 2 Ca 0.05 0.12 0.35 0.00 0.48 0.00 0.00 55.95 56.95 1bod s SER 2 Cb -0.01 0.14 1.74 0.00 0.10 0.00 0.00 66.02 68.00 1bod s SER 2 CO -0.04 -0.18 2.06 1.55 0.98 0.00 0.00 173.24 177.61 1bod h PRO 3 N 2.17 0.00 -0.05 4.02 0.13 -2.06 -0.90 132.00 135.31 1bod h PRO 3 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1bod h PRO 3 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1bod h PRO 3 CO 0.25 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.41 1bod n GLU 4 N -2.84 1.15 0.00 0.86 -0.58 -1.26 -3.54 120.64 114.43 1bod n GLU 4 Ca -0.01 -0.23 0.10 0.00 -0.42 0.00 0.00 57.16 56.60 1bod n GLU 4 Cb 0.15 -1.19 0.57 0.00 -0.57 0.00 0.00 31.44 30.40 1bod n GLU 4 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1bod n GLU 5 N -0.45 0.75 -0.08 3.49 2.13 -0.34 -3.07 120.64 123.07 1bod n GLU 5 Ca 0.09 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.76 1bod n GLU 5 Cb 0.09 -1.40 -0.11 0.00 0.27 0.00 0.00 31.44 30.29 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 0.00 4.31 4.07 -1.82 -3.26 115.31 118.62 1bod h LEU 6 Ca 0.00 -0.71 0.00 0.00 0.08 0.00 0.00 57.88 57.25 1bod h LEU 6 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1bod h LEU 6 CO 0.00 1.08 0.00 1.17 -1.08 0.00 0.00 178.44 179.61 1bod n LYS 7 N -4.58 0.04 0.00 1.13 0.00 -1.18 -1.93 118.16 111.64 1bod n LYS 7 Ca -0.15 0.33 0.13 0.00 0.00 0.00 0.00 58.31 58.61 1bod n LYS 7 Cb 0.48 -1.50 0.32 0.00 0.00 0.00 0.00 35.03 34.33 1bod n LYS 7 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1bod n GLY 8 N -0.77 0.01 0.74 3.14 0.00 -1.22 -4.16 105.19 102.92 1bod n GLY 8 Ca 0.02 -0.51 -0.03 0.00 0.00 0.00 0.00 46.02 45.50 1bod n GLY 8 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1bod n ILE 9 N 0.12 1.27 -0.10 -0.61 -6.64 -0.81 -4.42 119.36 108.16 1bod n ILE 9 Ca 0.15 0.29 -0.03 0.00 -1.77 0.00 0.00 62.75 61.39 1bod n ILE 9 Cb 0.42 -1.82 -0.02 0.00 -1.44 0.00 0.00 39.64 36.77 1bod n ILE 9 CO 0.00 0.00 0.00 0.33 -1.77 0.00 0.00 176.55 175.11 1bod n PHE 10 N -3.78 -0.11 -0.32 4.28 7.35 -1.20 0.50 117.46 124.18 1bod n PHE 10 Ca -0.05 0.31 0.23 0.00 -0.76 0.00 0.00 57.45 57.17 1bod n PHE 10 Cb 0.20 -0.51 0.44 0.00 0.35 0.00 0.00 39.48 39.96 1bod n PHE 10 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 1bod h GLU 11 N 0.00 0.11 -0.54 -4.13 4.57 -1.85 0.81 114.58 113.55 1bod h GLU 11 Ca 0.04 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 1bod h GLU 11 Cb 0.10 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 1bod h GLU 11 CO -0.23 0.07 0.23 1.57 -1.18 0.00 0.00 179.01 179.47 1bod h LYS 12 N 0.11 0.81 0.00 1.92 5.09 -0.16 -1.04 116.57 123.30 1bod h LYS 12 Ca 0.71 -0.14 0.00 0.00 0.09 0.00 0.00 60.65 61.31 1bod h LYS 12 Cb 1.68 -0.13 0.00 0.00 0.10 0.00 0.00 32.23 33.87 1bod h LYS 12 CO -0.75 0.69 0.00 0.66 -2.09 0.00 0.00 179.45 177.97 1bod n TYR 13 N -4.53 0.00 -1.36 0.07 4.01 0.28 -3.24 117.16 112.40 1bod n TYR 13 Ca 0.03 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.53 1bod n TYR 13 Cb 0.15 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.10 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 -0.82 6.17 -1.68 7.72 -0.08 -0.39 -4.68 116.55 122.79 1bod n ASP 15 Ca 0.08 -3.03 -0.04 0.00 -1.51 0.00 0.00 54.79 50.29 1bod n ASP 15 Cb 0.03 -1.27 -0.06 0.00 2.34 0.00 0.00 41.12 42.16 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 1.26 1.34 0.00 -0.67 5.02 -1.20 -3.49 118.16 120.42 1bod n LYS 16 Ca 0.47 -0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.41 1bod n LYS 16 Cb 0.64 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 34.30 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 1.86 0.00 0.00 1.97 2.13 -1.26 -5.07 120.64 120.26 1bod n GLU 17 Ca 0.15 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.97 1bod n GLU 17 Cb 0.64 -0.50 0.00 0.00 0.27 0.00 0.00 31.44 31.85 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 1.91 0.79 0.00 8.31 0.00 -1.23 -5.05 105.19 109.93 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 4.83 0.00 1.61 5.68 -1.26 -5.02 116.55 122.39 1bod n ASP 19 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1bod n ASP 19 Cb 0.00 0.58 0.00 0.00 -1.14 0.00 0.00 41.12 40.56 1bod n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1bod n GLY 20 N 2.82 2.65 2.40 6.12 0.00 -1.26 -5.01 105.19 112.90 1bod n GLY 20 Ca 0.00 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.23 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 0.90 -4.38 1.61 -0.00 -1.26 -4.49 117.38 109.76 1bod n GLN 22 Ca 0.00 -2.45 -0.34 0.00 -0.00 0.00 0.00 57.00 54.21 1bod n GLN 22 Cb 0.00 1.01 -0.15 0.00 -0.00 0.00 0.00 30.24 31.11 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 2.67 0.74 2.61 1.43 -0.65 -4.83 118.68 120.64 1bod s LEU 23 Ca 0.08 -0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 52.66 1bod s LEU 23 Cb 0.00 -1.63 0.03 0.00 0.03 0.00 0.00 46.19 44.63 1bod s LEU 23 CO 0.05 0.07 1.09 -0.94 0.23 0.00 0.00 176.35 176.86 1bod s SER 24 N 0.89 5.06 0.13 2.29 1.04 -1.26 -1.43 113.70 120.42 1bod s SER 24 Ca -0.03 1.31 0.07 0.00 0.48 0.00 0.00 55.95 57.78 1bod s SER 24 Cb -0.15 -2.11 0.38 0.00 0.10 0.00 0.00 66.02 64.24 1bod s SER 24 CO -0.00 -1.61 1.14 0.29 0.98 0.00 0.00 173.24 174.04 1bod n LYS 25 N -3.20 0.05 -0.26 4.02 5.02 -1.26 -0.71 118.16 121.81 1bod n LYS 25 Ca 0.07 0.48 -0.02 0.00 -2.02 0.00 0.00 58.31 56.82 1bod n LYS 25 Cb 0.56 -1.77 0.16 0.00 -0.02 0.00 0.00 35.03 33.96 1bod n LYS 25 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1bod h GLU 26 N 0.00 1.10 0.00 1.97 5.08 -1.98 -0.72 114.58 120.03 1bod h GLU 26 Ca 0.00 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.12 1bod h GLU 26 Cb 0.23 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1bod h GLU 26 CO 0.00 0.80 -1.24 0.93 -1.00 0.00 0.00 179.01 178.50 1bod h GLU 27 N 1.11 0.00 0.00 2.33 5.08 -1.23 -3.37 114.58 118.50 1bod h GLU 27 Ca 0.28 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1bod h GLU 27 Cb 0.01 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.26 1bod h GLU 27 CO -0.05 0.21 -0.05 1.25 -1.00 0.00 0.00 179.01 179.37 1bod h LEU 28 N 0.00 0.00 -0.92 1.33 5.85 -1.17 -2.95 115.31 117.45 1bod h LEU 28 Ca -0.11 -0.14 0.25 0.00 0.84 0.00 0.00 57.88 58.72 1bod h LEU 28 Cb 1.41 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 42.27 1bod h LEU 28 CO 0.03 0.60 0.09 0.50 -0.34 0.00 0.00 178.44 179.32 1bod h LYS 29 N -1.00 0.07 0.15 1.25 3.11 -1.36 0.57 116.57 119.36 1bod h LYS 29 Ca -0.00 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 1bod h LYS 29 Cb 0.19 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.39 1bod h LYS 29 CO -0.00 0.05 -0.13 -0.07 -2.81 0.00 0.00 179.45 176.49 1bod h LEU 30 N 0.07 -0.33 -0.77 5.20 3.38 -1.72 -2.63 115.31 118.51 1bod h LEU 30 Ca 0.56 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.72 1bod h LEU 30 Cb 1.14 0.11 -0.14 0.00 0.09 0.00 0.00 40.66 41.86 1bod h LEU 30 CO -0.81 -0.20 -0.12 0.25 0.09 0.00 0.00 178.44 177.66 1bod h LEU 31 N -0.29 -0.58 -0.71 1.67 6.46 0.31 -0.77 115.31 121.39 1bod h LEU 31 Ca -0.00 0.22 0.16 0.00 -0.12 0.00 0.00 57.88 58.14 1bod h LEU 31 Cb 0.27 0.43 -0.12 0.00 -0.73 0.00 0.00 40.66 40.52 1bod h LEU 31 CO -0.02 -0.23 0.06 0.17 -0.62 0.00 0.00 178.44 177.79 1bod h LEU 32 N 0.03 -0.22 0.07 2.25 8.10 -0.97 -1.95 115.31 122.61 1bod h LEU 32 Ca 0.39 0.17 -0.26 0.00 0.11 0.00 0.00 57.88 58.29 1bod h LEU 32 Cb 0.64 0.28 -0.01 0.00 -0.44 0.00 0.00 40.66 41.12 1bod h LEU 32 CO -0.75 -0.12 -1.25 0.06 -4.11 0.00 0.00 178.44 172.27 1bod h GLN 33 N 0.15 0.14 0.65 0.17 3.07 -1.22 -1.36 115.11 116.71 1bod h GLN 33 Ca 0.39 -0.25 -0.03 0.00 0.09 0.00 0.00 58.65 58.86 1bod h GLN 33 Cb 0.68 0.09 -0.00 0.00 0.08 0.00 0.00 27.48 28.32 1bod h GLN 33 CO -0.58 1.06 -0.38 1.79 0.09 0.00 0.00 178.83 180.81 1bod h THR 34 N 0.04 0.23 0.00 1.86 1.35 -0.52 -3.40 112.91 112.47 1bod h THR 34 Ca -0.12 0.00 -0.08 0.00 -0.55 0.00 0.00 66.41 65.66 1bod h THR 34 Cb 1.91 0.23 -0.15 0.00 -1.73 0.00 0.00 68.15 68.41 1bod h THR 34 CO 0.16 0.00 -0.55 -1.84 -0.25 0.00 0.00 175.52 173.04 1bod n GLU 35 N -5.52 0.00 -3.21 4.72 0.28 -0.89 -4.98 120.64 111.05 1bod n GLU 35 Ca -0.13 -1.15 -0.23 0.00 -0.16 0.00 0.00 57.16 55.49 1bod n GLU 35 Cb 0.41 -0.07 -0.07 0.00 1.43 0.00 0.00 31.44 33.14 1bod n GLU 35 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1bod n PHE 36 N 0.16 -0.97 0.11 -1.84 3.72 -0.55 -4.97 117.46 113.12 1bod n PHE 36 Ca -0.03 -3.23 -0.08 0.00 -0.05 0.00 0.00 57.45 54.06 1bod n PHE 36 Cb 0.81 0.10 -0.05 0.00 -0.94 0.00 0.00 39.48 39.40 1bod n PHE 36 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1bod h PRO 37 N 4.62 -0.35 -1.46 -1.08 0.13 -1.76 -3.25 132.00 128.85 1bod h PRO 37 Ca 0.12 0.02 0.42 0.00 -0.87 0.00 0.00 66.00 65.70 1bod h PRO 37 Cb 0.91 0.08 -0.07 0.00 0.13 0.00 0.00 31.00 32.05 1bod h PRO 37 CO 0.40 -0.09 1.04 0.77 -0.23 0.00 0.00 178.00 179.88 1bod h SER 38 N -1.02 0.05 -0.77 1.44 0.02 -1.92 0.16 113.55 111.49 1bod h SER 38 Ca -0.04 0.02 0.17 0.00 -0.84 0.00 0.00 61.79 61.10 1bod h SER 38 Cb 0.42 0.01 -0.11 0.00 0.14 0.00 0.00 62.40 62.86 1bod h SER 38 CO 0.06 -0.01 0.23 -0.07 -1.14 0.00 0.00 176.83 175.90 1bod h LEU 39 N 0.03 0.08 -2.47 5.07 3.38 -1.90 -3.03 115.31 116.48 1bod h LEU 39 Ca 0.71 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.83 1bod h LEU 39 Cb 2.76 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 43.69 1bod h LEU 39 CO -0.06 -0.03 -0.28 0.00 0.09 0.00 0.00 178.44 178.17 1bod n LEU 40 N -5.13 1.09 -1.40 1.67 -0.00 -0.03 -4.77 117.00 108.42 1bod n LEU 40 Ca 0.16 -1.97 -0.05 0.00 -0.00 0.00 0.00 56.01 54.14 1bod n LEU 40 Cb 0.50 -0.20 0.13 0.00 -0.00 0.00 0.00 43.42 43.85 1bod n LEU 40 CO 0.13 0.47 0.74 1.17 -0.00 0.00 0.00 177.39 179.89 1bod n LYS 41 N -0.66 2.08 0.00 1.47 4.81 0.34 -4.17 118.16 122.03 1bod n LYS 41 Ca 0.07 -1.42 0.00 0.00 -0.87 0.00 0.00 58.31 56.09 1bod n LYS 41 Cb 0.68 -1.67 0.00 0.00 0.02 0.00 0.00 35.03 34.05 1bod n LYS 41 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1bod n GLY 42 N -0.04 0.00 0.00 3.14 0.00 -1.26 -4.94 105.19 102.08 1bod n GLY 42 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1bod n GLY 42 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1bod n MET 43 N -2.49 3.52 -2.86 1.61 1.56 -1.26 -5.14 117.12 112.06 1bod n MET 43 Ca 0.00 0.00 -0.19 0.00 -0.27 0.00 0.00 57.70 57.24 1bod n MET 43 Cb 0.03 0.00 0.07 0.00 2.15 0.00 0.00 33.22 35.47 1bod n MET 43 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 1bod n SER 44 N 0.00 1.94 0.00 6.12 3.41 -1.26 -4.98 113.62 118.85 1bod n SER 44 Ca 0.00 -2.44 0.00 0.00 -0.26 0.00 0.00 58.87 56.17 1bod n SER 44 Cb 0.00 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 1bod n SER 44 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1bod n THR 45 N -2.33 0.00 0.00 6.66 5.66 -1.26 -4.78 114.28 118.23 1bod n THR 45 Ca 0.16 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.16 1bod n THR 45 Cb 0.58 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 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 -0.44 1.09 4.77 -1.26 -0.95 117.00 120.21 1bod n LEU 46 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 1bod n LEU 46 Cb 0.00 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.30 1bod n LEU 46 CO 0.00 0.00 0.66 0.47 -1.33 0.00 0.00 177.39 177.19 1bod n ASP 47 N 5.32 1.30 -0.02 -1.43 8.00 -1.26 -3.89 116.55 124.56 1bod n ASP 47 Ca 0.00 -1.89 -0.17 0.00 0.71 0.00 0.00 54.79 53.44 1bod n ASP 47 Cb 0.00 -0.14 -0.14 0.00 -0.02 0.00 0.00 41.12 40.82 1bod n ASP 47 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1bod n GLU 48 N 0.17 0.71 0.12 -1.24 -0.58 -0.12 -0.99 120.64 118.71 1bod n GLU 48 Ca 0.11 0.24 -0.02 0.00 -0.42 0.00 0.00 57.16 57.07 1bod n GLU 48 Cb 0.22 -1.70 0.11 0.00 -0.57 0.00 0.00 31.44 29.51 1bod n GLU 48 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1bod h LEU 49 N 0.04 0.00 0.00 -4.62 3.38 -1.77 1.62 115.31 113.97 1bod h LEU 49 Ca -0.41 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 1bod h LEU 49 Cb 2.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.77 1bod h LEU 49 CO 0.06 0.69 -0.19 0.15 0.09 0.00 0.00 178.44 179.24 1bod h PHE 50 N 0.00 0.00 0.00 1.13 3.04 -1.72 -3.23 116.94 116.16 1bod h PHE 50 Ca -0.01 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.92 1bod h PHE 50 Cb 1.24 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.75 1bod h PHE 50 CO 0.00 0.73 -0.10 1.05 -2.02 0.00 0.00 178.31 177.97 1bod h GLU 51 N -1.00 0.00 -1.29 1.11 -0.00 -1.09 -2.48 114.58 109.83 1bod h GLU 51 Ca -0.04 0.00 0.45 0.00 -0.00 0.00 0.00 59.36 59.77 1bod h GLU 51 Cb 0.74 0.00 -0.15 0.00 -0.00 0.00 0.00 28.75 29.34 1bod h GLU 51 CO -0.03 0.10 0.80 0.93 -0.00 0.00 0.00 179.01 180.82 1bod h GLU 52 N 0.00 0.03 0.00 1.06 4.39 0.24 1.75 114.58 122.06 1bod h GLU 52 Ca -0.00 -0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.37 1bod h GLU 52 Cb 0.36 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.94 1bod h GLU 52 CO 0.01 0.02 -2.34 1.28 -1.16 0.00 0.00 179.01 176.82 1bod n LEU 53 N -4.84 0.00 -1.77 1.33 7.99 -0.97 -4.91 117.00 113.84 1bod n LEU 53 Ca 0.39 0.00 -0.04 0.00 -0.01 0.00 0.00 56.01 56.35 1bod n LEU 53 Cb 1.47 0.44 -0.01 0.00 -0.11 0.00 0.00 43.42 45.21 1bod n LEU 53 CO 0.15 0.44 -0.04 -0.67 -1.51 0.00 0.00 177.39 175.76 1bod n ASP 54 N -2.69 -1.41 0.00 -1.43 2.03 0.60 -4.85 116.55 108.80 1bod n ASP 54 Ca -0.29 0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.26 1bod n ASP 54 Cb 1.09 -1.48 0.00 0.00 -0.72 0.00 0.00 41.12 40.01 1bod n ASP 54 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1bod n LYS 55 N -1.89 3.31 -0.39 -0.67 2.85 -1.26 -4.56 118.16 115.55 1bod n LYS 55 Ca -0.04 0.00 -0.04 0.00 -1.05 0.00 0.00 58.31 57.17 1bod n LYS 55 Cb 0.32 0.00 0.09 0.00 -0.65 0.00 0.00 35.03 34.79 1bod n LYS 55 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1bod n ASN 56 N 0.00 3.05 -4.21 -5.58 3.02 -1.26 -4.83 115.26 105.45 1bod n ASN 56 Ca 0.00 -2.48 -0.36 0.00 -0.03 0.00 0.00 54.58 51.71 1bod n ASN 56 Cb 0.00 -0.60 -0.05 0.00 -0.61 0.00 0.00 39.78 38.52 1bod n ASN 56 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bod n GLY 57 N 0.03 -0.43 0.72 7.41 0.00 -1.26 -4.73 105.19 106.92 1bod n GLY 57 Ca 0.17 0.09 0.04 0.00 0.00 0.00 0.00 46.02 46.32 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 -2.47 2.01 -1.68 1.61 -0.08 -1.26 -4.87 116.55 109.81 1bod n ASP 58 Ca 0.09 -2.15 -0.15 0.00 -1.51 0.00 0.00 54.79 51.07 1bod n ASP 58 Cb 0.47 -0.35 -0.01 0.00 2.34 0.00 0.00 41.12 43.58 1bod n ASP 58 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1bod n GLY 59 N 0.62 -0.24 3.63 0.27 0.00 -1.26 -5.00 105.19 103.22 1bod n GLY 59 Ca 0.09 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 1bod n GLY 59 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1bod s GLU 60 N -4.74 0.79 -0.43 1.61 4.04 -1.26 -4.40 118.70 114.30 1bod s GLU 60 Ca 0.00 1.07 0.03 0.00 0.04 0.00 0.00 54.97 56.11 1bod s GLU 60 Cb -0.00 0.31 0.12 0.00 0.02 0.00 0.00 34.13 34.58 1bod s GLU 60 CO 0.01 -0.12 0.19 0.08 -1.84 0.00 0.00 175.26 173.58 1bod s VAL 61 N 0.82 1.92 0.00 1.83 1.01 -0.51 -4.87 120.40 120.60 1bod s VAL 61 Ca -0.03 -2.64 0.00 0.00 0.00 0.00 0.00 61.98 59.30 1bod s VAL 61 Cb -0.05 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.96 1bod s VAL 61 CO -0.06 -0.78 0.00 -1.54 0.00 0.00 0.00 175.10 172.72 1bod n SER 62 N 3.69 0.00 0.00 3.32 3.41 -1.26 -1.63 113.62 121.14 1bod n SER 62 Ca 0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1bod n SER 62 Cb 0.36 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 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 -0.80 0.00 -0.46 7.33 7.35 -1.26 -1.29 117.46 128.33 1bod n PHE 63 Ca 0.00 0.00 0.39 0.00 -0.76 0.00 0.00 57.45 57.08 1bod n PHE 63 Cb 0.00 -0.34 0.67 0.00 0.35 0.00 0.00 39.48 40.16 1bod n PHE 63 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 1bod h GLU 64 N 0.00 0.04 0.05 -4.13 5.08 -1.97 1.40 114.58 115.04 1bod h GLU 64 Ca 0.00 -0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.08 1bod h GLU 64 Cb 0.00 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.27 1bod h GLU 64 CO 0.00 0.02 -1.11 0.93 -1.00 0.00 0.00 179.01 177.86 1bod h GLU 65 N 0.04 0.66 0.26 2.33 4.39 -1.90 -3.37 114.58 116.99 1bod h GLU 65 Ca 0.86 -0.78 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1bod h GLU 65 Cb 2.73 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 31.62 1bod h GLU 65 CO -0.45 1.34 -0.12 0.35 -1.16 0.00 0.00 179.01 178.96 1bod h PHE 66 N 0.31 -0.32 0.00 4.33 3.57 0.30 -3.34 116.94 121.79 1bod h PHE 66 Ca -0.15 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.34 1bod h PHE 66 Cb 1.77 0.11 0.00 0.00 2.79 0.00 0.00 35.95 40.62 1bod h PHE 66 CO 0.11 0.04 0.00 0.00 -2.23 0.00 0.00 178.31 176.23 1bod n GLN 67 N -5.03 0.09 -0.05 1.11 -0.00 0.11 -1.84 117.38 111.76 1bod n GLN 67 Ca -0.08 0.00 0.06 0.00 -0.00 0.00 0.00 57.00 56.98 1bod n GLN 67 Cb 0.26 -1.01 0.25 0.00 -0.00 0.00 0.00 30.24 29.74 1bod n GLN 67 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.06 178.61 1bod n VAL 68 N -0.31 0.14 -0.12 -0.39 3.14 -1.25 -3.05 118.33 116.49 1bod n VAL 68 Ca 0.00 -0.17 -0.18 0.00 -2.96 0.00 0.00 64.34 61.03 1bod n VAL 68 Cb 0.00 0.04 -0.11 0.00 -1.06 0.00 0.00 33.84 32.72 1bod n VAL 68 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1bod n LEU 69 N -0.20 2.82 0.11 6.55 4.77 -0.77 -2.94 117.00 127.33 1bod n LEU 69 Ca 0.09 -0.07 0.06 0.00 -0.03 0.00 0.00 56.01 56.06 1bod n LEU 69 Cb 0.14 -0.83 0.52 0.00 -2.33 0.00 0.00 43.42 40.92 1bod n LEU 69 CO 0.07 0.85 1.12 1.62 -1.33 0.00 0.00 177.39 179.73 1bod h VAL 70 N -0.13 1.06 0.15 4.08 3.04 -1.74 1.64 116.25 124.36 1bod h VAL 70 Ca -0.55 -0.11 -0.31 0.00 -1.01 0.00 0.00 66.70 64.72 1bod h VAL 70 Cb 1.79 0.71 0.01 0.00 -2.01 0.00 0.00 31.29 31.79 1bod h VAL 70 CO -0.13 0.06 -1.46 0.11 -1.01 0.00 0.00 177.57 175.14 1bod h LYS 71 N 0.32 0.33 0.00 4.17 1.57 -1.71 -3.15 116.57 118.09 1bod h LYS 71 Ca 0.09 -0.56 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1bod h LYS 71 Cb -0.04 0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1bod h LYS 71 CO -0.02 1.23 0.00 1.17 -0.57 0.00 0.00 179.45 181.26 1bod n LYS 72 N -3.54 0.96 0.01 3.15 4.81 -0.04 -2.82 118.16 120.69 1bod n LYS 72 Ca -0.15 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.40 1bod n LYS 72 Cb 1.05 -1.50 0.12 0.00 0.02 0.00 0.00 35.03 34.72 1bod n LYS 72 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 1bod n ILE 73 N -1.00 0.04 -2.66 3.15 5.41 0.54 -4.94 119.36 119.91 1bod n ILE 73 Ca 0.23 -0.05 -0.20 0.00 1.00 0.00 0.00 62.75 63.73 1bod n ILE 73 Cb 0.11 0.40 0.02 0.00 -0.71 0.00 0.00 39.64 39.45 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 -1.60 -2.97 0.00 4.38 2.88 -1.13 -4.96 113.62 110.22 1bod n SER 74 Ca 0.04 -0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.35 1bod n SER 74 Cb 0.36 -0.90 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 1bod n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81