#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bod n LYS 1 N 0.00 0.00 -4.35 3.17 4.76 -1.26 -4.93 118.16 115.55 1bod n LYS 1 Ca 0.00 0.20 -0.28 0.00 -2.87 0.00 0.00 58.31 55.36 1bod n LYS 1 Cb 0.00 -0.80 -0.12 0.00 -1.84 0.00 0.00 35.03 32.27 1bod n LYS 1 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1bod s SER 2 N -1.84 3.67 0.12 4.39 1.04 -1.26 -5.03 113.70 114.79 1bod s SER 2 Ca 0.00 -0.68 -0.17 0.00 0.48 0.00 0.00 55.95 55.57 1bod s SER 2 Cb 0.00 -0.41 -0.03 0.00 0.10 0.00 0.00 66.02 65.68 1bod s SER 2 CO 0.00 0.16 1.70 1.55 0.98 0.00 0.00 173.24 177.63 1bod h PRO 3 N 3.56 0.46 -0.98 4.02 0.14 -2.06 -2.05 132.00 135.09 1bod h PRO 3 Ca -0.49 -0.07 -0.05 0.00 0.14 0.00 0.00 66.00 65.53 1bod h PRO 3 Cb 1.18 -0.08 -0.03 0.00 0.14 0.00 0.00 31.00 32.21 1bod h PRO 3 CO 0.45 0.42 0.07 0.39 0.14 0.00 0.00 178.00 179.48 1bod n GLU 4 N -4.76 1.31 0.00 0.86 4.71 -1.26 -4.00 120.64 117.49 1bod n GLU 4 Ca -0.01 -0.45 0.12 0.00 -0.01 0.00 0.00 57.16 56.81 1bod n GLU 4 Cb 0.10 -1.31 0.73 0.00 -1.01 0.00 0.00 31.44 29.95 1bod n GLU 4 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1bod n GLU 5 N 0.21 0.81 0.03 3.49 2.13 -0.77 -3.21 120.64 123.33 1bod n GLU 5 Ca 0.07 0.00 -0.20 0.00 0.66 0.00 0.00 57.16 57.69 1bod n GLU 5 Cb 0.59 -1.47 -0.14 0.00 0.27 0.00 0.00 31.44 30.68 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 0.41 -1.78 4.31 4.07 -1.83 -3.24 115.31 117.26 1bod h LEU 6 Ca 0.00 -0.92 -0.03 0.00 0.08 0.00 0.00 57.88 57.01 1bod h LEU 6 Cb 0.00 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 41.60 1bod h LEU 6 CO 0.00 1.43 -0.15 0.50 -1.08 0.00 0.00 178.44 179.15 1bod h LYS 7 N -0.40 0.00 -3.94 1.13 3.11 -1.89 -3.30 116.57 111.28 1bod h LYS 7 Ca -0.18 0.00 -0.72 0.00 -2.81 0.00 0.00 60.65 56.94 1bod h LYS 7 Cb 1.63 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 32.79 1bod h LYS 7 CO 0.11 0.15 2.85 0.41 -2.81 0.00 0.00 179.45 180.16 1bod n GLY 8 N -1.00 4.45 0.00 5.01 0.00 -1.22 -3.95 105.19 108.48 1bod n GLY 8 Ca -0.02 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.29 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 4.72 0.00 -0.01 -0.61 0.13 -1.24 -4.98 119.36 117.36 1bod n ILE 9 Ca 0.49 0.00 -0.00 0.00 -1.10 0.00 0.00 62.75 62.14 1bod n ILE 9 Cb 0.39 0.00 -0.00 0.00 -0.84 0.00 0.00 39.64 39.18 1bod n ILE 9 CO 0.00 0.00 0.00 0.33 2.80 0.00 0.00 176.55 179.68 1bod n PHE 10 N 0.00 -0.01 -0.33 9.51 -0.00 -1.25 0.07 117.46 125.45 1bod n PHE 10 Ca 0.00 0.04 0.23 0.00 -0.00 0.00 0.00 57.45 57.72 1bod n PHE 10 Cb 0.00 -0.48 0.43 0.00 -0.00 0.00 0.00 39.48 39.43 1bod n PHE 10 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 1bod n GLU 11 N -3.02 -0.07 -0.16 -4.13 4.07 -1.25 0.11 120.64 116.18 1bod n GLU 11 Ca 0.00 1.44 -0.11 0.00 -0.06 0.00 0.00 57.16 58.43 1bod n GLU 11 Cb 0.01 -2.42 -0.00 0.00 -0.06 0.00 0.00 31.44 28.96 1bod n GLU 11 CO 0.00 0.00 0.00 1.57 -0.06 0.00 0.00 177.13 178.64 1bod h LYS 12 N 0.00 0.93 0.00 5.31 5.09 -0.61 -2.11 116.57 125.18 1bod h LYS 12 Ca 0.72 -0.36 0.00 0.00 0.09 0.00 0.00 60.65 61.10 1bod h LYS 12 Cb 1.70 -0.05 0.00 0.00 0.10 0.00 0.00 32.23 33.98 1bod h LYS 12 CO -0.86 1.01 0.00 0.66 -2.09 0.00 0.00 179.45 178.17 1bod n TYR 13 N -4.22 0.00 -1.07 0.07 4.02 0.30 -3.22 117.16 113.04 1bod n TYR 13 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.72 1bod n TYR 13 Cb 0.39 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.68 1bod n TYR 13 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1bod n ASP 15 N -0.92 6.10 -4.14 7.72 -0.08 -0.70 -4.79 116.55 119.75 1bod n ASP 15 Ca 0.11 -2.92 -0.41 0.00 -1.51 0.00 0.00 54.79 50.05 1bod n ASP 15 Cb 0.05 -1.20 -0.01 0.00 2.34 0.00 0.00 41.12 42.30 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 1.08 2.77 0.13 -0.67 4.01 -1.20 -3.85 118.16 120.43 1bod n LYS 16 Ca 0.35 -2.80 0.00 0.00 -0.51 0.00 0.00 58.31 55.35 1bod n LYS 16 Cb 0.62 -3.38 0.00 0.00 -0.51 0.00 0.00 35.03 31.76 1bod n LYS 16 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 1bod n GLU 17 N 7.31 0.00 0.00 1.97 2.13 -1.26 -5.08 120.64 125.71 1bod n GLU 17 Ca 0.50 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.32 1bod n GLU 17 Cb 0.43 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.14 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 -0.94 0.85 0.00 8.31 0.00 -1.25 -5.07 105.19 107.08 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 1.34 0.00 0.00 0.00 173.32 174.66 1bod n ASP 19 N 0.00 1.04 0.00 1.61 2.03 -1.26 -5.05 116.55 114.92 1bod n ASP 19 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1bod n ASP 19 Cb 0.00 0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.41 1bod n ASP 19 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1bod n GLY 20 N 1.91 0.99 2.49 0.27 0.00 -1.26 -5.07 105.19 104.52 1bod n GLY 20 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.03 0.59 -5.02 1.61 -0.00 -1.26 -4.16 117.38 109.11 1bod n GLN 22 Ca 0.00 -2.56 -0.32 0.00 -0.00 0.00 0.00 57.00 54.11 1bod n GLN 22 Cb 0.00 1.55 -0.15 0.00 -0.00 0.00 0.00 30.24 31.64 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 2.41 0.79 2.61 1.43 -0.67 -4.91 118.68 120.35 1bod s LEU 23 Ca 0.19 -0.42 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 1bod s LEU 23 Cb 0.01 -1.50 0.07 0.00 0.03 0.00 0.00 46.19 44.80 1bod s LEU 23 CO 0.13 0.20 1.12 -0.55 0.23 0.00 0.00 176.35 177.49 1bod s SER 24 N 0.12 4.62 0.00 2.29 0.15 -1.26 -2.72 113.70 116.89 1bod s SER 24 Ca -0.09 1.06 0.02 0.00 0.70 0.00 0.00 55.95 57.64 1bod s SER 24 Cb -0.15 -1.73 0.09 0.00 -1.71 0.00 0.00 66.02 62.51 1bod s SER 24 CO 0.06 -1.86 0.98 0.29 1.20 0.00 0.00 173.24 173.90 1bod n LYS 25 N -3.33 0.01 -0.04 5.44 4.76 -1.26 -0.46 118.16 123.27 1bod n LYS 25 Ca 0.07 0.38 -0.10 0.00 -2.87 0.00 0.00 58.31 55.79 1bod n LYS 25 Cb 0.58 -1.50 0.04 0.00 -1.84 0.00 0.00 35.03 32.32 1bod n LYS 25 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1bod h GLU 26 N 0.00 0.70 0.00 1.97 3.07 -2.00 -0.62 114.58 117.70 1bod h GLU 26 Ca 0.00 -0.39 -0.18 0.00 -0.50 0.00 0.00 59.36 58.29 1bod h GLU 26 Cb 0.03 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 27.93 1bod h GLU 26 CO 0.00 1.00 -1.22 0.93 -1.40 0.00 0.00 179.01 178.33 1bod h GLU 27 N 0.56 0.00 0.12 2.33 5.08 -1.08 -3.35 114.58 118.23 1bod h GLU 27 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1bod h GLU 27 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1bod h GLU 27 CO 0.09 0.47 -0.06 1.25 -1.00 0.00 0.00 179.01 179.77 1bod h LEU 28 N 0.00 -0.13 -1.69 1.33 5.85 -1.19 -2.94 115.31 116.54 1bod h LEU 28 Ca -0.13 -0.19 0.49 0.00 0.84 0.00 0.00 57.88 58.88 1bod h LEU 28 Cb 1.65 0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.64 1bod h LEU 28 CO 0.07 0.43 1.32 0.29 -0.34 0.00 0.00 178.44 180.21 1bod n LYS 29 N -4.86 0.00 -0.03 1.25 5.02 -0.25 0.11 118.16 119.41 1bod n LYS 29 Ca -0.04 1.02 -0.10 0.00 -2.02 0.00 0.00 58.31 57.17 1bod n LYS 29 Cb 0.16 -2.39 -0.09 0.00 -0.02 0.00 0.00 35.03 32.69 1bod n LYS 29 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1bod h LEU 30 N 0.00 -0.05 -1.59 -0.35 3.38 -1.69 -1.66 115.31 113.36 1bod h LEU 30 Ca 0.80 -0.59 0.19 0.00 0.09 0.00 0.00 57.88 58.37 1bod h LEU 30 Cb 3.43 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 44.13 1bod h LEU 30 CO -0.01 0.70 0.56 0.25 0.09 0.00 0.00 178.44 180.03 1bod h LEU 31 N -0.93 0.35 0.00 1.67 5.85 0.10 0.22 115.31 122.58 1bod h LEU 31 Ca -0.01 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1bod h LEU 31 Cb 0.63 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 1bod h LEU 31 CO 0.01 0.16 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.09 1bod h LEU 32 N 0.36 0.00 0.00 2.25 4.07 -1.28 -3.26 115.31 117.44 1bod h LEU 32 Ca 0.43 -0.80 0.00 0.00 0.08 0.00 0.00 57.88 57.58 1bod h LEU 32 Cb 1.11 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.85 1bod h LEU 32 CO -0.14 0.96 0.00 0.00 -1.08 0.00 0.00 178.44 178.18 1bod n GLN 33 N -4.62 0.69 0.00 1.13 6.02 -0.62 -2.89 117.38 117.08 1bod n GLN 33 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.89 1bod n GLN 33 Cb 0.42 -1.31 0.00 0.00 1.02 0.00 0.00 30.24 30.37 1bod n GLN 33 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1bod n THR 34 N -0.81 0.00 -0.83 5.09 -1.04 0.74 -4.83 114.28 112.60 1bod n THR 34 Ca 0.10 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.19 1bod n THR 34 Cb 0.05 -0.47 0.37 0.00 -1.82 0.00 0.00 70.33 68.46 1bod n THR 34 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1bod n GLU 35 N 0.00 4.26 -3.51 -2.82 -0.00 -1.24 -4.65 120.64 112.68 1bod n GLU 35 Ca 0.00 -3.02 -0.27 0.00 -0.00 0.00 0.00 57.16 53.87 1bod n GLU 35 Cb 0.00 -2.08 -0.10 0.00 -0.00 0.00 0.00 31.44 29.26 1bod n GLU 35 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1bod n PHE 36 N 0.60 1.43 0.08 -1.84 3.72 -1.14 -4.94 117.46 115.37 1bod n PHE 36 Ca 0.26 -3.84 -0.11 0.00 -0.05 0.00 0.00 57.45 53.71 1bod n PHE 36 Cb 1.05 -0.31 -0.08 0.00 -0.94 0.00 0.00 39.48 39.21 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 4.90 -0.25 -0.89 -1.08 0.13 -1.83 -3.29 132.00 129.69 1bod h PRO 37 Ca 0.18 0.02 0.28 0.00 -0.87 0.00 0.00 66.00 65.61 1bod h PRO 37 Cb 0.80 0.06 -0.16 0.00 0.13 0.00 0.00 31.00 31.83 1bod h PRO 37 CO 0.60 0.15 0.16 -1.13 -0.23 0.00 0.00 178.00 177.54 1bod n SER 38 N -4.97 0.02 0.32 1.44 3.41 -1.26 0.81 113.62 113.41 1bod n SER 38 Ca -0.08 1.50 -0.17 0.00 -0.26 0.00 0.00 58.87 59.86 1bod n SER 38 Cb 0.26 -0.60 -0.09 0.00 -0.26 0.00 0.00 64.21 63.52 1bod n SER 38 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1bod h LEU 39 N 0.00 -1.17 0.00 1.04 3.38 -1.89 -3.38 115.31 113.29 1bod h LEU 39 Ca 0.60 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.65 1bod h LEU 39 Cb 1.38 0.36 0.00 0.00 0.09 0.00 0.00 40.66 42.50 1bod h LEU 39 CO -0.79 -0.63 0.00 0.18 0.09 0.00 0.00 178.44 177.29 1bod n LEU 40 N -5.17 0.92 -3.12 1.67 4.32 0.19 -4.77 117.00 111.04 1bod n LEU 40 Ca -0.12 0.02 -0.20 0.00 -0.02 0.00 0.00 56.01 55.69 1bod n LEU 40 Cb 0.43 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.19 1bod n LEU 40 CO 0.27 0.00 -0.08 1.17 -1.22 0.00 0.00 177.39 177.53 1bod n LYS 41 N -0.17 -1.39 0.00 3.23 4.81 0.24 -4.70 118.16 120.18 1bod n LYS 41 Ca 0.00 0.07 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 1bod n LYS 41 Cb 0.00 -3.43 0.00 0.00 0.02 0.00 0.00 35.03 31.62 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 -0.72 1.49 3.57 3.14 0.00 -1.26 -4.99 105.19 106.42 1bod n GLY 42 Ca 0.06 -0.79 -0.24 0.00 0.00 0.00 0.00 46.02 45.04 1bod n GLY 42 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1bod s MET 43 N -2.00 2.20 -0.45 1.61 -1.94 -1.26 -4.54 119.30 112.92 1bod s MET 43 Ca 0.00 -0.74 0.05 0.00 -1.71 0.00 0.00 55.69 53.29 1bod s MET 43 Cb 0.00 -5.13 0.27 0.00 2.01 0.00 0.00 34.83 31.99 1bod s MET 43 CO 0.00 -4.18 1.04 0.43 -0.01 0.00 0.00 175.02 172.31 1bod n SER 44 N 15.59 -2.40 0.00 3.03 7.64 -1.26 -5.14 113.62 131.09 1bod n SER 44 Ca 0.43 -3.11 0.00 0.00 1.01 0.00 0.00 58.87 57.21 1bod n SER 44 Cb 0.46 1.66 0.00 0.00 -1.01 0.00 0.00 64.21 65.33 1bod n SER 44 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1bod n THR 45 N 1.16 0.00 0.00 0.44 5.66 -1.26 -4.41 114.28 115.87 1bod n THR 45 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 1bod n THR 45 Cb 0.67 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.45 1bod n THR 45 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 1bod n LEU 46 N 0.00 0.00 -0.21 1.09 7.94 -1.26 -1.04 117.00 123.52 1bod n LEU 46 Ca 0.00 0.00 0.14 0.00 -1.11 0.00 0.00 56.01 55.04 1bod n LEU 46 Cb 0.00 0.00 0.52 0.00 0.53 0.00 0.00 43.42 44.47 1bod n LEU 46 CO 0.00 0.00 0.79 0.47 -1.11 0.00 0.00 177.39 177.54 1bod n ASP 47 N 2.58 0.81 0.01 1.96 9.92 -1.26 -3.58 116.55 126.99 1bod n ASP 47 Ca 0.00 -0.84 -0.19 0.00 -0.53 0.00 0.00 54.79 53.22 1bod n ASP 47 Cb 0.00 0.02 -0.14 0.00 -0.64 0.00 0.00 41.12 40.36 1bod n ASP 47 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 1bod h GLU 48 N 1.04 0.24 0.00 -1.24 4.39 -1.31 -0.11 114.58 117.60 1bod h GLU 48 Ca 0.00 -0.42 -0.18 0.00 0.34 0.00 0.00 59.36 59.11 1bod h GLU 48 Cb 0.42 0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.20 1bod h GLU 48 CO 0.00 1.12 -0.85 -0.07 -1.16 0.00 0.00 179.01 178.05 1bod h LEU 49 N 0.07 0.00 0.00 1.33 3.38 -1.75 1.92 115.31 120.25 1bod h LEU 49 Ca -0.38 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.59 1bod h LEU 49 Cb 2.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.79 1bod h LEU 49 CO 0.10 0.85 -0.00 0.15 0.09 0.00 0.00 178.44 179.63 1bod h PHE 50 N 0.00 -0.00 0.00 1.13 3.04 -1.68 -3.10 116.94 116.33 1bod h PHE 50 Ca -0.01 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.90 1bod h PHE 50 Cb 1.52 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 40.02 1bod h PHE 50 CO 0.00 0.86 -0.19 1.05 -2.02 0.00 0.00 178.31 178.02 1bod h GLU 51 N -0.89 0.00 -1.13 1.11 -0.00 -1.03 -2.56 114.58 110.08 1bod h GLU 51 Ca -0.00 0.00 0.32 0.00 -0.00 0.00 0.00 59.36 59.68 1bod h GLU 51 Cb 0.87 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 29.54 1bod h GLU 51 CO 0.00 0.19 0.78 0.93 -0.00 0.00 0.00 179.01 180.90 1bod h GLU 52 N 0.00 0.17 0.00 1.06 4.39 0.31 1.18 114.58 121.68 1bod h GLU 52 Ca -0.00 -0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.55 1bod h GLU 52 Cb 0.66 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.24 1bod h GLU 52 CO 0.02 0.11 -2.04 -0.11 -1.16 0.00 0.00 179.01 175.84 1bod n LEU 53 N -4.40 0.12 -1.91 1.33 -0.00 -1.03 -4.87 117.00 106.24 1bod n LEU 53 Ca 0.26 0.05 -0.11 0.00 -0.00 0.00 0.00 56.01 56.21 1bod n LEU 53 Cb 1.10 0.17 -0.02 0.00 -0.00 0.00 0.00 43.42 44.67 1bod n LEU 53 CO 0.33 0.18 -0.12 -0.67 -0.00 0.00 0.00 177.39 177.10 1bod n ASP 54 N -2.50 -3.21 -3.74 1.96 2.03 0.40 -4.84 116.55 106.66 1bod n ASP 54 Ca -0.14 0.25 -0.22 0.00 0.52 0.00 0.00 54.79 55.20 1bod n ASP 54 Cb 0.79 -2.89 0.02 0.00 -0.72 0.00 0.00 41.12 38.32 1bod n ASP 54 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1bod n LYS 55 N -2.27 0.00 0.00 -0.67 5.02 -1.26 -4.69 118.16 114.29 1bod n LYS 55 Ca -0.12 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.21 1bod n LYS 55 Cb 0.48 -0.96 0.24 0.00 -0.02 0.00 0.00 35.03 34.78 1bod n LYS 55 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1bod n ASN 56 N 3.15 0.00 -0.85 4.39 3.02 -1.26 -4.79 115.26 118.92 1bod n ASN 56 Ca -0.01 -1.56 -0.02 0.00 -0.03 0.00 0.00 54.58 52.96 1bod n ASN 56 Cb 0.42 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.60 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 0.52 0.74 0.32 7.41 0.00 -1.26 -4.91 105.19 108.01 1bod n GLY 57 Ca 0.06 -0.57 0.01 0.00 0.00 0.00 0.00 46.02 45.53 1bod n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bod n ASP 58 N 0.63 0.80 0.00 1.61 9.92 -1.26 -4.82 116.55 123.42 1bod n ASP 58 Ca -0.00 -2.03 0.00 0.00 -0.53 0.00 0.00 54.79 52.22 1bod n ASP 58 Cb 0.51 -0.21 0.00 0.00 -0.64 0.00 0.00 41.12 40.77 1bod n ASP 58 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1bod n GLY 59 N 0.44 0.89 3.62 0.44 0.00 -1.26 -4.95 105.19 104.37 1bod n GLY 59 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.24 0.83 -0.54 1.61 -1.05 -1.26 -4.83 118.70 113.22 1bod s GLU 60 Ca 0.00 0.91 -0.05 0.00 -0.15 0.00 0.00 54.97 55.68 1bod s GLU 60 Cb 0.00 0.40 0.14 0.00 -0.44 0.00 0.00 34.13 34.23 1bod s GLU 60 CO 0.00 -0.11 0.37 0.08 0.95 0.00 0.00 175.26 176.55 1bod s VAL 61 N 0.24 3.86 0.00 1.83 1.01 -1.10 -4.91 120.40 121.33 1bod s VAL 61 Ca -0.01 -2.38 0.00 0.00 0.00 0.00 0.00 61.98 59.60 1bod s VAL 61 Cb -0.05 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.79 1bod s VAL 61 CO 0.01 -0.81 0.00 -1.54 0.00 0.00 0.00 175.10 172.76 1bod n SER 62 N 4.19 -0.10 -0.03 3.32 3.41 -1.26 -1.67 113.62 121.48 1bod n SER 62 Ca 0.02 -0.74 -0.15 0.00 -0.26 0.00 0.00 58.87 57.73 1bod n SER 62 Cb 0.40 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.23 1bod n SER 62 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1bod h PHE 63 N -0.85 0.18 -0.63 7.33 3.57 -1.97 -1.47 116.94 123.09 1bod h PHE 63 Ca 0.00 -0.12 0.18 0.00 3.53 0.00 0.00 57.97 61.56 1bod h PHE 63 Cb 0.00 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 1bod h PHE 63 CO 0.00 1.02 0.52 0.93 -2.23 0.00 0.00 178.31 178.55 1bod h GLU 64 N -0.71 0.00 -0.01 1.11 5.08 -1.94 0.16 114.58 118.27 1bod h GLU 64 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1bod h GLU 64 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1bod h GLU 64 CO 0.04 0.00 -0.14 -0.85 -1.00 0.00 0.00 179.01 177.06 1bod n GLU 65 N -4.08 1.54 -0.07 2.33 0.00 -1.24 -4.70 120.64 114.42 1bod n GLU 65 Ca 0.12 -0.80 -0.09 0.00 0.00 0.00 0.00 57.16 56.39 1bod n GLU 65 Cb 0.76 -1.14 -0.07 0.00 0.00 0.00 0.00 31.44 30.99 1bod n GLU 65 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 1bod h PHE 66 N 1.51 0.00 -0.12 -1.84 3.04 0.16 -3.37 116.94 116.32 1bod h PHE 66 Ca 0.00 0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.98 1bod h PHE 66 Cb 0.39 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 38.90 1bod h PHE 66 CO 0.00 0.62 0.91 0.00 -2.02 0.00 0.00 178.31 177.81 1bod n GLN 67 N -4.65 0.02 0.00 1.11 0.00 -1.11 -0.85 117.38 111.91 1bod n GLN 67 Ca -0.09 0.85 0.00 0.00 0.00 0.00 0.00 57.00 57.75 1bod n GLN 67 Cb 0.32 -2.26 0.00 0.00 0.00 0.00 0.00 30.24 28.30 1bod n GLN 67 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1bod n VAL 68 N -2.36 0.89 -0.04 -0.39 0.31 -1.26 0.08 118.33 115.56 1bod n VAL 68 Ca 0.03 0.29 -0.18 0.00 -0.01 0.00 0.00 64.34 64.46 1bod n VAL 68 Cb 0.94 -1.29 -0.14 0.00 -0.91 0.00 0.00 33.84 32.44 1bod n VAL 68 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1bod n LEU 69 N -1.17 2.38 0.22 7.52 4.77 -0.03 -2.12 117.00 128.57 1bod n LEU 69 Ca 0.00 0.14 0.08 0.00 -0.03 0.00 0.00 56.01 56.20 1bod n LEU 69 Cb 0.07 -0.83 0.51 0.00 -2.33 0.00 0.00 43.42 40.84 1bod n LEU 69 CO 0.00 0.80 0.82 0.58 -1.33 0.00 0.00 177.39 178.27 1bod h VAL 70 N 0.04 0.80 0.12 4.08 2.07 -0.57 1.20 116.25 123.99 1bod h VAL 70 Ca -0.45 -1.02 -0.27 0.00 0.82 0.00 0.00 66.70 65.78 1bod h VAL 70 Cb 2.01 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.40 1bod h VAL 70 CO 0.04 0.25 -1.24 0.11 0.02 0.00 0.00 177.57 176.74 1bod h LYS 71 N 0.00 0.26 -0.00 1.57 1.57 -1.32 -3.00 116.57 115.64 1bod h LYS 71 Ca -0.00 -0.44 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1bod h LYS 71 Cb 0.60 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1bod h LYS 71 CO 0.03 1.20 -0.09 1.17 -0.57 0.00 0.00 179.45 181.20 1bod n LYS 72 N -3.52 0.66 -0.15 3.15 0.00 -0.48 -3.28 118.16 114.54 1bod n LYS 72 Ca -0.08 -0.19 0.03 0.00 0.00 0.00 0.00 58.31 58.07 1bod n LYS 72 Cb 1.02 -1.50 0.11 0.00 0.00 0.00 0.00 35.03 34.66 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 -1.00 0.41 -4.11 3.15 5.41 0.40 -4.86 119.36 118.76 1bod n ILE 73 Ca 0.15 -0.33 -0.07 0.00 1.00 0.00 0.00 62.75 63.49 1bod n ILE 73 Cb 0.27 0.04 -0.03 0.00 -0.71 0.00 0.00 39.64 39.21 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 0.17 -0.28 0.00 4.38 2.88 -1.21 -4.92 113.62 114.65 1bod n SER 74 Ca 0.08 -1.84 0.00 0.00 -1.33 0.00 0.00 58.87 55.78 1bod n SER 74 Cb 0.26 0.65 0.00 0.00 -0.75 0.00 0.00 64.21 64.37 1bod n SER 74 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81