#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 -0.81 -4.31 0.03 4.81 -1.26 -5.08 118.16 111.54 1bod n LYS 1 Ca 0.00 1.02 -0.21 0.00 -0.87 0.00 0.00 58.31 58.25 1bod n LYS 1 Cb 0.00 -1.69 -0.11 0.00 0.02 0.00 0.00 35.03 33.25 1bod n LYS 1 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 1bod s SER 2 N -0.11 2.52 0.04 3.14 1.04 -1.26 -5.06 113.70 114.00 1bod s SER 2 Ca -0.05 -0.85 -0.31 0.00 0.48 0.00 0.00 55.95 55.23 1bod s SER 2 Cb 0.00 -0.14 -0.17 0.00 0.10 0.00 0.00 66.02 65.82 1bod s SER 2 CO 0.13 -0.06 1.33 1.55 0.98 0.00 0.00 173.24 177.18 1bod h PRO 3 N 3.33 -1.07 -0.94 4.02 0.13 -2.05 -2.93 132.00 132.49 1bod h PRO 3 Ca -0.42 0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1bod h PRO 3 Cb 1.20 0.24 0.00 0.00 0.13 0.00 0.00 31.00 32.58 1bod h PRO 3 CO 0.51 -0.71 0.00 0.39 -0.23 0.00 0.00 178.00 177.95 1bod n GLU 4 N -5.32 1.35 0.20 0.86 -0.58 -1.26 -4.27 120.64 111.62 1bod n GLU 4 Ca -0.14 -0.28 0.08 0.00 -0.42 0.00 0.00 57.16 56.40 1bod n GLU 4 Cb 0.44 -1.56 0.42 0.00 -0.57 0.00 0.00 31.44 30.17 1bod n GLU 4 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1bod h GLU 5 N 0.36 0.00 -0.35 3.49 4.81 -1.85 0.45 114.58 121.49 1bod h GLU 5 Ca 0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 1bod h GLU 5 Cb 0.62 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1bod h GLU 5 CO 0.04 0.00 -0.27 1.37 -0.73 0.00 0.00 179.01 179.42 1bod h LEU 6 N 0.00 0.85 -1.96 1.64 -0.00 -1.85 -2.07 115.31 111.92 1bod h LEU 6 Ca 0.00 -0.44 0.22 0.00 -0.00 0.00 0.00 57.88 57.65 1bod h LEU 6 Cb 0.66 -0.24 -0.03 0.00 -0.00 0.00 0.00 40.66 41.05 1bod h LEU 6 CO 0.00 1.11 0.55 0.50 -0.00 0.00 0.00 178.44 180.60 1bod h LYS 7 N 0.59 0.04 -4.21 0.17 3.11 -1.26 -3.27 116.57 111.74 1bod h LYS 7 Ca 0.07 -0.00 -0.67 0.00 -2.81 0.00 0.00 60.65 57.24 1bod h LYS 7 Cb 0.84 -0.01 -0.38 0.00 -1.00 0.00 0.00 32.23 31.68 1bod h LYS 7 CO 0.07 0.02 -0.61 0.20 -2.81 0.00 0.00 179.45 176.32 1bod s GLY 8 N -3.98 2.14 0.00 5.01 0.00 -0.78 -4.78 107.32 104.94 1bod s GLY 8 Ca -0.05 -2.80 0.00 0.00 0.00 0.00 0.00 44.72 41.87 1bod s GLY 8 CO 0.76 1.00 0.00 4.51 0.00 0.00 0.00 173.10 179.37 1bod n ILE 9 N 3.98 0.00 -0.05 0.90 3.06 -1.23 -4.86 119.36 121.15 1bod n ILE 9 Ca 0.03 0.00 -0.01 0.00 -2.50 0.00 0.00 62.75 60.27 1bod n ILE 9 Cb 0.39 0.00 -0.01 0.00 0.54 0.00 0.00 39.64 40.56 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 0.00 -0.06 -0.32 9.51 -0.00 -1.26 -0.10 117.46 125.23 1bod n PHE 10 Ca 0.00 0.16 0.22 0.00 -0.00 0.00 0.00 57.45 57.83 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 1.05 -0.00 0.00 0.00 176.76 177.81 1bod h GLU 11 N 0.00 0.20 -0.68 -4.13 4.11 -1.87 0.73 114.58 112.95 1bod h GLU 11 Ca 0.02 -0.01 -0.07 0.00 0.07 0.00 0.00 59.36 59.37 1bod h GLU 11 Cb 0.05 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1bod h GLU 11 CO -0.12 0.13 0.14 1.57 0.07 0.00 0.00 179.01 180.80 1bod h LYS 12 N 0.21 1.11 0.00 1.06 5.09 -0.90 -1.17 116.57 121.96 1bod h LYS 12 Ca 0.70 -0.28 0.00 0.00 0.09 0.00 0.00 60.65 61.16 1bod h LYS 12 Cb 1.60 -0.14 0.00 0.00 0.10 0.00 0.00 32.23 33.79 1bod h LYS 12 CO -0.68 1.00 0.00 0.66 -2.09 0.00 0.00 179.45 178.34 1bod n TYR 13 N -4.24 0.00 -1.16 0.07 4.01 0.25 -3.30 117.16 112.79 1bod n TYR 13 Ca 0.05 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.60 1bod n TYR 13 Cb 0.28 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.25 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 -0.89 6.09 -4.34 7.72 -0.08 -0.44 -4.75 116.55 119.86 1bod n ASP 15 Ca 0.10 -2.94 -0.41 0.00 -1.51 0.00 0.00 54.79 50.03 1bod n ASP 15 Cb 0.04 -1.23 -0.01 0.00 2.34 0.00 0.00 41.12 42.26 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 1.18 2.81 0.11 -0.67 4.01 -1.21 -3.84 118.16 120.56 1bod n LYS 16 Ca 0.39 -2.94 0.00 0.00 -0.51 0.00 0.00 58.31 55.25 1bod n LYS 16 Cb 0.64 -3.45 0.00 0.00 -0.51 0.00 0.00 35.03 31.71 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 7.79 0.00 0.00 1.97 2.13 -1.26 -5.07 120.64 126.20 1bod n GLU 17 Ca 0.49 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1bod n GLU 17 Cb 0.44 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.15 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 -1.32 0.93 0.00 8.31 0.00 -1.25 -5.06 105.19 106.80 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 1.51 0.00 1.61 5.68 -1.26 -5.01 116.55 119.07 1bod n ASP 19 Ca 0.00 -0.27 0.00 0.00 -0.50 0.00 0.00 54.79 54.02 1bod n ASP 19 Cb 0.00 0.83 0.00 0.00 -1.14 0.00 0.00 41.12 40.81 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 1.28 2.89 2.61 6.12 0.00 -1.26 -4.96 105.19 111.88 1bod n GLY 20 Ca 0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 46.02 45.10 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 0.53 -4.57 1.61 10.64 -1.26 -4.35 117.38 119.98 1bod n GLN 22 Ca 0.00 -2.70 -0.31 0.00 -1.83 0.00 0.00 57.00 52.16 1bod n GLN 22 Cb 0.00 1.73 -0.12 0.00 -0.86 0.00 0.00 30.24 30.99 1bod n GLN 22 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1bod s LEU 23 N 0.00 2.75 0.57 2.61 1.43 -1.07 -4.78 118.68 120.19 1bod s LEU 23 Ca 0.22 -0.38 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 1bod s LEU 23 Cb 0.01 -1.60 0.05 0.00 0.03 0.00 0.00 46.19 44.67 1bod s LEU 23 CO 0.15 0.25 0.80 -0.55 0.23 0.00 0.00 176.35 177.24 1bod s SER 24 N -1.53 5.16 0.09 2.29 0.15 -1.26 -0.97 113.70 117.63 1bod s SER 24 Ca 0.16 -0.08 0.05 0.00 0.70 0.00 0.00 55.95 56.78 1bod s SER 24 Cb -0.11 -0.74 0.27 0.00 -1.71 0.00 0.00 66.02 63.73 1bod s SER 24 CO 0.07 -1.23 1.08 0.29 1.20 0.00 0.00 173.24 174.65 1bod n LYS 25 N -2.40 0.03 -0.36 5.44 4.76 -1.26 -1.27 118.16 123.11 1bod n LYS 25 Ca 0.09 0.47 0.02 0.00 -2.87 0.00 0.00 58.31 56.02 1bod n LYS 25 Cb 0.60 -1.69 0.17 0.00 -1.84 0.00 0.00 35.03 32.27 1bod n LYS 25 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1bod h GLU 26 N 0.00 1.16 0.00 1.97 4.57 -1.95 -0.94 114.58 119.39 1bod h GLU 26 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1bod h GLU 26 Cb 0.17 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1bod h GLU 26 CO 0.00 0.77 -1.43 0.39 -1.18 0.00 0.00 179.01 177.56 1bod n GLU 27 N -4.47 0.51 -0.06 1.92 1.02 -0.39 -4.32 120.64 114.84 1bod n GLU 27 Ca 0.14 -0.05 -0.07 0.00 -0.02 0.00 0.00 57.16 57.16 1bod n GLU 27 Cb 0.15 -1.62 -0.06 0.00 -0.02 0.00 0.00 31.44 29.89 1bod n GLU 27 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1bod h LEU 28 N 0.00 0.00 -0.68 -4.62 6.46 -1.31 -2.87 115.31 112.29 1bod h LEU 28 Ca 0.00 -0.44 0.06 0.00 -0.12 0.00 0.00 57.88 57.39 1bod h LEU 28 Cb 0.90 0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 40.75 1bod h LEU 28 CO 0.00 0.75 -0.43 0.50 -0.62 0.00 0.00 178.44 178.65 1bod h LYS 29 N -1.00 -0.03 -0.69 1.25 3.64 -1.40 0.50 116.57 118.84 1bod h LYS 29 Ca -0.01 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 59.46 1bod h LYS 29 Cb 0.48 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.24 1bod h LYS 29 CO -0.01 -0.02 0.33 1.37 -2.27 0.00 0.00 179.45 178.85 1bod h LEU 30 N -0.03 0.41 -1.39 5.20 8.10 -1.75 -0.22 115.31 125.62 1bod h LEU 30 Ca 0.11 0.06 0.24 0.00 0.11 0.00 0.00 57.88 58.41 1bod h LEU 30 Cb 0.31 -0.00 -0.09 0.00 -0.44 0.00 0.00 40.66 40.44 1bod h LEU 30 CO -0.66 0.24 0.65 0.25 -4.11 0.00 0.00 178.44 174.81 1bod h LEU 31 N 0.56 0.45 0.00 0.17 6.46 0.16 -2.90 115.31 120.21 1bod h LEU 31 Ca 0.34 0.07 0.00 0.00 -0.12 0.00 0.00 57.88 58.17 1bod h LEU 31 Cb 0.37 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.29 1bod h LEU 31 CO -0.27 0.12 0.00 0.18 -0.62 0.00 0.00 178.44 177.85 1bod n LEU 32 N -4.59 0.00 -4.50 2.25 7.99 -0.10 -3.92 117.00 114.13 1bod n LEU 32 Ca 0.23 0.60 -0.36 0.00 -0.01 0.00 0.00 56.01 56.47 1bod n LEU 32 Cb 0.81 -0.10 0.07 0.00 -0.11 0.00 0.00 43.42 44.09 1bod n LEU 32 CO 0.27 -0.10 0.16 0.00 -1.51 0.00 0.00 177.39 176.21 1bod n GLN 33 N -0.82 0.35 0.00 3.23 10.64 -1.10 0.10 117.38 129.79 1bod n GLN 33 Ca 0.00 0.16 0.00 0.00 -1.83 0.00 0.00 57.00 55.33 1bod n GLN 33 Cb 0.00 -1.90 0.00 0.00 -0.86 0.00 0.00 30.24 27.48 1bod n GLN 33 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 1bod n THR 34 N -2.37 0.00 -0.14 -0.39 -1.04 -1.26 -4.29 114.28 104.78 1bod n THR 34 Ca 0.11 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.17 1bod n THR 34 Cb 0.50 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 69.14 1bod n THR 34 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1bod n GLU 35 N 0.00 2.84 -2.86 -2.82 -0.58 -1.07 -4.80 120.64 111.36 1bod n GLU 35 Ca 0.00 -1.97 -0.05 0.00 -0.42 0.00 0.00 57.16 54.72 1bod n GLU 35 Cb 0.00 -1.24 -0.00 0.00 -0.57 0.00 0.00 31.44 29.63 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 -1.00 -1.45 -0.03 -0.32 0.08 0.28 -4.98 117.98 110.57 1bod s PHE 36 Ca 0.20 -0.59 -0.08 0.00 0.12 0.00 0.00 56.93 56.58 1bod s PHE 36 Cb 0.11 0.24 -0.04 0.00 -0.57 0.00 0.00 43.02 42.75 1bod s PHE 36 CO 0.14 -1.24 0.47 -1.00 -0.10 0.00 0.00 175.22 173.49 1bod h PRO 37 N 5.29 -0.28 -1.17 0.24 0.13 -1.87 -3.27 132.00 131.07 1bod h PRO 37 Ca 0.07 0.02 0.44 0.00 -0.87 0.00 0.00 66.00 65.66 1bod h PRO 37 Cb 1.10 0.06 -0.15 0.00 0.13 0.00 0.00 31.00 32.14 1bod h PRO 37 CO 0.04 -0.18 0.70 -1.13 -0.23 0.00 0.00 178.00 177.20 1bod n SER 38 N -3.86 0.27 0.26 1.44 3.41 -1.26 0.37 113.62 114.25 1bod n SER 38 Ca -0.04 1.48 -0.17 0.00 -0.26 0.00 0.00 58.87 59.88 1bod n SER 38 Cb 0.11 -0.72 -0.09 0.00 -0.26 0.00 0.00 64.21 63.25 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 -1.31 -2.77 1.04 -0.00 -1.94 -1.28 115.31 109.04 1bod h LEU 39 Ca 0.84 0.11 -0.20 0.00 -0.00 0.00 0.00 57.88 58.63 1bod h LEU 39 Cb 2.49 0.44 -0.12 0.00 -0.00 0.00 0.00 40.66 43.47 1bod h LEU 39 CO -0.59 -0.62 0.25 0.18 -0.00 0.00 0.00 178.44 177.66 1bod n LEU 40 N -5.30 4.43 -1.52 1.67 4.32 0.16 -4.02 117.00 116.74 1bod n LEU 40 Ca -0.11 -2.31 -0.12 0.00 -0.02 0.00 0.00 56.01 53.45 1bod n LEU 40 Cb 0.43 -0.64 0.16 0.00 -1.62 0.00 0.00 43.42 41.75 1bod n LEU 40 CO 0.24 0.70 0.77 1.17 -1.22 0.00 0.00 177.39 179.05 1bod n LYS 41 N -0.15 2.19 0.00 3.23 3.00 0.16 -5.03 118.16 121.55 1bod n LYS 41 Ca 0.24 -3.31 0.00 0.00 -0.00 0.00 0.00 58.31 55.24 1bod n LYS 41 Cb 0.97 -1.97 0.00 0.00 0.00 0.00 0.00 35.03 34.03 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 -1.06 0.81 7.00 3.14 0.00 -1.26 -4.95 105.19 108.87 1bod n GLY 42 Ca 0.41 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.71 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 0.00 0.00 -3.15 1.61 0.00 -1.26 -4.42 117.12 109.89 1bod n MET 43 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 57.70 57.50 1bod n MET 43 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.16 1bod n MET 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1bod n SER 44 N -3.37 -1.18 0.00 6.12 7.64 -1.26 -5.11 113.62 116.46 1bod n SER 44 Ca 0.00 -2.65 0.00 0.00 1.01 0.00 0.00 58.87 57.23 1bod n SER 44 Cb 0.00 0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1bod n SER 44 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1bod n THR 45 N 2.41 0.00 0.00 0.44 -2.24 -1.26 -3.87 114.28 109.76 1bod n THR 45 Ca 0.23 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 1bod n THR 45 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1bod n THR 45 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1bod n LEU 46 N 0.00 0.00 -0.06 3.22 4.32 -1.26 -1.88 117.00 121.34 1bod n LEU 46 Ca 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 56.01 56.13 1bod n LEU 46 Cb 0.00 0.00 0.58 0.00 -1.62 0.00 0.00 43.42 42.38 1bod n LEU 46 CO 0.00 0.00 0.85 0.47 -1.22 0.00 0.00 177.39 177.49 1bod n ASP 47 N 2.21 0.33 0.00 -1.43 9.92 -1.26 -2.83 116.55 123.49 1bod n ASP 47 Ca 0.00 -0.27 0.00 0.00 -0.53 0.00 0.00 54.79 53.99 1bod n ASP 47 Cb 0.00 -0.14 0.00 0.00 -0.64 0.00 0.00 41.12 40.34 1bod n ASP 47 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1bod n GLU 48 N -1.17 0.00 0.27 -1.24 -0.58 -0.79 -0.03 120.64 117.09 1bod n GLU 48 Ca 0.12 0.17 0.18 0.00 -0.42 0.00 0.00 57.16 57.21 1bod n GLU 48 Cb 0.29 -0.67 0.93 0.00 -0.57 0.00 0.00 31.44 31.42 1bod n GLU 48 CO 0.00 0.00 0.00 1.37 -0.48 0.00 0.00 177.13 178.02 1bod h LEU 49 N 0.00 0.00 0.00 -4.62 -0.00 -1.80 0.52 115.31 109.41 1bod h LEU 49 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 57.88 57.85 1bod h LEU 49 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1bod h LEU 49 CO 0.00 0.00 -0.24 0.15 -0.00 0.00 0.00 178.44 178.35 1bod h PHE 50 N 0.00 0.00 -0.27 0.17 3.57 -1.63 -3.34 116.94 115.44 1bod h PHE 50 Ca 0.04 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1bod h PHE 50 Cb 0.38 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1bod h PHE 50 CO 0.00 0.47 0.01 0.93 -2.23 0.00 0.00 178.31 177.48 1bod h GLU 51 N -1.00 0.48 -1.20 1.11 4.39 -0.16 0.62 114.58 118.82 1bod h GLU 51 Ca -0.04 -0.15 0.45 0.00 0.34 0.00 0.00 59.36 59.96 1bod h GLU 51 Cb 0.53 -0.04 -0.16 0.00 -0.10 0.00 0.00 28.75 28.98 1bod h GLU 51 CO -0.03 0.63 0.72 0.39 -1.16 0.00 0.00 179.01 179.57 1bod n GLU 52 N -4.61 -0.05 0.00 2.33 -0.58 0.18 0.24 120.64 118.15 1bod n GLU 52 Ca -0.03 1.32 0.02 0.00 -0.42 0.00 0.00 57.16 58.05 1bod n GLU 52 Cb 0.24 -2.48 -0.00 0.00 -0.57 0.00 0.00 31.44 28.63 1bod n GLU 52 CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 1bod n LEU 53 N -4.99 0.74 -1.40 -4.62 -0.00 -1.09 -4.41 117.00 101.23 1bod n LEU 53 Ca 0.39 -0.73 0.11 0.00 -0.00 0.00 0.00 56.01 55.79 1bod n LEU 53 Cb 1.44 0.00 0.33 0.00 -0.00 0.00 0.00 43.42 45.19 1bod n LEU 53 CO 0.10 0.16 0.78 -0.67 -0.00 0.00 0.00 177.39 177.77 1bod n ASP 54 N -0.48 4.14 0.00 1.45 2.03 0.22 -3.75 116.55 120.16 1bod n ASP 54 Ca 0.02 -2.10 0.00 0.00 0.52 0.00 0.00 54.79 53.23 1bod n ASP 54 Cb 0.09 -0.51 0.00 0.00 -0.72 0.00 0.00 41.12 39.98 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 1.53 0.00 -0.51 -0.67 -0.00 0.14 -2.71 118.16 115.94 1bod n LYS 55 Ca 0.25 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.46 1bod n LYS 55 Cb 0.68 -0.18 0.07 0.00 -0.00 0.00 0.00 35.03 35.61 1bod n LYS 55 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1bod n ASN 56 N 0.00 3.43 0.00 -5.58 3.02 -1.26 -4.72 115.26 110.15 1bod n ASN 56 Ca 0.00 -2.66 0.00 0.00 -0.03 0.00 0.00 54.58 51.89 1bod n ASN 56 Cb 0.00 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.51 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 -0.14 0.79 1.23 7.41 0.00 -1.10 -5.04 105.19 108.35 1bod n GLY 57 Ca 0.24 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.52 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 0.00 0.14 -0.32 1.61 2.03 -1.25 -4.91 116.55 113.85 1bod n ASP 58 Ca 0.00 -1.97 0.35 0.00 0.52 0.00 0.00 54.79 53.69 1bod n ASP 58 Cb 0.00 -0.05 0.62 0.00 -0.72 0.00 0.00 41.12 40.97 1bod n ASP 58 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1bod h GLY 59 N 0.53 0.00 -4.68 0.27 0.00 -1.79 -3.35 103.07 94.05 1bod h GLY 59 Ca -0.35 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.43 1bod h GLY 59 CO -0.06 0.00 0.20 -0.54 0.00 0.00 0.00 176.54 176.13 1bod s GLU 60 N -4.63 4.50 -0.41 4.80 0.41 -1.25 -4.18 118.70 117.94 1bod s GLU 60 Ca -0.04 1.10 0.02 0.00 -0.41 0.00 0.00 54.97 55.64 1bod s GLU 60 Cb 0.19 -3.42 0.12 0.00 -1.78 0.00 0.00 34.13 29.24 1bod s GLU 60 CO 0.63 0.10 0.19 0.08 -0.49 0.00 0.00 175.26 175.78 1bod s VAL 61 N 0.57 1.46 0.00 2.63 1.01 -0.14 -4.83 120.40 121.10 1bod s VAL 61 Ca 0.42 -2.34 0.00 0.00 0.00 0.00 0.00 61.98 60.06 1bod s VAL 61 Cb -0.20 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.14 1bod s VAL 61 CO 0.23 -0.81 0.00 -1.54 0.00 0.00 0.00 175.10 172.97 1bod n SER 62 N 3.86 -0.65 0.00 3.32 3.41 -1.26 -2.60 113.62 119.69 1bod n SER 62 Ca 0.05 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1bod n SER 62 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 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 -1.63 0.00 -0.47 7.33 7.35 -1.26 -1.63 117.46 127.14 1bod n PHE 63 Ca 0.00 0.00 0.38 0.00 -0.76 0.00 0.00 57.45 57.07 1bod n PHE 63 Cb 0.00 -0.20 0.62 0.00 0.35 0.00 0.00 39.48 40.25 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 -1.09 -0.02 0.09 -4.13 1.02 -1.26 0.27 120.64 115.52 1bod n GLU 64 Ca 0.00 1.01 -0.09 0.00 -0.02 0.00 0.00 57.16 58.05 1bod n GLU 64 Cb 0.00 -2.10 -0.06 0.00 -0.02 0.00 0.00 31.44 29.26 1bod n GLU 64 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1bod h GLU 65 N 0.00 -0.29 0.62 3.49 4.57 -1.90 -3.27 114.58 117.79 1bod h GLU 65 Ca 0.76 0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.93 1bod h GLU 65 Cb 2.69 0.07 0.01 0.00 -0.16 0.00 0.00 28.75 31.36 1bod h GLU 65 CO -0.25 0.03 -0.30 0.35 -1.18 0.00 0.00 179.01 177.66 1bod h PHE 66 N -0.96 -0.77 -1.30 0.92 3.04 0.23 -3.12 116.94 114.98 1bod h PHE 66 Ca -0.03 -0.02 0.38 0.00 3.98 0.00 0.00 57.97 62.28 1bod h PHE 66 Cb 0.46 0.25 -0.05 0.00 2.56 0.00 0.00 35.95 39.18 1bod h PHE 66 CO 0.05 -0.44 1.25 -0.56 -2.02 0.00 0.00 178.31 176.59 1bod h GLN 67 N -1.12 0.00 -2.10 1.11 -0.00 0.36 5.66 115.11 119.03 1bod h GLN 67 Ca -0.08 0.00 -0.76 0.00 -0.00 0.00 0.00 58.65 57.80 1bod h GLN 67 Cb 0.68 0.00 -0.26 0.00 -0.00 0.00 0.00 27.48 27.90 1bod h GLN 67 CO 0.14 0.00 1.06 1.55 -0.00 0.00 0.00 178.83 181.58 1bod n VAL 68 N -3.49 4.41 0.02 1.86 3.14 -1.18 -4.04 118.33 119.05 1bod n VAL 68 Ca 0.29 -4.73 0.00 0.00 -2.96 0.00 0.00 64.34 56.94 1bod n VAL 68 Cb 1.64 -1.39 0.00 0.00 -1.06 0.00 0.00 33.84 33.03 1bod n VAL 68 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1bod n LEU 69 N -0.22 0.10 -0.40 6.55 7.94 1.84 -4.38 117.00 128.43 1bod n LEU 69 Ca 0.52 0.06 0.32 0.00 -1.11 0.00 0.00 56.01 55.80 1bod n LEU 69 Cb 0.26 0.01 0.60 0.00 0.53 0.00 0.00 43.42 44.82 1bod n LEU 69 CO 0.51 -0.34 1.24 -0.37 -1.11 0.00 0.00 177.39 177.31 1bod h VAL 70 N 0.00 0.28 0.20 1.96 -1.51 -1.70 2.18 116.25 117.66 1bod h VAL 70 Ca 0.00 -0.07 -0.31 0.00 -1.23 0.00 0.00 66.70 65.09 1bod h VAL 70 Cb 0.42 0.07 0.02 0.00 -2.13 0.00 0.00 31.29 29.67 1bod h VAL 70 CO 0.00 0.04 -1.42 0.11 -1.23 0.00 0.00 177.57 175.07 1bod h LYS 71 N 0.19 0.41 -0.53 5.19 1.57 -1.85 -3.21 116.57 118.34 1bod h LYS 71 Ca 0.73 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1bod h LYS 71 Cb 2.18 0.26 0.00 0.00 0.08 0.00 0.00 32.23 34.75 1bod h LYS 71 CO -0.35 1.33 0.00 1.17 -0.57 0.00 0.00 179.45 181.03 1bod n LYS 72 N -3.62 2.32 -0.19 3.15 4.81 0.38 -3.89 118.16 121.12 1bod n LYS 72 Ca -0.14 -1.48 0.04 0.00 -0.87 0.00 0.00 58.31 55.85 1bod n LYS 72 Cb 1.07 -1.52 0.13 0.00 0.02 0.00 0.00 35.03 34.73 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 0.52 0.54 -4.06 3.15 5.41 0.64 -4.86 119.36 120.70 1bod n ILE 73 Ca 0.13 -0.40 -0.12 0.00 1.00 0.00 0.00 62.75 63.36 1bod n ILE 73 Cb 0.48 0.02 -0.05 0.00 -0.71 0.00 0.00 39.64 39.38 1bod n ILE 73 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1bod s SER 74 N -0.80 0.39 0.00 4.38 1.04 -1.25 -5.00 113.70 112.46 1bod s SER 74 Ca 0.19 -1.24 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1bod s SER 74 Cb 0.11 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.83 1bod s SER 74 CO 0.11 -1.19 0.35 0.00 0.98 0.00 0.00 173.24 173.49