#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oyy n TRP 2 N 0.00 0.70 -3.73 -1.42 4.27 -1.26 -4.59 117.44 111.42 2oyy n TRP 2 Ca 0.00 0.20 -0.29 0.00 -3.89 0.00 0.00 57.50 53.52 2oyy n TRP 2 Cb 0.00 -0.77 -0.13 0.00 -1.36 0.00 0.00 31.31 29.05 2oyy n TRP 2 CO 0.00 0.00 0.00 -1.17 -2.29 0.00 0.00 177.69 174.23 2oyy s LEU 3 N -4.75 2.97 0.03 5.67 2.96 -1.26 -4.99 118.68 119.32 2oyy s LEU 3 Ca 0.02 -2.84 -0.22 0.00 -0.22 0.00 0.00 54.13 50.87 2oyy s LEU 3 Cb 0.12 -1.11 -0.15 0.00 0.50 0.00 0.00 46.19 45.55 2oyy s LEU 3 CO 0.77 -0.23 1.39 1.55 -1.32 0.00 0.00 176.35 178.51 2oyy h PRO 4 N 6.46 0.22 -3.61 0.98 0.13 -2.03 -3.48 132.00 130.68 2oyy h PRO 4 Ca 0.03 -0.09 -0.09 0.00 -0.87 0.00 0.00 66.00 64.98 2oyy h PRO 4 Cb 0.90 -0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.95 2oyy h PRO 4 CO 0.52 0.56 -0.05 0.95 -0.23 0.00 0.00 178.00 179.75 2oyy s THR 5 N -4.61 0.00 -0.03 1.56 -4.23 -1.26 -5.04 115.64 102.02 2oyy s THR 5 Ca -0.15 -1.36 0.20 0.00 -1.18 0.00 0.00 61.69 59.21 2oyy s THR 5 Cb 0.05 -2.36 -0.31 0.00 1.34 0.00 0.00 72.50 71.21 2oyy s THR 5 CO 0.72 0.00 0.43 0.18 -0.54 0.00 0.00 174.62 175.41 2oyy n LEU 6 N -0.44 0.00 -4.73 4.79 4.77 -1.26 -4.95 117.00 115.18 2oyy n LEU 6 Ca -0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.54 2oyy n LEU 6 Cb 0.61 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.69 2oyy n LEU 6 CO 0.24 0.01 1.26 -0.69 -1.33 0.00 0.00 177.39 176.88 2oyy s VAL 7 N -3.38 2.37 0.04 4.08 1.01 -1.26 -4.78 120.40 118.48 2oyy s VAL 7 Ca -0.07 0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.20 2oyy s VAL 7 Cb 0.13 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 2oyy s VAL 7 CO 0.84 0.03 -0.09 -0.89 0.00 0.00 0.00 175.10 174.99 2oyy s THR 8 N 0.90 0.61 0.20 3.92 2.01 -1.26 -5.07 115.64 116.95 2oyy s THR 8 Ca 0.70 -1.06 -0.06 0.00 0.31 0.00 0.00 61.69 61.57 2oyy s THR 8 Cb -0.46 -0.66 0.06 0.00 0.01 0.00 0.00 72.50 71.45 2oyy s THR 8 CO 0.35 -0.33 1.65 0.00 -0.69 0.00 0.00 174.62 175.60 2oyy h ALA 9 N 4.56 0.88 -3.07 7.40 0.00 -1.94 -3.46 119.26 123.63 2oyy h ALA 9 Ca -0.36 -0.33 -0.31 0.00 0.00 0.00 0.00 54.91 53.91 2oyy h ALA 9 Cb 1.20 -0.19 -0.20 0.00 0.00 0.00 0.00 17.79 18.60 2oyy h ALA 9 CO 0.41 0.64 -0.74 0.95 0.00 0.00 0.00 179.25 180.51 2oyy s THR 10 N -4.84 0.74 0.55 0.00 -4.23 -1.26 -5.01 115.64 101.59 2oyy s THR 10 Ca -0.10 -1.29 0.34 0.00 -1.18 0.00 0.00 61.69 59.46 2oyy s THR 10 Cb 0.13 -0.92 0.51 0.00 1.34 0.00 0.00 72.50 73.57 2oyy s THR 10 CO 0.84 -0.42 1.81 -0.65 -0.54 0.00 0.00 174.62 175.66 2oyy h PRO 11 N 4.17 0.00 -0.18 3.99 0.11 -1.95 0.01 132.00 138.15 2oyy h PRO 11 Ca -0.37 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.58 2oyy h PRO 11 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2oyy h PRO 11 CO 0.45 0.00 -0.51 0.37 -0.21 0.00 0.00 178.00 178.09 2oyy h GLN 12 N 0.00 0.66 0.00 1.05 4.15 -1.99 -1.35 115.11 117.63 2oyy h GLN 12 Ca 0.49 -0.47 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 2oyy h GLN 12 Cb 2.07 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 29.83 2oyy h GLN 12 CO -0.01 1.09 -0.20 0.93 -1.93 0.00 0.00 178.83 178.71 2oyy h GLU 13 N 0.34 0.00 -0.10 1.69 5.08 -1.47 -2.41 114.58 117.71 2oyy h GLU 13 Ca -0.01 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.13 2oyy h GLU 13 Cb 1.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.39 2oyy h GLU 13 CO 0.11 0.20 -0.81 0.78 -1.00 0.00 0.00 179.01 178.30 2oyy h GLY 14 N 1.61 0.68 0.87 -3.84 0.00 -0.89 -1.29 103.07 100.21 2oyy h GLY 14 Ca -0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 47.33 46.31 2oyy h GLY 14 CO 0.03 0.89 0.07 -2.75 0.00 0.00 0.00 176.54 174.78 2oyy h PHE 15 N 0.41 0.33 -0.87 5.60 3.57 -0.86 -1.12 116.94 124.01 2oyy h PHE 15 Ca -0.06 -0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.54 2oyy h PHE 15 Cb 1.42 -0.10 -0.09 0.00 2.79 0.00 0.00 35.95 39.98 2oyy h PHE 15 CO 0.07 0.41 0.48 -0.44 -2.23 0.00 0.00 178.31 176.60 2oyy h ASP 16 N 0.16 0.64 -0.74 0.41 3.32 -1.43 -0.63 116.42 118.16 2oyy h ASP 16 Ca 0.07 0.07 -0.03 0.00 0.02 0.00 0.00 57.03 57.16 2oyy h ASP 16 Cb 0.23 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.71 2oyy h ASP 16 CO -0.00 0.30 0.35 0.25 -1.72 0.00 0.00 179.24 178.42 2oyy h LEU 17 N 0.72 0.98 -0.31 1.55 5.85 -0.79 -1.66 115.31 121.64 2oyy h LEU 17 Ca 0.46 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 59.06 2oyy h LEU 17 Cb 0.57 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.34 2oyy h LEU 17 CO -0.32 0.83 0.20 0.00 -0.34 0.00 0.00 178.44 178.81 2oyy h ALA 18 N 1.32 0.40 -0.98 1.25 0.00 0.11 -1.98 119.26 119.38 2oyy h ALA 18 Ca 0.26 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2oyy h ALA 18 Cb 0.12 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 2oyy h ALA 18 CO -0.03 -0.12 0.63 0.28 0.00 0.00 0.00 179.25 180.01 2oyy h VAL 19 N 0.41 1.25 0.64 0.00 2.07 -0.83 -1.43 116.25 118.36 2oyy h VAL 19 Ca 0.11 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.12 2oyy h VAL 19 Cb -0.02 -0.17 0.01 0.00 -1.52 0.00 0.00 31.29 29.59 2oyy h VAL 19 CO -0.02 0.25 -0.31 0.50 0.02 0.00 0.00 177.57 178.01 2oyy h LYS 20 N 1.33 -0.83 -0.98 1.57 3.64 -1.11 -2.31 116.57 117.89 2oyy h LYS 20 Ca 0.36 0.06 0.33 0.00 -1.27 0.00 0.00 60.65 60.12 2oyy h LYS 20 Cb -0.13 0.19 -0.17 0.00 -0.41 0.00 0.00 32.23 31.71 2oyy h LYS 20 CO -0.07 -0.55 0.34 -0.07 -2.27 0.00 0.00 179.45 176.82 2oyy h LEU 21 N -1.01 0.06 -0.50 5.20 3.38 -1.21 0.26 115.31 121.49 2oyy h LEU 21 Ca -0.09 0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2oyy h LEU 21 Cb 0.66 0.31 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 2oyy h LEU 21 CO 0.14 -0.32 0.25 0.28 0.09 0.00 0.00 178.44 178.89 2oyy h SER 22 N 0.09 0.65 -0.31 -0.43 0.02 -1.09 -3.13 113.55 109.34 2oyy h SER 22 Ca 0.70 -0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 61.40 2oyy h SER 22 Cb 1.65 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 64.02 2oyy h SER 22 CO -0.77 0.58 -0.36 0.03 -1.14 0.00 0.00 176.83 175.18 2oyy h ARG 23 N 0.67 0.79 -0.79 3.45 3.08 0.03 -3.32 114.38 118.30 2oyy h ARG 23 Ca 0.17 -0.44 -0.04 0.00 0.07 0.00 0.00 59.98 59.75 2oyy h ARG 23 Cb 0.10 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.14 2oyy h ARG 23 CO -0.02 1.07 0.35 -0.84 -1.07 0.00 0.00 179.97 179.45 2oyy h ILE 24 N 0.56 1.25 -0.95 2.04 -0.00 -1.11 0.16 117.51 119.46 2oyy h ILE 24 Ca 0.04 -0.75 0.21 0.00 -0.00 0.00 0.00 64.86 64.37 2oyy h ILE 24 Cb 0.94 0.27 -0.08 0.00 -0.00 0.00 0.00 36.82 37.96 2oyy h ILE 24 CO 0.09 0.31 0.62 0.00 -0.00 0.00 0.00 178.15 179.17 2oyy h ALA 25 N 1.25 2.09 -0.14 0.16 0.00 -1.64 0.92 119.26 121.90 2oyy h ALA 25 Ca 0.27 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 55.04 2oyy h ALA 25 Cb 0.16 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.92 2oyy h ALA 25 CO -0.03 -0.41 -0.61 0.28 0.00 0.00 0.00 179.25 178.49 2oyy h VAL 26 N 0.49 1.32 0.11 0.00 2.07 -0.88 -2.04 116.25 117.33 2oyy h VAL 26 Ca 0.52 -1.87 0.01 0.00 0.82 0.00 0.00 66.70 66.18 2oyy h VAL 26 Cb 1.16 2.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.98 2oyy h VAL 26 CO -0.24 0.58 -0.19 0.50 0.02 0.00 0.00 177.57 178.23 2oyy h LYS 27 N 0.32 -0.36 -0.48 1.57 3.64 0.80 -0.91 116.57 121.15 2oyy h LYS 27 Ca -0.04 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 2oyy h LYS 27 Cb 1.24 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 33.10 2oyy h LYS 27 CO 0.13 -0.24 0.25 0.87 -2.27 0.00 0.00 179.45 178.19 2oyy h LYS 28 N -0.37 0.48 -0.18 1.90 1.57 0.73 -2.47 116.57 118.23 2oyy h LYS 28 Ca 0.02 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 2oyy h LYS 28 Cb 0.39 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2oyy h LYS 28 CO -0.10 0.32 -0.46 1.79 -0.57 0.00 0.00 179.45 180.42 2oyy h THR 29 N 0.49 1.32 -2.83 -0.16 1.35 -1.27 -3.37 112.91 108.43 2oyy h THR 29 Ca 0.21 -1.66 -0.61 0.00 -0.55 0.00 0.00 66.41 63.80 2oyy h THR 29 Cb 0.10 1.69 -0.40 0.00 -1.73 0.00 0.00 68.15 67.80 2oyy h THR 29 CO -0.13 0.51 -0.76 -1.58 -0.25 0.00 0.00 175.52 173.31 2oyy s GLN 30 N -4.11 1.49 0.24 4.72 2.00 -0.36 -4.98 119.66 118.67 2oyy s GLN 30 Ca -0.06 -2.39 0.26 0.00 -2.00 0.00 0.00 55.36 51.16 2oyy s GLN 30 Cb 0.12 -2.36 0.77 0.00 0.80 0.00 0.00 33.01 32.34 2oyy s GLN 30 CO 0.81 -1.26 1.76 -1.00 -0.50 0.00 0.00 175.29 175.10 2oyy h PRO 31 N 6.06 0.00 -5.38 1.67 0.13 -1.63 -3.41 132.00 129.45 2oyy h PRO 31 Ca 0.11 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 65.11 2oyy h PRO 31 Cb 0.87 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.99 2oyy h PRO 31 CO 0.51 0.00 0.37 0.34 -0.23 0.00 0.00 178.00 178.99 2oyy s ASP 32 N -4.73 4.21 0.58 1.44 3.68 -1.26 -4.77 116.67 115.82 2oyy s ASP 32 Ca 0.10 -0.73 0.31 0.00 2.13 0.00 0.00 52.55 54.36 2oyy s ASP 32 Cb 0.11 -2.57 1.36 0.00 -1.45 0.00 0.00 42.92 40.37 2oyy s ASP 32 CO 0.60 -3.77 1.71 0.00 0.13 0.00 0.00 175.17 173.83 2oyy h ALA 33 N 11.53 2.68 -0.18 3.66 0.00 -1.97 -0.49 119.26 134.48 2oyy h ALA 33 Ca 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2oyy h ALA 33 Cb 0.99 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 2oyy h ALA 33 CO 1.09 -1.24 0.07 0.37 0.00 0.00 0.00 179.25 179.54 2oyy h GLN 34 N 0.00 0.26 -0.14 0.00 4.15 -1.97 -2.33 115.11 115.09 2oyy h GLN 34 Ca 0.40 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.65 2oyy h GLN 34 Cb 2.00 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 29.64 2oyy h GLN 34 CO -0.00 0.35 -0.44 -0.39 -1.93 0.00 0.00 178.83 176.41 2oyy h VAL 35 N 0.13 1.32 -0.96 2.39 -1.51 -1.49 -2.46 116.25 113.66 2oyy h VAL 35 Ca 0.06 -1.60 0.13 0.00 -1.23 0.00 0.00 66.70 64.06 2oyy h VAL 35 Cb 0.18 1.70 -0.09 0.00 -2.13 0.00 0.00 31.29 30.95 2oyy h VAL 35 CO -0.00 0.48 0.58 0.03 -1.23 0.00 0.00 177.57 177.43 2oyy h ARG 36 N 0.26 0.85 -0.20 5.19 3.08 -1.33 0.54 114.38 122.77 2oyy h ARG 36 Ca 0.02 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 2oyy h ARG 36 Cb 0.88 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 2oyy h ARG 36 CO 0.07 0.56 0.12 -0.44 -1.07 0.00 0.00 179.97 179.21 2oyy h ASP 37 N 0.88 0.24 -0.81 7.04 3.32 -0.98 0.15 116.42 126.25 2oyy h ASP 37 Ca 0.49 -0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.54 2oyy h ASP 37 Cb 0.56 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 40.00 2oyy h ASP 37 CO -0.30 0.22 0.51 0.74 -1.72 0.00 0.00 179.24 178.69 2oyy h THR 38 N 0.24 1.09 -0.06 0.35 2.02 -0.44 -2.54 112.91 113.57 2oyy h THR 38 Ca 0.07 -0.33 -0.19 0.00 0.77 0.00 0.00 66.41 66.73 2oyy h THR 38 Cb 0.02 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.46 2oyy h THR 38 CO -0.01 0.18 -0.76 -0.07 0.37 0.00 0.00 175.52 175.22 2oyy h LEU 39 N 0.96 0.43 -0.79 2.58 3.38 0.18 -3.12 115.31 118.93 2oyy h LEU 39 Ca 0.33 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2oyy h LEU 39 Cb 0.07 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 2oyy h LEU 39 CO -0.14 1.04 0.47 -0.09 0.09 0.00 0.00 178.44 179.82 2oyy h ARG 40 N 0.23 0.84 0.00 1.13 9.65 -0.36 -1.98 114.38 123.89 2oyy h ARG 40 Ca -0.04 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.78 2oyy h ARG 40 Cb 1.34 -0.19 -0.00 0.00 -1.39 0.00 0.00 29.97 29.73 2oyy h ARG 40 CO 0.13 0.56 -0.05 0.00 2.80 0.00 0.00 179.97 183.40 2oyy h ALA 41 N 1.39 1.79 0.00 2.80 0.00 -1.40 -2.23 119.26 121.62 2oyy h ALA 41 Ca 0.35 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 2oyy h ALA 41 Cb 0.18 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 2oyy h ALA 41 CO -0.18 0.07 -0.02 0.28 0.00 0.00 0.00 179.25 179.40 2oyy h VAL 42 N 0.00 0.78 0.00 0.00 2.07 -1.42 -3.39 116.25 114.28 2oyy h VAL 42 Ca -0.00 -1.59 -0.17 0.00 0.82 0.00 0.00 66.70 65.76 2oyy h VAL 42 Cb 0.10 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 2oyy h VAL 42 CO 0.01 0.26 -0.81 0.10 0.02 0.00 0.00 177.57 177.15 2oyy h TYR 43 N -1.00 0.00 -0.25 1.57 -0.00 -1.39 -3.09 116.97 112.82 2oyy h TYR 43 Ca -0.00 0.00 0.07 0.00 -0.00 0.00 0.00 58.73 58.80 2oyy h TYR 43 Cb 0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.17 2oyy h TYR 43 CO 0.12 0.81 0.20 1.05 -0.00 0.00 0.00 178.16 180.33 2oyy h GLU 44 N 0.00 0.00 -0.59 0.10 4.11 -1.61 0.18 114.58 116.77 2oyy h GLU 44 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2oyy h GLU 44 Cb 1.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.79 2oyy h GLU 44 CO 0.10 0.00 0.00 0.36 0.07 0.00 0.00 179.01 179.54 2oyy n LYS 45 N -4.28 3.72 -3.82 1.06 2.85 -1.17 -4.91 118.16 111.61 2oyy n LYS 45 Ca 0.03 -2.86 -0.36 0.00 -1.05 0.00 0.00 58.31 54.07 2oyy n LYS 45 Cb 0.35 -1.88 -0.13 0.00 -0.65 0.00 0.00 35.03 32.71 2oyy n LYS 45 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2oyy s ASP 46 N -1.00 4.80 0.10 -5.58 -1.08 0.63 -5.01 116.67 109.52 2oyy s ASP 46 Ca 0.49 -0.56 -0.18 0.00 -0.52 0.00 0.00 52.55 51.78 2oyy s ASP 46 Cb 0.32 -1.82 -0.06 0.00 -1.46 0.00 0.00 42.92 39.90 2oyy s ASP 46 CO 0.22 -0.11 1.56 0.00 0.52 0.00 0.00 175.17 177.36 2oyy h ALA 47 N 8.17 0.39 -0.72 3.66 0.00 -1.91 -1.39 119.26 127.45 2oyy h ALA 47 Ca -0.35 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 2oyy h ALA 47 Cb 1.14 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2oyy h ALA 47 CO 0.60 0.10 0.33 -0.91 0.00 0.00 0.00 179.25 179.37 2oyy h ASN 48 N 0.30 0.94 -0.38 0.00 -0.26 -1.95 -2.47 115.58 111.76 2oyy h ASN 48 Ca 0.09 -0.11 -0.15 0.00 -0.56 0.00 0.00 56.30 55.57 2oyy h ASN 48 Cb 0.38 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 37.39 2oyy h ASN 48 CO 0.01 0.81 -0.33 0.00 -1.06 0.00 0.00 177.43 176.86 2oyy h ALA 49 N 1.34 0.56 0.00 -0.83 0.00 -1.80 -0.39 119.26 118.13 2oyy h ALA 49 Ca 0.25 -0.43 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 2oyy h ALA 49 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2oyy h ALA 49 CO -0.03 0.62 -0.53 -0.07 0.00 0.00 0.00 179.25 179.24 2oyy h LEU 50 N 0.71 0.00 -0.20 0.00 3.38 -1.19 0.39 115.31 118.39 2oyy h LEU 50 Ca 0.07 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.90 2oyy h LEU 50 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 2oyy h LEU 50 CO 0.08 0.53 -0.41 0.40 0.09 0.00 0.00 178.44 179.13 2oyy h ILE 51 N 0.00 1.32 -0.38 1.22 2.04 -1.35 -0.44 117.51 119.93 2oyy h ILE 51 Ca -0.01 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 2oyy h ILE 51 Cb 0.95 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 2oyy h ILE 51 CO 0.07 0.51 0.18 0.00 0.00 0.00 0.00 178.15 178.91 2oyy h ALA 52 N 0.60 0.49 -0.56 1.87 0.00 -0.73 -1.16 119.26 119.77 2oyy h ALA 52 Ca 0.01 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 54.89 2oyy h ALA 52 Cb 1.02 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.59 2oyy h ALA 52 CO 0.09 0.05 0.20 0.28 0.00 0.00 0.00 179.25 179.87 2oyy h VAL 53 N 0.47 0.79 -0.25 0.00 2.07 -0.20 0.19 116.25 119.32 2oyy h VAL 53 Ca 0.13 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2oyy h VAL 53 Cb 0.12 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2oyy h VAL 53 CO -0.02 0.07 0.09 -1.28 0.02 0.00 0.00 177.57 176.45 2oyy h SER 54 N 0.37 0.30 0.08 0.57 0.87 -0.61 -2.48 113.55 112.66 2oyy h SER 54 Ca 0.28 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.81 2oyy h SER 54 Cb 0.33 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2oyy h SER 54 CO -0.29 0.29 -0.04 0.00 -0.53 0.00 0.00 176.83 176.27 2oyy h ALA 55 N 1.76 -0.11 -0.78 6.23 0.00 0.27 -2.38 119.26 124.24 2oyy h ALA 55 Ca 0.09 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 54.96 2oyy h ALA 55 Cb 0.09 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2oyy h ALA 55 CO -0.01 -0.46 0.45 0.28 0.00 0.00 0.00 179.25 179.52 2oyy h VAL 56 N -0.31 0.96 0.00 0.00 2.07 -0.96 -0.01 116.25 117.99 2oyy h VAL 56 Ca -0.01 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 2oyy h VAL 56 Cb 0.27 0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 2oyy h VAL 56 CO 0.02 0.15 -0.07 1.62 0.02 0.00 0.00 177.57 179.30 2oyy h VAL 57 N 0.80 0.17 -0.05 2.57 3.04 -1.42 -2.62 116.25 118.74 2oyy h VAL 57 Ca 0.36 -0.73 -0.22 0.00 -1.01 0.00 0.00 66.70 65.10 2oyy h VAL 57 Cb 0.26 1.62 0.00 0.00 -2.01 0.00 0.00 31.29 31.17 2oyy h VAL 57 CO -0.21 0.07 -0.86 0.00 -1.01 0.00 0.00 177.57 175.56 2oyy h ALA 58 N 1.93 0.41 -0.16 3.17 0.00 -0.47 0.43 119.26 124.57 2oyy h ALA 58 Ca -0.00 -0.66 -0.05 0.00 0.00 0.00 0.00 54.91 54.20 2oyy h ALA 58 Cb 0.62 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2oyy h ALA 58 CO 0.01 0.77 -0.08 1.15 0.00 0.00 0.00 179.25 181.10 2oyy h THR 59 N 0.30 1.31 0.00 0.00 2.02 -1.25 -2.59 112.91 112.70 2oyy h THR 59 Ca -0.06 -1.11 -0.08 0.00 0.77 0.00 0.00 66.41 65.93 2oyy h THR 59 Cb 1.48 1.70 -0.01 0.00 -1.74 0.00 0.00 68.15 69.57 2oyy h THR 59 CO 0.15 0.33 -0.36 0.45 0.37 0.00 0.00 175.52 176.47 2oyy h HIS 60 N 0.02 0.00 -0.13 3.16 3.86 -1.43 -2.12 115.15 118.51 2oyy h HIS 60 Ca 0.04 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.13 2oyy h HIS 60 Cb 0.55 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.00 2oyy h HIS 60 CO 0.06 0.36 -0.45 0.35 0.86 0.00 0.00 177.93 179.12 2oyy h PHE 61 N 0.00 0.38 -0.03 2.45 3.57 -0.84 -1.52 116.94 120.95 2oyy h PHE 61 Ca -0.00 -0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 2oyy h PHE 61 Cb 0.64 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 2oyy h PHE 61 CO 0.00 0.71 0.01 0.37 -2.23 0.00 0.00 178.31 177.18 2oyy h GLN 62 N 0.26 0.05 0.24 1.11 4.15 -0.99 0.16 115.11 120.09 2oyy h GLN 62 Ca 0.02 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.44 2oyy h GLN 62 Cb 0.89 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.55 2oyy h GLN 62 CO 0.07 0.17 -0.30 1.15 -1.93 0.00 0.00 178.83 178.00 2oyy h THR 63 N -0.09 0.36 -0.20 2.39 2.02 -1.15 -1.79 112.91 114.45 2oyy h THR 63 Ca 0.01 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.06 2oyy h THR 63 Cb 0.14 0.36 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 2oyy h THR 63 CO -0.00 0.00 -0.43 -0.29 0.37 0.00 0.00 175.52 175.17 2oyy h ILE 64 N -0.60 1.31 -0.49 3.11 2.10 -1.17 -2.40 117.51 119.38 2oyy h ILE 64 Ca 0.00 -1.60 0.06 0.00 1.08 0.00 0.00 64.86 64.40 2oyy h ILE 64 Cb 0.57 1.62 -0.05 0.00 -1.09 0.00 0.00 36.82 37.86 2oyy h ILE 64 CO -0.10 0.50 0.19 0.00 -1.08 0.00 0.00 178.15 177.66 2oyy h ALA 65 N 1.14 0.60 -0.84 0.18 0.00 -0.54 -0.94 119.26 118.86 2oyy h ALA 65 Ca 0.03 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2oyy h ALA 65 Cb 0.92 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2oyy h ALA 65 CO 0.08 -0.19 0.50 0.00 0.00 0.00 0.00 179.25 179.63 2oyy h ALA 66 N 1.31 1.07 -0.12 0.00 0.00 -1.08 0.86 119.26 121.30 2oyy h ALA 66 Ca 0.23 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.08 2oyy h ALA 66 Cb 0.22 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2oyy h ALA 66 CO -0.22 0.54 -0.11 0.00 0.00 0.00 0.00 179.25 179.45 2oyy h ALA 67 N 1.27 -0.02 -0.10 0.00 0.00 -0.71 -1.91 119.26 117.79 2oyy h ALA 67 Ca 0.30 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2oyy h ALA 67 Cb -0.03 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2oyy h ALA 67 CO -0.05 -0.57 0.00 0.09 0.00 0.00 0.00 179.25 178.72 2oyy n ASN 68 N -5.26 1.55 -1.26 0.00 4.13 -0.57 -4.84 115.26 109.00 2oyy n ASN 68 Ca -0.03 -2.12 -0.13 0.00 1.68 0.00 0.00 54.58 53.98 2oyy n ASN 68 Cb 0.18 -0.44 -0.06 0.00 -1.54 0.00 0.00 39.78 37.93 2oyy n ASN 68 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2oyy n ASP 69 N 0.05 -3.90 -0.89 6.41 4.64 -0.72 -0.35 116.55 121.80 2oyy n ASP 69 Ca 0.05 0.32 -0.09 0.00 -1.38 0.00 0.00 54.79 53.69 2oyy n ASP 69 Cb 0.34 -3.44 -0.01 0.00 -1.04 0.00 0.00 41.12 36.96 2oyy n ASP 69 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 2oyy n TYR 70 N -1.90 -0.28 -0.22 -0.67 4.01 0.26 -4.99 117.16 113.37 2oyy n TYR 70 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 2oyy n TYR 70 Cb 0.47 -2.08 0.00 0.00 -0.31 0.00 0.00 39.34 37.42 2oyy n TYR 70 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31