#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ouf h PRO 14 N 0.00 0.50 -0.02 1.20 0.13 -2.03 0.63 132.00 132.40 2ouf h PRO 14 Ca 0.00 -0.03 -0.13 0.00 -0.87 0.00 0.00 66.00 64.97 2ouf h PRO 14 Cb 0.00 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 31.00 2ouf h PRO 14 CO 0.00 0.33 -0.61 -0.07 -0.23 0.00 0.00 178.00 177.42 2ouf h LEU 15 N 0.52 0.10 -0.36 1.56 4.07 -1.99 -1.47 115.31 117.73 2ouf h LEU 15 Ca 0.35 -0.06 -0.13 0.00 0.08 0.00 0.00 57.88 58.13 2ouf h LEU 15 Cb 0.66 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 42.37 2ouf h LEU 15 CO -0.12 0.68 -0.27 0.44 -1.08 0.00 0.00 178.44 178.09 2ouf h ASP 16 N 0.06 0.86 -0.86 -0.43 5.19 -1.58 -2.39 116.42 117.27 2ouf h ASP 16 Ca -0.01 -0.44 -0.01 0.00 -0.62 0.00 0.00 57.03 55.95 2ouf h ASP 16 Cb 1.09 -0.24 -0.04 0.00 0.18 0.00 0.00 39.33 40.32 2ouf h ASP 16 CO 0.08 1.12 0.52 0.11 -3.12 0.00 0.00 179.24 177.95 2ouf h LYS 17 N 0.61 1.18 -0.35 3.56 1.79 -0.76 -1.30 116.57 121.29 2ouf h LYS 17 Ca 0.07 -0.11 0.03 0.00 -2.18 0.00 0.00 60.65 58.45 2ouf h LYS 17 Cb 0.85 -0.24 -0.03 0.00 -1.58 0.00 0.00 32.23 31.22 2ouf h LYS 17 CO 0.07 0.83 0.17 2.35 -1.08 0.00 0.00 179.45 181.79 2ouf h TRP 18 N 1.19 0.32 -0.75 -1.35 7.01 -1.22 -1.61 115.95 119.54 2ouf h TRP 18 Ca 0.31 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.30 2ouf h TRP 18 Cb -0.04 -0.09 -0.04 0.00 -2.10 0.00 0.00 29.16 26.89 2ouf h TRP 18 CO -0.00 0.17 0.38 -0.97 -2.79 0.00 0.00 178.44 175.23 2ouf h ASN 19 N 0.36 0.94 -0.06 2.65 -0.73 -1.14 -1.05 115.58 116.55 2ouf h ASN 19 Ca 0.15 -0.09 0.01 0.00 1.87 0.00 0.00 56.30 58.23 2ouf h ASN 19 Cb 0.06 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.40 2ouf h ASN 19 CO -0.10 0.78 0.01 0.44 -0.37 0.00 0.00 177.43 178.19 2ouf h ASP 20 N 1.05 0.00 -0.19 1.15 3.32 -0.76 -1.46 116.42 119.53 2ouf h ASP 20 Ca 0.26 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.30 2ouf h ASP 20 Cb 0.07 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2ouf h ASP 20 CO -0.04 0.01 0.02 0.40 -1.72 0.00 0.00 179.24 177.92 2ouf h ILE 21 N 0.04 1.23 -0.38 0.35 1.08 -1.06 0.20 117.51 118.98 2ouf h ILE 21 Ca 0.03 -0.78 0.07 0.00 -0.39 0.00 0.00 64.86 63.79 2ouf h ILE 21 Cb 0.02 1.37 -0.06 0.00 -3.07 0.00 0.00 36.82 35.09 2ouf h ILE 21 CO -0.04 0.24 0.02 0.40 -0.69 0.00 0.00 178.15 178.08 2ouf h ILE 22 N 0.11 0.73 0.00 -0.67 1.08 -1.13 0.61 117.51 118.24 2ouf h ILE 22 Ca 0.06 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 2ouf h ILE 22 Cb 0.34 0.60 0.00 0.00 -3.07 0.00 0.00 36.82 34.69 2ouf h ILE 22 CO 0.01 0.02 -0.24 0.49 -0.69 0.00 0.00 178.15 177.74 2ouf n PHE 23 N -5.17 0.81 0.50 1.37 3.01 -0.56 -3.94 117.46 113.48 2ouf n PHE 23 Ca 0.02 0.24 0.07 0.00 1.01 0.00 0.00 57.45 58.78 2ouf n PHE 23 Cb 0.19 -0.84 -0.08 0.00 -0.01 0.00 0.00 39.48 38.74 2ouf n PHE 23 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 2ouf n HIS 24 N -2.22 0.00 -1.11 1.38 8.25 0.05 -4.99 115.22 116.58 2ouf n HIS 24 Ca 0.05 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.20 2ouf n HIS 24 Cb 0.44 -0.07 0.13 0.00 1.12 0.00 0.00 29.99 31.60 2ouf n HIS 24 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2ouf s ALA 25 N -2.43 1.75 0.54 -1.41 0.00 0.19 -4.98 121.76 115.42 2ouf s ALA 25 Ca 0.03 0.19 -0.20 0.00 0.00 0.00 0.00 51.96 51.97 2ouf s ALA 25 Cb 0.10 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.88 2ouf s ALA 25 CO 0.56 -2.24 0.97 -1.13 0.00 0.00 0.00 175.76 173.93 2ouf n SER 26 N -3.83 0.93 -0.18 0.00 3.41 -1.26 -4.78 113.62 107.91 2ouf n SER 26 Ca 0.08 0.88 0.01 0.00 -0.26 0.00 0.00 58.87 59.58 2ouf n SER 26 Cb 0.54 -1.38 0.27 0.00 -0.26 0.00 0.00 64.21 63.38 2ouf n SER 26 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 2ouf h LYS 27 N 0.86 0.91 -0.29 4.33 -0.00 -1.93 -2.24 116.57 118.20 2ouf h LYS 27 Ca -0.47 -0.06 0.05 0.00 -0.00 0.00 0.00 60.65 60.17 2ouf h LYS 27 Cb 1.35 -0.20 -0.05 0.00 -0.00 0.00 0.00 32.23 33.34 2ouf h LYS 27 CO 0.53 0.62 -0.01 -0.22 -0.00 0.00 0.00 179.45 180.36 2ouf h LYS 28 N 0.93 0.07 -0.07 0.07 3.64 -2.00 -2.25 116.57 116.97 2ouf h LYS 28 Ca 0.25 -0.00 -0.24 0.00 -1.27 0.00 0.00 60.65 59.38 2ouf h LYS 28 Cb -0.08 -0.02 0.02 0.00 -0.41 0.00 0.00 32.23 31.74 2ouf h LYS 28 CO -0.05 0.05 -0.91 -0.07 -2.27 0.00 0.00 179.45 176.20 2ouf h LEU 29 N 0.07 0.92 -0.97 5.20 3.38 -1.81 -2.74 115.31 119.36 2ouf h LEU 29 Ca 0.14 -0.69 -0.10 0.00 0.09 0.00 0.00 57.88 57.32 2ouf h LEU 29 Cb 0.19 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2ouf h LEU 29 CO -0.25 1.48 -0.33 0.77 0.09 0.00 0.00 178.44 180.19 2ouf h SER 30 N 0.44 0.34 -0.26 -0.43 4.64 -1.45 -2.03 113.55 114.80 2ouf h SER 30 Ca -0.09 -0.13 -0.06 0.00 -0.47 0.00 0.00 61.79 61.04 2ouf h SER 30 Cb 1.55 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.54 2ouf h SER 30 CO 0.18 0.66 -0.07 0.50 -0.87 0.00 0.00 176.83 177.23 2ouf h LYS 31 N 0.29 0.51 -0.65 4.77 3.64 -1.43 0.04 116.57 123.73 2ouf h LYS 31 Ca 0.04 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2ouf h LYS 31 Cb 0.73 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.49 2ouf h LYS 31 CO 0.06 0.73 0.42 -0.22 -2.27 0.00 0.00 179.45 178.17 2ouf h LYS 32 N 0.25 0.86 0.17 1.90 3.64 -1.42 -0.52 116.57 121.45 2ouf h LYS 32 Ca 0.06 -0.06 -0.25 0.00 -1.27 0.00 0.00 60.65 59.13 2ouf h LYS 32 Cb 0.55 -0.19 0.03 0.00 -0.41 0.00 0.00 32.23 32.21 2ouf h LYS 32 CO 0.03 0.58 -1.10 1.49 -2.27 0.00 0.00 179.45 178.17 2ouf h GLU 33 N 0.88 0.44 -0.83 1.90 4.57 -1.05 -1.35 114.58 119.14 2ouf h GLU 33 Ca 0.24 -0.71 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2ouf h GLU 33 Cb -0.09 0.26 -0.04 0.00 -0.16 0.00 0.00 28.75 28.72 2ouf h GLU 33 CO -0.05 1.33 0.52 -0.07 -1.18 0.00 0.00 179.01 179.56 2ouf h LEU 34 N -0.08 0.98 -1.39 1.64 3.38 -0.88 -1.53 115.31 117.43 2ouf h LEU 34 Ca -0.19 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 2ouf h LEU 34 Cb 1.86 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.34 2ouf h LEU 34 CO 0.21 0.74 0.17 -0.33 0.09 0.00 0.00 178.44 179.32 2ouf h GLU 35 N 1.14 0.58 -0.19 1.13 5.08 -1.06 -0.83 114.58 120.42 2ouf h GLU 35 Ca 0.30 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 2ouf h GLU 35 Cb -0.08 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 2ouf h GLU 35 CO -0.06 0.48 0.04 -0.09 -1.00 0.00 0.00 179.01 178.39 2ouf h ARG 36 N 0.58 0.31 -0.73 2.33 2.43 -0.82 -0.64 114.38 117.85 2ouf h ARG 36 Ca 0.14 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 2ouf h ARG 36 Cb 0.11 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.59 2ouf h ARG 36 CO -0.02 0.45 0.30 -0.07 -1.51 0.00 0.00 179.97 179.12 2ouf h LEU 37 N 0.13 1.00 -0.62 3.80 3.38 -1.06 -1.95 115.31 119.98 2ouf h LEU 37 Ca 0.06 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.89 2ouf h LEU 37 Cb 0.28 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2ouf h LEU 37 CO 0.00 0.89 0.39 0.25 0.09 0.00 0.00 178.44 180.06 2ouf h LEU 38 N 1.04 0.65 -0.62 1.67 5.85 -1.05 -0.85 115.31 122.00 2ouf h LEU 38 Ca 0.24 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.87 2ouf h LEU 38 Cb 0.20 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2ouf h LEU 38 CO -0.02 0.46 0.03 -0.08 -0.34 0.00 0.00 178.44 178.49 2ouf h GLU 39 N 0.78 1.07 -0.21 1.25 4.81 -0.93 -1.06 114.58 120.28 2ouf h GLU 39 Ca 0.24 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2ouf h GLU 39 Cb -0.01 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 2ouf h GLU 39 CO -0.09 1.03 0.09 1.25 -0.73 0.00 0.00 179.01 180.56 2ouf h LEU 40 N 0.97 0.29 -0.33 1.64 5.85 -1.14 0.11 115.31 122.70 2ouf h LEU 40 Ca 0.18 -0.15 0.06 0.00 0.84 0.00 0.00 57.88 58.82 2ouf h LEU 40 Cb 0.52 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 2ouf h LEU 40 CO 0.03 0.35 -0.06 0.25 -0.34 0.00 0.00 178.44 178.67 2ouf h LEU 41 N 0.20 -0.26 -0.68 2.25 5.85 -1.03 -0.49 115.31 121.15 2ouf h LEU 41 Ca 0.07 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.91 2ouf h LEU 41 Cb 0.15 0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2ouf h LEU 41 CO -0.01 -0.09 0.43 0.00 -0.34 0.00 0.00 178.44 178.43 2ouf h ALA 42 N 1.32 0.89 -0.47 1.25 0.00 -1.00 -0.13 119.26 121.12 2ouf h ALA 42 Ca 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2ouf h ALA 42 Cb 0.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2ouf h ALA 42 CO -0.32 0.19 0.27 -0.07 0.00 0.00 0.00 179.25 179.33 2ouf h LEU 43 N 0.83 0.58 -0.33 0.00 3.38 -0.50 -1.78 115.31 117.48 2ouf h LEU 43 Ca 0.28 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 58.03 2ouf h LEU 43 Cb 0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2ouf h LEU 43 CO -0.11 0.49 -0.33 -0.07 0.09 0.00 0.00 178.44 178.51 2ouf h LEU 44 N 0.63 0.87 -0.55 1.67 3.38 -0.76 -0.79 115.31 119.76 2ouf h LEU 44 Ca 0.17 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2ouf h LEU 44 Cb 0.03 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 2ouf h LEU 44 CO -0.03 1.16 0.35 -0.33 0.09 0.00 0.00 178.44 179.68 2ouf h GLU 45 N 0.60 0.73 -0.34 1.13 5.08 -1.06 -1.78 114.58 118.94 2ouf h GLU 45 Ca 0.05 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2ouf h GLU 45 Cb 0.91 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 2ouf h GLU 45 CO 0.08 0.50 -0.11 1.15 -1.00 0.00 0.00 179.01 179.64 2ouf h THR 46 N 0.74 1.24 -0.26 1.13 2.02 -1.19 -2.02 112.91 114.57 2ouf h THR 46 Ca 0.20 -1.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 2ouf h THR 46 Cb -0.06 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2ouf h THR 46 CO -0.04 0.35 0.08 0.15 0.37 0.00 0.00 175.52 176.42 2ouf h PHE 47 N 0.53 0.42 -0.84 3.16 3.57 -1.02 0.11 116.94 122.87 2ouf h PHE 47 Ca 0.10 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.60 2ouf h PHE 47 Cb 0.50 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.07 2ouf h PHE 47 CO 0.02 0.47 0.55 0.82 -2.23 0.00 0.00 178.31 177.94 2ouf h ILE 48 N 0.25 1.11 -0.03 1.41 1.08 -1.03 -0.33 117.51 119.97 2ouf h ILE 48 Ca 0.08 -0.35 -0.07 0.00 -0.39 0.00 0.00 64.86 64.14 2ouf h ILE 48 Cb 0.25 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 2ouf h ILE 48 CO -0.00 0.18 -0.25 -0.33 -0.69 0.00 0.00 178.15 177.06 2ouf h GLU 49 N 1.01 0.23 -0.23 2.37 5.08 -1.33 0.25 114.58 121.95 2ouf h GLU 49 Ca 0.34 -0.20 0.07 0.00 -1.00 0.00 0.00 59.36 58.57 2ouf h GLU 49 Cb 0.09 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2ouf h GLU 49 CO -0.11 0.87 0.28 -0.22 -1.00 0.00 0.00 179.01 178.83 2ouf h LYS 50 N -0.35 0.00 -0.44 2.33 3.64 -0.30 0.46 116.57 121.92 2ouf h LYS 50 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2ouf h LYS 50 Cb 0.93 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 2ouf h LYS 50 CO 0.05 0.00 0.00 -1.91 -2.27 0.00 0.00 179.45 175.32 2ouf n GLU 51 N -3.69 2.47 -3.77 1.90 4.07 -0.18 -4.99 120.64 116.46 2ouf n GLU 51 Ca 0.03 -2.23 -0.29 0.00 -0.06 0.00 0.00 57.16 54.61 2ouf n GLU 51 Cb 0.41 -1.44 0.03 0.00 -0.06 0.00 0.00 31.44 30.37 2ouf n GLU 51 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2ouf n ASP 52 N 1.22 -4.99 -1.51 4.31 8.00 0.15 -4.93 116.55 118.82 2ouf n ASP 52 Ca 0.18 -0.68 -0.02 0.00 0.71 0.00 0.00 54.79 54.97 2ouf n ASP 52 Cb 0.54 -3.99 0.27 0.00 -0.02 0.00 0.00 41.12 37.92 2ouf n ASP 52 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2ouf n LEU 53 N -4.58 5.06 -0.17 0.64 4.77 0.83 -4.81 117.00 118.73 2ouf n LEU 53 Ca 0.03 -3.30 -0.10 0.00 -0.03 0.00 0.00 56.01 52.61 2ouf n LEU 53 Cb 0.54 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 2ouf n LEU 53 CO 0.70 0.88 0.82 -0.33 -1.33 0.00 0.00 177.39 178.13 2ouf h GLU 54 N 1.99 0.84 0.17 3.23 3.07 -1.92 -2.26 114.58 119.71 2ouf h GLU 54 Ca 0.19 -0.25 -0.28 0.00 -0.50 0.00 0.00 59.36 58.52 2ouf h GLU 54 Cb 1.95 -0.08 0.03 0.00 -0.84 0.00 0.00 28.75 29.81 2ouf h GLU 54 CO 0.53 0.87 -1.21 1.05 -1.40 0.00 0.00 179.01 178.85 2ouf h GLU 55 N 0.70 0.51 -0.94 2.33 9.09 -1.97 -2.39 114.58 121.92 2ouf h GLU 55 Ca 0.14 -0.78 0.27 0.00 0.05 0.00 0.00 59.36 59.04 2ouf h GLU 55 Cb 0.47 0.28 -0.17 0.00 -1.65 0.00 0.00 28.75 27.68 2ouf h GLU 55 CO 0.02 1.36 0.16 -0.22 0.05 0.00 0.00 179.01 180.38 2ouf h LYS 56 N 0.06 0.08 -0.11 1.06 1.63 -1.92 0.28 116.57 117.65 2ouf h LYS 56 Ca -0.20 -0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.56 2ouf h LYS 56 Cb 1.93 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 33.54 2ouf h LYS 56 CO 0.23 0.05 -0.07 0.35 -3.45 0.00 0.00 179.45 176.56 2ouf h PHE 57 N 0.08 0.27 -0.45 1.91 3.57 -1.33 -2.38 116.94 118.62 2ouf h PHE 57 Ca 0.60 -0.07 0.05 0.00 3.53 0.00 0.00 57.97 62.08 2ouf h PHE 57 Cb 1.28 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.91 2ouf h PHE 57 CO -0.36 0.61 0.20 0.93 -2.23 0.00 0.00 178.31 177.46 2ouf h GLU 58 N -0.14 0.38 -0.23 1.11 5.08 -0.82 0.78 114.58 120.74 2ouf h GLU 58 Ca 0.02 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2ouf h GLU 58 Cb 0.55 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 2ouf h GLU 58 CO 0.02 0.25 0.07 0.66 -1.00 0.00 0.00 179.01 179.01 2ouf h SER 59 N 0.40 0.07 -0.69 1.42 4.64 -1.04 -1.67 113.55 116.68 2ouf h SER 59 Ca 0.20 0.03 0.07 0.00 -0.47 0.00 0.00 61.79 61.62 2ouf h SER 59 Cb 0.15 0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.21 2ouf h SER 59 CO -0.17 0.07 0.38 0.15 -0.87 0.00 0.00 176.83 176.39 2ouf h PHE 60 N 0.17 0.69 -0.15 4.77 3.57 -0.96 -3.01 116.94 122.02 2ouf h PHE 60 Ca 0.10 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.49 2ouf h PHE 60 Cb 0.08 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 2ouf h PHE 60 CO -0.13 0.32 -0.49 0.00 -2.23 0.00 0.00 178.31 175.78 2ouf h ALA 61 N 1.37 0.88 0.00 2.41 0.00 -0.33 -2.89 119.26 120.70 2ouf h ALA 61 Ca 0.31 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 2ouf h ALA 61 Cb 0.22 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ouf h ALA 61 CO -0.20 0.66 -0.01 1.57 0.00 0.00 0.00 179.25 181.27 2ouf h LYS 62 N 0.32 0.00 -0.12 0.00 5.09 -1.18 -2.48 116.57 118.19 2ouf h LYS 62 Ca 0.02 0.00 0.04 0.00 0.09 0.00 0.00 60.65 60.79 2ouf h LYS 62 Cb 0.98 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 33.30 2ouf h LYS 62 CO 0.08 0.01 0.10 0.00 -2.09 0.00 0.00 179.45 177.55 2ouf h ALA 63 N 1.99 2.02 -0.73 0.07 0.00 -1.57 -2.98 119.26 118.05 2ouf h ALA 63 Ca -0.00 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.00 2ouf h ALA 63 Cb 0.03 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2ouf h ALA 63 CO 0.00 -0.16 0.48 1.25 0.00 0.00 0.00 179.25 180.82 2ouf h LEU 64 N 0.00 0.56 -0.55 0.00 6.46 -1.63 0.34 115.31 120.49 2ouf h LEU 64 Ca 0.06 0.01 0.11 0.00 -0.12 0.00 0.00 57.88 57.95 2ouf h LEU 64 Cb 0.25 -0.10 -0.10 0.00 -0.73 0.00 0.00 40.66 39.98 2ouf h LEU 64 CO -0.00 0.33 -0.12 0.03 -0.62 0.00 0.00 178.44 178.06 2ouf h ARG 65 N 0.62 0.01 0.00 1.25 3.08 -1.75 -3.37 114.38 114.22 2ouf h ARG 65 Ca 0.34 -0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.17 2ouf h ARG 65 Cb 0.49 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 2ouf h ARG 65 CO -0.12 0.01 -1.82 0.44 -1.07 0.00 0.00 179.97 177.41 2ouf n ILE 66 N -5.37 0.82 -2.15 2.04 -5.35 -0.34 -4.99 119.36 104.01 2ouf n ILE 66 Ca 0.06 -0.38 -0.42 0.00 -0.27 0.00 0.00 62.75 61.73 2ouf n ILE 66 Cb 0.29 -0.90 -0.03 0.00 -1.74 0.00 0.00 39.64 37.27 2ouf n ILE 66 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2ouf s ASP 67 N -5.05 6.01 0.12 7.28 -1.08 0.11 -4.92 116.67 119.13 2ouf s ASP 67 Ca -0.15 0.98 -0.22 0.00 -0.52 0.00 0.00 52.55 52.64 2ouf s ASP 67 Cb 0.04 -2.53 -0.06 0.00 -1.46 0.00 0.00 42.92 38.91 2ouf s ASP 67 CO 0.39 -1.67 1.69 1.05 0.52 0.00 0.00 175.17 177.15 2ouf h GLU 68 N 12.15 -0.14 -0.78 4.34 -0.00 -1.91 -1.98 114.58 126.27 2ouf h GLU 68 Ca -0.30 0.01 -0.00 0.00 -0.00 0.00 0.00 59.36 59.06 2ouf h GLU 68 Cb 1.14 0.03 -0.04 0.00 -0.00 0.00 0.00 28.75 29.88 2ouf h GLU 68 CO 1.08 -0.09 0.47 0.93 -0.00 0.00 0.00 179.01 181.40 2ouf h GLU 69 N -0.14 1.06 -0.26 1.06 5.08 -1.99 -1.89 114.58 117.50 2ouf h GLU 69 Ca 0.06 -0.09 -0.15 0.00 -1.00 0.00 0.00 59.36 58.18 2ouf h GLU 69 Cb 0.23 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ouf h GLU 69 CO -0.15 0.74 -0.43 1.25 -1.00 0.00 0.00 179.01 179.43 2ouf h LEU 70 N 1.08 0.83 -0.63 1.33 5.85 -1.94 -2.14 115.31 119.69 2ouf h LEU 70 Ca 0.28 -0.52 0.08 0.00 0.84 0.00 0.00 57.88 58.56 2ouf h LEU 70 Cb -0.04 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.68 2ouf h LEU 70 CO -0.05 1.19 0.28 1.56 -0.34 0.00 0.00 178.44 181.09 2ouf h GLN 71 N 0.50 0.49 0.02 1.25 4.20 -0.90 -0.13 115.11 120.53 2ouf h GLN 71 Ca 0.02 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.72 2ouf h GLN 71 Cb 1.02 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.66 2ouf h GLN 71 CO 0.10 0.33 -0.15 0.37 -0.67 0.00 0.00 178.83 178.80 2ouf h GLN 72 N 0.51 -0.25 -0.49 1.46 5.75 -1.25 -1.34 115.11 119.50 2ouf h GLN 72 Ca 0.30 0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.84 2ouf h GLN 72 Cb 0.31 0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.89 2ouf h GLN 72 CO -0.26 -0.17 0.30 -0.22 -2.65 0.00 0.00 178.83 175.84 2ouf h LYS 73 N -0.26 0.59 -0.89 1.69 1.63 -0.89 -1.19 116.57 117.26 2ouf h LYS 73 Ca 0.05 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.79 2ouf h LYS 73 Cb 0.31 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.77 2ouf h LYS 73 CO -0.14 0.39 0.48 0.82 -3.45 0.00 0.00 179.45 177.55 2ouf h ILE 74 N 0.61 1.26 -0.57 2.00 1.08 -0.99 -0.98 117.51 119.93 2ouf h ILE 74 Ca 0.19 -0.66 -0.05 0.00 -0.39 0.00 0.00 64.86 63.95 2ouf h ILE 74 Cb -0.02 0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 33.77 2ouf h ILE 74 CO -0.07 0.30 0.16 -0.33 -0.69 0.00 0.00 178.15 177.51 2ouf h GLU 75 N 1.25 0.89 -0.58 2.37 4.39 -0.83 0.90 114.58 122.97 2ouf h GLU 75 Ca 0.31 -0.21 -0.07 0.00 0.34 0.00 0.00 59.36 59.74 2ouf h GLU 75 Cb 0.04 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 2ouf h GLU 75 CO -0.05 0.82 0.09 0.77 -1.16 0.00 0.00 179.01 179.48 2ouf h SER 76 N 0.80 0.90 -0.37 1.42 0.02 -1.02 -2.42 113.55 112.87 2ouf h SER 76 Ca 0.18 -0.20 -0.15 0.00 -0.84 0.00 0.00 61.79 60.78 2ouf h SER 76 Cb 0.32 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2ouf h SER 76 CO -0.00 0.91 -0.36 -0.09 -1.14 0.00 0.00 176.83 176.15 2ouf h ARG 77 N 0.89 0.90 -0.66 3.45 2.43 -0.90 -1.48 114.38 119.01 2ouf h ARG 77 Ca 0.18 -0.47 0.04 0.00 -0.81 0.00 0.00 59.98 58.92 2ouf h ARG 77 Cb 0.40 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 2ouf h ARG 77 CO 0.01 1.12 0.40 0.87 -1.51 0.00 0.00 179.97 180.86 2ouf h LYS 78 N 0.71 0.75 -0.36 0.20 1.57 -0.74 -0.63 116.57 118.05 2ouf h LYS 78 Ca 0.06 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 2ouf h LYS 78 Cb 0.95 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2ouf h LYS 78 CO 0.09 0.49 -0.25 1.79 -0.57 0.00 0.00 179.45 181.00 2ouf h THR 79 N 0.77 1.27 -0.99 -0.16 1.35 -1.23 -0.67 112.91 113.25 2ouf h THR 79 Ca 0.27 -1.37 0.02 0.00 -0.55 0.00 0.00 66.41 64.79 2ouf h THR 79 Cb 0.07 1.26 -0.05 0.00 -1.73 0.00 0.00 68.15 67.69 2ouf h THR 79 CO -0.13 0.45 0.65 0.44 -0.25 0.00 0.00 175.52 176.69 2ouf h ASP 80 N 0.64 1.10 -0.38 5.36 3.32 -0.93 -0.51 116.42 125.03 2ouf h ASP 80 Ca 0.08 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 2ouf h ASP 80 Cb 0.76 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2ouf h ASP 80 CO 0.06 0.78 -0.10 0.40 -1.72 0.00 0.00 179.24 178.66 2ouf h ILE 81 N 1.29 1.28 -0.64 0.35 2.04 -0.68 -2.34 117.51 118.80 2ouf h ILE 81 Ca 0.38 -1.18 0.06 0.00 1.00 0.00 0.00 64.86 65.12 2ouf h ILE 81 Cb -0.07 1.26 -0.05 0.00 -0.74 0.00 0.00 36.82 37.22 2ouf h ILE 81 CO -0.10 0.39 0.35 0.58 0.00 0.00 0.00 178.15 179.37 2ouf h VAL 82 N 0.54 0.97 -0.10 1.67 2.07 -0.87 -0.68 116.25 119.85 2ouf h VAL 82 Ca 0.10 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.38 2ouf h VAL 82 Cb 0.61 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2ouf h VAL 82 CO 0.04 0.12 0.04 0.40 0.02 0.00 0.00 177.57 178.19 2ouf h ILE 83 N 0.66 1.13 -0.50 4.57 2.04 -0.95 -2.67 117.51 121.80 2ouf h ILE 83 Ca 0.29 -0.39 0.07 0.00 1.00 0.00 0.00 64.86 65.83 2ouf h ILE 83 Cb 0.18 1.21 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 2ouf h ILE 83 CO -0.18 0.12 0.16 -0.61 0.00 0.00 0.00 178.15 177.64 2ouf h GLN 84 N 0.02 0.32 0.00 2.37 5.75 -1.29 0.63 115.11 122.90 2ouf h GLN 84 Ca 0.03 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2ouf h GLN 84 Cb 0.15 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.63 2ouf h GLN 84 CO -0.00 0.21 0.00 0.45 -2.65 0.00 0.00 178.83 176.84 2ouf n SER 85 N -5.03 0.00 0.00 -0.69 2.88 -0.27 -0.94 113.62 109.57 2ouf n SER 85 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 2ouf n SER 85 Cb 0.21 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 2ouf n SER 85 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ouf n ALA 87 N -0.00 0.00 -0.24 -1.46 0.00 0.21 -2.20 120.51 116.82 2ouf n ALA 87 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2ouf n ALA 87 Cb 0.00 0.00 0.31 0.00 0.00 0.00 0.00 19.45 19.76 2ouf n ALA 87 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2ouf h ASN 88 N 0.00 0.76 -0.02 0.00 2.35 -1.29 0.53 115.58 117.91 2ouf h ASN 88 Ca 0.00 0.01 -0.17 0.00 -0.55 0.00 0.00 56.30 55.59 2ouf h ASN 88 Cb 0.00 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 38.23 2ouf h ASN 88 CO 0.00 0.48 -0.67 0.40 -1.65 0.00 0.00 177.43 175.99 2ouf h ILE 89 N 0.86 1.39 0.00 2.81 2.04 -1.71 -2.52 117.51 120.38 2ouf h ILE 89 Ca 0.36 -2.07 -0.01 0.00 1.00 0.00 0.00 64.86 64.13 2ouf h ILE 89 Cb 0.28 2.50 -0.00 0.00 -0.74 0.00 0.00 36.82 38.86 2ouf h ILE 89 CO -0.13 0.61 -0.06 -0.07 0.00 0.00 0.00 178.15 178.50 2ouf h LEU 90 N 0.02 0.00 0.00 1.44 3.38 -1.81 -2.81 115.31 115.53 2ouf h LEU 90 Ca -0.08 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.74 2ouf h LEU 90 Cb 1.36 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 2ouf h LEU 90 CO 0.13 0.06 -0.87 -1.28 0.09 0.00 0.00 178.44 176.58 2ouf h SER 91 N 0.00 0.00 0.00 -0.43 0.87 -0.93 -3.51 113.55 109.56 2ouf h SER 91 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2ouf h SER 91 Cb 0.69 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 2ouf h SER 91 CO 0.01 0.63 0.00 0.61 -0.53 0.00 0.00 176.83 177.55