#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bv9 n ALA 1 N 0.00 0.00 -1.09 -1.84 0.00 -1.26 -2.90 120.51 113.42 3bv9 n ALA 1 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3bv9 n ALA 1 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 3bv9 n ALA 1 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3bv9 n ASP 1 N 6.65 2.06 -4.70 0.00 2.03 -1.26 -5.07 116.55 116.26 3bv9 n ASP 1 Ca 0.00 -2.88 -0.38 0.00 0.52 0.00 0.00 54.79 52.05 3bv9 n ASP 1 Cb 0.00 -0.37 0.05 0.00 -0.72 0.00 0.00 41.12 40.08 3bv9 n ASP 1 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3bv9 n GLY 2 N 0.96 0.29 3.18 0.00 0.00 -1.26 -4.97 105.19 103.39 3bv9 n GLY 2 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 3bv9 n GLY 2 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bv9 s LEU 3 N 0.00 4.27 0.12 0.99 1.43 -1.19 -5.02 118.68 119.29 3bv9 s LEU 3 Ca 0.00 -1.42 -0.30 0.00 -1.03 0.00 0.00 54.13 51.38 3bv9 s LEU 3 Cb 0.00 -1.76 -0.06 0.00 0.03 0.00 0.00 46.19 44.39 3bv9 s LEU 3 CO 0.00 -0.33 1.08 -0.13 0.23 0.00 0.00 176.35 177.20 3bv9 s ARG 4 N 1.25 4.57 0.39 1.70 0.52 -1.26 -4.75 118.95 121.38 3bv9 s ARG 4 Ca -0.02 1.64 0.11 0.00 -0.52 0.00 0.00 55.73 56.95 3bv9 s ARG 4 Cb -0.20 -3.33 0.91 0.00 0.52 0.00 0.00 34.95 32.85 3bv9 s ARG 4 CO -0.01 0.01 1.92 -1.35 0.02 0.00 0.00 175.30 175.89 3bv9 h PRO 5 N 5.77 0.55 -0.04 3.54 0.11 -1.97 -1.38 132.00 138.59 3bv9 h PRO 5 Ca -0.43 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3bv9 h PRO 5 Cb 1.21 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3bv9 h PRO 5 CO 0.74 0.36 0.00 1.28 -0.21 0.00 0.00 178.00 180.18 3bv9 n LEU 6 N -4.50 2.38 0.00 2.35 4.77 -1.26 -4.16 117.00 116.58 3bv9 n LEU 6 Ca 0.14 -0.80 0.00 0.00 -0.03 0.00 0.00 56.01 55.32 3bv9 n LEU 6 Cb 0.43 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 3bv9 n LEU 6 CO 0.32 0.40 0.00 0.49 -1.33 0.00 0.00 177.39 177.27 3bv9 n PHE 7 N 0.86 0.00 -0.27 -1.77 3.72 -0.89 -4.73 117.46 114.38 3bv9 n PHE 7 Ca 0.16 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.62 3bv9 n PHE 7 Cb 0.50 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.23 3bv9 n PHE 7 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3bv9 h GLU 8 N 0.00 0.46 0.00 -1.08 3.07 -1.56 0.30 114.58 115.77 3bv9 h GLU 8 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 3bv9 h GLU 8 Cb 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 3bv9 h GLU 8 CO 0.00 0.31 0.00 0.87 -1.40 0.00 0.00 179.01 178.79 3bv9 h LYS 9 N 0.48 0.00 -0.20 2.33 1.79 -1.48 -2.19 116.57 117.30 3bv9 h LYS 9 Ca 0.43 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.90 3bv9 h LYS 9 Cb 0.64 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 3bv9 h LYS 9 CO -0.40 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.60 3bv9 n LYS 10 N -3.05 2.11 -3.21 3.15 5.02 -0.16 -4.99 118.16 117.03 3bv9 n LYS 10 Ca -0.01 -1.67 -0.22 0.00 -2.02 0.00 0.00 58.31 54.39 3bv9 n LYS 10 Cb 0.16 -1.20 0.05 0.00 -0.02 0.00 0.00 35.03 34.03 3bv9 n LYS 10 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 3bv9 n SER 11 N 0.36 -6.11 -4.47 4.39 7.64 -0.12 -4.99 113.62 110.32 3bv9 n SER 11 Ca 0.08 -0.37 -0.32 0.00 1.01 0.00 0.00 58.87 59.27 3bv9 n SER 11 Cb 0.34 -4.85 -0.13 0.00 -1.01 0.00 0.00 64.21 58.56 3bv9 n SER 11 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3bv9 s LEU 12 N -6.71 2.67 -0.01 -3.43 1.02 -0.09 -5.00 118.68 107.12 3bv9 s LEU 12 Ca 0.40 -0.32 0.01 0.00 0.02 0.00 0.00 54.13 54.24 3bv9 s LEU 12 Cb -0.17 -1.55 -0.04 0.00 0.02 0.00 0.00 46.19 44.45 3bv9 s LEU 12 CO 0.49 0.29 -0.01 -1.61 0.02 0.00 0.00 176.35 175.54 3bv9 s GLU 13 N -1.13 2.78 0.81 1.70 2.02 -1.26 -3.71 118.70 119.91 3bv9 s GLU 13 Ca 0.13 -0.61 -0.12 0.00 0.02 0.00 0.00 54.97 54.40 3bv9 s GLU 13 Cb -0.11 -2.66 0.08 0.00 0.10 0.00 0.00 34.13 31.55 3bv9 s GLU 13 CO 0.03 0.63 1.16 0.16 0.02 0.00 0.00 175.26 177.26 3bv9 s ASP 14 N -1.47 4.46 0.61 -0.19 1.47 -1.26 -4.95 116.67 115.33 3bv9 s ASP 14 Ca 0.19 0.86 0.36 0.00 1.18 0.00 0.00 52.55 55.14 3bv9 s ASP 14 Cb -0.11 -1.41 1.98 0.00 -0.34 0.00 0.00 42.92 43.03 3bv9 s ASP 14 CO 0.09 -1.94 2.25 0.11 0.68 0.00 0.00 175.17 176.35 3bv9 h LYS 14 N -1.08 0.00 0.00 2.11 1.57 -2.05 -3.26 116.57 113.86 3bv9 h LYS 14 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 3bv9 h LYS 14 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3bv9 h LYS 14 CO 0.65 0.02 0.00 0.25 -0.57 0.00 0.00 179.45 179.80 3bv9 n THR 14 N -3.39 0.15 0.23 -0.16 -2.24 -1.26 -4.74 114.28 102.87 3bv9 n THR 14 Ca -0.02 -0.50 0.07 0.00 -2.27 0.00 0.00 64.05 61.32 3bv9 n THR 14 Cb 0.13 1.05 0.56 0.00 -2.10 0.00 0.00 70.33 69.97 3bv9 n THR 14 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3bv9 h GLU 14 N 0.00 0.00 -0.42 -0.78 4.11 -1.96 -1.38 114.58 114.16 3bv9 h GLU 14 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.46 3bv9 h GLU 14 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3bv9 h GLU 14 CO 0.00 0.16 0.28 -0.09 0.07 0.00 0.00 179.01 179.42 3bv9 h ARG 14 N 0.00 0.46 -1.37 1.06 2.43 -1.85 -1.63 114.38 113.47 3bv9 h ARG 14 Ca -0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3bv9 h ARG 14 Cb 0.29 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3bv9 h ARG 14 CO 0.02 0.30 0.00 -1.91 -1.51 0.00 0.00 179.97 176.87 3bv9 n GLU 14 N -4.48 0.19 0.00 0.20 2.13 -0.52 -0.68 120.64 117.48 3bv9 n GLU 14 Ca 0.04 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.86 3bv9 n GLU 14 Cb 0.13 -1.32 0.00 0.00 0.27 0.00 0.00 31.44 30.52 3bv9 n GLU 14 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 3bv9 n LEU 14 N 0.77 0.00 0.17 4.31 0.00 -0.62 -2.33 117.00 119.31 3bv9 n LEU 14 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 56.01 56.15 3bv9 n LEU 14 Cb 0.08 0.00 0.70 0.00 0.00 0.00 0.00 43.42 44.20 3bv9 n LEU 14 CO 0.00 0.00 1.12 -0.33 0.00 0.00 0.00 177.39 178.18 3bv9 h GLU 14 N 0.00 0.00 0.00 1.96 5.08 -1.17 -1.54 114.58 118.91 3bv9 h GLU 14 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3bv9 h GLU 14 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3bv9 h GLU 14 CO 0.00 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.88 3bv9 n SER 14 N -4.34 0.13 -0.06 1.42 3.41 -0.98 -2.07 113.62 111.12 3bv9 n SER 14 Ca 0.02 0.53 0.06 0.00 -0.26 0.00 0.00 58.87 59.21 3bv9 n SER 14 Cb 0.28 -0.56 0.32 0.00 -0.26 0.00 0.00 64.21 63.99 3bv9 n SER 14 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3bv9 n TYR 14 N -1.64 0.03 -0.01 7.33 4.01 -0.58 -3.47 117.16 122.83 3bv9 n TYR 14 Ca 0.04 -0.02 -0.02 0.00 -0.16 0.00 0.00 57.90 57.74 3bv9 n TYR 14 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.23 3bv9 n TYR 14 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 3bv9 n ILE 14 N -0.55 0.14 1.53 -0.72 5.41 -0.88 -5.17 119.36 119.12 3bv9 n ILE 14 Ca 0.09 -0.05 0.14 0.00 1.00 0.00 0.00 62.75 63.92 3bv9 n ILE 14 Cb 0.07 -0.63 0.55 0.00 -0.71 0.00 0.00 39.64 38.92 3bv9 n ILE 14 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02