#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1und n LEU 2 N 0.00 -7.12 -4.72 2.98 4.32 -1.26 -4.96 117.00 106.25 1und n LEU 2 Ca 0.00 1.81 -0.38 0.00 -0.02 0.00 0.00 56.01 57.42 1und n LEU 2 Cb 0.00 -3.28 0.05 0.00 -1.62 0.00 0.00 43.42 38.56 1und n LEU 2 CO 0.00 -3.58 0.89 -1.54 -1.22 0.00 0.00 177.39 171.94 1und n SER 3 N 1.18 2.24 0.26 -1.43 3.41 -1.26 -4.73 113.62 113.29 1und n SER 3 Ca -0.19 0.93 0.16 0.00 -0.26 0.00 0.00 58.87 59.51 1und n SER 3 Cb 0.30 -1.54 0.88 0.00 -0.26 0.00 0.00 64.21 63.59 1und n SER 3 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1und h GLU 4 N 1.13 0.00 0.03 4.33 4.39 -1.98 0.14 114.58 122.63 1und h GLU 4 Ca -0.50 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.15 1und h GLU 4 Cb 1.32 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.98 1und h GLU 4 CO 0.55 0.00 -0.21 1.96 -1.16 0.00 0.00 179.01 180.16 1und h GLN 5 N 0.00 0.08 -0.89 2.33 7.50 -1.99 -1.32 115.11 120.82 1und h GLN 5 Ca 0.04 -0.13 0.05 0.00 0.50 0.00 0.00 58.65 59.10 1und h GLN 5 Cb 0.22 0.05 -0.05 0.00 0.05 0.00 0.00 27.48 27.75 1und h GLN 5 CO -0.00 1.03 0.58 -0.44 -1.50 0.00 0.00 178.83 178.51 1und h ASP 6 N -0.80 0.94 0.69 1.46 5.19 -1.77 -1.14 116.42 120.99 1und h ASP 6 Ca -0.03 -0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.34 1und h ASP 6 Cb 1.13 -0.21 -0.00 0.00 0.18 0.00 0.00 39.33 40.43 1und h ASP 6 CO 0.04 0.63 -0.45 0.15 -3.12 0.00 0.00 179.24 176.49 1und h PHE 7 N 1.08 -1.20 -0.99 4.55 3.04 -0.81 -2.77 116.94 119.83 1und h PHE 7 Ca 0.37 -0.01 0.22 0.00 3.98 0.00 0.00 57.97 62.52 1und h PHE 7 Cb 0.09 0.43 -0.10 0.00 2.56 0.00 0.00 35.95 38.94 1und h PHE 7 CO -0.00 -0.66 0.62 0.28 -2.02 0.00 0.00 178.31 176.53 1und h VAL 8 N -1.07 0.64 -0.49 1.41 2.07 -0.63 0.37 116.25 118.56 1und h VAL 8 Ca -0.09 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.22 1und h VAL 8 Cb 0.87 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1und h VAL 8 CO 0.08 0.11 0.28 -1.28 0.02 0.00 0.00 177.57 176.77 1und h SER 9 N 0.59 0.58 0.04 0.57 0.87 -0.97 -1.48 113.55 113.74 1und h SER 9 Ca 0.57 -0.03 -0.37 0.00 -1.23 0.00 0.00 61.79 60.72 1und h SER 9 Cb 1.13 -0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 62.88 1und h SER 9 CO -0.33 0.47 -2.36 0.52 -0.53 0.00 0.00 176.83 174.60 1und n VAL 10 N -4.42 1.44 -0.00 2.23 0.31 0.24 -4.61 118.33 113.52 1und n VAL 10 Ca 0.04 -0.77 -0.20 0.00 -0.01 0.00 0.00 64.34 63.40 1und n VAL 10 Cb 0.09 -0.80 -0.14 0.00 -0.91 0.00 0.00 33.84 32.08 1und n VAL 10 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1und n PHE 11 N -2.93 1.17 -0.93 3.52 3.01 0.11 -4.99 117.46 116.42 1und n PHE 11 Ca -0.35 0.26 0.00 0.00 1.01 0.00 0.00 57.45 58.37 1und n PHE 11 Cb 1.10 -1.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.42 1und n PHE 11 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1und n GLY 12 N 1.97 0.70 3.24 1.37 0.00 -0.56 -5.03 105.19 106.88 1und n GLY 12 Ca -0.31 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 1und n GLY 12 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1und s ILE 13 N -2.71 1.70 0.79 -0.61 -4.36 -1.26 -5.09 121.20 109.65 1und s ILE 13 Ca 0.00 -0.97 -0.11 0.00 -0.26 0.00 0.00 60.65 59.31 1und s ILE 13 Cb 0.00 -1.42 0.07 0.00 1.25 0.00 0.00 42.46 42.36 1und s ILE 13 CO 0.00 0.43 1.11 0.28 0.24 0.00 0.00 174.94 177.01 1und s THR 14 N -0.55 2.98 0.29 8.37 -1.32 -1.26 -4.48 115.64 119.67 1und s THR 14 Ca 0.08 0.34 0.03 0.00 -1.21 0.00 0.00 61.69 60.93 1und s THR 14 Cb -0.08 -2.73 0.29 0.00 -1.51 0.00 0.00 72.50 68.46 1und s THR 14 CO -0.00 -0.39 1.83 -0.09 -2.21 0.00 0.00 174.62 173.75 1und h ARG 15 N -1.11 0.89 0.47 7.08 2.43 -1.98 0.35 114.38 122.52 1und h ARG 15 Ca -0.44 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 58.65 1und h ARG 15 Cb 1.24 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 1und h ARG 15 CO 0.49 0.59 -0.23 0.78 -1.51 0.00 0.00 179.97 180.10 1und h GLY 16 N 0.92 -0.66 1.07 2.80 0.00 -1.98 -0.40 103.07 104.82 1und h GLY 16 Ca 0.51 0.24 -0.08 0.00 0.00 0.00 0.00 47.33 48.01 1und h GLY 16 CO -0.29 -0.24 0.09 -1.61 0.00 0.00 0.00 176.54 174.50 1und h GLN 17 N -0.69 1.09 -0.23 4.80 4.15 -1.83 -1.45 115.11 120.94 1und h GLN 17 Ca -0.06 -0.30 0.03 0.00 0.77 0.00 0.00 58.65 59.09 1und h GLN 17 Cb 0.51 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.05 1und h GLN 17 CO 0.11 1.01 0.04 0.35 -1.93 0.00 0.00 178.83 178.40 1und h PHE 18 N 1.01 0.06 0.00 3.99 3.57 -0.93 0.64 116.94 125.27 1und h PHE 18 Ca 0.20 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.71 1und h PHE 18 Cb 0.45 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.20 1und h PHE 18 CO 0.03 0.01 0.00 0.00 -2.23 0.00 0.00 178.31 176.13 1und h ALA 19 N 1.17 1.00 0.12 2.41 0.00 -0.75 -2.40 119.26 120.82 1und h ALA 19 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.72 1und h ALA 19 Cb 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1und h ALA 19 CO -0.15 0.00 -1.47 0.00 0.00 0.00 0.00 179.25 177.63 1und h ALA 20 N 2.01 0.23 -2.99 0.00 0.00 -0.43 -3.46 119.26 114.62 1und h ALA 20 Ca 0.00 -1.06 -0.54 0.00 0.00 0.00 0.00 54.91 53.31 1und h ALA 20 Cb 0.34 0.22 0.13 0.00 0.00 0.00 0.00 17.79 18.48 1und h ALA 20 CO 0.00 1.10 0.57 -0.51 0.00 0.00 0.00 179.25 180.40 1und s LEU 21 N -7.02 3.80 0.47 0.00 1.43 0.14 -4.94 118.68 112.56 1und s LEU 21 Ca -0.08 2.66 -0.23 0.00 -1.03 0.00 0.00 54.13 55.45 1und s LEU 21 Cb 0.07 -4.37 -0.09 0.00 0.03 0.00 0.00 46.19 41.83 1und s LEU 21 CO 0.86 -1.59 1.02 -2.65 0.23 0.00 0.00 176.35 174.22 1und n PRO 22 N -1.19 1.29 -0.20 1.29 -0.02 -1.26 -4.72 135.00 130.18 1und n PRO 22 Ca 0.11 0.47 0.22 0.00 -2.02 0.00 0.00 63.50 62.28 1und n PRO 22 Cb 0.46 -2.11 0.59 0.00 -0.02 0.00 0.00 33.50 32.43 1und n PRO 22 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1und h GLY 23 N 1.31 0.54 0.62 -1.23 0.00 -1.92 0.11 103.07 102.50 1und h GLY 23 Ca -0.46 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 46.75 1und h GLY 23 CO 0.55 -0.01 -0.02 0.11 0.00 0.00 0.00 176.54 177.18 1und h TRP 24 N 0.25 -0.05 -0.37 5.60 5.08 -1.99 -1.62 115.95 122.85 1und h TRP 24 Ca 0.44 -0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.38 1und h TRP 24 Cb 1.33 0.02 -0.02 0.00 -3.00 0.00 0.00 29.16 27.49 1und h TRP 24 CO -0.00 0.33 0.12 -0.22 -1.28 0.00 0.00 178.44 177.39 1und h LYS 25 N -0.44 0.52 0.79 0.12 1.63 -1.52 0.01 116.57 117.68 1und h LYS 25 Ca -0.01 -0.07 -0.04 0.00 -0.85 0.00 0.00 60.65 59.68 1und h LYS 25 Cb 0.40 -0.10 0.01 0.00 -0.60 0.00 0.00 32.23 31.94 1und h LYS 25 CO 0.01 0.46 -0.38 1.96 -3.45 0.00 0.00 179.45 178.05 1und h GLN 26 N 0.52 -1.02 -0.74 1.90 4.20 -0.97 -1.16 115.11 117.84 1und h GLN 26 Ca 0.13 0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.87 1und h GLN 26 Cb 0.16 0.23 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 1und h GLN 26 CO -0.01 -0.67 0.32 1.37 -0.67 0.00 0.00 178.83 179.17 1und h LEU 27 N -1.13 0.98 0.46 1.46 8.10 -1.01 -1.92 115.31 122.25 1und h LEU 27 Ca -0.11 -0.13 -0.02 0.00 0.11 0.00 0.00 57.88 57.73 1und h LEU 27 Cb 0.82 -0.25 -0.00 0.00 -0.44 0.00 0.00 40.66 40.79 1und h LEU 27 CO 0.18 0.86 -0.25 -0.61 -4.11 0.00 0.00 178.44 174.50 1und h GLN 28 N 1.06 -0.64 -0.77 0.17 4.15 -0.99 -2.57 115.11 115.52 1und h GLN 28 Ca 0.25 0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.79 1und h GLN 28 Cb 0.16 0.14 -0.06 0.00 0.21 0.00 0.00 27.48 27.93 1und h GLN 28 CO -0.03 -0.42 0.44 0.52 -1.93 0.00 0.00 178.83 177.41 1und h MET 29 N -0.66 0.76 0.09 1.69 2.86 -0.87 0.99 114.93 119.79 1und h MET 29 Ca -0.06 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1und h MET 29 Cb 0.53 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.97 1und h MET 29 CO 0.08 0.51 -0.30 0.87 1.06 0.00 0.00 176.91 179.12 1und h LYS 30 N 0.79 -0.48 -0.28 1.72 1.79 -1.30 -2.62 116.57 116.19 1und h LYS 30 Ca 0.35 0.03 -0.05 0.00 -2.18 0.00 0.00 60.65 58.81 1und h LYS 30 Cb 0.25 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.00 1und h LYS 30 CO -0.21 -0.32 -0.03 0.87 -1.08 0.00 0.00 179.45 178.68 1und h LYS 31 N -0.50 0.43 -0.11 3.15 1.57 -0.95 -2.99 116.57 117.16 1und h LYS 31 Ca 0.04 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 1und h LYS 31 Cb 0.55 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 1und h LYS 31 CO -0.20 0.49 0.00 0.93 -0.57 0.00 0.00 179.45 180.10 1und h GLU 32 N 0.41 0.20 -0.11 3.15 5.08 -0.57 0.11 114.58 122.85 1und h GLU 32 Ca 0.09 -0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1und h GLU 32 Cb 0.33 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1und h GLU 32 CO 0.01 0.44 0.08 0.87 -1.00 0.00 0.00 179.01 179.41 1und h LYS 33 N -0.06 0.00 0.00 2.33 6.56 -1.48 -3.26 116.57 120.65 1und h LYS 33 Ca 0.03 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.62 1und h LYS 33 Cb 0.34 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.00 1und h LYS 33 CO 0.01 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.81 1und n GLY 34 N -1.52 -1.81 0.55 3.86 0.00 -0.61 -4.97 105.19 100.68 1und n GLY 34 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1und n GLY 34 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1und n LEU 35 N 0.00 -0.29 0.00 0.99 -0.00 0.26 -5.10 117.00 112.86 1und n LEU 35 Ca 0.00 -0.93 0.00 0.00 -0.00 0.00 0.00 56.01 55.08 1und n LEU 35 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1und n LEU 35 CO 0.00 0.96 0.00 0.33 -0.00 0.00 0.00 177.39 178.68