#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1und s LEU 2 N 0.00 -1.14 0.31 2.98 2.96 -1.26 -5.14 118.68 117.39 1und s LEU 2 Ca 0.00 1.33 -0.28 0.00 -0.22 0.00 0.00 54.13 54.95 1und s LEU 2 Cb 0.00 2.20 -0.13 0.00 0.50 0.00 0.00 46.19 48.76 1und s LEU 2 CO 0.00 -0.22 1.18 -1.20 -1.32 0.00 0.00 176.35 174.79 1und n SER 3 N 5.41 2.15 -0.16 3.68 7.64 -1.26 -4.60 113.62 126.47 1und n SER 3 Ca -0.09 1.19 0.27 0.00 1.01 0.00 0.00 58.87 61.25 1und n SER 3 Cb 0.50 -1.40 0.71 0.00 -1.01 0.00 0.00 64.21 63.01 1und n SER 3 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1und h GLU 4 N 2.42 0.02 0.10 1.43 9.09 -2.01 0.29 114.58 125.93 1und h GLU 4 Ca -0.43 -0.00 -0.22 0.00 0.05 0.00 0.00 59.36 58.76 1und h GLU 4 Cb 1.31 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.40 1und h GLU 4 CO 0.62 0.02 -1.08 1.96 0.05 0.00 0.00 179.01 180.58 1und h GLN 5 N 0.02 0.21 -0.87 1.06 1.08 -2.00 -3.09 115.11 111.53 1und h GLN 5 Ca 0.41 -0.37 0.12 0.00 -1.45 0.00 0.00 58.65 57.36 1und h GLN 5 Cb 1.60 0.14 -0.07 0.00 -0.05 0.00 0.00 27.48 29.10 1und h GLN 5 CO -0.02 1.18 0.56 -0.44 -0.95 0.00 0.00 178.83 179.16 1und h ASP 6 N -0.46 0.69 0.23 1.46 5.19 -1.62 -0.17 116.42 121.74 1und h ASP 6 Ca -0.23 0.03 0.01 0.00 -0.62 0.00 0.00 57.03 56.22 1und h ASP 6 Cb 1.61 -0.11 -0.04 0.00 0.18 0.00 0.00 39.33 40.97 1und h ASP 6 CO 0.06 0.38 -0.45 0.15 -3.12 0.00 0.00 179.24 176.25 1und h PHE 7 N 0.75 -1.27 -0.38 4.55 3.04 -0.60 -1.29 116.94 121.74 1und h PHE 7 Ca 0.42 0.02 0.04 0.00 3.98 0.00 0.00 57.97 62.43 1und h PHE 7 Cb 0.58 0.53 -0.02 0.00 2.56 0.00 0.00 35.95 39.60 1und h PHE 7 CO -0.00 -0.57 0.26 0.28 -2.02 0.00 0.00 178.31 176.26 1und h VAL 8 N -0.76 1.01 -0.12 1.41 2.07 -0.99 0.43 116.25 119.29 1und h VAL 8 Ca -0.01 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 1und h VAL 8 Cb 0.74 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1und h VAL 8 CO -0.19 0.07 0.01 -1.28 0.02 0.00 0.00 177.57 176.20 1und h SER 9 N 0.37 0.20 0.53 0.57 0.87 -0.78 0.32 113.55 115.63 1und h SER 9 Ca 0.16 -0.28 -0.18 0.00 -1.23 0.00 0.00 61.79 60.25 1und h SER 9 Cb 0.17 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1und h SER 9 CO -0.04 0.43 -0.80 0.58 -0.53 0.00 0.00 176.83 176.47 1und h VAL 10 N -0.03 1.47 0.18 2.23 2.07 -0.17 -3.30 116.25 118.69 1und h VAL 10 Ca 0.04 -2.46 -0.33 0.00 0.82 0.00 0.00 66.70 64.78 1und h VAL 10 Cb 0.32 2.34 0.01 0.00 -1.52 0.00 0.00 31.29 32.45 1und h VAL 10 CO 0.00 0.72 -1.56 -0.26 0.02 0.00 0.00 177.57 176.49 1und h PHE 11 N 0.12 0.68 0.00 1.57 -1.00 -0.23 -3.48 116.94 114.60 1und h PHE 11 Ca -0.03 -0.50 0.00 0.00 2.81 0.00 0.00 57.97 60.25 1und h PHE 11 Cb 1.40 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.93 1und h PHE 11 CO 0.03 1.51 0.00 0.41 -1.61 0.00 0.00 178.31 178.65 1und n GLY 12 N 1.73 0.49 3.28 -1.45 0.00 0.10 -5.03 105.19 104.30 1und n GLY 12 Ca -0.18 -0.67 -0.13 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.00 0.01 0.85 -0.61 -4.36 -1.22 -5.05 121.20 108.82 1und s ILE 13 Ca 0.00 -0.09 -0.11 0.00 -0.26 0.00 0.00 60.65 60.20 1und s ILE 13 Cb 0.00 -0.57 0.10 0.00 1.25 0.00 0.00 42.46 43.24 1und s ILE 13 CO 0.00 -0.05 1.11 0.28 0.24 0.00 0.00 174.94 176.52 1und s THR 14 N -0.12 2.78 0.30 8.37 -1.32 -1.26 -4.49 115.64 119.91 1und s THR 14 Ca -0.03 0.25 0.04 0.00 -1.21 0.00 0.00 61.69 60.75 1und s THR 14 Cb -0.03 -2.57 0.30 0.00 -1.51 0.00 0.00 72.50 68.69 1und s THR 14 CO 0.01 -0.33 1.81 -0.09 -2.21 0.00 0.00 174.62 173.81 1und h ARG 15 N -1.48 0.83 0.44 7.08 2.43 -1.98 0.89 114.38 122.59 1und h ARG 15 Ca -0.45 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 58.65 1und h ARG 15 Cb 1.25 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1und h ARG 15 CO 0.48 0.55 -0.21 0.78 -1.51 0.00 0.00 179.97 180.06 1und h GLY 16 N 0.86 -0.62 0.85 2.80 0.00 -1.98 -0.88 103.07 104.10 1und h GLY 16 Ca 0.53 0.23 0.03 0.00 0.00 0.00 0.00 47.33 48.12 1und h GLY 16 CO -0.32 -0.23 0.31 1.46 0.00 0.00 0.00 176.54 177.76 1und h GLN 17 N -0.81 0.59 -0.18 4.80 4.20 -1.86 -2.05 115.11 119.80 1und h GLN 17 Ca -0.06 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1und h GLN 17 Cb 0.55 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1und h GLN 17 CO 0.10 0.39 0.12 0.35 -0.67 0.00 0.00 178.83 179.11 1und h PHE 18 N 0.61 0.23 0.00 2.96 3.04 -0.82 0.28 116.94 123.24 1und h PHE 18 Ca 0.21 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.17 1und h PHE 18 Cb 0.04 -0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.47 1und h PHE 18 CO -0.07 0.17 0.00 0.00 -2.02 0.00 0.00 178.31 176.39 1und h ALA 19 N 1.05 1.00 0.09 2.41 0.00 -0.95 -2.37 119.26 120.49 1und h ALA 19 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.68 1und h ALA 19 Cb -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1und h ALA 19 CO -0.01 0.00 -1.52 0.00 0.00 0.00 0.00 179.25 177.71 1und h ALA 20 N 2.01 0.34 -2.96 0.00 0.00 -0.60 -3.47 119.26 114.58 1und h ALA 20 Ca 0.00 -1.14 -0.55 0.00 0.00 0.00 0.00 54.91 53.22 1und h ALA 20 Cb 0.29 0.28 0.15 0.00 0.00 0.00 0.00 17.79 18.51 1und h ALA 20 CO 0.00 1.21 0.48 -0.51 0.00 0.00 0.00 179.25 180.43 1und s LEU 21 N -6.86 3.54 0.48 0.00 1.43 0.01 -4.94 118.68 112.34 1und s LEU 21 Ca -0.08 2.53 -0.22 0.00 -1.03 0.00 0.00 54.13 55.32 1und s LEU 21 Cb 0.07 -4.61 -0.09 0.00 0.03 0.00 0.00 46.19 41.60 1und s LEU 21 CO 0.84 -1.97 0.97 -2.65 0.23 0.00 0.00 176.35 173.77 1und n PRO 22 N -2.00 1.19 -0.23 1.29 -0.02 -1.26 -4.73 135.00 129.25 1und n PRO 22 Ca 0.15 0.43 0.22 0.00 -2.02 0.00 0.00 63.50 62.29 1und n PRO 22 Cb 0.49 -2.07 0.58 0.00 -0.02 0.00 0.00 33.50 32.48 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 1.17 0.62 0.60 -1.23 0.00 -1.92 -0.16 103.07 102.14 1und h GLY 23 Ca -0.46 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 1und h GLY 23 CO 0.54 -0.02 -0.03 0.11 0.00 0.00 0.00 176.54 177.15 1und h TRP 24 N 0.27 -0.08 -0.36 5.60 5.08 -1.99 -1.42 115.95 123.04 1und h TRP 24 Ca 0.47 -0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.41 1und h TRP 24 Cb 1.37 0.03 -0.02 0.00 -3.00 0.00 0.00 29.16 27.54 1und h TRP 24 CO -0.00 0.31 0.13 -0.22 -1.28 0.00 0.00 178.44 177.38 1und h LYS 25 N -0.48 0.51 0.71 0.12 1.63 -1.58 0.00 116.57 117.48 1und h LYS 25 Ca -0.01 -0.07 -0.04 0.00 -0.85 0.00 0.00 60.65 59.69 1und h LYS 25 Cb 0.42 -0.10 0.01 0.00 -0.60 0.00 0.00 32.23 31.96 1und h LYS 25 CO 0.01 0.44 -0.34 1.96 -3.45 0.00 0.00 179.45 178.07 1und h GLN 26 N 0.51 -0.92 -0.79 1.90 4.20 -1.01 -1.03 115.11 117.97 1und h GLN 26 Ca 0.13 0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 1und h GLN 26 Cb 0.13 0.21 -0.04 0.00 0.30 0.00 0.00 27.48 28.08 1und h GLN 26 CO -0.01 -0.60 0.35 1.37 -0.67 0.00 0.00 178.83 179.27 1und h LEU 27 N -1.03 1.06 0.16 1.46 8.10 -0.95 -1.99 115.31 122.12 1und h LEU 27 Ca -0.10 -0.14 -0.00 0.00 0.11 0.00 0.00 57.88 57.75 1und h LEU 27 Cb 0.75 -0.27 -0.00 0.00 -0.44 0.00 0.00 40.66 40.70 1und h LEU 27 CO 0.16 0.92 -0.11 -0.61 -4.11 0.00 0.00 178.44 174.69 1und h GLN 28 N 1.14 -0.26 -0.69 0.17 4.15 -0.99 -2.41 115.11 116.23 1und h GLN 28 Ca 0.27 0.02 0.09 0.00 0.77 0.00 0.00 58.65 59.79 1und h GLN 28 Cb 0.16 0.06 -0.07 0.00 0.21 0.00 0.00 27.48 27.85 1und h GLN 28 CO -0.03 -0.17 0.34 0.52 -1.93 0.00 0.00 178.83 177.56 1und h MET 29 N -0.27 0.58 -0.10 1.69 2.86 -0.83 0.73 114.93 119.58 1und h MET 29 Ca -0.01 -0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.62 1und h MET 29 Cb 0.23 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.73 1und h MET 29 CO 0.01 0.38 -0.09 0.87 1.06 0.00 0.00 176.91 179.13 1und h LYS 30 N 0.59 -0.11 -0.56 1.72 1.57 -1.17 -0.59 116.57 118.03 1und h LYS 30 Ca 0.33 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.13 1und h LYS 30 Cb 0.33 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.64 1und h LYS 30 CO -0.25 -0.07 0.37 0.87 -0.57 0.00 0.00 179.45 179.79 1und h LYS 31 N -0.11 0.73 0.18 3.15 1.57 -0.92 -2.03 116.57 119.13 1und h LYS 31 Ca 0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1und h LYS 31 Cb 0.22 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1und h LYS 31 CO -0.17 0.48 -0.09 0.93 -0.57 0.00 0.00 179.45 180.04 1und h GLU 32 N 0.75 -0.23 -0.22 3.15 5.08 -0.46 0.13 114.58 122.77 1und h GLU 32 Ca 0.21 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.65 1und h GLU 32 Cb -0.08 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1und h GLU 32 CO -0.05 0.11 0.16 0.87 -1.00 0.00 0.00 179.01 179.11 1und h LYS 33 N -0.61 0.00 0.00 2.33 6.56 -1.20 -3.18 116.57 120.47 1und h LYS 33 Ca -0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1und h LYS 33 Cb 0.45 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.11 1und h LYS 33 CO 0.04 0.00 0.00 0.41 -2.06 0.00 0.00 179.45 177.84 1und n GLY 34 N -1.57 -2.23 0.96 3.86 0.00 -0.76 -4.93 105.19 100.51 1und n GLY 34 Ca 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.92 -0.21 0.99 -0.00 0.33 -5.09 117.00 112.10 1und n LEU 35 Ca 0.00 -1.91 0.03 0.00 -0.00 0.00 0.00 56.01 54.12 1und n LEU 35 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.44 1und n LEU 35 CO 0.00 1.46 0.33 0.33 -0.00 0.00 0.00 177.39 179.51