#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 -0.75 0.53 2.98 2.34 -1.26 -5.11 118.68 117.41 1und s LEU 2 Ca 0.00 1.16 -0.20 0.00 0.06 0.00 0.00 54.13 55.16 1und s LEU 2 Cb 0.00 2.04 -0.09 0.00 -0.56 0.00 0.00 46.19 47.58 1und s LEU 2 CO 0.00 -0.18 0.68 -1.20 -1.06 0.00 0.00 176.35 174.59 1und n SER 3 N 4.25 -0.34 0.21 1.48 7.64 -1.26 -4.47 113.62 121.12 1und n SER 3 Ca -0.18 0.82 0.14 0.00 1.01 0.00 0.00 58.87 60.66 1und n SER 3 Cb 0.57 -1.23 0.74 0.00 -1.01 0.00 0.00 64.21 63.28 1und n SER 3 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1und h GLU 4 N 0.55 0.00 0.00 1.43 4.39 -2.02 0.29 114.58 119.23 1und h GLU 4 Ca -0.45 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 1und h GLU 4 Cb 1.38 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 30.03 1und h GLU 4 CO 0.50 0.00 -0.06 1.96 -1.16 0.00 0.00 179.01 180.25 1und h GLN 5 N 0.00 0.00 -0.36 2.33 7.50 -2.01 -3.16 115.11 119.42 1und h GLN 5 Ca 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 58.65 59.15 1und h GLN 5 Cb 0.02 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 27.53 1und h GLN 5 CO 0.00 0.94 0.21 -0.44 -1.50 0.00 0.00 178.83 178.04 1und h ASP 6 N -1.00 0.43 -0.13 1.46 5.19 -1.42 -1.73 116.42 119.21 1und h ASP 6 Ca -0.01 -0.02 0.05 0.00 -0.62 0.00 0.00 57.03 56.42 1und h ASP 6 Cb 0.95 -0.11 -0.05 0.00 0.18 0.00 0.00 39.33 40.30 1und h ASP 6 CO -0.01 0.33 -0.21 0.15 -3.12 0.00 0.00 179.24 176.38 1und h PHE 7 N 0.49 -0.56 -0.49 4.55 3.04 -0.65 -1.92 116.94 121.39 1und h PHE 7 Ca 0.13 0.03 0.08 0.00 3.98 0.00 0.00 57.97 62.19 1und h PHE 7 Cb -0.01 0.27 -0.03 0.00 2.56 0.00 0.00 35.95 38.74 1und h PHE 7 CO 0.00 -0.29 0.33 0.28 -2.02 0.00 0.00 178.31 176.61 1und h VAL 8 N -0.27 0.93 0.00 1.41 2.07 -1.27 0.41 116.25 119.52 1und h VAL 8 Ca 0.10 -0.12 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 1und h VAL 8 Cb 0.42 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1und h VAL 8 CO -0.29 0.06 -0.18 -1.28 0.02 0.00 0.00 177.57 175.91 1und h SER 9 N 0.34 0.00 0.00 0.57 0.87 -1.25 -1.48 113.55 112.60 1und h SER 9 Ca 0.22 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.50 1und h SER 9 Cb 0.43 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.34 1und h SER 9 CO -0.05 0.18 -2.04 0.52 -0.53 0.00 0.00 176.83 174.90 1und n VAL 10 N -3.48 1.05 0.06 2.23 0.31 0.09 -4.60 118.33 113.98 1und n VAL 10 Ca -0.01 -0.58 -0.21 0.00 -0.01 0.00 0.00 64.34 63.53 1und n VAL 10 Cb 0.34 -0.75 -0.15 0.00 -0.91 0.00 0.00 33.84 32.38 1und n VAL 10 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1und h PHE 11 N 0.00 0.61 0.00 3.52 -1.00 -0.36 -3.49 116.94 116.23 1und h PHE 11 Ca -0.41 -0.45 0.00 0.00 2.81 0.00 0.00 57.97 59.92 1und h PHE 11 Cb 1.86 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 41.39 1und h PHE 11 CO 0.01 1.62 0.00 0.41 -1.61 0.00 0.00 178.31 178.73 1und n GLY 12 N 1.84 0.53 2.98 -1.45 0.00 -0.56 -5.03 105.19 103.50 1und n GLY 12 Ca -0.24 -0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 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 0.02 0.78 -0.61 -4.36 -1.26 -5.08 121.20 108.69 1und s ILE 13 Ca 0.00 -0.17 -0.12 0.00 -0.26 0.00 0.00 60.65 60.10 1und s ILE 13 Cb 0.00 -0.18 0.07 0.00 1.25 0.00 0.00 42.46 43.60 1und s ILE 13 CO 0.00 -0.09 1.13 0.28 0.24 0.00 0.00 174.94 176.50 1und s THR 14 N -0.27 2.79 0.29 8.37 -1.32 -1.26 -4.57 115.64 119.68 1und s THR 14 Ca -0.03 0.30 0.04 0.00 -1.21 0.00 0.00 61.69 60.79 1und s THR 14 Cb -0.02 -2.69 0.29 0.00 -1.51 0.00 0.00 72.50 68.57 1und s THR 14 CO 0.00 -0.29 1.80 -0.09 -2.21 0.00 0.00 174.62 173.83 1und h ARG 15 N -0.94 0.83 0.44 7.08 2.43 -1.98 0.13 114.38 122.37 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 1.26 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1und h ARG 15 CO 0.49 0.55 -0.21 0.78 -1.51 0.00 0.00 179.97 180.07 1und h GLY 16 N 0.86 -0.62 1.30 2.80 0.00 -1.99 -1.47 103.07 103.96 1und h GLY 16 Ca 0.54 0.23 -0.09 0.00 0.00 0.00 0.00 47.33 48.01 1und h GLY 16 CO -0.33 -0.22 -0.08 -1.61 0.00 0.00 0.00 176.54 174.29 1und h GLN 17 N -0.75 0.83 -0.10 4.80 4.15 -1.84 -2.34 115.11 119.85 1und h GLN 17 Ca -0.06 -0.27 0.00 0.00 0.77 0.00 0.00 58.65 59.09 1und h GLN 17 Cb 0.53 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 1und h GLN 17 CO 0.10 0.88 0.07 0.35 -1.93 0.00 0.00 178.83 178.30 1und h PHE 18 N 0.76 0.13 0.00 3.99 3.57 -0.77 0.25 116.94 124.87 1und h PHE 18 Ca 0.13 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1und h PHE 18 Cb 0.57 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.27 1und h PHE 18 CO 0.03 0.10 0.00 0.00 -2.23 0.00 0.00 178.31 176.21 1und h ALA 19 N 1.02 1.00 0.09 2.41 0.00 -1.05 -2.30 119.26 120.42 1und h ALA 19 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.65 1und h ALA 19 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1und h ALA 19 CO -0.01 0.00 -1.57 0.00 0.00 0.00 0.00 179.25 177.68 1und h ALA 20 N 2.02 0.39 -2.84 0.00 0.00 -0.81 -3.47 119.26 114.54 1und h ALA 20 Ca 0.00 -1.19 -0.54 0.00 0.00 0.00 0.00 54.91 53.18 1und h ALA 20 Cb 0.24 0.32 0.16 0.00 0.00 0.00 0.00 17.79 18.52 1und h ALA 20 CO 0.00 1.25 0.43 -0.51 0.00 0.00 0.00 179.25 180.42 1und s LEU 21 N -6.81 3.40 0.45 0.00 1.43 0.00 -4.94 118.68 112.22 1und s LEU 21 Ca -0.09 2.47 -0.23 0.00 -1.03 0.00 0.00 54.13 55.25 1und s LEU 21 Cb 0.07 -4.60 -0.10 0.00 0.03 0.00 0.00 46.19 41.59 1und s LEU 21 CO 0.84 -2.21 0.91 -2.65 0.23 0.00 0.00 176.35 173.46 1und n PRO 22 N -2.46 1.13 -0.18 1.29 -0.02 -1.26 -4.71 135.00 128.79 1und n PRO 22 Ca 0.14 0.41 0.20 0.00 -2.02 0.00 0.00 63.50 62.23 1und n PRO 22 Cb 0.49 -1.95 0.57 0.00 -0.02 0.00 0.00 33.50 32.59 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 1.24 0.57 0.63 -1.23 0.00 -1.93 0.36 103.07 102.71 1und h GLY 23 Ca -0.44 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 46.74 1und h GLY 23 CO 0.55 0.02 -0.03 0.11 0.00 0.00 0.00 176.54 177.19 1und h TRP 24 N 0.29 0.12 -0.26 5.60 5.08 -1.99 -1.61 115.95 123.18 1und h TRP 24 Ca 0.40 -0.03 -0.02 0.00 1.08 0.00 0.00 58.89 60.32 1und h TRP 24 Cb 1.13 -0.03 -0.01 0.00 -3.00 0.00 0.00 29.16 27.25 1und h TRP 24 CO -0.00 0.50 0.06 -0.22 -1.28 0.00 0.00 178.44 177.51 1und h LYS 25 N -0.30 0.37 0.69 0.12 1.63 -1.50 0.12 116.57 117.71 1und h LYS 25 Ca 0.01 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.73 1und h LYS 25 Cb 0.47 -0.07 0.01 0.00 -0.60 0.00 0.00 32.23 32.04 1und h LYS 25 CO 0.01 0.35 -0.33 1.96 -3.45 0.00 0.00 179.45 177.99 1und h GLN 26 N 0.37 -0.90 -0.68 1.90 4.20 -0.91 -1.55 115.11 117.54 1und h GLN 26 Ca 0.09 0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.81 1und h GLN 26 Cb 0.15 0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.10 1und h GLN 26 CO -0.00 -0.57 0.22 1.37 -0.67 0.00 0.00 178.83 179.17 1und h LEU 27 N -1.05 0.98 0.01 1.46 8.10 -1.00 -1.55 115.31 122.25 1und h LEU 27 Ca -0.10 -0.17 0.03 0.00 0.11 0.00 0.00 57.88 57.75 1und h LEU 27 Cb 0.74 -0.25 -0.05 0.00 -0.44 0.00 0.00 40.66 40.65 1und h LEU 27 CO 0.16 0.91 -0.41 -0.61 -4.11 0.00 0.00 178.44 174.37 1und h GLN 28 N 1.01 -0.55 -0.32 0.17 5.75 -0.77 -1.37 115.11 119.03 1und h GLN 28 Ca 0.22 0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.77 1und h GLN 28 Cb 0.28 0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.93 1und h GLN 28 CO -0.01 -0.37 0.19 0.52 -2.65 0.00 0.00 178.83 176.52 1und h MET 29 N -0.57 0.38 -0.28 1.69 2.86 -0.94 0.28 114.93 118.35 1und h MET 29 Ca 0.05 -0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.72 1und h MET 29 Cb 0.65 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.17 1und h MET 29 CO -0.31 0.25 -0.08 0.87 1.06 0.00 0.00 176.91 178.70 1und h LYS 30 N 0.39 -0.02 0.44 1.72 1.57 -1.02 -0.33 116.57 119.32 1und h LYS 30 Ca 0.13 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.89 1und h LYS 30 Cb -0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1und h LYS 30 CO -0.06 -0.01 -0.21 0.87 -0.57 0.00 0.00 179.45 179.47 1und h LYS 31 N -0.02 -0.57 -0.28 3.15 1.57 -1.08 -3.01 116.57 116.34 1und h LYS 31 Ca 0.14 0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1und h LYS 31 Cb 0.22 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1und h LYS 31 CO -0.30 -0.36 0.17 0.93 -0.57 0.00 0.00 179.45 179.32 1und h GLU 32 N -0.62 0.37 0.00 3.15 4.39 -0.55 0.19 114.58 121.51 1und h GLU 32 Ca -0.06 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 1und h GLU 32 Cb 0.47 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.04 1und h GLU 32 CO 0.10 0.28 -0.03 0.87 -1.16 0.00 0.00 179.01 179.07 1und h LYS 33 N 0.35 0.00 0.00 2.33 6.56 -1.18 -3.26 116.57 121.38 1und h LYS 33 Ca 0.10 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.69 1und h LYS 33 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1und h LYS 33 CO -0.02 0.03 0.00 0.41 -2.06 0.00 0.00 179.45 177.81 1und n GLY 34 N -1.45 -0.79 0.77 3.86 0.00 -0.16 -4.94 105.19 102.48 1und n GLY 34 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.01 -0.39 0.00 0.99 -0.00 0.40 -5.10 117.00 112.88 1und n LEU 35 Ca 0.00 -1.49 0.00 0.00 -0.00 0.00 0.00 56.01 54.52 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 1.16 0.00 0.33 -0.00 0.00 0.00 177.39 178.88