#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2khf n ALA 2 N 0.00 0.00 0.25 4.61 0.00 -1.26 -4.96 120.51 119.16 2khf n ALA 2 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 2khf n ALA 2 Cb 0.00 0.00 0.63 0.00 0.00 0.00 0.00 19.45 20.08 2khf n ALA 2 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2khf h TRP 3 N 0.00 0.00 -0.54 0.00 5.08 -2.05 -2.11 115.95 116.34 2khf h TRP 3 Ca 0.00 0.00 -0.05 0.00 1.08 0.00 0.00 58.89 59.92 2khf h TRP 3 Cb 0.00 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.14 2khf h TRP 3 CO 0.00 0.05 0.15 1.57 -1.28 0.00 0.00 178.44 178.93 2khf h LYS 4 N 0.00 0.85 -0.25 0.12 5.09 -1.98 0.21 116.57 120.61 2khf h LYS 4 Ca -0.00 -0.20 -0.14 0.00 0.09 0.00 0.00 60.65 60.41 2khf h LYS 4 Cb 0.10 -0.12 -0.01 0.00 0.10 0.00 0.00 32.23 32.30 2khf h LYS 4 CO 0.01 0.79 -0.41 -0.91 -2.09 0.00 0.00 179.45 176.84 2khf h ASN 5 N 0.75 0.62 0.05 7.07 2.35 -1.79 -1.54 115.58 123.09 2khf h ASN 5 Ca 0.17 -0.28 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2khf h ASN 5 Cb 0.31 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.51 2khf h ASN 5 CO -0.00 0.96 -0.02 0.15 -1.65 0.00 0.00 177.43 176.87 2khf h PHE 6 N 0.48 -0.06 0.66 1.19 3.57 -1.21 -2.48 116.94 119.09 2khf h PHE 6 Ca 0.04 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 2khf h PHE 6 Cb 0.92 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.67 2khf h PHE 6 CO 0.04 0.50 -0.37 -1.49 -2.23 0.00 0.00 178.31 174.76 2khf h TRP 7 N -0.66 -0.97 -0.96 0.41 4.06 -0.61 -2.57 115.95 114.64 2khf h TRP 7 Ca -0.01 -0.01 0.19 0.00 2.06 0.00 0.00 58.89 61.12 2khf h TRP 7 Cb 0.58 0.34 -0.09 0.00 -1.00 0.00 0.00 29.16 28.99 2khf h TRP 7 CO 0.12 -0.57 0.61 1.03 -3.56 0.00 0.00 178.44 176.07 2khf h SER 8 N -0.96 0.65 -0.85 -3.49 0.87 -1.40 0.17 113.55 108.54 2khf h SER 8 Ca -0.08 0.07 0.07 0.00 -1.23 0.00 0.00 61.79 60.62 2khf h SER 8 Cb 0.76 -0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 62.61 2khf h SER 8 CO 0.11 0.26 0.55 -1.28 -0.53 0.00 0.00 176.83 175.94 2khf h SER 9 N 0.65 0.81 0.61 6.23 0.87 -1.04 -2.01 113.55 119.66 2khf h SER 9 Ca 0.53 0.01 -0.28 0.00 -1.23 0.00 0.00 61.79 60.82 2khf h SER 9 Cb 0.96 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 2khf h SER 9 CO -0.28 0.51 -1.39 -0.07 -0.53 0.00 0.00 176.83 175.07 2khf h LEU 10 N 0.91 0.27 -0.79 2.23 3.38 -0.54 -3.33 115.31 117.44 2khf h LEU 10 Ca 0.37 -0.35 0.14 0.00 0.09 0.00 0.00 57.88 58.14 2khf h LEU 10 Cb 0.28 -0.09 -0.09 0.00 0.09 0.00 0.00 40.66 40.85 2khf h LEU 10 CO -0.14 1.29 0.36 0.03 0.09 0.00 0.00 178.44 180.06 2khf h ARG 11 N 0.05 0.50 0.00 1.13 2.47 -0.22 0.27 114.38 118.57 2khf h ARG 11 Ca -0.18 -0.03 -0.06 0.00 -1.26 0.00 0.00 59.98 58.45 2khf h ARG 11 Cb 1.96 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 30.15 2khf h ARG 11 CO 0.15 0.33 -0.31 0.87 0.56 0.00 0.00 179.97 181.58 2khf h LYS 12 N 0.52 0.00 0.01 0.04 1.57 -1.59 -0.98 116.57 116.15 2khf h LYS 12 Ca 0.44 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 59.00 2khf h LYS 12 Cb 0.64 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.93 2khf h LYS 12 CO -0.38 0.31 -0.99 0.78 -0.57 0.00 0.00 179.45 178.59 2khf h GLY 13 N 0.95 0.04 1.48 3.86 0.00 -0.71 -2.92 103.07 105.77 2khf h GLY 13 Ca -0.00 -0.10 -0.29 0.00 0.00 0.00 0.00 47.33 46.94 2khf h GLY 13 CO 0.04 0.09 -1.26 0.74 0.00 0.00 0.00 176.54 176.14 2khf h PHE 14 N 0.01 0.69 0.00 5.60 -1.00 -0.53 -3.24 116.94 118.48 2khf h PHE 14 Ca -0.02 -0.48 -0.07 0.00 2.81 0.00 0.00 57.97 60.20 2khf h PHE 14 Cb 1.73 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 41.24 2khf h PHE 14 CO 0.01 1.36 -0.35 1.88 -1.61 0.00 0.00 178.31 179.60 2khf h TYR 15 N 0.14 0.00 0.00 -0.55 0.05 -1.27 -0.33 116.97 115.00 2khf h TYR 15 Ca -0.16 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.61 2khf h TYR 15 Cb 1.96 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 39.70 2khf h TYR 15 CO 0.09 0.35 -0.02 -0.44 -1.05 0.00 0.00 178.16 177.08 2khf h ASP 16 N 0.00 0.00 0.00 3.88 5.19 -1.55 -3.45 116.42 120.49 2khf h ASP 16 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2khf h ASP 16 Cb 0.81 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.32 2khf h ASP 16 CO 0.05 0.02 0.00 0.61 -3.12 0.00 0.00 179.24 176.80 2khf n GLY 17 N -1.27 0.66 0.33 2.75 0.00 -1.06 -4.99 105.19 101.60 2khf n GLY 17 Ca -0.03 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.15 2khf n GLY 17 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2khf h GLU 18 N 0.00 0.00 -0.13 1.61 5.08 -1.57 0.25 114.58 119.81 2khf h GLU 18 Ca 0.00 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2khf h GLU 18 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2khf h GLU 18 CO 0.00 0.00 0.19 0.00 -1.00 0.00 0.00 179.01 178.20 2khf h ALA 19 N 1.82 1.63 0.00 3.43 0.00 -1.30 -0.60 119.26 124.24 2khf h ALA 19 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2khf h ALA 19 Cb 0.45 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2khf h ALA 19 CO -0.00 -0.26 -0.88 0.41 0.00 0.00 0.00 179.25 178.53 2khf n GLY 20 N -1.33 0.00 0.21 0.00 0.00 -0.12 -4.69 105.19 99.25 2khf n GLY 20 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 2khf n GLY 20 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2khf h ARG 21 N 0.00 0.00 0.00 1.61 2.43 -0.52 -3.02 114.38 114.89 2khf h ARG 21 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2khf h ARG 21 Cb 0.73 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 2khf h ARG 21 CO 0.00 0.23 0.00 0.00 -1.51 0.00 0.00 179.97 178.69 2khf h ALA 22 N 1.77 1.00 -0.02 2.80 0.00 -1.32 0.12 119.26 123.60 2khf h ALA 22 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2khf h ALA 22 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2khf h ALA 22 CO 0.03 0.00 -0.12 -0.89 0.00 0.00 0.00 179.25 178.27 2khf n ILE 23 N -2.76 0.00 -2.06 0.00 -0.00 -1.14 -4.94 119.36 108.47 2khf n ILE 23 Ca -0.02 -0.38 -0.16 0.00 -0.00 0.00 0.00 62.75 62.19 2khf n ILE 23 Cb 0.09 1.20 -0.03 0.00 -0.00 0.00 0.00 39.64 40.89 2khf n ILE 23 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2khf n ARG 24 N 0.70 -1.75 0.00 0.38 3.00 0.40 -5.17 116.66 114.23 2khf n ARG 24 Ca 0.14 0.84 0.08 0.00 -0.01 0.00 0.00 57.85 58.91 2khf n ARG 24 Cb 0.51 -5.35 0.50 0.00 0.00 0.00 0.00 32.46 28.12 2khf n ARG 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17