#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kj1 h PRO 2 N 0.00 0.00 -0.03 -0.14 0.11 -2.05 -2.28 132.00 127.61 3kj1 h PRO 2 Ca 0.00 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.88 3kj1 h PRO 2 Cb 0.00 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.12 3kj1 h PRO 2 CO 0.00 0.17 -0.93 0.93 -0.21 0.00 0.00 178.00 177.95 3kj1 h GLU 3 N 0.00 0.56 -0.54 1.05 5.08 -2.05 -1.33 114.58 117.35 3kj1 h GLU 3 Ca -0.00 -0.56 -0.12 0.00 -1.00 0.00 0.00 59.36 57.68 3kj1 h GLU 3 Cb 0.30 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3kj1 h GLU 3 CO 0.02 1.18 -0.11 0.82 -1.00 0.00 0.00 179.01 179.92 3kj1 h ILE 4 N 0.33 1.27 -0.51 3.13 2.04 -1.96 -2.20 117.51 119.62 3kj1 h ILE 4 Ca -0.09 -1.27 -0.09 0.00 1.00 0.00 0.00 64.86 64.41 3kj1 h ILE 4 Cb 1.57 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 3kj1 h ILE 4 CO 0.17 0.45 -0.04 -0.25 0.00 0.00 0.00 178.15 178.48 3kj1 h TRP 5 N 0.90 1.01 -0.80 1.37 7.01 -1.38 -1.29 115.95 122.77 3kj1 h TRP 5 Ca 0.14 -0.19 -0.02 0.00 2.11 0.00 0.00 58.89 60.93 3kj1 h TRP 5 Cb 0.68 -0.26 -0.04 0.00 -2.10 0.00 0.00 29.16 27.45 3kj1 h TRP 5 CO 0.05 0.95 0.44 0.00 -2.79 0.00 0.00 178.44 177.09 3kj1 h ALA 6 N 0.92 1.02 -0.38 2.65 0.00 -1.19 -0.78 119.26 121.51 3kj1 h ALA 6 Ca 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3kj1 h ALA 6 Cb 0.57 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 3kj1 h ALA 6 CO 0.03 0.53 0.11 0.00 0.00 0.00 0.00 179.25 179.93 3kj1 h ALA 7 N 1.23 0.50 -0.81 0.00 0.00 -1.22 0.07 119.26 119.03 3kj1 h ALA 7 Ca 0.28 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3kj1 h ALA 7 Cb 0.03 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 3kj1 h ALA 7 CO -0.05 0.14 0.49 0.37 0.00 0.00 0.00 179.25 180.21 3kj1 h GLN 8 N 0.46 0.88 -0.15 0.00 4.15 -0.95 -0.04 115.11 119.47 3kj1 h GLN 8 Ca 0.12 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.45 3kj1 h GLN 8 Cb 0.27 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.75 3kj1 h GLN 8 CO -0.00 0.59 -0.05 1.49 -1.93 0.00 0.00 178.83 178.92 3kj1 h GLU 9 N 0.91 0.31 -0.44 1.69 4.57 -0.81 -1.53 114.58 119.28 3kj1 h GLU 9 Ca 0.35 -0.13 -0.09 0.00 -1.18 0.00 0.00 59.36 58.31 3kj1 h GLU 9 Cb 0.15 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 3kj1 h GLU 9 CO -0.17 0.61 -0.10 -0.07 -1.18 0.00 0.00 179.01 178.10 3kj1 h LEU 10 N -0.01 0.77 -0.50 1.64 3.38 -0.82 -1.74 115.31 118.04 3kj1 h LEU 10 Ca 0.04 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 3kj1 h LEU 10 Cb 0.50 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3kj1 h LEU 10 CO 0.02 0.90 0.13 -0.09 0.09 0.00 0.00 178.44 179.49 3kj1 h ARG 11 N 0.71 0.80 -0.14 1.13 2.43 -0.99 0.15 114.38 118.48 3kj1 h ARG 11 Ca 0.12 -0.19 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 3kj1 h ARG 11 Cb 0.59 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.99 3kj1 h ARG 11 CO 0.04 0.77 -0.09 -0.09 -1.51 0.00 0.00 179.97 179.09 3kj1 h ARG 12 N 0.69 -0.08 -0.45 0.20 2.43 -0.97 -0.48 114.38 115.71 3kj1 h ARG 12 Ca 0.16 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.20 3kj1 h ARG 12 Cb 0.32 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 3kj1 h ARG 12 CO 0.00 -0.06 -0.23 0.82 -1.51 0.00 0.00 179.97 179.00 3kj1 h ILE 13 N -0.09 1.27 -0.41 1.20 2.04 -1.21 -1.63 117.51 118.68 3kj1 h ILE 13 Ca 0.08 -1.39 0.01 0.00 1.00 0.00 0.00 64.86 64.56 3kj1 h ILE 13 Cb 0.21 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 3kj1 h ILE 13 CO -0.19 0.47 0.27 1.23 0.00 0.00 0.00 178.15 179.93 3kj1 h GLY 14 N 0.79 0.58 1.78 5.37 0.00 -0.49 -0.42 103.07 110.67 3kj1 h GLY 14 Ca 0.10 -0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 3kj1 h GLY 14 CO 0.07 0.20 -0.55 -0.55 0.00 0.00 0.00 176.54 175.71 3kj1 h ASP 15 N 0.54 0.26 -0.30 0.19 3.32 -0.99 -0.84 116.42 118.61 3kj1 h ASP 15 Ca 0.15 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3kj1 h ASP 15 Cb -0.05 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 3kj1 h ASP 15 CO -0.04 0.76 0.16 -0.08 -1.72 0.00 0.00 179.24 178.32 3kj1 h GLU 16 N 0.18 0.42 -0.34 3.56 4.81 -0.89 -0.21 114.58 122.12 3kj1 h GLU 16 Ca 0.00 -0.05 -0.12 0.00 -0.13 0.00 0.00 59.36 59.06 3kj1 h GLU 16 Cb 1.03 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3kj1 h GLU 16 CO 0.08 0.37 -0.27 0.35 -0.73 0.00 0.00 179.01 178.82 3kj1 h PHE 17 N 0.36 0.80 0.08 0.92 3.04 -0.90 -0.66 116.94 120.58 3kj1 h PHE 17 Ca 0.10 -0.19 -0.00 0.00 3.98 0.00 0.00 57.97 61.86 3kj1 h PHE 17 Cb 0.08 -0.19 0.00 0.00 2.56 0.00 0.00 35.95 38.40 3kj1 h PHE 17 CO -0.03 0.89 -0.04 -0.97 -2.02 0.00 0.00 178.31 176.15 3kj1 h ASN 18 N 0.60 -0.09 -0.85 0.41 -1.24 -1.00 -2.67 115.58 110.74 3kj1 h ASN 18 Ca 0.08 -0.08 0.06 0.00 0.71 0.00 0.00 56.30 57.07 3kj1 h ASN 18 Cb 0.77 0.02 -0.05 0.00 0.73 0.00 0.00 38.32 39.79 3kj1 h ASN 18 CO 0.06 0.02 0.56 0.00 -1.29 0.00 0.00 177.43 176.78 3kj1 h ALA 19 N 0.72 1.56 -0.27 1.57 0.00 -0.80 0.23 119.26 122.27 3kj1 h ALA 19 Ca -0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3kj1 h ALA 19 Cb 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3kj1 h ALA 19 CO 0.02 0.31 0.07 -0.92 0.00 0.00 0.00 179.25 178.73 3kj1 h TYR 20 N 0.96 0.13 0.00 0.00 3.20 -0.88 -2.89 116.97 117.49 3kj1 h TYR 20 Ca 0.37 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.25 3kj1 h TYR 20 Cb 0.20 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.46 3kj1 h TYR 20 CO -0.00 0.05 -0.58 1.88 -1.64 0.00 0.00 178.16 177.87 3kj1 h TYR 21 N 0.18 0.00 0.00 -3.82 -1.99 -1.10 -3.51 116.97 106.73 3kj1 h TYR 21 Ca 0.12 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.85 3kj1 h TYR 21 Cb 0.11 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.84 3kj1 h TYR 21 CO -0.15 0.00 0.00 -2.13 -0.00 0.00 0.00 178.16 175.88