#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sqk n LEU 11 N 0.00 0.72 0.21 0.64 7.94 -1.26 -4.05 117.00 121.19 1sqk n LEU 11 Ca 0.00 -0.16 0.06 0.00 -1.11 0.00 0.00 56.01 54.81 1sqk n LEU 11 Cb 0.00 -0.18 0.43 0.00 0.53 0.00 0.00 43.42 44.21 1sqk n LEU 11 CO 0.00 0.17 0.76 1.55 -1.11 0.00 0.00 177.39 178.76 1sqk h PRO 12 N 0.24 0.00 -0.23 1.96 0.13 -2.04 -1.98 132.00 130.08 1sqk h PRO 12 Ca 0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 1sqk h PRO 12 Cb 0.51 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 1sqk h PRO 12 CO 0.00 0.31 -0.28 0.87 -0.23 0.00 0.00 178.00 178.68 1sqk h LYS 13 N 0.00 0.45 0.70 0.86 1.57 -1.98 0.73 116.57 118.90 1sqk h LYS 13 Ca -0.00 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.56 1sqk h LYS 13 Cb 0.69 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.99 1sqk h LYS 13 CO 0.04 0.69 -0.34 0.28 -0.57 0.00 0.00 179.45 179.56 1sqk h VAL 14 N 0.40 0.16 -0.36 0.50 2.07 -1.59 -0.04 116.25 117.38 1sqk h VAL 14 Ca 0.06 -0.24 0.08 0.00 0.82 0.00 0.00 66.70 67.42 1sqk h VAL 14 Cb 0.70 0.21 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 1sqk h VAL 14 CO 0.05 0.02 -0.15 0.00 0.02 0.00 0.00 177.57 177.51 1sqk h ALA 15 N -1.00 0.15 -0.39 1.67 0.00 -1.19 0.20 119.26 118.70 1sqk h ALA 15 Ca -0.10 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.03 1sqk h ALA 15 Cb 0.75 0.37 -0.09 0.00 0.00 0.00 0.00 17.79 18.82 1sqk h ALA 15 CO 0.16 -0.52 -0.28 1.49 0.00 0.00 0.00 179.25 180.10 1sqk h GLU 16 N -0.08 -0.21 -0.21 0.00 4.81 0.56 0.29 114.58 119.75 1sqk h GLU 16 Ca 0.18 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.37 1sqk h GLU 16 Cb 0.35 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1sqk h GLU 16 CO -0.42 -0.14 -0.14 -0.97 -0.73 0.00 0.00 179.01 176.61 1sqk h ASN 17 N -0.22 0.33 -0.49 1.04 -1.24 -0.20 -2.45 115.58 112.35 1sqk h ASN 17 Ca 0.18 -0.08 -0.05 0.00 0.71 0.00 0.00 56.30 57.06 1sqk h ASN 17 Cb 0.51 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.45 1sqk h ASN 17 CO -0.51 0.50 0.09 0.25 -1.29 0.00 0.00 177.43 176.46 1sqk h LEU 18 N 0.32 0.76 -1.52 0.34 6.46 0.15 -1.06 115.31 120.77 1sqk h LEU 18 Ca 0.06 -0.25 0.02 0.00 -0.12 0.00 0.00 57.88 57.59 1sqk h LEU 18 Cb 0.44 -0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.14 1sqk h LEU 18 CO 0.03 0.82 0.34 0.11 -0.62 0.00 0.00 178.44 179.12 1sqk h LYS 19 N 0.67 0.63 -0.28 1.25 1.57 -0.09 -1.29 116.57 119.04 1sqk h LYS 19 Ca 0.15 -0.04 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 1sqk h LYS 19 Cb 0.37 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1sqk h LYS 19 CO 0.01 0.42 -0.27 0.77 -0.57 0.00 0.00 179.45 179.80 1sqk h SER 20 N 0.65 0.73 0.37 0.86 0.02 -1.07 -2.55 113.55 112.56 1sqk h SER 20 Ca 0.20 -0.47 -0.02 0.00 -0.84 0.00 0.00 61.79 60.66 1sqk h SER 20 Cb -0.00 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 62.33 1sqk h SER 20 CO -0.05 1.04 -0.10 1.56 -1.14 0.00 0.00 176.83 178.14 1sqk h GLN 21 N 0.42 0.00 0.13 3.45 7.50 -0.19 -2.25 115.11 124.17 1sqk h GLN 21 Ca 0.05 0.00 -0.30 0.00 0.50 0.00 0.00 58.65 58.90 1sqk h GLN 21 Cb 0.84 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.37 1sqk h GLN 21 CO 0.07 0.10 -1.44 -0.07 -1.50 0.00 0.00 178.83 176.00 1sqk h LEU 22 N 0.00 0.43 -0.50 1.46 3.38 -1.11 -2.99 115.31 115.98 1sqk h LEU 22 Ca -0.00 -0.54 -0.08 0.00 0.09 0.00 0.00 57.88 57.35 1sqk h LEU 22 Cb 0.32 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1sqk h LEU 22 CO 0.01 1.44 -0.38 -0.33 0.09 0.00 0.00 178.44 179.27 1sqk h GLU 23 N 0.08 0.00 -0.40 1.13 5.08 -1.18 -3.22 114.58 116.06 1sqk h GLU 23 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 1sqk h GLU 23 Cb 2.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.26 1sqk h GLU 23 CO 0.18 0.38 0.00 0.41 -1.00 0.00 0.00 179.01 178.98 1sqk n GLY 24 N 0.72 2.20 3.67 -3.84 0.00 -0.87 -4.99 105.19 102.08 1sqk n GLY 24 Ca 0.01 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 1sqk n GLY 24 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1sqk s PHE 25 N -1.05 2.62 -0.66 1.61 5.36 -1.13 -4.96 117.98 119.77 1sqk s PHE 25 Ca 0.30 0.73 -0.25 0.00 -0.96 0.00 0.00 56.93 56.75 1sqk s PHE 25 Cb 0.16 -3.66 0.05 0.00 -0.34 0.00 0.00 43.02 39.22 1sqk s PHE 25 CO 0.22 -2.51 1.09 1.21 -1.46 0.00 0.00 175.22 173.76 1sqk s ASN 26 N 2.30 6.23 0.61 6.13 2.47 -1.26 -4.89 114.94 126.54 1sqk s ASN 26 Ca 0.63 -0.56 0.24 0.00 0.42 0.00 0.00 52.86 53.59 1sqk s ASN 26 Cb -0.28 -2.48 1.02 0.00 -1.45 0.00 0.00 41.25 38.06 1sqk s ASN 26 CO 0.23 -1.54 1.48 -0.61 -3.72 0.00 0.00 177.10 172.94 1sqk h GLN 27 N 9.67 0.00 0.00 0.43 4.15 -1.99 -3.35 115.11 124.02 1sqk h GLN 27 Ca -0.28 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.14 1sqk h GLN 27 Cb 1.06 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1sqk h GLN 27 CO 1.20 0.00 0.00 -3.47 -1.93 0.00 0.00 178.83 174.63 1sqk n ASP 28 N -3.25 0.00 -0.17 -0.69 -0.08 -1.26 -3.89 116.55 107.22 1sqk n ASP 28 Ca 0.14 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.41 1sqk n ASP 28 Cb 1.14 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 44.60 1sqk n ASP 28 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 1sqk n LYS 29 N 0.00 -1.88 -3.76 -0.67 2.85 -1.26 -4.81 118.16 108.63 1sqk n LYS 29 Ca 0.00 0.18 -0.37 0.00 -1.05 0.00 0.00 58.31 57.07 1sqk n LYS 29 Cb 0.00 -3.42 -0.13 0.00 -0.65 0.00 0.00 35.03 30.83 1sqk n LYS 29 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 1sqk s LEU 30 N -0.40 3.82 0.07 -5.58 2.96 -1.25 -5.05 118.68 113.25 1sqk s LEU 30 Ca 0.00 -0.69 -0.37 0.00 -0.22 0.00 0.00 54.13 52.85 1sqk s LEU 30 Cb 0.00 -1.88 -0.17 0.00 0.50 0.00 0.00 46.19 44.64 1sqk s LEU 30 CO 0.00 -0.18 1.24 0.29 -1.32 0.00 0.00 176.35 176.38 1sqk n LYS 31 N 4.87 0.84 -2.04 1.98 5.02 -1.26 -4.81 118.16 122.74 1sqk n LYS 31 Ca -0.15 0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 56.04 1sqk n LYS 31 Cb 0.48 -1.88 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 1sqk n LYS 31 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1sqk s ASN 32 N 0.29 5.61 0.33 4.39 3.84 -1.26 -4.96 114.94 123.18 1sqk s ASN 32 Ca 0.85 0.80 -0.28 0.00 0.21 0.00 0.00 52.86 54.43 1sqk s ASN 32 Cb -1.03 -2.53 -0.10 0.00 -0.55 0.00 0.00 41.25 37.05 1sqk s ASN 32 CO 0.50 -2.02 1.21 0.00 -2.79 0.00 0.00 177.10 174.00 1sqk s ALA 33 N 7.88 3.39 0.00 1.71 0.00 -1.26 -5.29 121.76 128.19 1sqk s ALA 33 Ca 0.72 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.77 1sqk s ALA 33 Cb -0.17 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1sqk s ALA 33 CO 0.27 -0.46 0.00 -1.13 0.00 0.00 0.00 175.76 174.44