#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dtc h ALA 2 N 0.00 0.82 -0.85 3.04 0.00 -2.05 0.17 119.26 120.40 1dtc h ALA 2 Ca 0.00 0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1dtc h ALA 2 Cb 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 1dtc h ALA 2 CO 0.00 -0.22 0.53 1.96 0.00 0.00 0.00 179.25 181.52 1dtc h GLN 3 N 0.39 0.95 -0.33 0.00 4.20 -2.05 0.19 115.11 118.47 1dtc h GLN 3 Ca 0.33 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.86 1dtc h GLN 3 Cb 0.44 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1dtc h GLN 3 CO -0.34 0.63 -0.28 -0.44 -0.67 0.00 0.00 178.83 177.73 1dtc h ASP 4 N 0.98 0.81 -0.31 1.46 3.32 -1.51 0.17 116.42 121.34 1dtc h ASP 4 Ca 0.36 -0.45 0.01 0.00 0.02 0.00 0.00 57.03 56.96 1dtc h ASP 4 Cb 0.12 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1dtc h ASP 4 CO -0.16 1.09 0.19 0.40 -1.72 0.00 0.00 179.24 179.05 1dtc h ILE 5 N 0.54 1.06 -0.38 0.35 2.04 -0.52 0.14 117.51 120.74 1dtc h ILE 5 Ca 0.06 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1dtc h ILE 5 Cb 0.85 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 1dtc h ILE 5 CO 0.07 0.07 0.13 0.40 0.00 0.00 0.00 178.15 178.83 1dtc h ILE 6 N 0.39 1.20 -0.35 -0.67 2.04 -0.55 0.15 117.51 119.72 1dtc h ILE 6 Ca 0.12 -0.65 0.03 0.00 1.00 0.00 0.00 64.86 65.36 1dtc h ILE 6 Cb -0.02 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1dtc h ILE 6 CO -0.04 0.23 0.16 0.28 0.00 0.00 0.00 178.15 178.77 1dtc h SER 7 N 0.46 0.21 0.04 1.72 0.02 -0.52 0.23 113.55 115.71 1dtc h SER 7 Ca 0.12 0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1dtc h SER 7 Cb 0.22 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1dtc h SER 7 CO -0.01 0.16 -0.02 0.74 -1.14 0.00 0.00 176.83 176.56 1dtc h THR 8 N 0.33 0.97 -0.94 -2.27 2.02 -0.54 0.13 112.91 112.61 1dtc h THR 8 Ca 0.15 -0.02 0.10 0.00 0.77 0.00 0.00 66.41 67.41 1dtc h THR 8 Cb 0.09 0.98 -0.08 0.00 -1.74 0.00 0.00 68.15 67.41 1dtc h THR 8 CO -0.13 0.01 0.58 0.40 0.37 0.00 0.00 175.52 176.75 1dtc h ILE 9 N -0.06 0.96 -0.28 3.11 2.04 -0.44 0.13 117.51 122.96 1dtc h ILE 9 Ca -0.01 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.56 1dtc h ILE 9 Cb 0.05 -0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.00 1dtc h ILE 9 CO 0.01 0.18 0.05 1.23 0.00 0.00 0.00 178.15 179.61 1dtc h GLY 10 N 0.97 0.31 0.88 5.37 0.00 0.02 0.23 103.07 110.85 1dtc h GLY 10 Ca 0.44 -0.01 0.03 0.00 0.00 0.00 0.00 47.33 47.79 1dtc h GLY 10 CO -0.23 -0.02 0.39 -0.55 0.00 0.00 0.00 176.54 176.13 1dtc h ASP 11 N 0.15 0.64 -0.20 0.19 3.32 0.41 0.24 116.42 121.17 1dtc h ASP 11 Ca 0.13 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.22 1dtc h ASP 11 Cb 0.14 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1dtc h ASP 11 CO -0.18 0.45 -0.01 -0.07 -1.72 0.00 0.00 179.24 177.71 1dtc h LEU 12 N 0.77 -0.11 -0.87 1.55 3.38 -0.51 -2.62 115.31 116.91 1dtc h LEU 12 Ca 0.25 0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.41 1dtc h LEU 12 Cb 0.02 0.09 -0.09 0.00 0.09 0.00 0.00 40.66 40.77 1dtc h LEU 12 CO -0.10 -0.03 0.48 0.58 0.09 0.00 0.00 178.44 179.46 1dtc h VAL 13 N 0.05 0.80 -0.45 1.22 2.07 0.27 0.18 116.25 120.39 1dtc h VAL 13 Ca 0.10 -0.25 0.08 0.00 0.82 0.00 0.00 66.70 67.45 1dtc h VAL 13 Cb 0.13 0.01 -0.07 0.00 -1.52 0.00 0.00 31.29 29.84 1dtc h VAL 13 CO -0.17 0.13 0.01 0.11 0.02 0.00 0.00 177.57 177.67 1dtc h LYS 14 N 0.72 0.12 -0.26 1.57 1.57 -0.20 0.21 116.57 120.31 1dtc h LYS 14 Ca 0.46 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 59.13 1dtc h LYS 14 Cb 0.57 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1dtc h LYS 14 CO -0.32 0.08 -0.23 -1.49 -0.57 0.00 0.00 179.45 176.92 1dtc h TRP 15 N 0.12 0.72 -0.57 -1.35 -0.00 -0.79 0.83 115.95 114.91 1dtc h TRP 15 Ca 0.22 -0.21 0.09 0.00 -0.00 0.00 0.00 58.89 58.99 1dtc h TRP 15 Cb 0.32 -0.15 -0.07 0.00 -0.00 0.00 0.00 29.16 29.25 1dtc h TRP 15 CO -0.28 0.92 0.19 0.82 -0.00 0.00 0.00 178.44 180.09 1dtc h ILE 16 N 0.32 0.76 -0.15 1.49 2.04 -0.55 0.18 117.51 121.60 1dtc h ILE 16 Ca 0.04 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 1dtc h ILE 16 Cb 0.78 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 1dtc h ILE 16 CO 0.06 0.07 -0.02 0.40 0.00 0.00 0.00 178.15 178.65 1dtc h ILE 17 N 0.36 1.28 0.19 -0.67 2.04 -0.34 0.45 117.51 120.82 1dtc h ILE 17 Ca 0.29 -0.93 0.01 0.00 1.00 0.00 0.00 64.86 65.23 1dtc h ILE 17 Cb 0.36 1.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.99 1dtc h ILE 17 CO -0.31 0.28 -0.41 0.44 0.00 0.00 0.00 178.15 178.14 1dtc h ASP 18 N 0.00 -1.20 -0.89 1.72 3.32 -0.69 0.32 116.42 119.01 1dtc h ASP 18 Ca 0.04 0.13 0.08 0.00 0.02 0.00 0.00 57.03 57.29 1dtc h ASP 18 Cb 0.43 0.44 -0.07 0.00 0.22 0.00 0.00 39.33 40.35 1dtc h ASP 18 CO 0.01 -0.50 0.55 0.74 -1.72 0.00 0.00 179.24 178.31 1dtc h THR 19 N -0.70 1.00 0.30 0.35 2.02 -0.61 0.93 112.91 116.21 1dtc h THR 19 Ca 0.01 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 1dtc h THR 19 Cb 0.69 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 1dtc h THR 19 CO -0.20 0.18 -0.15 0.58 0.37 0.00 0.00 175.52 176.30 1dtc h VAL 20 N 0.96 0.73 -0.34 3.16 2.07 0.13 0.23 116.25 123.19 1dtc h VAL 20 Ca 0.40 -0.32 -0.04 0.00 0.82 0.00 0.00 66.70 67.56 1dtc h VAL 20 Cb 0.26 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1dtc h VAL 20 CO -0.20 0.07 0.02 0.78 0.02 0.00 0.00 177.57 178.26 1dtc h ASN 21 N -0.58 0.47 0.00 0.57 4.21 0.06 0.35 115.58 120.66 1dtc h ASN 21 Ca -0.04 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.39 1dtc h ASN 21 Cb 0.42 -0.12 0.00 0.00 -1.12 0.00 0.00 38.32 37.50 1dtc h ASN 21 CO 0.07 0.53 0.00 0.29 -1.29 0.00 0.00 177.43 177.02 1dtc n LYS 22 N -4.30 0.00 -3.01 0.81 5.02 0.28 -4.50 118.16 112.46 1dtc n LYS 22 Ca 0.02 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.86 1dtc n LYS 22 Cb 0.22 -0.74 -0.03 0.00 -0.02 0.00 0.00 35.03 34.46 1dtc n LYS 22 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1dtc s PHE 23 N -0.50 3.11 -1.32 2.13 0.08 0.79 -4.93 117.98 117.34 1dtc s PHE 23 Ca 0.00 -1.26 -0.16 0.00 0.12 0.00 0.00 56.93 55.63 1dtc s PHE 23 Cb 0.00 -4.17 0.02 0.00 -0.57 0.00 0.00 43.02 38.30 1dtc s PHE 23 CO 0.00 -1.41 2.05 2.41 -0.10 0.00 0.00 175.22 178.17 1dtc n THR 24 N 5.36 3.31 -2.43 0.64 -1.04 0.12 -3.93 114.28 116.32 1dtc n THR 24 Ca 0.11 -3.09 -0.05 0.00 -2.04 0.00 0.00 64.05 58.98 1dtc n THR 24 Cb 0.47 -2.48 0.01 0.00 -1.82 0.00 0.00 70.33 66.50 1dtc n THR 24 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1dtc n LYS 25 N 6.94 -1.71 -0.54 -2.82 5.02 -1.26 -5.08 118.16 118.71 1dtc n LYS 25 Ca 0.51 1.66 0.00 0.00 -2.02 0.00 0.00 58.31 58.46 1dtc n LYS 25 Cb 0.41 -4.37 0.00 0.00 -0.02 0.00 0.00 35.03 31.05 1dtc n LYS 25 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51