#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r2v h LYS 4 N 0.00 0.32 -0.65 1.96 1.63 -2.05 -1.14 116.57 116.64 2r2v h LYS 4 Ca 0.00 -0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.69 2r2v h LYS 4 Cb 0.00 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 2r2v h LYS 4 CO 0.00 0.25 0.07 0.37 -3.45 0.00 0.00 179.45 176.69 2r2v h GLN 5 N 0.32 1.09 0.35 1.90 4.15 -2.05 0.19 115.11 121.07 2r2v h GLN 5 Ca 0.08 -0.31 -0.02 0.00 0.77 0.00 0.00 58.65 59.18 2r2v h GLN 5 Cb 0.04 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.61 2r2v h GLN 5 CO -0.01 1.02 -0.17 0.28 -1.93 0.00 0.00 178.83 178.02 2r2v h VAL 6 N 1.01 0.67 -0.72 2.39 2.07 -1.82 -1.58 116.25 118.27 2r2v h VAL 6 Ca 0.19 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.69 2r2v h VAL 6 Cb 0.48 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 2r2v h VAL 6 CO 0.02 0.02 0.42 0.00 0.02 0.00 0.00 177.57 178.05 2r2v h ALA 7 N 0.13 0.98 -0.86 1.67 0.00 -1.12 0.63 119.26 120.70 2r2v h ALA 7 Ca -0.05 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2r2v h ALA 7 Cb 0.39 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2r2v h ALA 7 CO 0.08 0.13 0.52 -0.44 0.00 0.00 0.00 179.25 179.54 2r2v h ASP 8 N 0.78 1.02 -0.22 0.00 3.32 -0.91 -0.40 116.42 120.02 2r2v h ASP 8 Ca 0.32 -0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.22 2r2v h ASP 8 Cb 0.16 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 2r2v h ASP 8 CO -0.17 0.78 -0.22 0.50 -1.72 0.00 0.00 179.24 178.41 2r2v h LYS 9 N 1.18 0.54 -0.92 3.56 3.64 -0.33 -2.19 116.57 122.04 2r2v h LYS 9 Ca 0.31 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2r2v h LYS 9 Cb -0.06 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.73 2r2v h LYS 9 CO -0.06 0.87 0.59 -0.07 -2.27 0.00 0.00 179.45 178.51 2r2v h LEU 10 N 0.23 1.08 -1.22 5.20 4.07 -0.66 -1.04 115.31 122.96 2r2v h LEU 10 Ca 0.03 -0.05 -0.07 0.00 0.08 0.00 0.00 57.88 57.88 2r2v h LEU 10 Cb 0.77 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 42.23 2r2v h LEU 10 CO 0.06 0.81 -0.23 -0.33 -1.08 0.00 0.00 178.44 177.66 2r2v h GLU 11 N 1.26 0.25 -0.45 1.13 4.39 -1.06 -0.96 114.58 119.14 2r2v h GLU 11 Ca 0.34 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 59.83 2r2v h GLU 11 Cb -0.11 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.51 2r2v h GLU 11 CO -0.07 0.47 -0.23 1.49 -1.16 0.00 0.00 179.01 179.51 2r2v h GLU 12 N 0.23 0.96 -0.29 2.33 4.81 -0.67 -1.34 114.58 120.60 2r2v h GLU 12 Ca 0.04 -0.42 -0.08 0.00 -0.13 0.00 0.00 59.36 58.77 2r2v h GLU 12 Cb 0.53 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 2r2v h GLU 12 CO 0.04 1.09 -0.12 0.28 -0.73 0.00 0.00 179.01 179.56 2r2v h VAL 13 N 0.80 1.29 -0.66 0.32 2.07 -1.08 -2.29 116.25 116.70 2r2v h VAL 13 Ca 0.10 -1.20 0.10 0.00 0.82 0.00 0.00 66.70 66.52 2r2v h VAL 13 Cb 0.81 1.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.97 2r2v h VAL 13 CO 0.07 0.38 0.27 0.00 0.02 0.00 0.00 177.57 178.31 2r2v h ALA 14 N 0.76 0.88 -0.84 1.67 0.00 -1.09 -0.22 119.26 120.41 2r2v h ALA 14 Ca 0.07 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2r2v h ALA 14 Cb 0.63 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.42 2r2v h ALA 14 CO 0.04 -0.16 0.41 0.77 0.00 0.00 0.00 179.25 180.31 2r2v h SER 15 N 0.46 1.10 -0.60 0.00 0.02 -1.08 -0.56 113.55 112.88 2r2v h SER 15 Ca 0.34 -0.13 -0.07 0.00 -0.84 0.00 0.00 61.79 61.09 2r2v h SER 15 Cb 0.42 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 2r2v h SER 15 CO -0.32 0.92 0.13 0.11 -1.14 0.00 0.00 176.83 176.54 2r2v h LYS 16 N 1.20 1.00 -0.49 3.45 1.57 -0.77 -1.87 116.57 120.65 2r2v h LYS 16 Ca 0.29 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2r2v h LYS 16 Cb 0.11 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2r2v h LYS 16 CO -0.04 0.90 0.14 -0.07 -0.57 0.00 0.00 179.45 179.81 2r2v h LEU 17 N 0.95 0.73 -0.32 2.94 3.38 -0.46 -0.18 115.31 122.34 2r2v h LEU 17 Ca 0.20 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.96 2r2v h LEU 17 Cb 0.37 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2r2v h LEU 17 CO 0.00 0.75 0.19 1.88 0.09 0.00 0.00 178.44 181.35 2r2v h TYR 18 N 0.67 0.35 -0.38 1.13 0.99 -0.92 0.17 116.97 118.98 2r2v h TYR 18 Ca 0.16 0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.92 2r2v h TYR 18 Cb 0.29 -0.11 -0.03 0.00 1.00 0.00 0.00 36.73 37.88 2r2v h TYR 18 CO 0.02 0.21 0.20 1.25 -0.00 0.00 0.00 178.16 179.84 2r2v h HIS 19 N 0.39 0.36 -0.65 4.88 2.76 -1.14 -0.57 115.15 121.18 2r2v h HIS 19 Ca 0.12 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.28 2r2v h HIS 19 Cb -0.01 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 28.81 2r2v h HIS 19 CO -0.07 0.20 0.32 -0.91 -1.30 0.00 0.00 177.93 176.16 2r2v h ASN 20 N 0.40 0.85 -0.66 3.26 -0.26 -0.82 -1.62 115.58 116.73 2r2v h ASN 20 Ca 0.16 -0.13 0.04 0.00 -0.56 0.00 0.00 56.30 55.81 2r2v h ASN 20 Cb 0.06 -0.22 -0.05 0.00 -1.06 0.00 0.00 38.32 37.05 2r2v h ASN 20 CO -0.10 0.74 0.39 0.00 -1.06 0.00 0.00 177.43 177.39 2r2v h ALA 21 N 1.14 0.87 -0.62 -0.83 0.00 -0.63 -1.59 119.26 117.61 2r2v h ALA 21 Ca 0.22 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2r2v h ALA 21 Cb 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2r2v h ALA 21 CO -0.03 0.11 0.03 -0.91 0.00 0.00 0.00 179.25 178.45 2r2v h ASN 22 N 0.75 1.04 -0.23 0.00 2.35 -0.78 -0.62 115.58 118.09 2r2v h ASN 22 Ca 0.28 -0.29 0.03 0.00 -0.55 0.00 0.00 56.30 55.76 2r2v h ASN 22 Cb 0.09 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.16 2r2v h ASN 22 CO -0.14 1.08 0.07 -0.33 -1.65 0.00 0.00 177.43 176.46 2r2v h GLU 23 N 0.97 0.17 -0.78 0.81 5.08 -1.09 -1.91 114.58 117.82 2r2v h GLU 23 Ca 0.18 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 2r2v h GLU 23 Cb 0.53 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 2r2v h GLU 23 CO 0.03 0.11 0.33 -0.07 -1.00 0.00 0.00 179.01 178.41 2r2v h LEU 24 N 0.17 1.05 -1.14 1.33 3.38 -1.02 -0.66 115.31 118.41 2r2v h LEU 24 Ca 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2r2v h LEU 24 Cb 0.08 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2r2v h LEU 24 CO -0.11 0.91 0.39 0.00 0.09 0.00 0.00 178.44 179.72 2r2v h ALA 25 N 1.24 1.35 -0.10 1.53 0.00 -0.79 0.29 119.26 122.77 2r2v h ALA 25 Ca 0.26 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.85 2r2v h ALA 25 Cb 0.18 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.69 2r2v h ALA 25 CO -0.03 0.53 -0.80 0.00 0.00 0.00 0.00 179.25 178.96 2r2v h ARG 26 N 0.99 0.64 -0.52 0.00 3.08 -1.04 -2.40 114.38 115.13 2r2v h ARG 26 Ca 0.25 -0.55 -0.09 0.00 0.07 0.00 0.00 59.98 59.67 2r2v h ARG 26 Cb 0.03 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2r2v h ARG 26 CO -0.04 1.16 -0.01 0.28 -1.07 0.00 0.00 179.97 180.29 2r2v h VAL 27 N 0.42 1.26 -0.66 2.04 2.07 -0.84 -0.68 116.25 119.88 2r2v h VAL 27 Ca -0.06 -1.11 0.07 0.00 0.82 0.00 0.00 66.70 66.42 2r2v h VAL 27 Cb 1.42 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 32.07 2r2v h VAL 27 CO 0.15 0.39 0.35 0.00 0.02 0.00 0.00 177.57 178.49 2r2v h ALA 28 N 0.94 0.88 -0.62 1.67 0.00 -0.95 0.02 119.26 121.20 2r2v h ALA 28 Ca 0.15 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2r2v h ALA 28 Cb 0.54 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2r2v h ALA 28 CO 0.03 -0.00 0.34 -0.22 0.00 0.00 0.00 179.25 179.40 2r2v h LYS 29 N 0.63 0.87 -0.93 0.00 1.63 -1.11 0.16 116.57 117.82 2r2v h LYS 29 Ca 0.30 -0.10 0.03 0.00 -0.85 0.00 0.00 60.65 60.03 2r2v h LYS 29 Cb 0.23 -0.17 -0.05 0.00 -0.60 0.00 0.00 32.23 31.64 2r2v h LYS 29 CO -0.20 0.66 0.61 1.25 -3.45 0.00 0.00 179.45 178.32 2r2v h LEU 30 N 0.85 1.01 0.00 5.20 5.85 -0.22 -2.59 115.31 125.41 2r2v h LEU 30 Ca 0.22 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2r2v h LEU 30 Cb 0.05 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.85 2r2v h LEU 30 CO -0.03 0.70 -0.30 -0.07 -0.34 0.00 0.00 178.44 178.39 2r2v h LEU 31 N 1.18 0.00 -0.15 2.25 3.38 -0.77 -3.34 115.31 117.86 2r2v h LEU 31 Ca 0.37 -0.04 -0.20 0.00 0.09 0.00 0.00 57.88 58.10 2r2v h LEU 31 Cb -0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 2r2v h LEU 31 CO -0.11 0.02 -0.94 1.23 0.09 0.00 0.00 178.44 178.72 2r2v h GLY 32 N 4.22 0.05 0.00 0.83 0.00 -0.56 -3.51 103.07 104.11 2r2v h GLY 32 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.22 2r2v h GLY 32 CO 0.00 0.10 0.00 -1.84 0.00 0.00 0.00 176.54 174.80