#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ie6 n ASP 2 N 0.00 -1.55 -4.61 1.61 5.75 -1.26 -5.14 116.55 111.35 1ie6 n ASP 2 Ca 0.00 -3.16 -0.30 0.00 -0.01 0.00 0.00 54.79 51.32 1ie6 n ASP 2 Cb 0.00 1.17 0.19 0.00 -1.03 0.00 0.00 41.12 41.45 1ie6 n ASP 2 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ie6 s LEU 4 N -6.75 3.29 1.03 0.00 1.43 0.74 -4.59 118.68 113.83 1ie6 s LEU 4 Ca 0.66 0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 54.36 1ie6 s LEU 4 Cb -0.22 -3.56 0.21 0.00 0.03 0.00 0.00 46.19 42.64 1ie6 s LEU 4 CO 0.60 -1.00 1.07 -2.16 0.23 0.00 0.00 176.35 175.09 1ie6 s PRO 5 N -4.95 0.15 -0.19 1.29 0.04 -1.26 0.32 135.00 130.39 1ie6 s PRO 5 Ca 0.53 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.37 1ie6 s PRO 5 Cb -0.10 -1.68 0.18 0.00 0.04 0.00 0.00 34.50 32.93 1ie6 s PRO 5 CO 0.45 -2.99 1.73 1.58 0.04 0.00 0.00 177.00 177.80 1ie6 n HIS 6 N -4.40 1.05 -1.85 0.56 -0.00 -1.26 -3.62 115.22 105.69 1ie6 n HIS 6 Ca 0.05 -1.38 -0.01 0.00 0.46 0.00 0.00 57.72 56.84 1ie6 n HIS 6 Cb 0.55 -0.68 -0.01 0.00 -0.12 0.00 0.00 29.99 29.73 1ie6 n HIS 6 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 1ie6 n LEU 7 N 0.40 -0.11 -4.45 0.27 4.77 -1.13 -4.30 117.00 112.45 1ie6 n LEU 7 Ca 0.20 -0.95 -0.23 0.00 -0.03 0.00 0.00 56.01 55.01 1ie6 n LEU 7 Cb 0.69 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.68 1ie6 n LEU 7 CO 0.24 0.98 -0.44 -0.75 -1.33 0.00 0.00 177.39 176.08 1ie6 s LYS 8 N 0.00 1.60 0.37 3.23 2.20 -1.24 -4.64 119.74 121.26 1ie6 s LYS 8 Ca 0.00 -1.75 -0.27 0.00 -0.36 0.00 0.00 55.97 53.58 1ie6 s LYS 8 Cb 0.00 -1.53 -0.11 0.00 -1.51 0.00 0.00 37.83 34.67 1ie6 s LYS 8 CO 0.00 0.23 1.34 0.54 -0.36 0.00 0.00 175.35 177.10 1ie6 n ARG 9 N -0.58 2.22 -5.10 4.03 5.12 -1.26 0.39 116.66 121.48 1ie6 n ARG 9 Ca -0.06 0.78 -0.29 0.00 -1.93 0.00 0.00 57.85 56.36 1ie6 n ARG 9 Cb 0.61 -2.43 -0.16 0.00 -1.16 0.00 0.00 32.46 29.32 1ie6 n ARG 9 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ie6 n LYS 11 N 2.67 0.13 -3.75 0.00 4.81 -1.26 -4.22 118.16 116.54 1ie6 n LYS 11 Ca -0.16 0.08 -0.09 0.00 -0.87 0.00 0.00 58.31 57.27 1ie6 n LYS 11 Cb 0.52 -1.63 -0.03 0.00 0.02 0.00 0.00 35.03 33.92 1ie6 n LYS 11 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ie6 s ALA 12 N -3.06 -1.12 0.28 3.14 0.00 -1.26 -4.98 121.76 114.75 1ie6 s ALA 12 Ca 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 51.96 51.86 1ie6 s ALA 12 Cb 0.16 0.88 0.39 0.00 0.00 0.00 0.00 23.12 24.55 1ie6 s ALA 12 CO 0.61 -0.90 1.90 -0.44 0.00 0.00 0.00 175.76 176.94 1ie6 h ASP 13 N 2.08 0.92 -0.18 0.00 3.32 -1.91 -1.64 116.42 119.02 1ie6 h ASP 13 Ca -0.25 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1ie6 h ASP 13 Cb 1.27 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.58 1ie6 h ASP 13 CO 0.31 0.75 0.00 -0.46 -1.72 0.00 0.00 179.24 178.12 1ie6 n ASN 14 N -4.35 1.44 0.13 6.45 0.23 -1.26 -3.52 115.26 114.38 1ie6 n ASN 14 Ca 0.07 -1.75 -0.02 0.00 -0.53 0.00 0.00 54.58 52.36 1ie6 n ASN 14 Cb 0.10 -0.12 0.16 0.00 -2.08 0.00 0.00 39.78 37.85 1ie6 n ASN 14 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 1ie6 h ASP 15 N 1.82 0.02 -4.37 0.53 3.58 -1.68 -3.45 116.42 112.86 1ie6 h ASP 15 Ca 0.00 -0.01 -0.51 0.00 0.42 0.00 0.00 57.03 56.93 1ie6 h ASP 15 Cb 0.40 -0.01 0.07 0.00 1.72 0.00 0.00 39.33 41.52 1ie6 h ASP 15 CO 0.00 0.64 0.41 0.00 -2.88 0.00 0.00 179.24 177.41 1ie6 n GLY 18 N 1.25 0.41 2.44 0.00 0.00 -1.26 -4.93 105.19 103.10 1ie6 n GLY 18 Ca 0.13 -0.62 -0.19 0.00 0.00 0.00 0.00 46.02 45.34 1ie6 n GLY 18 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ie6 n LYS 19 N 0.60 -1.53 -3.23 1.61 5.02 -1.06 -4.87 118.16 114.69 1ie6 n LYS 19 Ca 0.11 1.06 -0.25 0.00 -2.02 0.00 0.00 58.31 57.21 1ie6 n LYS 19 Cb 0.49 -5.50 -0.08 0.00 -0.02 0.00 0.00 35.03 29.93 1ie6 n LYS 19 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1ie6 n LYS 20 N -2.46 0.69 -2.15 1.97 2.85 -1.23 -4.73 118.16 113.10 1ie6 n LYS 20 Ca -0.20 -3.27 -0.32 0.00 -1.05 0.00 0.00 58.31 53.47 1ie6 n LYS 20 Cb 0.63 -1.33 -0.01 0.00 -0.65 0.00 0.00 35.03 33.68 1ie6 n LYS 20 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ie6 s LYS 22 N -4.45 0.61 1.00 0.00 2.20 0.05 -3.91 119.74 115.25 1ie6 s LYS 22 Ca 0.58 0.05 -0.17 0.00 -0.36 0.00 0.00 55.97 56.07 1ie6 s LYS 22 Cb -0.11 -0.86 0.23 0.00 -1.51 0.00 0.00 37.83 35.58 1ie6 s LYS 22 CO 0.40 -0.22 1.32 -2.13 -0.36 0.00 0.00 175.35 174.35 1ie6 n ARG 23 N 4.72 -1.46 -1.05 4.03 0.63 -1.26 -2.10 116.66 120.17 1ie6 n ARG 23 Ca -0.14 -2.04 -0.25 0.00 -0.92 0.00 0.00 57.85 54.50 1ie6 n ARG 23 Cb 0.50 -1.40 -0.07 0.00 0.45 0.00 0.00 32.46 31.94 1ie6 n ARG 23 CO 0.00 0.00 0.00 2.89 -2.51 0.00 0.00 177.63 178.01 1ie6 n ARG 24 N -3.91 2.68 0.00 -0.14 1.85 -1.26 -4.59 116.66 111.29 1ie6 n ARG 24 Ca 0.17 -1.56 0.00 0.00 -1.00 0.00 0.00 57.85 55.45 1ie6 n ARG 24 Cb 0.58 -2.41 0.00 0.00 -1.05 0.00 0.00 32.46 29.58 1ie6 n ARG 24 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ie6 n GLY 25 N 3.21 4.24 3.14 2.89 0.00 -1.26 -5.07 105.19 112.35 1ie6 n GLY 25 Ca 0.57 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1ie6 n GLY 25 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ie6 n THR 26 N -0.13 -1.70 -0.13 2.61 5.66 -1.26 -4.60 114.28 114.72 1ie6 n THR 26 Ca 0.00 0.35 -0.04 0.00 -3.05 0.00 0.00 64.05 61.31 1ie6 n THR 26 Cb 0.00 -2.84 -0.00 0.00 -1.55 0.00 0.00 70.33 65.94 1ie6 n THR 26 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1ie6 n ASN 27 N 1.65 -0.13 0.00 1.09 2.04 -1.26 -4.40 115.26 114.25 1ie6 n ASN 27 Ca 0.00 0.10 0.00 0.00 -0.44 0.00 0.00 54.58 54.24 1ie6 n ASN 27 Cb 0.35 -0.09 0.00 0.00 -2.53 0.00 0.00 39.78 37.52 1ie6 n ASN 27 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ie6 n ALA 28 N -0.01 0.00 -2.65 -2.53 0.00 -1.25 -4.58 120.51 109.48 1ie6 n ALA 28 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 1ie6 n ALA 28 Cb 0.02 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.53 1ie6 n ALA 28 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ie6 n GLU 29 N -1.37 0.02 0.00 0.00 2.13 -1.26 -4.35 120.64 115.81 1ie6 n GLU 29 Ca 0.00 -0.53 0.00 0.00 0.66 0.00 0.00 57.16 57.29 1ie6 n GLU 29 Cb 0.00 -0.01 0.00 0.00 0.27 0.00 0.00 31.44 31.70 1ie6 n GLU 29 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1ie6 n LYS 30 N 0.09 0.00 -4.24 5.31 4.76 -1.15 -4.72 118.16 118.21 1ie6 n LYS 30 Ca -0.17 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 54.99 1ie6 n LYS 30 Cb 0.71 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.81 1ie6 n LYS 30 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1ie6 s ARG 31 N 0.49 2.20 -0.08 1.97 3.52 -0.89 0.32 118.95 126.49 1ie6 s ARG 31 Ca 0.00 -1.13 -0.29 0.00 -0.13 0.00 0.00 55.73 54.18 1ie6 s ARG 31 Cb 0.00 -2.28 -0.06 0.00 -1.56 0.00 0.00 34.95 31.05 1ie6 s ARG 31 CO 0.00 0.47 1.80 0.00 -0.81 0.00 0.00 175.30 176.76