#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ie6 s ASP 2 N 0.00 3.61 0.16 1.61 2.15 -1.26 -5.12 116.67 117.82 1ie6 s ASP 2 Ca 0.00 -1.36 -0.25 0.00 0.43 0.00 0.00 52.55 51.37 1ie6 s ASP 2 Cb 0.00 -0.43 0.06 0.00 -0.30 0.00 0.00 42.92 42.25 1ie6 s ASP 2 CO 0.00 -0.43 0.94 0.00 -0.17 0.00 0.00 175.17 175.50 1ie6 s LEU 4 N -2.93 3.51 0.91 0.00 1.43 0.96 -4.63 118.68 117.94 1ie6 s LEU 4 Ca 0.12 0.56 -0.11 0.00 -1.03 0.00 0.00 54.13 53.67 1ie6 s LEU 4 Cb -0.02 -3.43 0.14 0.00 0.03 0.00 0.00 46.19 42.91 1ie6 s LEU 4 CO 0.02 -0.79 1.11 -2.16 0.23 0.00 0.00 176.35 174.76 1ie6 s PRO 5 N -4.73 1.13 -0.21 1.29 0.04 -1.26 0.26 135.00 131.51 1ie6 s PRO 5 Ca 0.50 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.80 1ie6 s PRO 5 Cb -0.10 -1.76 0.20 0.00 0.04 0.00 0.00 34.50 32.87 1ie6 s PRO 5 CO 0.42 -2.46 1.74 1.58 0.04 0.00 0.00 177.00 178.31 1ie6 n HIS 6 N -4.09 1.15 -1.92 0.56 -0.00 -1.26 -3.65 115.22 106.01 1ie6 n HIS 6 Ca 0.09 -1.44 0.00 0.00 -0.00 0.00 0.00 57.72 56.37 1ie6 n HIS 6 Cb 0.53 -0.71 0.00 0.00 -0.00 0.00 0.00 29.99 29.81 1ie6 n HIS 6 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1ie6 n LEU 7 N 0.33 0.00 -4.32 0.27 4.77 -1.20 -4.30 117.00 112.56 1ie6 n LEU 7 Ca 0.22 -0.76 -0.30 0.00 -0.03 0.00 0.00 56.01 55.14 1ie6 n LEU 7 Cb 0.71 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.65 1ie6 n LEU 7 CO 0.26 0.79 -0.56 -0.75 -1.33 0.00 0.00 177.39 175.80 1ie6 s LYS 8 N 0.00 1.84 0.07 3.23 2.20 -1.24 -4.76 119.74 121.08 1ie6 s LYS 8 Ca 0.00 -1.02 -0.37 0.00 -0.36 0.00 0.00 55.97 54.22 1ie6 s LYS 8 Cb 0.00 -1.93 -0.18 0.00 -1.51 0.00 0.00 37.83 34.21 1ie6 s LYS 8 CO 0.00 0.51 1.12 -2.13 -0.36 0.00 0.00 175.35 174.49 1ie6 n ARG 9 N 2.01 0.53 -3.41 4.03 0.00 -1.26 -2.45 116.66 116.12 1ie6 n ARG 9 Ca -0.17 0.19 -0.20 0.00 -0.00 0.00 0.00 57.85 57.68 1ie6 n ARG 9 Cb 0.52 -1.69 -0.02 0.00 0.00 0.00 0.00 32.46 31.27 1ie6 n ARG 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ie6 n LYS 11 N -1.63 0.69 -3.61 0.00 5.02 -1.26 -4.43 118.16 112.94 1ie6 n LYS 11 Ca 0.04 -0.14 -0.10 0.00 -2.02 0.00 0.00 58.31 56.08 1ie6 n LYS 11 Cb 0.61 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 34.10 1ie6 n LYS 11 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ie6 s ALA 12 N -3.19 -1.19 0.19 7.82 0.00 -1.26 -4.81 121.76 119.31 1ie6 s ALA 12 Ca -0.08 0.07 -0.14 0.00 0.00 0.00 0.00 51.96 51.81 1ie6 s ALA 12 Cb 0.11 0.83 0.19 0.00 0.00 0.00 0.00 23.12 24.25 1ie6 s ALA 12 CO 0.83 -0.77 1.66 -0.44 0.00 0.00 0.00 175.76 177.04 1ie6 h ASP 13 N 2.15 -0.39 -1.10 0.00 3.32 -1.93 -2.09 116.42 116.38 1ie6 h ASP 13 Ca -0.31 0.15 -0.58 0.00 0.02 0.00 0.00 57.03 56.31 1ie6 h ASP 13 Cb 1.28 0.29 -0.16 0.00 0.22 0.00 0.00 39.33 40.96 1ie6 h ASP 13 CO 0.39 -0.14 1.04 0.59 -1.72 0.00 0.00 179.24 179.39 1ie6 n ASN 14 N -5.33 6.98 -0.00 6.45 5.03 -1.26 -3.50 115.26 123.62 1ie6 n ASN 14 Ca 0.06 -3.19 -0.00 0.00 0.87 0.00 0.00 54.58 52.32 1ie6 n ASN 14 Cb 0.29 -1.27 -0.00 0.00 -1.02 0.00 0.00 39.78 37.77 1ie6 n ASN 14 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1ie6 n ASP 15 N 1.15 4.95 -4.63 6.41 2.03 -0.79 -4.96 116.55 120.71 1ie6 n ASP 15 Ca 0.53 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.55 1ie6 n ASP 15 Cb 0.45 0.61 0.13 0.00 -0.72 0.00 0.00 41.12 41.59 1ie6 n ASP 15 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ie6 n GLY 18 N 1.28 -0.79 2.65 0.00 0.00 -1.26 -4.93 105.19 102.14 1ie6 n GLY 18 Ca 0.06 -0.58 -0.15 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.16 -1.58 -3.48 1.61 5.02 -0.98 -4.87 118.16 112.72 1ie6 n LYS 19 Ca 0.05 1.03 -0.28 0.00 -2.02 0.00 0.00 58.31 57.10 1ie6 n LYS 19 Cb 0.36 -5.42 -0.11 0.00 -0.02 0.00 0.00 35.03 29.85 1ie6 n LYS 19 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ie6 s LYS 20 N -3.29 1.04 0.89 1.97 1.02 -1.23 -4.43 119.74 115.71 1ie6 s LYS 20 Ca 0.00 -2.11 -0.15 0.00 0.02 0.00 0.00 55.97 53.73 1ie6 s LYS 20 Cb 0.00 -1.67 0.21 0.00 -0.52 0.00 0.00 37.83 35.85 1ie6 s LYS 20 CO 0.00 -1.34 1.16 0.00 -0.92 0.00 0.00 175.35 174.25 1ie6 s LYS 22 N -5.53 0.18 0.07 0.00 2.47 0.73 -4.55 119.74 113.11 1ie6 s LYS 22 Ca 0.66 0.31 0.03 0.00 -1.56 0.00 0.00 55.97 55.41 1ie6 s LYS 22 Cb -0.02 -0.96 -0.04 0.00 -1.46 0.00 0.00 37.83 35.35 1ie6 s LYS 22 CO 0.47 -0.59 0.08 0.50 0.16 0.00 0.00 175.35 175.97 1ie6 s ARG 23 N 2.35 2.90 -0.52 4.03 3.52 -1.26 -2.75 118.95 127.21 1ie6 s ARG 23 Ca 0.06 -0.67 -0.07 0.00 -0.13 0.00 0.00 55.73 54.92 1ie6 s ARG 23 Cb -0.15 -2.74 -0.20 0.00 -1.56 0.00 0.00 34.95 30.30 1ie6 s ARG 23 CO -0.11 0.57 3.30 -2.13 -0.81 0.00 0.00 175.30 176.12 1ie6 n ARG 24 N 0.50 2.47 0.00 5.12 3.00 -1.26 -3.64 116.66 122.85 1ie6 n ARG 24 Ca -0.09 -1.35 0.00 0.00 -0.00 0.00 0.00 57.85 56.41 1ie6 n ARG 24 Cb 0.52 -2.24 0.00 0.00 0.00 0.00 0.00 32.46 30.73 1ie6 n ARG 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ie6 n GLY 25 N 2.88 -1.03 3.81 5.14 0.00 -1.26 -4.94 105.19 109.79 1ie6 n GLY 25 Ca 0.53 0.89 -0.30 0.00 0.00 0.00 0.00 46.02 47.15 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 0.00 0.00 -1.16 2.61 5.66 -1.26 -4.36 114.28 115.77 1ie6 n THR 26 Ca 0.00 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.12 1ie6 n THR 26 Cb 0.00 -0.35 -0.06 0.00 -1.55 0.00 0.00 70.33 68.37 1ie6 n THR 26 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1ie6 n ASN 27 N -1.98 -5.59 0.00 1.09 5.03 -1.24 -4.98 115.26 107.60 1ie6 n ASN 27 Ca 0.08 0.91 0.00 0.00 0.87 0.00 0.00 54.58 56.44 1ie6 n ASN 27 Cb 0.42 -3.85 0.00 0.00 -1.02 0.00 0.00 39.78 35.33 1ie6 n ASN 27 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ie6 n ALA 28 N -3.59 0.00 -2.70 5.41 0.00 -1.26 -4.80 120.51 113.57 1ie6 n ALA 28 Ca -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.35 1ie6 n ALA 28 Cb 0.53 0.00 0.03 0.00 0.00 0.00 0.00 19.45 20.01 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 0.00 0.24 0.00 0.00 0.00 -1.26 -3.59 120.64 116.03 1ie6 n GLU 29 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 57.16 56.04 1ie6 n GLU 29 Cb 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 31.44 31.06 1ie6 n GLU 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1ie6 n LYS 30 N 2.47 0.00 -3.90 5.31 4.01 -1.25 -4.78 118.16 120.02 1ie6 n LYS 30 Ca 0.12 0.00 -0.11 0.00 -0.51 0.00 0.00 58.31 57.81 1ie6 n LYS 30 Cb 0.64 0.00 -0.11 0.00 -0.51 0.00 0.00 35.03 35.05 1ie6 n LYS 30 CO 0.00 0.00 0.00 1.03 -1.11 0.00 0.00 177.40 177.32 1ie6 s ARG 31 N 0.00 0.35 0.05 1.97 0.52 -1.11 -2.18 118.95 118.55 1ie6 s ARG 31 Ca 0.00 -0.37 -0.30 0.00 -0.52 0.00 0.00 55.73 54.54 1ie6 s ARG 31 Cb 0.00 0.14 -0.08 0.00 0.52 0.00 0.00 34.95 35.53 1ie6 s ARG 31 CO 0.00 -0.07 1.75 0.00 0.02 0.00 0.00 175.30 177.00