#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ugl n LEU 2 N 0.00 0.00 -3.49 -4.53 4.77 -1.26 -4.89 117.00 107.60 1ugl n LEU 2 Ca 0.00 -0.14 -0.19 0.00 -0.03 0.00 0.00 56.01 55.65 1ugl n LEU 2 Cb 0.00 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 40.96 1ugl n LEU 2 CO 0.00 0.23 -0.21 -0.32 -1.33 0.00 0.00 177.39 175.76 1ugl s MET 3 N 0.00 0.19 0.00 3.23 1.75 -1.26 -5.14 119.30 118.07 1ugl s MET 3 Ca 0.00 0.16 0.00 0.00 -1.25 0.00 0.00 55.69 54.60 1ugl s MET 3 Cb 0.00 -1.22 0.00 0.00 2.84 0.00 0.00 34.83 36.45 1ugl s MET 3 CO 0.00 -0.68 0.00 1.63 -0.65 0.00 0.00 175.02 175.32 1ugl n LYS 4 N 5.32 3.40 -3.04 4.11 4.01 -1.26 -4.93 118.16 125.77 1ugl n LYS 4 Ca -0.05 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 57.59 1ugl n LYS 4 Cb 0.49 0.00 -0.03 0.00 -0.51 0.00 0.00 35.03 34.98 1ugl n LYS 4 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1ugl n ARG 5 N 0.00 0.47 -1.31 1.97 3.00 -1.26 -5.03 116.66 114.50 1ugl n ARG 5 Ca 0.00 -2.55 -0.60 0.00 -0.01 0.00 0.00 57.85 54.68 1ugl n ARG 5 Cb 0.00 -1.51 -0.12 0.00 0.00 0.00 0.00 32.46 30.84 1ugl n ARG 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1ugl n THR 7 N 6.27 -2.67 -1.24 0.00 -2.24 -1.26 -4.62 114.28 108.52 1ugl n THR 7 Ca 0.52 1.34 -0.29 0.00 -2.27 0.00 0.00 64.05 63.35 1ugl n THR 7 Cb -0.03 -2.23 0.12 0.00 -2.10 0.00 0.00 70.33 66.09 1ugl n THR 7 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1ugl n ARG 8 N -2.56 2.43 0.00 -0.78 3.00 -1.26 -4.60 116.66 112.90 1ugl n ARG 8 Ca -0.00 -3.06 0.00 0.00 -0.00 0.00 0.00 57.85 54.79 1ugl n ARG 8 Cb 0.45 -2.20 0.00 0.00 0.00 0.00 0.00 32.46 30.71 1ugl n ARG 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ugl n GLY 9 N -0.97 1.64 2.93 5.14 0.00 -1.26 -4.80 105.19 107.87 1ugl n GLY 9 Ca 0.60 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.54 1ugl n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ugl n PHE 10 N -0.62 -3.35 -2.83 1.61 -0.00 -1.26 -5.01 117.46 105.99 1ugl n PHE 10 Ca 0.00 1.34 -0.11 0.00 -0.00 0.00 0.00 57.45 58.68 1ugl n PHE 10 Cb 0.00 -3.99 0.05 0.00 -0.00 0.00 0.00 39.48 35.54 1ugl n PHE 10 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.76 179.65 1ugl n ARG 11 N -0.59 1.08 -4.26 -4.13 -4.01 -1.26 -4.96 116.66 98.53 1ugl n ARG 11 Ca 0.08 -2.66 -0.25 0.00 -1.04 0.00 0.00 57.85 53.99 1ugl n ARG 11 Cb 0.48 -1.05 -0.08 0.00 -3.04 0.00 0.00 32.46 28.78 1ugl n ARG 11 CO 0.00 0.00 0.00 0.15 -3.04 0.00 0.00 177.63 174.74 1ugl s LYS 12 N -1.41 2.30 0.07 2.89 3.01 0.13 -5.01 119.74 121.72 1ugl s LYS 12 Ca 0.28 -1.29 -0.07 0.00 -1.01 0.00 0.00 55.97 53.88 1ugl s LYS 12 Cb 0.38 -2.23 -0.01 0.00 -1.01 0.00 0.00 37.83 34.96 1ugl s LYS 12 CO -0.04 0.40 0.15 -0.48 0.51 0.00 0.00 175.35 175.89 1ugl s LEU 13 N -3.32 1.59 0.00 3.17 0.05 -1.26 -1.12 118.68 117.79 1ugl s LEU 13 Ca 0.29 -0.65 0.00 0.00 0.05 0.00 0.00 54.13 53.82 1ugl s LEU 13 Cb -0.08 0.87 0.00 0.00 -2.05 0.00 0.00 46.19 44.94 1ugl s LEU 13 CO 0.19 -0.67 0.00 0.61 -0.55 0.00 0.00 176.35 175.93 1ugl n GLY 14 N 0.14 0.70 0.12 -3.48 0.00 -0.33 -4.30 105.19 98.04 1ugl n GLY 14 Ca -0.16 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1ugl n GLY 14 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ugl n LYS 15 N -0.50 0.00 -3.29 1.61 5.02 -1.17 -0.15 118.16 119.68 1ugl n LYS 15 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.20 1ugl n LYS 15 Cb 0.19 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.21 1ugl n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ugl s THR 17 N -3.06 5.07 0.00 0.00 2.01 0.78 -4.96 115.64 115.49 1ugl s THR 17 Ca 0.07 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 61.82 1ugl s THR 17 Cb -0.02 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.67 1ugl s THR 17 CO 0.79 -0.49 0.91 0.41 -0.69 0.00 0.00 174.62 175.54 1ugl n THR 18 N -1.52 0.00 -0.02 -0.82 -1.04 -1.26 -1.19 114.28 108.43 1ugl n THR 18 Ca -0.03 1.41 0.20 0.00 -2.04 0.00 0.00 64.05 63.58 1ugl n THR 18 Cb 0.55 -2.30 0.39 0.00 -1.82 0.00 0.00 70.33 67.15 1ugl n THR 18 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1ugl h LEU 19 N 0.00 0.00 0.07 -4.42 7.12 -1.96 0.33 115.31 116.46 1ugl h LEU 19 Ca 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.01 1ugl h LEU 19 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.13 1ugl h LEU 19 CO 0.00 0.00 -0.04 -0.08 -0.13 0.00 0.00 178.44 178.19 1ugl h GLU 20 N 0.00 -0.10 -0.80 1.25 4.22 -1.67 0.20 114.58 117.68 1ugl h GLU 20 Ca 0.31 0.01 0.22 0.00 0.08 0.00 0.00 59.36 59.98 1ugl h GLU 20 Cb 2.37 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 31.60 1ugl h GLU 20 CO -0.00 -0.06 0.57 1.05 -2.18 0.00 0.00 179.01 178.38 1ugl h GLU 21 N -0.58 0.07 -0.03 1.92 4.11 0.59 0.26 114.58 120.92 1ugl h GLU 21 Ca -0.01 -0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.22 1ugl h GLU 21 Cb 0.08 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.32 1ugl h GLU 21 CO 0.02 0.04 -0.74 0.93 0.07 0.00 0.00 179.01 179.33 1ugl h GLU 22 N 0.07 0.55 -0.79 1.06 4.39 -0.53 -2.89 114.58 116.44 1ugl h GLU 22 Ca 0.39 -0.56 0.18 0.00 0.34 0.00 0.00 59.36 59.72 1ugl h GLU 22 Cb 1.44 0.15 -0.14 0.00 -0.10 0.00 0.00 28.75 30.10 1ugl h GLU 22 CO -0.03 1.18 0.01 -0.22 -1.16 0.00 0.00 179.01 178.78 1ugl h LYS 23 N 0.13 0.09 0.46 2.33 1.63 0.28 0.38 116.57 121.86 1ugl h LYS 23 Ca -0.09 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.69 1ugl h LYS 23 Cb 1.42 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 33.03 1ugl h LYS 23 CO 0.15 0.06 -0.23 0.00 -3.45 0.00 0.00 179.45 175.98 1ugl n LYS 25 N -5.36 0.00 -0.25 0.00 4.01 0.31 -0.32 118.16 116.55 1ugl n LYS 25 Ca -0.11 0.06 0.17 0.00 -0.51 0.00 0.00 58.31 57.92 1ugl n LYS 25 Cb 0.26 -0.93 0.32 0.00 -0.51 0.00 0.00 35.03 34.18 1ugl n LYS 25 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1ugl n THR 26 N -0.68 -0.31 0.03 -0.18 -2.24 0.11 0.46 114.28 111.47 1ugl n THR 26 Ca 0.00 1.56 -0.14 0.00 -2.27 0.00 0.00 64.05 63.20 1ugl n THR 26 Cb 0.00 -2.39 -0.14 0.00 -2.10 0.00 0.00 70.33 65.70 1ugl n THR 26 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ugl h LEU 27 N 0.00 0.24 -8.33 3.22 4.07 -1.58 -3.46 115.31 109.47 1ugl h LEU 27 Ca 0.53 -0.37 -0.65 0.00 0.08 0.00 0.00 57.88 57.48 1ugl h LEU 27 Cb 1.27 -0.08 -0.32 0.00 1.08 0.00 0.00 40.66 42.61 1ugl h LEU 27 CO -0.63 1.31 -0.87 -0.31 -1.08 0.00 0.00 178.44 176.86 1ugl s TYR 28 N -2.62 2.28 -1.40 1.13 2.02 0.17 -5.04 117.35 113.89 1ugl s TYR 28 Ca -0.08 -0.81 -0.08 0.00 -0.37 0.00 0.00 57.07 55.73 1ugl s TYR 28 Cb 0.08 -1.52 0.07 0.00 -0.40 0.00 0.00 41.96 40.18 1ugl s TYR 28 CO 0.83 -0.31 2.42 -0.35 -1.57 0.00 0.00 175.55 176.58 1ugl n PRO 29 N 3.32 4.03 -0.35 -1.71 -0.04 -1.26 -4.08 135.00 134.93 1ugl n PRO 29 Ca -0.19 -3.08 -0.02 0.00 -0.04 0.00 0.00 63.50 60.17 1ugl n PRO 29 Cb 0.53 -2.79 0.01 0.00 -0.04 0.00 0.00 33.50 31.21 1ugl n PRO 29 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ugl n ARG 30 N 2.99 0.13 0.00 0.54 3.00 -1.26 -4.76 116.66 117.30 1ugl n ARG 30 Ca 0.61 -0.16 0.00 0.00 -0.01 0.00 0.00 57.85 58.29 1ugl n ARG 30 Cb 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 32.46 32.66 1ugl n ARG 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ugl n GLY 31 N 4.41 0.00 0.73 -0.13 0.00 -1.26 -4.86 105.19 104.08 1ugl n GLY 31 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1ugl n GLY 31 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ugl n GLN 32 N -0.38 2.64 -3.43 1.61 1.13 -1.26 -5.01 117.38 112.67 1ugl n GLN 32 Ca 0.00 -2.76 -0.21 0.00 -1.94 0.00 0.00 57.00 52.10 1ugl n GLN 32 Cb 0.00 -1.76 -0.01 0.00 0.11 0.00 0.00 30.24 28.58 1ugl n GLN 32 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ugl n THR 34 N -1.72 0.00 -3.51 0.00 5.66 -1.26 -4.91 114.28 108.54 1ugl n THR 34 Ca 0.05 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.68 1ugl n THR 34 Cb 0.61 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.31 1ugl n THR 34 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ugl s SER 36 N 1.01 2.83 0.33 0.00 0.01 -0.88 -4.94 113.70 112.06 1ugl s SER 36 Ca 0.14 -0.75 0.08 0.00 1.31 0.00 0.00 55.95 56.73 1ugl s SER 36 Cb -0.14 -0.66 -0.04 0.00 0.21 0.00 0.00 66.02 65.40 1ugl s SER 36 CO 0.06 -0.28 0.20 1.51 0.41 0.00 0.00 173.24 175.15 1ugl s ASP 37 N 1.81 4.95 0.00 2.44 1.47 -1.26 -2.35 116.67 123.73 1ugl s ASP 37 Ca -0.01 -0.64 0.00 0.00 1.18 0.00 0.00 52.55 53.08 1ugl s ASP 37 Cb -0.16 -0.85 0.00 0.00 -0.34 0.00 0.00 42.92 41.57 1ugl s ASP 37 CO -0.07 -0.31 0.00 -1.20 0.68 0.00 0.00 175.17 174.27 1ugl n SER 38 N -1.23 0.00 -0.82 2.11 7.64 -1.26 -5.02 113.62 115.02 1ugl n SER 38 Ca -0.03 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.81 1ugl n SER 38 Cb 0.60 -0.10 -0.04 0.00 -1.01 0.00 0.00 64.21 63.67 1ugl n SER 38 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 1ugl n LYS 39 N -1.80 0.02 -4.24 1.43 2.85 -1.26 -5.15 118.16 110.01 1ugl n LYS 39 Ca 0.00 -0.58 -0.18 0.00 -1.05 0.00 0.00 58.31 56.50 1ugl n LYS 39 Cb 0.00 0.49 -0.07 0.00 -0.65 0.00 0.00 35.03 34.80 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 177.40 175.71 1ugl s MET 40 N 0.00 1.78 0.44 -1.58 -1.94 -1.26 -5.03 119.30 111.71 1ugl s MET 40 Ca 0.00 -1.95 0.29 0.00 -1.71 0.00 0.00 55.69 52.32 1ugl s MET 40 Cb 0.01 0.35 1.12 0.00 2.01 0.00 0.00 34.83 38.32 1ugl s MET 40 CO -0.00 -0.68 1.86 -0.97 -0.01 0.00 0.00 175.02 175.22 1ugl h ASN 41 N 2.14 0.00 -3.37 3.03 -0.00 -2.00 -3.43 115.58 111.95 1ugl h ASN 41 Ca -0.26 0.00 -0.67 0.00 -0.00 0.00 0.00 56.30 55.37 1ugl h ASN 41 Cb 1.23 0.00 -0.15 0.00 -0.00 0.00 0.00 38.32 39.41 1ugl h ASN 41 CO 0.37 0.00 -0.64 0.42 -0.00 0.00 0.00 177.43 177.59 1ugl s THR 42 N -3.49 4.19 0.00 -3.57 -4.23 -1.26 -1.19 115.64 106.09 1ugl s THR 42 Ca 0.03 -0.42 -0.00 0.00 -1.18 0.00 0.00 61.69 60.12 1ugl s THR 42 Cb 0.09 -2.80 0.00 0.00 1.34 0.00 0.00 72.50 71.12 1ugl s THR 42 CO 0.52 0.51 0.01 0.00 -0.54 0.00 0.00 174.62 175.11 1ugl n HIS 43 N 1.82 -0.57 -1.06 3.99 1.44 -0.28 -4.59 115.22 115.97 1ugl n HIS 43 Ca -0.17 -0.02 0.00 0.00 -2.01 0.00 0.00 57.72 55.52 1ugl n HIS 43 Cb 0.53 0.01 0.00 0.00 0.12 0.00 0.00 29.99 30.65 1ugl n HIS 43 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 1ugl n SER 44 N -1.87 0.68 -4.97 4.39 3.41 -0.99 0.19 113.62 114.46 1ugl n SER 44 Ca -0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 1ugl n SER 44 Cb 0.01 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 1ugl n SER 44 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ugl n ASP 46 N -2.01 -0.15 0.29 0.00 2.03 -1.26 -4.39 116.55 111.07 1ugl n ASP 46 Ca 0.07 -2.33 0.17 0.00 0.52 0.00 0.00 54.79 53.22 1ugl n ASP 46 Cb 0.63 0.20 0.86 0.00 -0.72 0.00 0.00 41.12 42.08 1ugl n ASP 46 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ugl s LYS 48 N -4.00 0.65 0.00 0.00 -0.14 -1.26 -4.50 119.74 110.49 1ugl s LYS 48 Ca -0.02 -0.94 0.00 0.00 -1.36 0.00 0.00 55.97 53.65 1ugl s LYS 48 Cb 0.12 -0.34 0.00 0.00 -1.68 0.00 0.00 37.83 35.92 1ugl s LYS 48 CO 0.52 0.05 1.55 -1.13 -0.76 0.00 0.00 175.35 175.58 1ugl n SER 49 N 1.03 4.17 0.00 2.83 3.41 -1.26 -4.86 113.62 118.94 1ugl n SER 49 Ca -0.20 -2.10 0.09 0.00 -0.26 0.00 0.00 58.87 56.41 1ugl n SER 49 Cb 0.56 -0.88 0.54 0.00 -0.26 0.00 0.00 64.21 64.18 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88