#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 -3.07 -3.67 3.41 4.32 -1.26 -4.98 117.00 111.75 1ugl n LEU 2 Ca 0.00 -0.73 -0.09 0.00 -0.02 0.00 0.00 56.01 55.18 1ugl n LEU 2 Cb 0.00 -2.76 -0.09 0.00 -1.62 0.00 0.00 43.42 38.96 1ugl n LEU 2 CO 0.00 0.48 0.19 0.00 -1.22 0.00 0.00 177.39 176.84 1ugl s MET 3 N -6.21 0.54 -0.15 3.23 0.23 -1.26 -5.14 119.30 110.54 1ugl s MET 3 Ca 0.36 1.01 -0.06 0.00 -1.03 0.00 0.00 55.69 55.97 1ugl s MET 3 Cb -0.17 0.08 0.07 0.00 -1.53 0.00 0.00 34.83 33.27 1ugl s MET 3 CO 0.79 -0.16 0.33 0.21 -2.03 0.00 0.00 175.02 174.16 1ugl s LYS 4 N 1.57 0.24 -0.44 3.16 2.36 -1.26 -5.10 119.74 120.27 1ugl s LYS 4 Ca -0.09 0.82 -0.27 0.00 -2.55 0.00 0.00 55.97 53.88 1ugl s LYS 4 Cb -0.07 0.08 -0.07 0.00 -1.05 0.00 0.00 37.83 36.72 1ugl s LYS 4 CO -0.16 -0.25 2.38 2.89 1.55 0.00 0.00 175.35 181.76 1ugl n ARG 5 N 5.13 1.22 -1.58 4.03 1.85 -1.26 -3.77 116.66 122.28 1ugl n ARG 5 Ca -0.11 0.11 -0.45 0.00 -1.00 0.00 0.00 57.85 56.40 1ugl n ARG 5 Cb 0.51 -3.37 -0.02 0.00 -1.05 0.00 0.00 32.46 28.53 1ugl n ARG 5 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ugl n THR 7 N 0.24 -2.37 -1.26 0.00 -2.24 -1.26 -4.60 114.28 102.80 1ugl n THR 7 Ca 0.10 1.34 -0.29 0.00 -2.27 0.00 0.00 64.05 62.93 1ugl n THR 7 Cb 0.32 -2.18 0.13 0.00 -2.10 0.00 0.00 70.33 66.50 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 -3.18 2.44 0.00 -0.78 3.00 -1.26 -4.59 116.66 112.29 1ugl n ARG 8 Ca -0.03 -3.10 0.00 0.00 -0.00 0.00 0.00 57.85 54.72 1ugl n ARG 8 Cb 0.56 -2.22 0.00 0.00 0.00 0.00 0.00 32.46 30.80 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 -1.01 1.56 2.75 5.14 0.00 -1.26 -4.83 105.19 107.53 1ugl n GLY 9 Ca 0.61 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.47 -3.58 -2.73 1.61 -0.00 -1.26 -5.03 117.46 106.00 1ugl n PHE 10 Ca 0.00 1.51 -0.09 0.00 -0.00 0.00 0.00 57.45 58.87 1ugl n PHE 10 Cb 0.00 -3.98 0.09 0.00 -0.00 0.00 0.00 39.48 35.59 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 0.10 1.13 -4.20 -4.13 -4.01 -1.26 -4.99 116.66 99.30 1ugl n ARG 11 Ca 0.07 -2.16 -0.27 0.00 -1.04 0.00 0.00 57.85 54.45 1ugl n ARG 11 Cb 0.26 -0.57 -0.08 0.00 -3.04 0.00 0.00 32.46 29.03 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 -0.45 2.38 0.05 2.89 3.01 0.15 -5.01 119.74 122.76 1ugl s LYS 12 Ca 0.24 -1.09 -0.12 0.00 -1.01 0.00 0.00 55.97 53.99 1ugl s LYS 12 Cb 0.38 -2.36 0.01 0.00 -1.01 0.00 0.00 37.83 34.85 1ugl s LYS 12 CO -0.06 0.46 0.27 -0.48 0.51 0.00 0.00 175.35 176.05 1ugl s LEU 13 N -2.85 1.04 0.00 3.17 0.05 -1.26 -0.85 118.68 117.98 1ugl s LEU 13 Ca 0.27 -0.30 0.00 0.00 0.05 0.00 0.00 54.13 54.15 1ugl s LEU 13 Cb -0.10 1.24 0.00 0.00 -2.05 0.00 0.00 46.19 45.29 1ugl s LEU 13 CO 0.18 -0.63 0.00 0.61 -0.55 0.00 0.00 176.35 175.96 1ugl n GLY 14 N 0.48 0.66 1.78 -3.48 0.00 -0.77 -4.30 105.19 99.56 1ugl n GLY 14 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 -0.51 -3.72 1.61 4.76 -1.01 -0.71 118.16 118.58 1ugl n LYS 15 Ca 0.00 0.44 -0.24 0.00 -2.87 0.00 0.00 58.31 55.64 1ugl n LYS 15 Cb 0.00 -0.61 0.03 0.00 -1.84 0.00 0.00 35.03 32.61 1ugl n LYS 15 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ugl s THR 17 N -3.67 3.97 0.13 0.00 2.01 0.11 -4.86 115.64 113.34 1ugl s THR 17 Ca 0.12 0.96 -0.27 0.00 0.31 0.00 0.00 61.69 62.82 1ugl s THR 17 Cb -0.04 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.97 1ugl s THR 17 CO 0.83 -0.52 1.61 0.74 -0.69 0.00 0.00 174.62 176.59 1ugl h THR 18 N 0.65 0.27 -0.55 -0.82 2.02 -1.91 0.11 112.91 112.67 1ugl h THR 18 Ca -0.47 0.00 0.16 0.00 0.77 0.00 0.00 66.41 66.87 1ugl h THR 18 Cb 1.21 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1ugl h THR 18 CO 0.58 0.00 0.61 0.25 0.37 0.00 0.00 175.52 177.33 1ugl h LEU 19 N -0.44 0.00 0.01 2.58 7.12 -1.93 0.64 115.31 123.29 1ugl h LEU 19 Ca 0.08 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 58.07 1ugl h LEU 19 Cb 0.56 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.70 1ugl h LEU 19 CO -0.33 0.00 -0.09 -0.33 -0.13 0.00 0.00 178.44 177.56 1ugl h GLU 20 N 0.00 0.03 0.00 1.25 4.39 -1.12 -0.42 114.58 118.71 1ugl h GLU 20 Ca 0.26 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 1ugl h GLU 20 Cb 1.48 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.14 1ugl h GLU 20 CO -0.00 1.02 -0.09 1.05 -1.16 0.00 0.00 179.01 179.83 1ugl h GLU 21 N -0.94 0.00 0.18 2.33 4.11 0.04 -1.68 114.58 118.62 1ugl h GLU 21 Ca -0.02 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 59.11 1ugl h GLU 21 Cb 1.07 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.34 1ugl h GLU 21 CO 0.01 0.09 -1.34 0.93 0.07 0.00 0.00 179.01 178.77 1ugl h GLU 22 N 0.00 0.49 -0.24 1.06 5.08 0.15 -2.34 114.58 118.78 1ugl h GLU 22 Ca -0.00 -0.77 0.06 0.00 -1.00 0.00 0.00 59.36 57.64 1ugl h GLU 22 Cb 0.37 0.28 -0.06 0.00 0.50 0.00 0.00 28.75 29.84 1ugl h GLU 22 CO 0.01 1.36 -0.12 -0.22 -1.00 0.00 0.00 179.01 179.04 1ugl h LYS 23 N 0.17 -0.09 -0.19 2.33 1.63 -0.12 0.29 116.57 120.59 1ugl h LYS 23 Ca -0.20 0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 59.50 1ugl h LYS 23 Cb 2.03 0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 33.67 1ugl h LYS 23 CO 0.25 -0.06 -0.32 0.00 -3.45 0.00 0.00 179.45 175.86 1ugl n LYS 25 N -4.08 0.00 -0.34 0.00 4.01 -0.65 -1.16 118.16 115.93 1ugl n LYS 25 Ca -0.01 0.39 0.19 0.00 -0.51 0.00 0.00 58.31 58.37 1ugl n LYS 25 Cb 0.44 -0.94 0.41 0.00 -0.51 0.00 0.00 35.03 34.42 1ugl n LYS 25 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 1ugl h THR 26 N 0.00 0.51 0.16 -0.18 1.35 -0.62 -1.84 112.91 112.29 1ugl h THR 26 Ca 0.00 -0.18 -0.34 0.00 -0.55 0.00 0.00 66.41 65.34 1ugl h THR 26 Cb 0.00 -0.08 0.00 0.00 -1.73 0.00 0.00 68.15 66.35 1ugl h THR 26 CO 0.00 0.10 -1.70 -0.07 -0.25 0.00 0.00 175.52 173.60 1ugl h LEU 27 N 0.54 0.53 -7.89 3.87 4.07 -1.58 -3.44 115.31 111.41 1ugl h LEU 27 Ca 0.65 -0.79 -0.68 0.00 0.08 0.00 0.00 57.88 57.14 1ugl h LEU 27 Cb 1.30 -0.17 -0.35 0.00 1.08 0.00 0.00 40.66 42.52 1ugl h LEU 27 CO -0.47 1.67 -0.68 -0.31 -1.08 0.00 0.00 178.44 177.57 1ugl s TYR 28 N -2.59 3.45 -1.46 1.13 2.02 -0.31 -5.02 117.35 114.58 1ugl s TYR 28 Ca -0.14 -2.31 -0.14 0.00 -0.37 0.00 0.00 57.07 54.11 1ugl s TYR 28 Cb 0.06 -2.54 0.04 0.00 -0.40 0.00 0.00 41.96 39.12 1ugl s TYR 28 CO 0.85 -0.89 2.24 -0.35 -1.57 0.00 0.00 175.55 175.83 1ugl n PRO 29 N 4.51 2.85 -3.01 -1.71 -0.04 -1.23 -4.11 135.00 132.26 1ugl n PRO 29 Ca -0.07 -2.59 -0.17 0.00 -0.04 0.00 0.00 63.50 60.63 1ugl n PRO 29 Cb 0.42 -3.28 0.00 0.00 -0.04 0.00 0.00 33.50 30.61 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 6.07 0.94 -0.00 0.54 5.12 -1.26 -5.06 116.66 123.01 1ugl n ARG 30 Ca 0.52 -2.27 0.00 0.00 -1.93 0.00 0.00 57.85 54.18 1ugl n ARG 30 Cb 0.39 0.23 -0.01 0.00 -1.16 0.00 0.00 32.46 31.90 1ugl n ARG 30 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ugl n GLY 31 N 0.60 -0.07 0.79 -0.13 0.00 -1.26 -4.62 105.19 100.50 1ugl n GLY 31 Ca -0.01 -0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.80 2.94 -3.95 1.61 3.00 -1.26 -4.98 117.38 112.94 1ugl n GLN 32 Ca -0.01 -2.32 -0.34 0.00 -0.01 0.00 0.00 57.00 54.32 1ugl n GLN 32 Cb 0.29 -1.46 -0.05 0.00 0.00 0.00 0.00 30.24 29.01 1ugl n GLN 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ugl n THR 34 N 1.10 0.00 -3.76 0.00 5.66 -1.26 -4.90 114.28 111.12 1ugl n THR 34 Ca -0.12 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.51 1ugl n THR 34 Cb 0.53 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.25 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 2.23 0.19 0.00 0.01 -0.47 -4.88 113.70 109.77 1ugl s SER 36 Ca 0.18 -0.53 0.08 0.00 1.31 0.00 0.00 55.95 56.99 1ugl s SER 36 Cb -0.13 -0.29 -0.05 0.00 0.21 0.00 0.00 66.02 65.77 1ugl s SER 36 CO 0.07 -0.32 -0.15 -0.62 0.41 0.00 0.00 173.24 172.62 1ugl s ASP 37 N 2.10 2.59 0.00 2.44 2.15 -1.26 -2.34 116.67 122.35 1ugl s ASP 37 Ca 0.02 -0.97 0.00 0.00 0.43 0.00 0.00 52.55 52.03 1ugl s ASP 37 Cb -0.15 -0.14 0.00 0.00 -0.30 0.00 0.00 42.92 42.32 1ugl s ASP 37 CO -0.08 -0.13 0.00 -1.20 -0.17 0.00 0.00 175.17 173.59 1ugl n SER 38 N -0.19 0.00 -2.68 -0.34 7.64 -1.26 -5.07 113.62 111.72 1ugl n SER 38 Ca -0.09 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.74 1ugl n SER 38 Cb 0.59 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.90 1ugl n SER 38 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1ugl n LYS 39 N -0.96 0.36 -0.22 1.43 0.00 -1.26 -4.99 118.16 112.52 1ugl n LYS 39 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 58.31 57.31 1ugl n LYS 39 Cb 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 35.03 34.65 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.40 176.07 1ugl n MET 40 N 0.55 0.00 0.00 1.64 2.81 -1.26 -5.00 117.12 115.85 1ugl n MET 40 Ca -0.02 -0.36 0.00 0.00 -1.81 0.00 0.00 57.70 55.51 1ugl n MET 40 Cb 0.74 -0.25 0.00 0.00 -0.71 0.00 0.00 33.22 33.00 1ugl n MET 40 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1ugl n ASN 41 N 0.00 0.00 -4.89 7.83 5.15 -1.26 -4.92 115.26 117.17 1ugl n ASN 41 Ca 0.00 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.63 1ugl n ASN 41 Cb 0.54 0.00 -0.05 0.00 -0.53 0.00 0.00 39.78 39.74 1ugl n ASN 41 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1ugl s THR 42 N 0.00 5.42 0.18 -0.44 -4.23 -1.26 -1.84 115.64 113.47 1ugl s THR 42 Ca 0.00 -0.04 -0.02 0.00 -1.18 0.00 0.00 61.69 60.45 1ugl s THR 42 Cb 0.00 -3.47 0.01 0.00 1.34 0.00 0.00 72.50 70.38 1ugl s THR 42 CO 0.00 0.43 0.27 0.00 -0.54 0.00 0.00 174.62 174.78 1ugl n HIS 43 N 1.33 -1.06 -0.89 3.99 1.44 -0.03 -4.58 115.22 115.42 1ugl n HIS 43 Ca -0.14 -1.13 0.00 0.00 -2.01 0.00 0.00 57.72 54.44 1ugl n HIS 43 Cb 0.53 0.30 0.00 0.00 0.12 0.00 0.00 29.99 30.95 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 -1.78 1.10 -4.93 4.39 3.41 -0.99 0.30 113.62 115.11 1ugl n SER 44 Ca -0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.41 1ugl n SER 44 Cb 0.29 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.23 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 -1.73 -0.14 0.29 0.00 2.03 -1.23 -4.11 116.55 111.67 1ugl n ASP 46 Ca 0.06 -2.27 0.16 0.00 0.52 0.00 0.00 54.79 53.25 1ugl n ASP 46 Cb 0.61 0.19 0.88 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 -4.30 0.93 -0.85 0.00 2.36 -1.25 -4.51 119.74 112.11 1ugl s LYS 48 Ca -0.04 -0.30 -0.22 0.00 -2.55 0.00 0.00 55.97 52.87 1ugl s LYS 48 Cb 0.13 -0.87 -0.21 0.00 -1.05 0.00 0.00 37.83 35.83 1ugl s LYS 48 CO 0.54 0.12 2.40 0.45 1.55 0.00 0.00 175.35 180.41 1ugl n SER 49 N 3.26 0.46 0.00 1.43 2.88 -1.26 -4.67 113.62 115.72 1ugl n SER 49 Ca -0.18 -0.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.78 1ugl n SER 49 Cb 0.54 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81