#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 1.87 -4.37 1.20 4.77 -1.26 -4.99 117.00 114.22 1ugl n LEU 2 Ca 0.00 -1.19 -0.30 0.00 -0.03 0.00 0.00 56.01 54.49 1ugl n LEU 2 Cb 0.00 -0.03 -0.14 0.00 -2.33 0.00 0.00 43.42 40.92 1ugl n LEU 2 CO 0.00 0.40 -0.56 -0.32 -1.33 0.00 0.00 177.39 175.58 1ugl s MET 3 N -0.74 1.77 -0.00 3.23 1.75 -1.26 -5.02 119.30 119.02 1ugl s MET 3 Ca 0.11 -1.14 0.00 0.00 -1.25 0.00 0.00 55.69 53.42 1ugl s MET 3 Cb 0.07 -1.99 -0.00 0.00 2.84 0.00 0.00 34.83 35.74 1ugl s MET 3 CO 0.10 0.51 -0.00 1.63 -0.65 0.00 0.00 175.02 176.61 1ugl n LYS 4 N 1.60 1.89 -3.06 4.11 4.01 -1.26 -5.09 118.16 120.36 1ugl n LYS 4 Ca -0.17 0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.56 1ugl n LYS 4 Cb 0.52 -1.01 0.01 0.00 -0.51 0.00 0.00 35.03 34.04 1ugl n LYS 4 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1ugl n ARG 5 N -2.27 -1.81 -1.65 1.97 0.63 -1.26 -4.87 116.66 107.39 1ugl n ARG 5 Ca -0.01 1.70 -0.45 0.00 -0.92 0.00 0.00 57.85 58.18 1ugl n ARG 5 Cb 0.51 -5.25 -0.02 0.00 0.45 0.00 0.00 32.46 28.15 1ugl n ARG 5 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ugl n THR 7 N 1.14 -3.59 -1.24 0.00 -2.24 -1.26 -4.65 114.28 102.45 1ugl n THR 7 Ca 0.10 1.74 -0.28 0.00 -2.27 0.00 0.00 64.05 63.34 1ugl n THR 7 Cb 0.32 -2.73 0.13 0.00 -2.10 0.00 0.00 70.33 65.95 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 -2.24 2.41 0.00 -0.78 3.00 -1.26 -4.58 116.66 113.21 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 0.38 -2.20 0.00 0.00 0.00 0.00 0.00 32.46 30.64 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 -1.00 1.75 2.82 5.14 0.00 -1.26 -4.85 105.19 107.78 1ugl n GLY 9 Ca 0.60 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.57 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 -0.30 -3.60 -2.73 1.61 7.35 -1.26 -5.02 117.46 113.51 1ugl n PHE 10 Ca 0.00 1.54 -0.08 0.00 -0.76 0.00 0.00 57.45 58.14 1ugl n PHE 10 Cb 0.00 -3.85 0.10 0.00 0.35 0.00 0.00 39.48 36.08 1ugl n PHE 10 CO 0.00 0.00 0.00 2.89 -0.76 0.00 0.00 176.76 178.89 1ugl n ARG 11 N 0.31 1.10 -4.22 -4.13 1.85 -1.26 -5.01 116.66 105.30 1ugl n ARG 11 Ca 0.04 -1.96 -0.28 0.00 -1.00 0.00 0.00 57.85 54.66 1ugl n ARG 11 Cb 0.23 -0.60 -0.09 0.00 -1.05 0.00 0.00 32.46 30.95 1ugl n ARG 11 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1ugl s LYS 12 N 0.07 2.27 0.04 2.89 3.01 0.12 -5.01 119.74 123.13 1ugl s LYS 12 Ca 0.23 -1.09 -0.12 0.00 -1.01 0.00 0.00 55.97 53.98 1ugl s LYS 12 Cb 0.35 -2.32 0.01 0.00 -1.01 0.00 0.00 37.83 34.86 1ugl s LYS 12 CO -0.07 0.48 0.27 -0.48 0.51 0.00 0.00 175.35 176.06 1ugl s LEU 13 N -2.64 1.04 0.00 3.17 0.05 -1.26 -0.81 118.68 118.24 1ugl s LEU 13 Ca 0.25 -0.23 0.00 0.00 0.05 0.00 0.00 54.13 54.20 1ugl s LEU 13 Cb -0.10 1.21 0.00 0.00 -2.05 0.00 0.00 46.19 45.25 1ugl s LEU 13 CO 0.16 -0.58 0.00 0.61 -0.55 0.00 0.00 176.35 175.99 1ugl n GLY 14 N 0.66 0.77 2.08 -3.48 0.00 -0.51 -4.29 105.19 100.41 1ugl n GLY 14 Ca -0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.71 -3.71 1.61 5.02 -1.00 -0.66 118.16 118.70 1ugl n LYS 15 Ca 0.00 0.59 -0.22 0.00 -2.02 0.00 0.00 58.31 56.66 1ugl n LYS 15 Cb 0.00 -0.82 0.03 0.00 -0.02 0.00 0.00 35.03 34.22 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 -3.68 3.60 0.13 0.00 2.01 0.16 -4.84 115.64 113.02 1ugl s THR 17 Ca 0.04 0.74 -0.25 0.00 0.31 0.00 0.00 61.69 62.53 1ugl s THR 17 Cb -0.01 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 1ugl s THR 17 CO 0.82 -0.47 1.63 0.74 -0.69 0.00 0.00 174.62 176.66 1ugl h THR 18 N 0.22 0.40 -0.54 -0.82 2.02 -1.90 0.13 112.91 112.42 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 1.23 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 1ugl h THR 18 CO 0.56 0.00 0.59 0.25 0.37 0.00 0.00 175.52 177.29 1ugl h LEU 19 N -0.37 0.00 0.00 2.58 7.12 -1.93 0.45 115.31 123.17 1ugl h LEU 19 Ca 0.08 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.09 1ugl h LEU 19 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.62 1ugl h LEU 19 CO -0.27 0.00 -0.00 -0.08 -0.13 0.00 0.00 178.44 177.96 1ugl h GLU 20 N 0.00 -0.00 0.00 1.25 4.57 -1.07 -0.26 114.58 119.06 1ugl h GLU 20 Ca 0.26 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.42 1ugl h GLU 20 Cb 1.44 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 30.03 1ugl h GLU 20 CO -0.00 0.90 -0.07 1.05 -1.18 0.00 0.00 179.01 179.70 1ugl h GLU 21 N -0.96 0.00 -0.03 1.92 4.11 0.12 -1.17 114.58 118.57 1ugl h GLU 21 Ca -0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.30 1ugl h GLU 21 Cb 0.90 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.16 1ugl h GLU 21 CO 0.00 0.07 -0.49 0.93 0.07 0.00 0.00 179.01 179.59 1ugl h GLU 22 N 0.00 0.38 -0.81 1.06 5.08 -0.21 -2.47 114.58 117.60 1ugl h GLU 22 Ca -0.00 -0.37 0.12 0.00 -1.00 0.00 0.00 59.36 58.11 1ugl h GLU 22 Cb 0.19 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 1ugl h GLU 22 CO 0.01 1.04 0.53 -0.22 -1.00 0.00 0.00 179.01 179.37 1ugl h LYS 23 N -0.14 0.62 -0.20 2.33 3.64 0.14 0.24 116.57 123.20 1ugl h LYS 23 Ca -0.05 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.10 1ugl h LYS 23 Cb 1.19 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1ugl h LYS 23 CO 0.10 0.41 -0.62 0.00 -2.27 0.00 0.00 179.45 177.07 1ugl h LYS 25 N 0.51 -0.06 -0.87 0.00 6.56 -0.66 -2.10 116.57 119.94 1ugl h LYS 25 Ca -0.01 0.00 0.11 0.00 -1.06 0.00 0.00 60.65 59.70 1ugl h LYS 25 Cb 1.21 0.01 -0.06 0.00 -0.57 0.00 0.00 32.23 32.82 1ugl h LYS 25 CO 0.12 -0.04 0.56 1.79 -2.06 0.00 0.00 179.45 179.83 1ugl h THR 26 N -0.62 0.93 0.24 -0.16 1.35 -0.76 -2.55 112.91 111.34 1ugl h THR 26 Ca -0.01 -0.28 -0.33 0.00 -0.55 0.00 0.00 66.41 65.24 1ugl h THR 26 Cb 0.05 0.05 0.04 0.00 -1.73 0.00 0.00 68.15 66.56 1ugl h THR 26 CO 0.01 0.15 -1.45 -0.07 -0.25 0.00 0.00 175.52 173.91 1ugl h LEU 27 N 0.81 0.82 -7.75 3.87 -0.00 -1.56 -3.45 115.31 108.06 1ugl h LEU 27 Ca 0.41 -0.87 -0.56 0.00 -0.00 0.00 0.00 57.88 56.86 1ugl h LEU 27 Cb 0.50 -0.27 -0.37 0.00 -0.00 0.00 0.00 40.66 40.52 1ugl h LEU 27 CO -0.18 1.68 -0.81 -0.31 -0.00 0.00 0.00 178.44 178.82 1ugl s TYR 28 N -2.63 1.78 -0.35 1.13 2.02 -0.79 -5.03 117.35 113.48 1ugl s TYR 28 Ca -0.09 -1.00 -0.05 0.00 -0.37 0.00 0.00 57.07 55.57 1ugl s TYR 28 Cb 0.04 -1.38 -0.09 0.00 -0.40 0.00 0.00 41.96 40.14 1ugl s TYR 28 CO 0.94 -0.59 3.14 -0.35 -1.57 0.00 0.00 175.55 177.12 1ugl n PRO 29 N 4.87 2.40 -3.16 -1.71 -0.04 -1.24 -4.07 135.00 132.04 1ugl n PRO 29 Ca -0.14 -1.81 -0.23 0.00 -0.04 0.00 0.00 63.50 61.28 1ugl n PRO 29 Cb 0.49 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.82 1ugl n PRO 29 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1ugl s ARG 30 N -0.33 3.25 0.02 0.54 3.00 -1.26 -5.01 118.95 119.16 1ugl s ARG 30 Ca 0.63 -0.44 0.22 0.00 -1.00 0.00 0.00 55.73 55.14 1ugl s ARG 30 Cb 0.34 -2.61 -0.25 0.00 0.00 0.00 0.00 34.95 32.42 1ugl s ARG 30 CO -0.11 -0.08 0.63 0.41 0.00 0.00 0.00 175.30 176.14 1ugl n GLY 31 N -1.94 -1.10 0.83 8.12 0.00 -1.26 -4.11 105.19 105.73 1ugl n GLY 31 Ca -0.01 -0.46 0.08 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.32 2.93 -3.86 1.61 6.02 -1.26 -4.98 117.38 115.52 1ugl n GLN 32 Ca -0.03 -2.62 -0.35 0.00 -0.01 0.00 0.00 57.00 53.99 1ugl n GLN 32 Cb 0.55 -1.69 -0.05 0.00 1.02 0.00 0.00 30.24 30.07 1ugl n GLN 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ugl n THR 34 N 1.31 0.00 -3.46 0.00 5.66 -1.26 -4.90 114.28 111.62 1ugl n THR 34 Ca -0.14 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.49 1ugl n THR 34 Cb 0.53 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.23 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 1.03 2.66 0.05 0.00 0.15 -0.49 -4.95 113.70 112.16 1ugl s SER 36 Ca 0.16 -0.49 0.04 0.00 0.70 0.00 0.00 55.95 56.36 1ugl s SER 36 Cb -0.14 -1.20 -0.02 0.00 -1.71 0.00 0.00 66.02 62.94 1ugl s SER 36 CO 0.07 0.03 -0.11 -0.62 1.20 0.00 0.00 173.24 173.81 1ugl s ASP 37 N 0.97 1.25 0.00 5.45 -1.08 -1.26 -2.35 116.67 119.65 1ugl s ASP 37 Ca -0.06 -0.54 0.00 0.00 -0.52 0.00 0.00 52.55 51.43 1ugl s ASP 37 Cb -0.15 -0.02 0.00 0.00 -1.46 0.00 0.00 42.92 41.29 1ugl s ASP 37 CO -0.02 -0.11 0.00 -0.24 0.52 0.00 0.00 175.17 175.32 1ugl n SER 38 N 1.53 0.00 -2.52 -0.34 2.88 -1.26 -5.00 113.62 108.92 1ugl n SER 38 Ca -0.21 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.29 1ugl n SER 38 Cb 0.55 -0.42 0.06 0.00 -0.75 0.00 0.00 64.21 63.64 1ugl n SER 38 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1ugl n LYS 39 N -2.34 0.74 -3.86 -1.46 3.00 -1.26 -5.15 118.16 107.82 1ugl n LYS 39 Ca 0.00 -1.09 -0.10 0.00 -0.00 0.00 0.00 58.31 57.13 1ugl n LYS 39 Cb 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 35.03 35.04 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.40 175.76 1ugl s MET 40 N 0.10 1.18 0.52 1.64 -1.94 -1.26 -5.03 119.30 114.51 1ugl s MET 40 Ca 0.10 -1.03 0.19 0.00 -1.71 0.00 0.00 55.69 53.24 1ugl s MET 40 Cb 0.24 0.42 1.34 0.00 2.01 0.00 0.00 34.83 38.85 1ugl s MET 40 CO -0.06 -0.45 2.14 -0.97 -0.01 0.00 0.00 175.02 175.67 1ugl h ASN 41 N 2.46 0.00 -2.72 3.03 -1.24 -2.00 -3.42 115.58 111.69 1ugl h ASN 41 Ca -0.31 0.00 -0.66 0.00 0.71 0.00 0.00 56.30 56.04 1ugl h ASN 41 Cb 1.24 0.00 -0.06 0.00 0.73 0.00 0.00 38.32 40.22 1ugl h ASN 41 CO 0.46 0.04 -0.49 0.42 -1.29 0.00 0.00 177.43 176.57 1ugl s THR 42 N -4.86 5.45 0.11 -3.57 -4.23 -1.26 -1.42 115.64 105.86 1ugl s THR 42 Ca -0.05 0.05 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 1ugl s THR 42 Cb 0.16 -3.45 0.01 0.00 1.34 0.00 0.00 72.50 70.56 1ugl s THR 42 CO 0.65 0.50 0.16 0.00 -0.54 0.00 0.00 174.62 175.39 1ugl n HIS 43 N 1.56 -0.88 -2.00 3.99 1.44 0.01 -4.75 115.22 114.59 1ugl n HIS 43 Ca -0.16 -0.66 0.00 0.00 -2.01 0.00 0.00 57.72 54.89 1ugl n HIS 43 Cb 0.54 0.19 0.00 0.00 0.12 0.00 0.00 29.99 30.84 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 -1.80 0.00 -5.01 4.39 3.41 -0.99 0.15 113.62 113.76 1ugl n SER 44 Ca -0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 1ugl n SER 44 Cb 0.17 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.15 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 -1.97 -0.28 0.26 0.00 2.03 -1.17 -3.99 116.55 111.42 1ugl n ASP 46 Ca 0.10 -2.60 0.15 0.00 0.52 0.00 0.00 54.79 52.96 1ugl n ASP 46 Cb 0.60 0.27 0.58 0.00 -0.72 0.00 0.00 41.12 41.85 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 -3.64 1.61 -0.85 0.00 2.20 -1.26 -4.53 119.74 113.27 1ugl s LYS 48 Ca 0.01 -0.60 -0.23 0.00 -0.36 0.00 0.00 55.97 54.79 1ugl s LYS 48 Cb 0.09 -1.46 -0.18 0.00 -1.51 0.00 0.00 37.83 34.77 1ugl s LYS 48 CO 0.58 0.29 2.21 0.45 -0.36 0.00 0.00 175.35 178.52 1ugl n SER 49 N 2.96 1.04 -0.93 1.43 2.88 -1.26 -4.62 113.62 115.11 1ugl n SER 49 Ca -0.17 -1.66 0.12 0.00 -1.33 0.00 0.00 58.87 55.82 1ugl n SER 49 Cb 0.53 -1.48 0.10 0.00 -0.75 0.00 0.00 64.21 62.61 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81