#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 1.43 0.00 1.20 4.32 -1.26 -5.06 117.00 117.63 1ugl n LEU 2 Ca 0.00 -1.43 0.00 0.00 -0.02 0.00 0.00 56.01 54.56 1ugl n LEU 2 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1ugl n LEU 2 CO 0.00 0.36 0.00 0.23 -1.22 0.00 0.00 177.39 176.76 1ugl n MET 3 N -0.31 0.00 -3.96 3.23 2.81 -1.26 -4.62 117.12 113.01 1ugl n MET 3 Ca 0.00 0.00 -0.21 0.00 -1.81 0.00 0.00 57.70 55.68 1ugl n MET 3 Cb 0.25 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.70 1ugl n MET 3 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1ugl n LYS 4 N 0.00 0.64 -3.34 0.03 4.01 -1.26 -5.13 118.16 113.11 1ugl n LYS 4 Ca 0.00 -2.81 -0.21 0.00 -0.51 0.00 0.00 58.31 54.77 1ugl n LYS 4 Cb 0.00 1.55 -0.09 0.00 -0.51 0.00 0.00 35.03 35.98 1ugl n LYS 4 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1ugl s ARG 5 N -3.26 0.73 -0.18 1.97 1.70 -1.26 -4.92 118.95 113.73 1ugl s ARG 5 Ca 0.17 -1.35 -0.39 0.00 -0.47 0.00 0.00 55.73 53.69 1ugl s ARG 5 Cb 0.01 -0.99 -0.16 0.00 -0.57 0.00 0.00 34.95 33.24 1ugl s ARG 5 CO 0.12 -1.27 1.64 0.00 -1.08 0.00 0.00 175.30 174.72 1ugl n THR 7 N 4.05 -3.69 -1.16 0.00 -2.24 0.25 -4.65 114.28 106.85 1ugl n THR 7 Ca 0.24 1.78 -0.22 0.00 -2.27 0.00 0.00 64.05 63.58 1ugl n THR 7 Cb 0.15 -2.76 0.18 0.00 -2.10 0.00 0.00 70.33 65.80 1ugl n THR 7 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ugl n ARG 8 N -2.15 2.29 0.00 -0.78 1.74 -1.26 -4.53 116.66 111.97 1ugl n ARG 8 Ca 0.00 -2.93 0.00 0.00 -0.77 0.00 0.00 57.85 54.15 1ugl n ARG 8 Cb 0.35 -2.15 0.00 0.00 -1.02 0.00 0.00 32.46 29.64 1ugl n ARG 8 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ugl n GLY 9 N -1.06 0.53 2.82 -0.13 0.00 -1.26 -4.94 105.19 101.16 1ugl n GLY 9 Ca 0.57 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.55 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 0.00 -3.53 -2.80 1.61 -0.00 -1.26 -5.02 117.46 106.45 1ugl n PHE 10 Ca 0.00 1.52 -0.10 0.00 -0.00 0.00 0.00 57.45 58.87 1ugl n PHE 10 Cb 0.00 -3.76 0.07 0.00 -0.00 0.00 0.00 39.48 35.79 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 0.40 1.08 -4.21 -4.13 -4.01 -1.26 -4.99 116.66 99.54 1ugl n ARG 11 Ca 0.03 -2.37 -0.29 0.00 -1.04 0.00 0.00 57.85 54.18 1ugl n ARG 11 Cb 0.21 -0.92 -0.09 0.00 -3.04 0.00 0.00 32.46 28.61 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 -0.76 2.24 0.04 2.89 3.01 0.13 -5.01 119.74 122.27 1ugl s LYS 12 Ca 0.26 -1.02 -0.09 0.00 -1.01 0.00 0.00 55.97 54.11 1ugl s LYS 12 Cb 0.36 -2.34 0.00 0.00 -1.01 0.00 0.00 37.83 34.83 1ugl s LYS 12 CO -0.05 0.50 0.20 -0.48 0.51 0.00 0.00 175.35 176.02 1ugl s LEU 13 N -2.38 1.36 0.00 3.17 2.34 -1.26 -0.79 118.68 121.12 1ugl s LEU 13 Ca 0.23 -0.36 0.00 0.00 0.06 0.00 0.00 54.13 54.06 1ugl s LEU 13 Cb -0.11 0.96 0.00 0.00 -0.56 0.00 0.00 46.19 46.48 1ugl s LEU 13 CO 0.15 -0.56 0.00 0.61 -1.06 0.00 0.00 176.35 175.50 1ugl n GLY 14 N 0.69 0.79 2.36 -3.48 0.00 -0.44 -4.33 105.19 100.78 1ugl n GLY 14 Ca -0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.90 -3.81 1.61 5.02 -1.14 -1.02 118.16 117.91 1ugl n LYS 15 Ca 0.00 0.73 -0.27 0.00 -2.02 0.00 0.00 58.31 56.75 1ugl n LYS 15 Cb 0.00 -1.02 0.01 0.00 -0.02 0.00 0.00 35.03 34.00 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 -3.73 3.82 0.11 0.00 2.01 -0.19 -4.86 115.64 112.81 1ugl s THR 17 Ca 0.18 0.81 -0.35 0.00 0.31 0.00 0.00 61.69 62.65 1ugl s THR 17 Cb -0.07 -3.37 -0.14 0.00 0.01 0.00 0.00 72.50 68.93 1ugl s THR 17 CO 0.87 -0.56 1.56 0.74 -0.69 0.00 0.00 174.62 176.53 1ugl h THR 18 N 0.20 0.00 -1.08 -0.82 2.02 -1.91 -0.56 112.91 110.76 1ugl h THR 18 Ca -0.46 0.00 0.32 0.00 0.77 0.00 0.00 66.41 67.04 1ugl h THR 18 Cb 1.22 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 67.51 1ugl h THR 18 CO 0.57 0.00 0.67 0.25 0.37 0.00 0.00 175.52 177.38 1ugl h LEU 19 N -0.72 0.46 0.22 2.58 5.85 -1.93 0.27 115.31 122.03 1ugl h LEU 19 Ca 0.00 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1ugl h LEU 19 Cb 0.75 0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1ugl h LEU 19 CO -0.32 -0.04 -0.11 -0.33 -0.34 0.00 0.00 178.44 177.30 1ugl h GLU 20 N 0.33 -0.29 -0.44 1.25 4.39 -1.43 0.28 114.58 118.68 1ugl h GLU 20 Ca 0.70 0.02 0.01 0.00 0.34 0.00 0.00 59.36 60.43 1ugl h GLU 20 Cb 1.75 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 30.44 1ugl h GLU 20 CO -0.45 0.01 0.29 1.05 -1.16 0.00 0.00 179.01 178.75 1ugl h GLU 21 N -0.59 0.55 -0.53 2.33 4.11 0.05 -0.05 114.58 120.45 1ugl h GLU 21 Ca -0.03 -0.03 -0.07 0.00 0.07 0.00 0.00 59.36 59.29 1ugl h GLU 21 Cb 0.43 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 1ugl h GLU 21 CO 0.05 0.36 0.04 0.93 0.07 0.00 0.00 179.01 180.46 1ugl h GLU 22 N 0.56 0.91 -0.31 1.06 4.39 -0.33 -2.50 114.58 118.35 1ugl h GLU 22 Ca 0.16 -0.27 0.06 0.00 0.34 0.00 0.00 59.36 59.66 1ugl h GLU 22 Cb -0.03 -0.09 -0.06 0.00 -0.10 0.00 0.00 28.75 28.47 1ugl h GLU 22 CO -0.04 0.91 -0.09 -0.22 -1.16 0.00 0.00 179.01 178.41 1ugl h LYS 23 N 0.79 -0.02 -0.97 2.33 1.63 0.14 0.25 116.57 120.72 1ugl h LYS 23 Ca 0.16 0.00 0.17 0.00 -0.85 0.00 0.00 60.65 60.13 1ugl h LYS 23 Cb 0.47 0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 32.01 1ugl h LYS 23 CO 0.02 -0.01 0.61 0.00 -3.45 0.00 0.00 179.45 176.62 1ugl n LYS 25 N -4.66 0.00 -0.38 0.00 4.01 0.17 -1.86 118.16 115.44 1ugl n LYS 25 Ca 0.21 0.15 0.30 0.00 -0.51 0.00 0.00 58.31 58.45 1ugl n LYS 25 Cb 0.53 -0.70 0.58 0.00 -0.51 0.00 0.00 35.03 34.93 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 0.34 0.20 -0.18 1.35 -0.69 -0.13 112.91 113.80 1ugl h THR 26 Ca 0.00 -0.08 -0.28 0.00 -0.55 0.00 0.00 66.41 65.50 1ugl h THR 26 Cb 0.00 0.08 0.03 0.00 -1.73 0.00 0.00 68.15 66.53 1ugl h THR 26 CO 0.00 0.04 -1.24 -0.07 -0.25 0.00 0.00 175.52 174.01 1ugl h LEU 27 N 0.24 0.66 -7.51 3.87 -0.00 -1.01 -3.44 115.31 108.12 1ugl h LEU 27 Ca 0.69 -0.93 -0.57 0.00 -0.00 0.00 0.00 57.88 57.07 1ugl h LEU 27 Cb 2.01 -0.22 -0.39 0.00 -0.00 0.00 0.00 40.66 42.07 1ugl h LEU 27 CO -0.34 1.59 -0.78 -0.31 -0.00 0.00 0.00 178.44 178.60 1ugl s TYR 28 N -2.52 1.82 -1.56 1.13 2.02 -0.07 -5.04 117.35 113.14 1ugl s TYR 28 Ca -0.12 -1.35 -0.11 0.00 -0.37 0.00 0.00 57.07 55.12 1ugl s TYR 28 Cb 0.03 -1.35 -0.04 0.00 -0.40 0.00 0.00 41.96 40.20 1ugl s TYR 28 CO 0.89 -0.69 2.69 -0.35 -1.57 0.00 0.00 175.55 176.51 1ugl n PRO 29 N 4.83 3.44 -3.67 -1.71 -0.04 -1.21 -4.06 135.00 132.58 1ugl n PRO 29 Ca -0.11 -2.39 -0.21 0.00 -0.04 0.00 0.00 63.50 60.75 1ugl n PRO 29 Cb 0.46 -2.96 -0.04 0.00 -0.04 0.00 0.00 33.50 30.91 1ugl n PRO 29 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1ugl s ARG 30 N 2.41 2.51 -0.02 0.54 3.00 -1.26 -5.04 118.95 121.10 1ugl s ARG 30 Ca 0.61 -1.55 0.19 0.00 0.00 0.00 0.00 55.73 54.98 1ugl s ARG 30 Cb 0.17 -2.34 -0.25 0.00 0.00 0.00 0.00 34.95 32.52 1ugl s ARG 30 CO -0.07 -0.15 0.56 0.41 0.00 0.00 0.00 175.30 176.05 1ugl n GLY 31 N -1.48 -0.81 0.41 -3.53 0.00 -1.26 -4.27 105.19 94.25 1ugl n GLY 31 Ca 0.02 -0.47 0.06 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 -1.87 2.58 -3.83 1.61 3.00 -1.26 -4.99 117.38 112.62 1ugl n GLN 32 Ca -0.01 -2.21 -0.37 0.00 -0.01 0.00 0.00 57.00 54.41 1ugl n GLN 32 Cb 0.41 -1.38 -0.06 0.00 0.00 0.00 0.00 30.24 29.20 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 2.30 0.00 -3.40 0.00 5.66 -1.26 -4.84 114.28 112.74 1ugl n THR 34 Ca -0.19 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.41 1ugl n THR 34 Cb 0.54 0.00 -0.09 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 1.70 3.80 0.07 0.00 1.04 -0.38 -4.93 113.70 115.00 1ugl s SER 36 Ca 0.13 -0.36 -0.09 0.00 0.48 0.00 0.00 55.95 56.11 1ugl s SER 36 Cb -0.16 -1.44 0.00 0.00 0.10 0.00 0.00 66.02 64.52 1ugl s SER 36 CO 0.11 0.19 0.20 -0.62 0.98 0.00 0.00 173.24 174.10 1ugl s ASP 37 N 0.18 0.08 -0.03 7.02 2.15 -1.26 -2.35 116.67 122.47 1ugl s ASP 37 Ca -0.09 -0.54 -0.04 0.00 0.43 0.00 0.00 52.55 52.31 1ugl s ASP 37 Cb -0.16 0.32 -0.01 0.00 -0.30 0.00 0.00 42.92 42.78 1ugl s ASP 37 CO 0.06 -0.67 -0.07 -1.20 -0.17 0.00 0.00 175.17 173.11 1ugl n SER 38 N 0.20 0.51 -2.45 -0.34 7.64 -1.26 -5.01 113.62 112.91 1ugl n SER 38 Ca -0.16 0.08 -0.03 0.00 1.01 0.00 0.00 58.87 59.77 1ugl n SER 38 Cb 0.61 -0.41 0.01 0.00 -1.01 0.00 0.00 64.21 63.41 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 -3.00 0.36 -4.09 1.43 4.81 -1.26 -5.16 118.16 111.25 1ugl n LYS 39 Ca -0.03 -0.74 -0.09 0.00 -0.87 0.00 0.00 58.31 56.59 1ugl n LYS 39 Cb 0.10 0.02 -0.09 0.00 0.02 0.00 0.00 35.03 35.08 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1ugl s MET 40 N 0.05 0.85 0.62 1.64 -1.94 -1.26 -5.03 119.30 114.23 1ugl s MET 40 Ca 0.05 -1.31 0.39 0.00 -1.71 0.00 0.00 55.69 53.12 1ugl s MET 40 Cb 0.12 0.25 2.01 0.00 2.01 0.00 0.00 34.83 39.22 1ugl s MET 40 CO -0.03 -0.23 2.23 -0.97 -0.01 0.00 0.00 175.02 176.01 1ugl h ASN 41 N 2.91 0.00 -3.55 3.03 -1.24 -2.00 -3.42 115.58 111.32 1ugl h ASN 41 Ca -0.34 0.00 -0.68 0.00 0.71 0.00 0.00 56.30 55.99 1ugl h ASN 41 Cb 1.18 0.00 -0.17 0.00 0.73 0.00 0.00 38.32 40.07 1ugl h ASN 41 CO 0.60 0.01 -0.68 0.42 -1.29 0.00 0.00 177.43 176.49 1ugl s THR 42 N -4.02 3.82 0.11 -3.57 -4.23 -1.26 -1.33 115.64 105.15 1ugl s THR 42 Ca -0.03 -0.63 -0.01 0.00 -1.18 0.00 0.00 61.69 59.84 1ugl s THR 42 Cb 0.12 -2.64 0.01 0.00 1.34 0.00 0.00 72.50 71.32 1ugl s THR 42 CO 0.47 0.45 0.17 0.00 -0.54 0.00 0.00 174.62 175.17 1ugl n HIS 43 N 1.72 -0.88 -1.76 3.99 1.44 0.03 -4.79 115.22 114.97 1ugl n HIS 43 Ca -0.16 -0.69 0.00 0.00 -2.01 0.00 0.00 57.72 54.86 1ugl n HIS 43 Cb 0.53 0.19 0.00 0.00 0.12 0.00 0.00 29.99 30.83 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 -1.81 0.00 -4.08 4.39 3.41 -0.99 0.18 113.62 114.72 1ugl n SER 44 Ca -0.00 0.00 -0.32 0.00 -0.26 0.00 0.00 58.87 58.29 1ugl n SER 44 Cb 0.18 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 63.97 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 4.65 6.29 0.24 0.00 -0.08 -1.19 -0.58 116.55 125.87 1ugl n ASP 46 Ca -0.19 -3.36 0.12 0.00 -1.51 0.00 0.00 54.79 49.85 1ugl n ASP 46 Cb 0.49 -1.29 0.56 0.00 2.34 0.00 0.00 41.12 43.22 1ugl n ASP 46 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ugl s LYS 48 N -3.75 1.51 -0.84 0.00 2.20 -1.26 -4.41 119.74 113.19 1ugl s LYS 48 Ca -0.00 -0.50 -0.22 0.00 -0.36 0.00 0.00 55.97 54.89 1ugl s LYS 48 Cb 0.11 -1.33 -0.19 0.00 -1.51 0.00 0.00 37.83 34.91 1ugl s LYS 48 CO 0.61 0.19 2.25 0.45 -0.36 0.00 0.00 175.35 178.49 1ugl n SER 49 N 3.22 0.93 0.00 1.43 2.88 -1.26 -4.67 113.62 116.15 1ugl n SER 49 Ca -0.18 -1.47 0.00 0.00 -1.33 0.00 0.00 58.87 55.89 1ugl n SER 49 Cb 0.53 -1.41 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81