#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 -4.71 3.41 4.77 -1.26 -4.76 117.00 114.45 1ugl n LEU 2 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 1ugl n LEU 2 Cb 0.00 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.20 1ugl n LEU 2 CO 0.00 0.00 0.77 0.00 -1.33 0.00 0.00 177.39 176.83 1ugl s MET 3 N 0.00 1.90 0.00 3.23 0.23 -1.26 -5.03 119.30 118.37 1ugl s MET 3 Ca 0.00 1.70 0.00 0.00 -1.03 0.00 0.00 55.69 56.36 1ugl s MET 3 Cb 0.00 -1.81 0.00 0.00 -1.53 0.00 0.00 34.83 31.49 1ugl s MET 3 CO 0.00 -2.01 0.00 1.63 -2.03 0.00 0.00 175.02 172.61 1ugl n LYS 4 N -3.08 0.00 0.00 3.16 4.01 -1.26 -5.06 118.16 115.93 1ugl n LYS 4 Ca 0.13 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.93 1ugl n LYS 4 Cb 0.51 -0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.02 1ugl n LYS 4 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1ugl n ARG 5 N -0.04 0.00 -1.40 1.97 1.85 -1.26 -4.94 116.66 112.84 1ugl n ARG 5 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 57.85 56.24 1ugl n ARG 5 Cb 0.00 0.00 -0.11 0.00 -1.05 0.00 0.00 32.46 31.30 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 5.89 -5.03 -1.21 0.00 -2.24 -1.26 -4.75 114.28 105.67 1ugl n THR 7 Ca 0.47 2.32 -0.23 0.00 -2.27 0.00 0.00 64.05 64.34 1ugl n THR 7 Cb -0.02 -3.09 0.18 0.00 -2.10 0.00 0.00 70.33 65.30 1ugl n THR 7 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1ugl n ARG 8 N -0.19 2.29 0.00 -0.78 1.85 -1.26 -4.53 116.66 114.04 1ugl n ARG 8 Ca 0.00 -3.00 0.00 0.00 -1.00 0.00 0.00 57.85 53.85 1ugl n ARG 8 Cb 0.00 -2.18 0.00 0.00 -1.05 0.00 0.00 32.46 29.23 1ugl n ARG 8 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ugl n GLY 9 N -1.11 -0.46 2.84 2.89 0.00 -1.26 -4.96 105.19 103.13 1ugl n GLY 9 Ca 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.56 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 -3.48 -2.77 1.61 -0.00 -1.26 -5.02 117.46 106.54 1ugl n PHE 10 Ca 0.00 1.49 -0.09 0.00 -0.00 0.00 0.00 57.45 58.84 1ugl n PHE 10 Cb 0.00 -3.71 0.08 0.00 -0.00 0.00 0.00 39.48 35.85 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 0.36 1.05 -4.22 -4.13 -4.01 -1.26 -4.99 116.66 99.46 1ugl n ARG 11 Ca 0.04 -2.08 -0.23 0.00 -1.04 0.00 0.00 57.85 54.53 1ugl n ARG 11 Cb 0.23 -0.91 -0.06 0.00 -3.04 0.00 0.00 32.46 28.68 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 -0.09 2.53 0.09 2.89 3.01 0.12 -5.01 119.74 123.28 1ugl s LYS 12 Ca 0.24 -1.24 -0.13 0.00 -1.01 0.00 0.00 55.97 53.83 1ugl s LYS 12 Cb 0.32 -2.33 0.02 0.00 -1.01 0.00 0.00 37.83 34.83 1ugl s LYS 12 CO -0.06 0.39 0.31 -0.48 0.51 0.00 0.00 175.35 176.03 1ugl s LEU 13 N -3.60 0.84 0.00 3.17 0.05 -1.26 -1.01 118.68 116.88 1ugl s LEU 13 Ca 0.31 -0.38 0.00 0.00 0.05 0.00 0.00 54.13 54.12 1ugl s LEU 13 Cb -0.07 1.46 0.00 0.00 -2.05 0.00 0.00 46.19 45.53 1ugl s LEU 13 CO 0.21 -0.75 0.00 0.61 -0.55 0.00 0.00 176.35 175.88 1ugl n GLY 14 N 0.06 0.55 1.23 -3.48 0.00 -0.54 -4.28 105.19 98.73 1ugl n GLY 14 Ca -0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.21 -3.56 1.61 5.02 -1.07 -0.46 118.16 119.49 1ugl n LYS 15 Ca 0.00 0.19 -0.22 0.00 -2.02 0.00 0.00 58.31 56.26 1ugl n LYS 15 Cb 0.00 -0.26 0.05 0.00 -0.02 0.00 0.00 35.03 34.80 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 -3.52 4.09 0.12 0.00 2.01 0.39 -4.91 115.64 113.82 1ugl s THR 17 Ca 0.24 1.20 -0.24 0.00 0.31 0.00 0.00 61.69 63.20 1ugl s THR 17 Cb -0.06 -3.53 -0.05 0.00 0.01 0.00 0.00 72.50 68.87 1ugl s THR 17 CO 0.80 -0.38 1.66 0.74 -0.69 0.00 0.00 174.62 176.74 1ugl h THR 18 N 1.36 0.54 -0.17 -0.82 2.02 -1.90 0.10 112.91 114.05 1ugl h THR 18 Ca -0.48 0.00 0.05 0.00 0.77 0.00 0.00 66.41 66.74 1ugl h THR 18 Cb 1.20 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1ugl h THR 18 CO 0.60 0.00 0.39 0.25 0.37 0.00 0.00 175.52 177.12 1ugl h LEU 19 N -0.30 0.00 0.01 2.58 7.12 -1.93 0.33 115.31 123.12 1ugl h LEU 19 Ca 0.06 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 58.05 1ugl h LEU 19 Cb 0.38 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.52 1ugl h LEU 19 CO -0.19 0.00 -0.08 1.05 -0.13 0.00 0.00 178.44 179.09 1ugl h GLU 20 N 0.00 0.03 0.00 1.25 -0.00 -1.11 0.14 114.58 114.89 1ugl h GLU 20 Ca 0.08 -0.05 -0.03 0.00 -0.00 0.00 0.00 59.36 59.36 1ugl h GLU 20 Cb 0.85 0.02 -0.00 0.00 -0.00 0.00 0.00 28.75 29.62 1ugl h GLU 20 CO -0.00 1.02 -0.15 1.05 -0.00 0.00 0.00 179.01 180.93 1ugl h GLU 21 N -0.93 0.00 0.08 1.06 4.11 -0.14 -1.34 114.58 117.42 1ugl h GLU 21 Ca -0.01 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.16 1ugl h GLU 21 Cb 1.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1ugl h GLU 21 CO 0.02 0.15 -1.13 0.93 0.07 0.00 0.00 179.01 179.04 1ugl h GLU 22 N 0.00 0.24 -0.53 1.06 4.39 -0.48 -2.72 114.58 116.55 1ugl h GLU 22 Ca -0.00 -0.37 -0.00 0.00 0.34 0.00 0.00 59.36 59.32 1ugl h GLU 22 Cb 0.30 0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 29.06 1ugl h GLU 22 CO 0.02 1.15 0.32 -0.22 -1.16 0.00 0.00 179.01 179.12 1ugl h LYS 23 N 0.09 0.71 0.11 2.33 3.64 0.43 0.22 116.57 124.09 1ugl h LYS 23 Ca -0.10 -0.05 -0.28 0.00 -1.27 0.00 0.00 60.65 58.94 1ugl h LYS 23 Cb 1.85 -0.15 0.02 0.00 -0.41 0.00 0.00 32.23 33.53 1ugl h LYS 23 CO 0.18 0.49 -1.21 0.00 -2.27 0.00 0.00 179.45 176.64 1ugl h LYS 25 N 0.20 0.12 0.14 0.00 6.56 -1.12 0.16 116.57 122.64 1ugl h LYS 25 Ca -0.16 -0.15 -0.33 0.00 -1.06 0.00 0.00 60.65 58.95 1ugl h LYS 25 Cb 1.89 0.05 -0.00 0.00 -0.57 0.00 0.00 32.23 33.60 1ugl h LYS 25 CO 0.22 0.95 -1.67 1.79 -2.06 0.00 0.00 179.45 178.68 1ugl h THR 26 N 0.06 1.01 0.12 -0.16 1.35 -0.69 -3.39 112.91 111.22 1ugl h THR 26 Ca -0.04 -2.64 -0.27 0.00 -0.55 0.00 0.00 66.41 62.91 1ugl h THR 26 Cb 1.57 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 70.72 1ugl h THR 26 CO 0.13 0.83 -1.37 -0.07 -0.25 0.00 0.00 175.52 174.79 1ugl h LEU 27 N 0.08 0.41 -9.75 3.87 -0.00 -1.39 -3.48 115.31 105.06 1ugl h LEU 27 Ca -0.30 -0.87 -0.53 0.00 -0.00 0.00 0.00 57.88 56.17 1ugl h LEU 27 Cb 2.06 -0.13 -0.07 0.00 -0.00 0.00 0.00 40.66 42.51 1ugl h LEU 27 CO 0.16 1.61 -0.57 -0.31 -0.00 0.00 0.00 178.44 179.33 1ugl s TYR 28 N -2.48 2.83 -0.02 1.13 2.02 0.56 -5.05 117.35 116.35 1ugl s TYR 28 Ca -0.19 -0.23 -0.03 0.00 -0.37 0.00 0.00 57.07 56.25 1ugl s TYR 28 Cb 0.04 -1.40 -0.01 0.00 -0.40 0.00 0.00 41.96 40.18 1ugl s TYR 28 CO 0.78 0.49 0.30 -1.00 -1.57 0.00 0.00 175.55 174.55 1ugl h PRO 29 N 1.64 -0.09 0.00 -1.71 0.13 -1.82 -3.34 132.00 126.81 1ugl h PRO 29 Ca -0.45 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1ugl h PRO 29 Cb 1.25 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1ugl h PRO 29 CO 0.61 -0.06 0.00 2.89 -0.23 0.00 0.00 178.00 181.21 1ugl n ARG 30 N -2.80 0.00 -2.24 0.86 1.85 -1.26 -4.81 116.66 108.26 1ugl n ARG 30 Ca -0.01 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.81 1ugl n ARG 30 Cb 0.04 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.45 1ugl n ARG 30 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ugl n GLY 31 N 0.00 -0.94 2.45 2.89 0.00 -1.26 -3.60 105.19 104.72 1ugl n GLY 31 Ca 0.00 0.46 -0.19 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.72 -1.59 -3.62 1.61 1.13 -1.26 -4.08 117.38 108.85 1ugl n GLN 32 Ca 0.04 1.05 -0.37 0.00 -1.94 0.00 0.00 57.00 55.78 1ugl n GLN 32 Cb 0.32 -5.54 -0.09 0.00 0.11 0.00 0.00 30.24 25.04 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 4.24 0.00 -3.62 0.00 5.66 -1.26 -4.86 114.28 114.44 1ugl n THR 34 Ca -0.14 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.50 1ugl n THR 34 Cb 0.52 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.22 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 0.52 0.60 0.08 0.00 0.15 -0.56 -4.91 113.70 109.58 1ugl s SER 36 Ca 0.12 0.43 0.02 0.00 0.70 0.00 0.00 55.95 57.23 1ugl s SER 36 Cb -0.12 0.44 -0.03 0.00 -1.71 0.00 0.00 66.02 64.59 1ugl s SER 36 CO 0.02 -0.24 -0.08 -0.62 1.20 0.00 0.00 173.24 173.51 1ugl s ASP 37 N 2.34 1.14 -0.02 5.45 2.15 -1.26 -2.19 116.67 124.28 1ugl s ASP 37 Ca 0.02 -0.81 -0.02 0.00 0.43 0.00 0.00 52.55 52.17 1ugl s ASP 37 Cb -0.12 0.05 -0.01 0.00 -0.30 0.00 0.00 42.92 42.54 1ugl s ASP 37 CO -0.07 -0.32 -0.04 -0.24 -0.17 0.00 0.00 175.17 174.33 1ugl n SER 38 N 0.60 0.24 -2.48 -0.34 2.88 -1.26 -4.99 113.62 108.27 1ugl n SER 38 Ca -0.17 0.04 -0.04 0.00 -1.33 0.00 0.00 58.87 57.38 1ugl n SER 38 Cb 0.58 -0.53 0.04 0.00 -0.75 0.00 0.00 64.21 63.55 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 -2.74 0.59 -3.81 -1.46 4.81 -1.26 -5.16 118.16 109.14 1ugl n LYS 39 Ca -0.02 -0.95 -0.09 0.00 -0.87 0.00 0.00 58.31 56.38 1ugl n LYS 39 Cb 0.06 0.05 -0.06 0.00 0.02 0.00 0.00 35.03 35.10 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 0.08 1.04 0.50 1.64 -1.94 -1.26 -5.03 119.30 114.33 1ugl s MET 40 Ca 0.08 -0.93 0.15 0.00 -1.71 0.00 0.00 55.69 53.29 1ugl s MET 40 Cb 0.20 0.41 1.21 0.00 2.01 0.00 0.00 34.83 38.65 1ugl s MET 40 CO -0.05 -0.38 2.12 -0.97 -0.01 0.00 0.00 175.02 175.73 1ugl h ASN 41 N 2.53 0.08 -2.70 3.03 -0.73 -2.00 -3.42 115.58 112.37 1ugl h ASN 41 Ca -0.33 -0.00 -0.66 0.00 1.87 0.00 0.00 56.30 57.18 1ugl h ASN 41 Cb 1.23 -0.02 -0.07 0.00 0.27 0.00 0.00 38.32 39.73 1ugl h ASN 41 CO 0.50 0.06 -0.46 0.42 -0.37 0.00 0.00 177.43 177.58 1ugl s THR 42 N -5.14 5.47 0.11 -3.57 -4.23 -1.26 -1.47 115.64 105.55 1ugl s THR 42 Ca -0.06 0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 60.70 1ugl s THR 42 Cb 0.17 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.59 1ugl s THR 42 CO 0.69 0.61 0.17 0.00 -0.54 0.00 0.00 174.62 175.55 1ugl n HIS 43 N 2.05 -0.90 -1.14 3.99 1.44 -0.18 -4.78 115.22 115.71 1ugl n HIS 43 Ca -0.19 -0.71 0.00 0.00 -2.01 0.00 0.00 57.72 54.81 1ugl n HIS 43 Cb 0.55 0.20 0.00 0.00 0.12 0.00 0.00 29.99 30.85 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 0.43 -4.88 4.39 3.41 -0.93 0.14 113.62 114.38 1ugl n SER 44 Ca -0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.37 1ugl n SER 44 Cb 0.19 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 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 -1.66 1.15 0.30 0.00 2.03 -1.26 -4.46 116.55 112.64 1ugl n ASP 46 Ca 0.02 -2.04 0.19 0.00 0.52 0.00 0.00 54.79 53.47 1ugl n ASP 46 Cb 0.63 -0.32 1.01 0.00 -0.72 0.00 0.00 41.12 41.72 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 -4.32 0.34 -0.85 0.00 2.36 -1.26 -4.43 119.74 111.58 1ugl s LYS 48 Ca -0.05 0.16 -0.24 0.00 -2.55 0.00 0.00 55.97 53.29 1ugl s LYS 48 Cb 0.13 0.16 -0.18 0.00 -1.05 0.00 0.00 37.83 36.89 1ugl s LYS 48 CO 0.43 -0.06 2.27 0.45 1.55 0.00 0.00 175.35 180.00 1ugl n SER 49 N 2.56 1.26 0.00 1.43 2.88 -1.26 -4.77 113.62 115.71 1ugl n SER 49 Ca -0.15 -1.65 0.00 0.00 -1.33 0.00 0.00 58.87 55.74 1ugl n SER 49 Cb 0.58 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.49 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81