#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ugl s LEU 2 N 0.00 1.30 -0.05 3.41 1.02 -1.26 -5.12 118.68 117.98 1ugl s LEU 2 Ca 0.00 -0.55 0.02 0.00 0.02 0.00 0.00 54.13 53.62 1ugl s LEU 2 Cb 0.00 -0.76 0.01 0.00 0.02 0.00 0.00 46.19 45.47 1ugl s LEU 2 CO 0.00 -0.20 -0.09 -0.04 0.02 0.00 0.00 176.35 176.03 1ugl s MET 3 N 1.75 1.30 0.00 1.70 -1.94 -1.26 -4.96 119.30 115.88 1ugl s MET 3 Ca 0.02 -0.31 0.00 0.00 -1.71 0.00 0.00 55.69 53.69 1ugl s MET 3 Cb -0.15 -1.14 0.00 0.00 2.01 0.00 0.00 34.83 35.55 1ugl s MET 3 CO -0.07 0.02 0.00 1.63 -0.01 0.00 0.00 175.02 176.59 1ugl n LYS 4 N 3.74 0.00 -2.06 2.03 4.01 -1.26 -5.08 118.16 119.54 1ugl n LYS 4 Ca -0.23 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.56 1ugl n LYS 4 Cb 0.52 0.00 -0.02 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 -0.28 0.02 -1.51 1.97 1.85 -1.26 -5.01 116.66 112.44 1ugl n ARG 5 Ca 0.00 -0.26 -0.51 0.00 -1.00 0.00 0.00 57.85 56.08 1ugl n ARG 5 Cb 0.00 0.00 -0.05 0.00 -1.05 0.00 0.00 32.46 31.37 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 0.98 -4.87 -1.27 0.00 -2.24 -1.25 -4.79 114.28 100.84 1ugl n THR 7 Ca 0.17 2.26 -0.24 0.00 -2.27 0.00 0.00 64.05 63.97 1ugl n THR 7 Cb 0.21 -2.91 0.17 0.00 -2.10 0.00 0.00 70.33 65.70 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 0.54 2.28 0.00 -0.78 0.63 -1.26 -4.55 116.66 113.52 1ugl n ARG 8 Ca 0.00 -3.07 0.00 0.00 -0.92 0.00 0.00 57.85 53.86 1ugl n ARG 8 Cb 0.00 -2.17 0.00 0.00 0.45 0.00 0.00 32.46 30.74 1ugl n ARG 8 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ugl n GLY 9 N -1.12 0.36 2.82 5.14 0.00 -1.26 -4.89 105.19 106.24 1ugl n GLY 9 Ca 0.58 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 0.69 0.00 0.00 0.00 173.32 174.01 1ugl n PHE 10 N 0.00 -3.06 -2.86 1.61 3.72 -1.26 -5.04 117.46 110.58 1ugl n PHE 10 Ca 0.00 1.21 -0.09 0.00 -0.05 0.00 0.00 57.45 58.52 1ugl n PHE 10 Cb 0.00 -3.91 0.00 0.00 -0.94 0.00 0.00 39.48 34.63 1ugl n PHE 10 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 1ugl n ARG 11 N -0.85 0.57 -4.49 -1.08 1.85 -1.26 -5.02 116.66 106.37 1ugl n ARG 11 Ca 0.07 -2.16 -0.25 0.00 -1.00 0.00 0.00 57.85 54.51 1ugl n ARG 11 Cb 0.45 -1.48 -0.13 0.00 -1.05 0.00 0.00 32.46 30.25 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 0.60 1.28 0.05 2.89 3.01 0.02 -5.02 119.74 122.57 1ugl s LYS 12 Ca 0.31 -1.03 -0.07 0.00 -1.01 0.00 0.00 55.97 54.17 1ugl s LYS 12 Cb 0.08 -1.46 -0.01 0.00 -1.01 0.00 0.00 37.83 35.43 1ugl s LYS 12 CO -0.13 0.36 0.15 -0.48 0.51 0.00 0.00 175.35 175.76 1ugl s LEU 13 N -1.48 1.60 0.00 3.17 0.05 -1.26 -0.46 118.68 120.30 1ugl s LEU 13 Ca 0.07 -0.52 0.00 0.00 0.05 0.00 0.00 54.13 53.73 1ugl s LEU 13 Cb -0.09 0.80 0.00 0.00 -2.05 0.00 0.00 46.19 44.85 1ugl s LEU 13 CO 0.03 -0.57 0.00 0.61 -0.55 0.00 0.00 176.35 175.86 1ugl n GLY 14 N 0.54 1.28 2.79 -3.48 0.00 0.19 -4.35 105.19 102.16 1ugl n GLY 14 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.20 -0.78 -3.81 1.61 5.02 -0.79 -2.04 118.16 117.17 1ugl n LYS 15 Ca 0.00 0.83 -0.25 0.00 -2.02 0.00 0.00 58.31 56.87 1ugl n LYS 15 Cb 0.00 -1.12 0.01 0.00 -0.02 0.00 0.00 35.03 33.90 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 -3.77 4.18 0.11 0.00 2.01 -0.86 -4.85 115.64 112.46 1ugl s THR 17 Ca 0.09 1.02 -0.30 0.00 0.31 0.00 0.00 61.69 62.81 1ugl s THR 17 Cb -0.03 -3.56 -0.09 0.00 0.01 0.00 0.00 72.50 68.83 1ugl s THR 17 CO 0.86 -0.63 1.60 0.74 -0.69 0.00 0.00 174.62 176.50 1ugl h THR 18 N 0.59 0.22 -0.63 -0.82 2.02 -1.90 0.51 112.91 112.90 1ugl h THR 18 Ca -0.47 0.00 0.18 0.00 0.77 0.00 0.00 66.41 66.90 1ugl h THR 18 Cb 1.20 0.22 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 1ugl h THR 18 CO 0.59 0.00 0.65 0.25 0.37 0.00 0.00 175.52 177.38 1ugl h LEU 19 N -0.60 0.00 0.02 2.58 7.12 -1.94 0.50 115.31 123.00 1ugl h LEU 19 Ca 0.03 0.00 -0.07 0.00 0.13 0.00 0.00 57.88 57.97 1ugl h LEU 19 Cb 0.63 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.76 1ugl h LEU 19 CO -0.23 0.00 -0.34 -0.33 -0.13 0.00 0.00 178.44 177.41 1ugl h GLU 20 N 0.00 0.04 0.00 1.25 4.39 -1.27 -1.08 114.58 117.91 1ugl h GLU 20 Ca 0.30 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.93 1ugl h GLU 20 Cb 1.60 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 30.27 1ugl h GLU 20 CO -0.00 1.03 -0.01 1.05 -1.16 0.00 0.00 179.01 179.92 1ugl h GLU 21 N -0.92 0.00 0.14 2.33 4.11 0.93 -1.32 114.58 119.85 1ugl h GLU 21 Ca -0.08 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.34 1ugl h GLU 21 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1ugl h GLU 21 CO -0.02 0.01 -0.07 0.93 0.07 0.00 0.00 179.01 179.94 1ugl h GLU 22 N 0.00 -0.18 -1.16 1.06 4.39 -0.12 -2.72 114.58 115.85 1ugl h GLU 22 Ca -0.00 0.01 0.40 0.00 0.34 0.00 0.00 59.36 60.11 1ugl h GLU 22 Cb 0.03 0.04 -0.14 0.00 -0.10 0.00 0.00 28.75 28.58 1ugl h GLU 22 CO 0.00 0.29 0.70 -0.22 -1.16 0.00 0.00 179.01 178.62 1ugl h LYS 23 N -0.84 0.14 -0.14 2.33 3.64 -0.04 0.50 116.57 122.16 1ugl h LYS 23 Ca -0.02 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.23 1ugl h LYS 23 Cb 0.54 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1ugl h LYS 23 CO 0.03 0.09 -0.41 0.00 -2.27 0.00 0.00 179.45 176.90 1ugl h LYS 25 N 0.14 0.00 -0.38 0.00 6.56 0.05 -1.44 116.57 121.50 1ugl h LYS 25 Ca -0.01 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.43 1ugl h LYS 25 Cb 1.03 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.68 1ugl h LYS 25 CO 0.09 0.91 -0.34 1.79 -2.06 0.00 0.00 179.45 179.84 1ugl h THR 26 N -1.00 1.28 0.14 -0.16 1.35 -0.42 -3.31 112.91 110.78 1ugl h THR 26 Ca -0.01 -1.51 -0.29 0.00 -0.55 0.00 0.00 66.41 64.04 1ugl h THR 26 Cb 0.93 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.69 1ugl h THR 26 CO -0.01 0.50 -1.49 -0.07 -0.25 0.00 0.00 175.52 174.21 1ugl h LEU 27 N 0.73 0.46 -9.63 3.87 -0.00 -1.50 -3.48 115.31 105.76 1ugl h LEU 27 Ca 0.07 -0.88 -0.56 0.00 -0.00 0.00 0.00 57.88 56.51 1ugl h LEU 27 Cb 0.91 -0.15 -0.09 0.00 -0.00 0.00 0.00 40.66 41.34 1ugl h LEU 27 CO 0.08 1.66 -0.62 -0.31 -0.00 0.00 0.00 178.44 179.26 1ugl s TYR 28 N -2.50 2.85 0.00 1.13 2.02 -0.54 -5.03 117.35 115.27 1ugl s TYR 28 Ca -0.18 -0.17 0.00 0.00 -0.37 0.00 0.00 57.07 56.35 1ugl s TYR 28 Cb 0.05 -1.30 0.00 0.00 -0.40 0.00 0.00 41.96 40.31 1ugl s TYR 28 CO 0.79 0.57 0.44 -0.35 -1.57 0.00 0.00 175.55 175.43 1ugl n PRO 29 N -0.76 0.00 0.00 -1.71 -0.04 -1.26 -3.93 135.00 127.30 1ugl n PRO 29 Ca -0.08 0.49 0.00 0.00 -0.04 0.00 0.00 63.50 63.88 1ugl n PRO 29 Cb 0.58 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 1ugl n PRO 29 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1ugl n ARG 30 N -1.97 0.00 -2.03 0.54 1.85 -1.26 -4.79 116.66 108.99 1ugl n ARG 30 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 57.85 56.82 1ugl n ARG 30 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 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 -0.92 2.41 2.89 0.00 -1.26 -3.77 105.19 104.54 1ugl n GLY 31 Ca 0.00 0.40 -0.18 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.48 -1.59 -3.61 1.61 3.00 -1.26 -4.08 117.38 110.97 1ugl n GLN 32 Ca 0.04 1.01 -0.37 0.00 -0.01 0.00 0.00 57.00 57.67 1ugl n GLN 32 Cb 0.20 -5.48 -0.09 0.00 0.00 0.00 0.00 30.24 24.88 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 4.11 0.00 -3.53 0.00 5.66 -1.26 -4.88 114.28 114.38 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 0.52 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.21 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 1.32 -0.08 0.03 0.00 0.15 -0.87 -4.98 113.70 109.27 1ugl s SER 36 Ca 0.12 0.26 0.06 0.00 0.70 0.00 0.00 55.95 57.08 1ugl s SER 36 Cb -0.15 0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.29 1ugl s SER 36 CO 0.08 -0.14 -0.17 -0.62 1.20 0.00 0.00 173.24 173.58 1ugl s ASP 37 N 1.09 2.07 0.00 5.45 2.15 -1.26 -2.35 116.67 123.81 1ugl s ASP 37 Ca -0.09 -0.46 0.00 0.00 0.43 0.00 0.00 52.55 52.44 1ugl s ASP 37 Cb -0.11 -0.17 0.00 0.00 -0.30 0.00 0.00 42.92 42.34 1ugl s ASP 37 CO -0.05 0.12 0.10 -1.20 -0.17 0.00 0.00 175.17 173.97 1ugl n SER 38 N 2.02 0.00 0.00 -0.34 7.64 -1.26 -5.03 113.62 116.65 1ugl n SER 38 Ca -0.17 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.71 1ugl n SER 38 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 1ugl n SER 38 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1ugl n LYS 39 N 0.00 0.00 0.00 1.43 4.76 -1.26 -5.17 118.16 117.92 1ugl n LYS 39 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1ugl n LYS 39 Cb 0.35 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.54 1ugl n LYS 39 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 1ugl n MET 40 N -0.82 0.00 0.33 1.97 1.56 -1.26 -4.98 117.12 113.93 1ugl n MET 40 Ca 0.00 0.00 0.13 0.00 -0.27 0.00 0.00 57.70 57.56 1ugl n MET 40 Cb 0.00 0.00 0.72 0.00 2.15 0.00 0.00 33.22 36.09 1ugl n MET 40 CO 0.00 0.00 0.00 -0.97 -0.73 0.00 0.00 175.97 174.27 1ugl h ASN 41 N 0.00 0.00 -2.66 6.12 -1.24 -1.99 -3.40 115.58 112.41 1ugl h ASN 41 Ca 0.00 0.00 -0.67 0.00 0.71 0.00 0.00 56.30 56.34 1ugl h ASN 41 Cb 0.00 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 38.98 1ugl h ASN 41 CO 0.00 0.00 -0.47 0.42 -1.29 0.00 0.00 177.43 176.09 1ugl s THR 42 N -4.08 5.49 0.13 -3.57 -4.23 -1.26 -0.64 115.64 107.49 1ugl s THR 42 Ca -0.03 0.22 -0.02 0.00 -1.18 0.00 0.00 61.69 60.68 1ugl s THR 42 Cb 0.08 -3.41 0.01 0.00 1.34 0.00 0.00 72.50 70.51 1ugl s THR 42 CO 0.24 0.61 0.21 0.00 -0.54 0.00 0.00 174.62 175.13 1ugl n HIS 43 N 1.94 -0.96 -1.65 3.99 1.44 0.39 -4.44 115.22 115.93 1ugl n HIS 43 Ca -0.20 -0.83 0.00 0.00 -2.01 0.00 0.00 57.72 54.68 1ugl n HIS 43 Cb 0.55 0.24 0.00 0.00 0.12 0.00 0.00 29.99 30.89 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 0.00 -4.47 4.39 3.41 -0.99 -0.80 113.62 113.38 1ugl n SER 44 Ca -0.01 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.30 1ugl n SER 44 Cb 0.22 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.05 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 1.38 5.37 0.30 0.00 -0.08 -1.26 -3.84 116.55 118.42 1ugl n ASP 46 Ca -0.16 -3.75 0.17 0.00 -1.51 0.00 0.00 54.79 49.54 1ugl n ASP 46 Cb 0.52 -0.57 0.91 0.00 2.34 0.00 0.00 41.12 44.32 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 -4.20 0.76 -0.99 0.00 2.36 -1.26 -4.42 119.74 111.99 1ugl s LYS 48 Ca -0.03 -0.28 -0.24 0.00 -2.55 0.00 0.00 55.97 52.87 1ugl s LYS 48 Cb 0.13 0.33 -0.15 0.00 -1.05 0.00 0.00 37.83 37.10 1ugl s LYS 48 CO 0.52 -0.23 1.93 0.45 1.55 0.00 0.00 175.35 179.57 1ugl n SER 49 N 0.97 2.58 -0.96 1.43 2.88 -1.26 -4.79 113.62 114.47 1ugl n SER 49 Ca -0.20 -2.65 0.12 0.00 -1.33 0.00 0.00 58.87 54.80 1ugl n SER 49 Cb 0.57 -1.49 0.10 0.00 -0.75 0.00 0.00 64.21 62.64 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81