#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 6.58 0.17 1.20 7.94 -1.26 -4.77 117.00 126.87 1ugl n LEU 2 Ca 0.00 -5.00 -0.14 0.00 -1.11 0.00 0.00 56.01 49.75 1ugl n LEU 2 Cb 0.00 -0.87 -0.08 0.00 0.53 0.00 0.00 43.42 43.00 1ugl n LEU 2 CO 0.00 1.94 0.70 0.24 -1.11 0.00 0.00 177.39 179.16 1ugl h MET 3 N 2.93 -0.39 0.00 1.96 2.86 -2.06 -3.46 114.93 116.76 1ugl h MET 3 Ca 0.47 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 58.14 1ugl h MET 3 Cb 0.32 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1ugl h MET 3 CO 1.23 -0.18 0.00 1.63 1.06 0.00 0.00 176.91 180.65 1ugl n LYS 4 N -5.21 2.53 -3.26 1.72 4.01 -1.26 -5.14 118.16 111.54 1ugl n LYS 4 Ca -0.10 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 57.65 1ugl n LYS 4 Cb 0.21 0.00 -0.04 0.00 -0.51 0.00 0.00 35.03 34.70 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 -0.81 0.62 0.28 1.97 1.70 -1.26 -4.97 118.95 116.48 1ugl s ARG 5 Ca 0.00 -0.15 -0.30 0.00 -0.47 0.00 0.00 55.73 54.80 1ugl s ARG 5 Cb 0.00 -0.17 -0.12 0.00 -0.57 0.00 0.00 34.95 34.09 1ugl s ARG 5 CO 0.00 -1.13 1.53 0.00 -1.08 0.00 0.00 175.30 174.63 1ugl n THR 7 N 1.96 -3.13 -1.25 0.00 -2.24 -1.26 -4.62 114.28 103.75 1ugl n THR 7 Ca 0.09 1.54 -0.30 0.00 -2.27 0.00 0.00 64.05 63.11 1ugl n THR 7 Cb 0.35 -2.51 0.11 0.00 -2.10 0.00 0.00 70.33 66.18 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 -2.48 2.49 0.00 -0.78 3.00 -1.26 -4.55 116.66 113.08 1ugl n ARG 8 Ca 0.00 -3.08 0.00 0.00 -0.00 0.00 0.00 57.85 54.77 1ugl n ARG 8 Cb 0.44 -2.21 0.00 0.00 0.00 0.00 0.00 32.46 30.69 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 -0.91 1.59 2.66 5.14 0.00 -1.26 -4.86 105.19 107.54 1ugl n GLY 9 Ca 0.60 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.59 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 -0.67 -4.27 -2.69 1.61 7.35 -1.26 -5.04 117.46 112.49 1ugl n PHE 10 Ca 0.00 2.22 -0.06 0.00 -0.76 0.00 0.00 57.45 58.85 1ugl n PHE 10 Cb 0.00 -3.96 0.08 0.00 0.35 0.00 0.00 39.48 35.95 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 1.26 0.80 -4.21 -4.13 -4.01 -1.26 -5.03 116.66 100.08 1ugl n ARG 11 Ca -0.23 -1.46 -0.26 0.00 -1.04 0.00 0.00 57.85 54.86 1ugl n ARG 11 Cb 0.36 -0.30 -0.07 0.00 -3.04 0.00 0.00 32.46 29.40 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 0.16 2.45 0.05 2.89 3.01 0.12 -5.01 119.74 123.41 1ugl s LYS 12 Ca 0.18 -1.14 -0.12 0.00 -1.01 0.00 0.00 55.97 53.87 1ugl s LYS 12 Cb 0.29 -2.35 0.01 0.00 -1.01 0.00 0.00 37.83 34.77 1ugl s LYS 12 CO -0.08 0.44 0.26 -0.48 0.51 0.00 0.00 175.35 176.00 1ugl s LEU 13 N -3.15 1.06 0.00 3.17 2.34 -1.26 -1.10 118.68 119.75 1ugl s LEU 13 Ca 0.29 -0.30 0.00 0.00 0.06 0.00 0.00 54.13 54.18 1ugl s LEU 13 Cb -0.09 1.22 0.00 0.00 -0.56 0.00 0.00 46.19 46.76 1ugl s LEU 13 CO 0.20 -0.62 0.00 0.61 -1.06 0.00 0.00 176.35 175.48 1ugl n GLY 14 N 0.51 0.76 0.75 -3.48 0.00 -0.42 -4.25 105.19 99.06 1ugl n GLY 14 Ca -0.18 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.05 0.00 -3.60 1.61 5.02 -1.18 0.00 118.16 119.96 1ugl n LYS 15 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 1ugl n LYS 15 Cb 0.02 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.08 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 -3.48 4.47 0.08 0.00 2.01 0.10 -4.89 115.64 113.94 1ugl s THR 17 Ca 0.42 0.80 -0.34 0.00 0.31 0.00 0.00 61.69 62.89 1ugl s THR 17 Cb -0.13 -3.76 -0.16 0.00 0.01 0.00 0.00 72.50 68.46 1ugl s THR 17 CO 0.83 -1.05 1.59 0.74 -0.69 0.00 0.00 174.62 176.05 1ugl h THR 18 N -0.42 0.16 -0.60 -0.82 2.02 -1.89 -0.98 112.91 110.38 1ugl h THR 18 Ca -0.44 0.00 0.17 0.00 0.77 0.00 0.00 66.41 66.91 1ugl h THR 18 Cb 1.20 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 1ugl h THR 18 CO 0.61 0.00 0.67 0.25 0.37 0.00 0.00 175.52 177.43 1ugl h LEU 19 N -0.93 0.00 0.05 2.58 7.12 -1.94 0.23 115.31 122.42 1ugl h LEU 19 Ca -0.06 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 57.95 1ugl h LEU 19 Cb 0.79 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.92 1ugl h LEU 19 CO 0.00 0.00 -0.02 -0.08 -0.13 0.00 0.00 178.44 178.21 1ugl h GLU 20 N 0.00 -0.07 -0.04 1.25 4.57 -1.51 -0.03 114.58 118.76 1ugl h GLU 20 Ca 0.28 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.48 1ugl h GLU 20 Cb 1.63 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 30.23 1ugl h GLU 20 CO -0.00 0.53 0.03 1.05 -1.18 0.00 0.00 179.01 179.43 1ugl h GLU 21 N -0.92 0.00 -0.07 1.92 4.11 0.04 -0.81 114.58 118.85 1ugl h GLU 21 Ca -0.01 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.38 1ugl h GLU 21 Cb 0.62 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1ugl h GLU 21 CO 0.01 0.00 -0.12 0.93 0.07 0.00 0.00 179.01 179.91 1ugl h GLU 22 N 0.00 0.20 -0.96 1.06 4.39 -0.65 -2.70 114.58 115.91 1ugl h GLU 22 Ca 0.02 -0.12 0.21 0.00 0.34 0.00 0.00 59.36 59.80 1ugl h GLU 22 Cb 0.07 0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 28.65 1ugl h GLU 22 CO -0.00 0.69 0.62 -0.22 -1.16 0.00 0.00 179.01 178.94 1ugl h LYS 23 N -0.27 0.51 -0.18 2.33 3.64 0.41 0.25 116.57 123.27 1ugl h LYS 23 Ca 0.01 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1ugl h LYS 23 Cb 0.68 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1ugl h LYS 23 CO 0.03 0.34 0.03 0.00 -2.27 0.00 0.00 179.45 177.57 1ugl h LYS 25 N 0.08 -0.08 -0.96 0.00 6.56 -0.72 -1.68 116.57 119.79 1ugl h LYS 25 Ca 0.05 0.01 0.24 0.00 -1.06 0.00 0.00 60.65 59.89 1ugl h LYS 25 Cb 0.32 0.02 -0.13 0.00 -0.57 0.00 0.00 32.23 31.87 1ugl h LYS 25 CO 0.00 -0.05 0.50 1.79 -2.06 0.00 0.00 179.45 179.63 1ugl h THR 26 N -0.44 0.48 0.23 -0.16 1.35 -0.76 -1.37 112.91 112.24 1ugl h THR 26 Ca -0.01 -0.16 -0.32 0.00 -0.55 0.00 0.00 66.41 65.37 1ugl h THR 26 Cb 0.06 -0.03 0.04 0.00 -1.73 0.00 0.00 68.15 66.49 1ugl h THR 26 CO 0.01 0.09 -1.40 -0.07 -0.25 0.00 0.00 175.52 173.89 1ugl h LEU 27 N 0.47 0.84 -7.89 3.87 -0.00 -1.55 -3.45 115.31 107.58 1ugl h LEU 27 Ca 0.62 -0.91 -0.56 0.00 -0.00 0.00 0.00 57.88 57.03 1ugl h LEU 27 Cb 1.21 -0.27 -0.35 0.00 -0.00 0.00 0.00 40.66 41.25 1ugl h LEU 27 CO -0.52 1.68 -0.82 -0.31 -0.00 0.00 0.00 178.44 178.47 1ugl s TYR 28 N -2.65 1.79 -0.28 1.13 2.02 -0.52 -5.03 117.35 113.83 1ugl s TYR 28 Ca -0.09 -0.87 -0.04 0.00 -0.37 0.00 0.00 57.07 55.69 1ugl s TYR 28 Cb 0.04 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.22 1ugl s TYR 28 CO 0.94 -0.49 2.95 -0.35 -1.57 0.00 0.00 175.55 177.02 1ugl n PRO 29 N 4.46 2.16 -2.72 -1.71 -0.04 -1.24 -3.92 135.00 131.99 1ugl n PRO 29 Ca -0.17 -1.74 -0.27 0.00 -0.04 0.00 0.00 63.50 61.28 1ugl n PRO 29 Cb 0.51 -2.00 -0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 -0.78 3.55 -0.01 0.54 3.00 -1.26 -5.00 118.95 118.99 1ugl s ARG 30 Ca 0.56 0.16 0.22 0.00 -1.00 0.00 0.00 55.73 55.67 1ugl s ARG 30 Cb 0.33 -2.40 -0.27 0.00 0.00 0.00 0.00 34.95 32.61 1ugl s ARG 30 CO -0.12 -0.16 0.69 0.41 0.00 0.00 0.00 175.30 176.11 1ugl n GLY 31 N -2.16 -1.01 0.41 8.12 0.00 -1.26 -4.18 105.19 105.10 1ugl n GLY 31 Ca 0.00 -0.55 0.09 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.93 1.81 -3.88 1.61 1.13 -1.26 -5.02 117.38 109.84 1ugl n GLN 32 Ca -0.00 -2.74 -0.32 0.00 -1.94 0.00 0.00 57.00 51.99 1ugl n GLN 32 Cb 0.46 -1.63 -0.04 0.00 0.11 0.00 0.00 30.24 29.14 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 0.63 0.00 -3.56 0.00 5.66 -1.26 -4.89 114.28 110.86 1ugl n THR 34 Ca -0.08 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.56 1ugl n THR 34 Cb 0.52 0.00 -0.07 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 0.24 0.93 0.06 0.00 0.15 -0.25 -4.94 113.70 109.89 1ugl s SER 36 Ca 0.17 -0.14 -0.04 0.00 0.70 0.00 0.00 55.95 56.64 1ugl s SER 36 Cb -0.13 -0.32 -0.03 0.00 -1.71 0.00 0.00 66.02 63.84 1ugl s SER 36 CO 0.05 0.01 0.05 -0.62 1.20 0.00 0.00 173.24 173.93 1ugl s ASP 37 N 0.44 0.35 0.00 5.45 2.15 -1.26 -2.35 116.67 121.44 1ugl s ASP 37 Ca -0.06 -0.85 0.00 0.00 0.43 0.00 0.00 52.55 52.07 1ugl s ASP 37 Cb -0.10 0.25 0.00 0.00 -0.30 0.00 0.00 42.92 42.77 1ugl s ASP 37 CO 0.00 -0.64 0.00 -1.20 -0.17 0.00 0.00 175.17 173.16 1ugl n SER 38 N 0.09 0.00 -2.69 -0.34 7.64 -1.26 -5.01 113.62 112.05 1ugl n SER 38 Ca -0.15 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.68 1ugl n SER 38 Cb 0.61 -0.29 0.07 0.00 -1.01 0.00 0.00 64.21 63.60 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 -2.12 0.63 -1.56 1.43 4.81 -1.26 -5.16 118.16 114.93 1ugl n LYS 39 Ca 0.00 -1.27 -0.00 0.00 -0.87 0.00 0.00 58.31 56.16 1ugl n LYS 39 Cb 0.00 -0.28 -0.00 0.00 0.02 0.00 0.00 35.03 34.77 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 1ugl n MET 40 N -0.10 0.02 0.09 1.64 2.81 -1.26 -5.05 117.12 115.28 1ugl n MET 40 Ca -0.08 -0.08 0.05 0.00 -1.81 0.00 0.00 57.70 55.77 1ugl n MET 40 Cb 0.74 0.08 -0.01 0.00 -0.71 0.00 0.00 33.22 33.32 1ugl n MET 40 CO 0.00 0.00 0.00 -0.97 1.51 0.00 0.00 175.97 176.51 1ugl h ASN 41 N 0.06 0.00 -3.25 7.83 -0.00 -2.00 -3.42 115.58 114.80 1ugl h ASN 41 Ca -0.01 0.00 -0.67 0.00 -0.00 0.00 0.00 56.30 55.62 1ugl h ASN 41 Cb 0.04 0.00 -0.14 0.00 -0.00 0.00 0.00 38.32 38.22 1ugl h ASN 41 CO 0.01 0.33 -0.61 0.42 -0.00 0.00 0.00 177.43 177.58 1ugl s THR 42 N -3.09 4.42 0.16 -3.57 -4.23 -1.26 -1.30 115.64 106.77 1ugl s THR 42 Ca 0.00 -0.30 -0.02 0.00 -1.18 0.00 0.00 61.69 60.19 1ugl s THR 42 Cb 0.08 -2.90 0.01 0.00 1.34 0.00 0.00 72.50 71.03 1ugl s THR 42 CO 0.78 0.53 0.24 0.00 -0.54 0.00 0.00 174.62 175.64 1ugl n HIS 43 N 1.88 -1.04 -2.39 3.99 1.44 -0.26 -4.76 115.22 114.08 1ugl n HIS 43 Ca -0.17 -0.99 0.00 0.00 -2.01 0.00 0.00 57.72 54.55 1ugl n HIS 43 Cb 0.53 0.28 0.00 0.00 0.12 0.00 0.00 29.99 30.92 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 -1.76 0.00 -5.01 4.39 3.41 -0.99 0.15 113.62 113.81 1ugl n SER 44 Ca -0.01 -0.09 -0.19 0.00 -0.26 0.00 0.00 58.87 58.33 1ugl n SER 44 Cb 0.26 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.25 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 -2.14 -0.31 0.29 0.00 2.03 -1.13 -4.08 116.55 111.21 1ugl n ASP 46 Ca 0.13 -2.56 0.16 0.00 0.52 0.00 0.00 54.79 53.03 1ugl n ASP 46 Cb 0.61 0.28 0.89 0.00 -0.72 0.00 0.00 41.12 42.18 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 -4.38 1.20 -0.85 0.00 2.20 -1.26 -4.45 119.74 112.20 1ugl s LYS 48 Ca -0.04 -0.85 -0.22 0.00 -0.36 0.00 0.00 55.97 54.50 1ugl s LYS 48 Cb 0.14 -1.27 -0.19 0.00 -1.51 0.00 0.00 37.83 35.01 1ugl s LYS 48 CO 0.54 0.32 2.13 0.45 -0.36 0.00 0.00 175.35 178.43 1ugl n SER 49 N 1.91 0.92 -0.89 1.43 2.88 -1.26 -4.70 113.62 113.92 1ugl n SER 49 Ca -0.17 -1.80 0.11 0.00 -1.33 0.00 0.00 58.87 55.68 1ugl n SER 49 Cb 0.54 -1.48 0.09 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