#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 0.00 3.41 7.99 -1.26 -4.66 117.00 122.48 1ugl n LEU 2 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 56.01 55.76 1ugl n LEU 2 Cb 0.00 0.00 0.14 0.00 -0.11 0.00 0.00 43.42 43.45 1ugl n LEU 2 CO 0.00 0.00 0.64 1.15 -1.51 0.00 0.00 177.39 177.67 1ugl n MET 3 N 0.00 -0.49 -3.90 3.23 0.00 -1.26 -5.12 117.12 109.57 1ugl n MET 3 Ca 0.00 -2.34 -0.11 0.00 0.00 0.00 0.00 57.70 55.25 1ugl n MET 3 Cb 0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 33.22 32.25 1ugl n MET 3 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 1ugl s LYS 4 N -5.24 0.38 -0.87 3.17 2.36 -1.26 -5.11 119.74 113.16 1ugl s LYS 4 Ca 0.66 -0.40 -0.10 0.00 -2.55 0.00 0.00 55.97 53.57 1ugl s LYS 4 Cb -0.03 0.15 0.23 0.00 -1.05 0.00 0.00 37.83 37.13 1ugl s LYS 4 CO 0.45 -0.08 0.80 -0.98 1.55 0.00 0.00 175.35 177.09 1ugl s ARG 5 N -1.23 3.56 0.35 4.03 1.70 -1.26 -4.53 118.95 121.58 1ugl s ARG 5 Ca -0.13 -2.74 -0.26 0.00 -0.47 0.00 0.00 55.73 52.12 1ugl s ARG 5 Cb -0.08 -4.31 -0.13 0.00 -0.57 0.00 0.00 34.95 29.87 1ugl s ARG 5 CO 0.01 -1.26 0.98 0.00 -1.08 0.00 0.00 175.30 173.94 1ugl n THR 7 N -0.14 -2.88 -1.24 0.00 -2.24 -1.26 -4.64 114.28 101.88 1ugl n THR 7 Ca 0.09 1.44 -0.27 0.00 -2.27 0.00 0.00 64.05 63.04 1ugl n THR 7 Cb 0.35 -2.39 0.15 0.00 -2.10 0.00 0.00 70.33 66.35 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 -2.58 2.35 0.00 -0.78 1.74 -1.26 -4.63 116.66 111.50 1ugl n ARG 8 Ca 0.00 -3.06 0.00 0.00 -0.77 0.00 0.00 57.85 54.02 1ugl n ARG 8 Cb 0.47 -2.20 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 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 -1.08 1.45 2.52 -0.13 0.00 -1.26 -4.80 105.19 101.88 1ugl n GLY 9 Ca 0.60 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.60 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 -1.04 -3.12 -2.70 1.61 -0.00 -1.26 -5.03 117.46 105.92 1ugl n PHE 10 Ca 0.00 1.35 -0.06 0.00 -0.00 0.00 0.00 57.45 58.73 1ugl n PHE 10 Cb 0.00 -3.57 0.09 0.00 -0.00 0.00 0.00 39.48 36.00 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 0.28 1.25 -4.19 -4.13 -4.01 -1.26 -4.98 116.66 99.61 1ugl n ARG 11 Ca 0.03 -2.26 -0.27 0.00 -1.04 0.00 0.00 57.85 54.31 1ugl n ARG 11 Cb 0.12 -0.43 -0.08 0.00 -3.04 0.00 0.00 32.46 29.03 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 -1.04 2.45 0.04 2.89 3.01 0.15 -5.01 119.74 122.24 1ugl s LYS 12 Ca 0.22 -1.08 -0.14 0.00 -1.01 0.00 0.00 55.97 53.97 1ugl s LYS 12 Cb 0.42 -2.39 0.02 0.00 -1.01 0.00 0.00 37.83 34.87 1ugl s LYS 12 CO -0.06 0.46 0.30 -0.48 0.51 0.00 0.00 175.35 176.09 1ugl s LEU 13 N -2.93 0.88 0.00 3.17 0.05 -1.26 -0.97 118.68 117.62 1ugl s LEU 13 Ca 0.28 -0.20 0.00 0.00 0.05 0.00 0.00 54.13 54.26 1ugl s LEU 13 Cb -0.09 1.36 0.00 0.00 -2.05 0.00 0.00 46.19 45.40 1ugl s LEU 13 CO 0.19 -0.62 0.00 0.61 -0.55 0.00 0.00 176.35 175.98 1ugl n GLY 14 N 0.56 0.80 2.24 -3.48 0.00 -0.37 -4.31 105.19 100.64 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 -3.62 1.61 4.76 -1.11 -1.26 118.16 117.64 1ugl n LYS 15 Ca 0.00 0.69 -0.25 0.00 -2.87 0.00 0.00 58.31 55.88 1ugl n LYS 15 Cb 0.00 -0.96 0.04 0.00 -1.84 0.00 0.00 35.03 32.27 1ugl n LYS 15 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ugl s THR 17 N -3.55 4.36 0.13 0.00 2.01 -0.39 -4.89 115.64 113.32 1ugl s THR 17 Ca 0.29 1.19 -0.26 0.00 0.31 0.00 0.00 61.69 63.22 1ugl s THR 17 Cb -0.08 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1ugl s THR 17 CO 0.82 -0.60 1.62 0.74 -0.69 0.00 0.00 174.62 176.51 1ugl h THR 18 N 0.98 0.32 -0.44 -0.82 2.02 -1.91 0.85 112.91 113.91 1ugl h THR 18 Ca -0.47 0.00 0.13 0.00 0.77 0.00 0.00 66.41 66.84 1ugl h THR 18 Cb 1.19 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 1ugl h THR 18 CO 0.61 0.00 0.54 0.25 0.37 0.00 0.00 175.52 177.29 1ugl h LEU 19 N -0.40 0.00 0.05 2.58 7.12 -1.93 0.31 115.31 123.04 1ugl h LEU 19 Ca 0.09 0.00 -0.08 0.00 0.13 0.00 0.00 57.88 58.02 1ugl h LEU 19 Cb 0.53 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.67 1ugl h LEU 19 CO -0.32 0.00 -0.35 -0.33 -0.13 0.00 0.00 178.44 177.31 1ugl h GLU 20 N 0.00 0.11 -0.40 1.25 4.39 -1.15 -1.68 114.58 117.09 1ugl h GLU 20 Ca 0.21 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 1ugl h GLU 20 Cb 1.29 0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 30.00 1ugl h GLU 20 CO -0.00 1.09 0.07 1.05 -1.16 0.00 0.00 179.01 180.06 1ugl h GLU 21 N -0.76 0.61 -0.52 2.33 4.11 -0.14 -1.64 114.58 118.57 1ugl h GLU 21 Ca -0.06 -0.12 -0.09 0.00 0.07 0.00 0.00 59.36 59.16 1ugl h GLU 21 Cb 1.25 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.39 1ugl h GLU 21 CO 0.05 0.58 -0.01 0.93 0.07 0.00 0.00 179.01 180.63 1ugl h GLU 22 N 0.59 0.93 0.08 1.06 4.39 -0.56 -2.20 114.58 118.86 1ugl h GLU 22 Ca 0.13 -0.30 0.00 0.00 0.34 0.00 0.00 59.36 59.53 1ugl h GLU 22 Cb 0.27 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.82 1ugl h GLU 22 CO 0.00 0.95 -0.23 -0.22 -1.16 0.00 0.00 179.01 178.35 1ugl h LYS 23 N 0.79 -0.34 -0.92 2.33 1.63 -0.36 0.52 116.57 120.23 1ugl h LYS 23 Ca 0.15 0.02 0.27 0.00 -0.85 0.00 0.00 60.65 60.23 1ugl h LYS 23 Cb 0.54 0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 32.21 1ugl h LYS 23 CO 0.03 -0.23 0.72 0.00 -3.45 0.00 0.00 179.45 176.53 1ugl n LYS 25 N -4.04 0.00 0.32 0.00 4.01 -0.25 -1.46 118.16 116.75 1ugl n LYS 25 Ca 0.19 0.32 0.20 0.00 -0.51 0.00 0.00 58.31 58.52 1ugl n LYS 25 Cb 1.04 -0.94 1.10 0.00 -0.51 0.00 0.00 35.03 35.72 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 0.14 0.13 -0.18 1.35 -0.85 -2.34 112.91 111.16 1ugl h THR 26 Ca 0.00 0.00 -0.28 0.00 -0.55 0.00 0.00 66.41 65.58 1ugl h THR 26 Cb 0.00 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.37 1ugl h THR 26 CO 0.00 0.00 -1.40 -0.07 -0.25 0.00 0.00 175.52 173.80 1ugl h LEU 27 N 0.00 0.42 -7.44 3.87 -0.00 -0.68 -3.45 115.31 108.03 1ugl h LEU 27 Ca 0.01 -0.87 -0.54 0.00 -0.00 0.00 0.00 57.88 56.48 1ugl h LEU 27 Cb 0.11 -0.14 -0.39 0.00 -0.00 0.00 0.00 40.66 40.24 1ugl h LEU 27 CO -0.00 1.62 -0.77 -0.31 -0.00 0.00 0.00 178.44 178.97 1ugl s TYR 28 N -2.49 1.44 -1.59 1.13 2.02 -0.53 -5.04 117.35 112.29 1ugl s TYR 28 Ca -0.19 -1.05 -0.10 0.00 -0.37 0.00 0.00 57.07 55.37 1ugl s TYR 28 Cb 0.04 -1.19 -0.07 0.00 -0.40 0.00 0.00 41.96 40.34 1ugl s TYR 28 CO 0.78 -0.63 2.92 -0.35 -1.57 0.00 0.00 175.55 176.71 1ugl n PRO 29 N 4.94 3.78 -3.48 -1.71 -0.04 -1.24 -4.29 135.00 132.95 1ugl n PRO 29 Ca -0.10 -2.31 -0.19 0.00 -0.04 0.00 0.00 63.50 60.86 1ugl n PRO 29 Cb 0.47 -2.78 -0.01 0.00 -0.04 0.00 0.00 33.50 31.14 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 1.86 2.95 0.02 0.54 1.81 -1.26 -5.02 118.95 119.86 1ugl s ARG 30 Ca 0.69 -1.14 0.23 0.00 -1.72 0.00 0.00 55.73 53.78 1ugl s ARG 30 Cb 0.18 -2.71 -0.01 0.00 -0.45 0.00 0.00 34.95 31.96 1ugl s ARG 30 CO -0.06 0.01 0.98 0.41 -0.68 0.00 0.00 175.30 175.96 1ugl n GLY 31 N -1.61 -1.13 0.07 -3.53 0.00 -1.26 -4.02 105.19 93.71 1ugl n GLY 31 Ca 0.01 -0.46 0.07 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 -1.81 1.85 -3.74 1.61 1.13 -1.26 -5.01 117.38 110.15 1ugl n GLN 32 Ca 0.02 -2.25 -0.35 0.00 -1.94 0.00 0.00 57.00 52.48 1ugl n GLN 32 Cb 0.41 -1.35 -0.08 0.00 0.11 0.00 0.00 30.24 29.33 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 3.25 0.00 -3.53 0.00 5.66 -1.26 -4.83 114.28 113.57 1ugl n THR 34 Ca -0.16 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.46 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 0.99 2.06 0.16 0.00 0.15 -0.82 -4.93 113.70 111.32 1ugl s SER 36 Ca 0.13 -0.35 -0.09 0.00 0.70 0.00 0.00 55.95 56.34 1ugl s SER 36 Cb -0.14 -0.90 -0.01 0.00 -1.71 0.00 0.00 66.02 63.26 1ugl s SER 36 CO 0.06 0.07 0.27 -0.62 1.20 0.00 0.00 173.24 174.22 1ugl s ASP 37 N 0.52 0.05 0.00 5.45 2.15 -1.26 -2.34 116.67 121.24 1ugl s ASP 37 Ca -0.14 -0.88 0.00 0.00 0.43 0.00 0.00 52.55 51.96 1ugl s ASP 37 Cb -0.16 0.43 0.00 0.00 -0.30 0.00 0.00 42.92 42.89 1ugl s ASP 37 CO 0.04 -0.88 0.00 -0.24 -0.17 0.00 0.00 175.17 173.92 1ugl n SER 38 N -0.21 0.00 -2.63 -0.34 2.88 -1.26 -5.02 113.62 107.05 1ugl n SER 38 Ca -0.07 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.42 1ugl n SER 38 Cb 0.63 -0.26 0.05 0.00 -0.75 0.00 0.00 64.21 63.88 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 -2.44 0.63 -3.44 -1.46 4.81 -1.26 -5.16 118.16 109.84 1ugl n LYS 39 Ca 0.00 -1.14 -0.13 0.00 -0.87 0.00 0.00 58.31 56.18 1ugl n LYS 39 Cb 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.00 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 -0.57 0.29 0.12 1.64 2.81 -1.26 -5.05 117.12 115.09 1ugl n MET 40 Ca -0.16 -2.16 0.02 0.00 -1.81 0.00 0.00 57.70 53.58 1ugl n MET 40 Cb 0.73 1.81 -0.00 0.00 -0.71 0.00 0.00 33.22 35.05 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 1.35 0.00 -3.25 7.83 -1.24 -2.00 -3.41 115.58 114.86 1ugl h ASN 41 Ca -0.16 0.00 -0.67 0.00 0.71 0.00 0.00 56.30 56.18 1ugl h ASN 41 Cb 0.79 0.00 -0.13 0.00 0.73 0.00 0.00 38.32 39.71 1ugl h ASN 41 CO 0.23 0.52 -0.61 0.42 -1.29 0.00 0.00 177.43 176.69 1ugl s THR 42 N -2.95 4.41 0.16 -3.57 -4.23 -1.26 -1.23 115.64 106.96 1ugl s THR 42 Ca 0.02 -0.40 -0.02 0.00 -1.18 0.00 0.00 61.69 60.11 1ugl s THR 42 Cb 0.08 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.99 1ugl s THR 42 CO 0.76 0.45 0.24 0.00 -0.54 0.00 0.00 174.62 175.54 1ugl n HIS 43 N 1.60 -1.03 0.00 3.99 1.44 -0.14 -4.79 115.22 116.29 1ugl n HIS 43 Ca -0.16 -0.98 0.00 0.00 -2.01 0.00 0.00 57.72 54.57 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 -1.77 2.62 -4.84 4.39 3.41 -0.99 0.34 113.62 116.77 1ugl n SER 44 Ca -0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.36 1ugl n SER 44 Cb 0.26 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.17 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 -1.53 -0.05 0.27 0.00 2.03 -1.21 -4.26 116.55 111.80 1ugl n ASP 46 Ca -0.00 -2.09 0.18 0.00 0.52 0.00 0.00 54.79 53.40 1ugl n ASP 46 Cb 0.64 0.11 0.93 0.00 -0.72 0.00 0.00 41.12 42.07 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 -4.43 0.94 0.00 0.00 -0.14 -1.26 -4.34 119.74 110.50 1ugl s LYS 48 Ca -0.05 -1.32 -0.05 0.00 -1.36 0.00 0.00 55.97 53.20 1ugl s LYS 48 Cb 0.14 0.28 -0.20 0.00 -1.68 0.00 0.00 37.83 36.36 1ugl s LYS 48 CO 0.47 -0.28 3.13 -1.13 -0.76 0.00 0.00 175.35 176.78 1ugl n SER 49 N -0.10 4.90 0.00 2.83 3.41 -1.26 -4.74 113.62 118.66 1ugl n SER 49 Ca -0.08 -2.40 0.09 0.00 -0.26 0.00 0.00 58.87 56.23 1ugl n SER 49 Cb 0.63 -1.27 0.55 0.00 -0.26 0.00 0.00 64.21 63.85 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88