#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 -0.16 0.60 -4.53 1.43 -1.26 -5.18 118.68 109.57 1ugl s LEU 2 Ca 0.00 -0.71 0.05 0.00 -1.03 0.00 0.00 54.13 52.44 1ugl s LEU 2 Cb 0.00 2.63 0.09 0.00 0.03 0.00 0.00 46.19 48.94 1ugl s LEU 2 CO 0.00 -1.34 0.83 0.00 0.23 0.00 0.00 176.35 176.07 1ugl s MET 3 N -3.31 2.18 0.00 1.70 0.23 -1.26 -5.14 119.30 113.70 1ugl s MET 3 Ca 0.13 -1.34 0.00 0.00 -1.03 0.00 0.00 55.69 53.45 1ugl s MET 3 Cb -0.05 -2.54 0.00 0.00 -1.53 0.00 0.00 34.83 30.71 1ugl s MET 3 CO 0.07 -0.97 0.00 1.63 -2.03 0.00 0.00 175.02 173.72 1ugl n LYS 4 N -2.40 3.66 -2.93 3.16 4.01 -1.26 -5.11 118.16 117.28 1ugl n LYS 4 Ca 0.14 0.00 -0.15 0.00 -0.51 0.00 0.00 58.31 57.79 1ugl n LYS 4 Cb 0.61 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.13 1ugl n LYS 4 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1ugl n ARG 5 N 0.00 0.75 -1.67 1.97 1.74 -1.26 -4.98 116.66 113.21 1ugl n ARG 5 Ca 0.00 -2.35 -0.52 0.00 -0.77 0.00 0.00 57.85 54.21 1ugl n ARG 5 Cb 0.00 -1.36 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 1ugl n ARG 5 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ugl n THR 7 N 4.04 -3.61 -1.24 0.00 -2.24 -1.26 -4.65 114.28 105.32 1ugl n THR 7 Ca 0.22 1.74 -0.29 0.00 -2.27 0.00 0.00 64.05 63.45 1ugl n THR 7 Cb 0.21 -2.70 0.12 0.00 -2.10 0.00 0.00 70.33 65.86 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 -2.14 2.45 0.00 -0.78 3.00 -1.26 -4.58 116.66 113.35 1ugl n ARG 8 Ca 0.00 -3.07 0.00 0.00 -0.00 0.00 0.00 57.85 54.78 1ugl n ARG 8 Cb 0.35 -2.20 0.00 0.00 0.00 0.00 0.00 32.46 30.61 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 -0.96 1.74 2.76 5.14 0.00 -1.26 -4.87 105.19 107.74 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 -0.28 -3.82 -2.72 1.61 7.35 -1.26 -5.03 117.46 113.32 1ugl n PHE 10 Ca 0.00 1.66 -0.08 0.00 -0.76 0.00 0.00 57.45 58.27 1ugl n PHE 10 Cb 0.00 -3.95 0.10 0.00 0.35 0.00 0.00 39.48 35.98 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 0.53 0.96 -4.27 -4.13 1.85 -1.26 -5.02 116.66 105.32 1ugl n ARG 11 Ca 0.02 -1.76 -0.27 0.00 -1.00 0.00 0.00 57.85 54.84 1ugl n ARG 11 Cb 0.10 -0.71 -0.09 0.00 -1.05 0.00 0.00 32.46 30.71 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 0.23 2.11 0.08 2.89 3.01 0.95 -5.02 119.74 123.99 1ugl s LYS 12 Ca 0.21 -1.19 -0.08 0.00 -1.01 0.00 0.00 55.97 53.89 1ugl s LYS 12 Cb 0.31 -2.21 -0.00 0.00 -1.01 0.00 0.00 37.83 34.91 1ugl s LYS 12 CO -0.07 0.45 0.18 -0.48 0.51 0.00 0.00 175.35 175.94 1ugl s LEU 13 N -2.70 1.47 0.00 3.17 0.05 -1.26 -0.93 118.68 118.48 1ugl s LEU 13 Ca 0.24 -0.61 0.00 0.00 0.05 0.00 0.00 54.13 53.82 1ugl s LEU 13 Cb -0.09 0.97 0.00 0.00 -2.05 0.00 0.00 46.19 45.02 1ugl s LEU 13 CO 0.15 -0.68 0.00 0.61 -0.55 0.00 0.00 176.35 175.88 1ugl n GLY 14 N 0.12 0.90 0.63 -3.48 0.00 -0.58 -4.17 105.19 98.62 1ugl n GLY 14 Ca -0.16 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.37 0.00 -3.56 1.61 5.02 -1.16 0.22 118.16 119.93 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 0.12 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.19 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 -3.44 4.71 0.09 0.00 2.01 0.13 -4.90 115.64 114.24 1ugl s THR 17 Ca 0.47 0.65 -0.34 0.00 0.31 0.00 0.00 61.69 62.78 1ugl s THR 17 Cb -0.14 -3.85 -0.15 0.00 0.01 0.00 0.00 72.50 68.37 1ugl s THR 17 CO 0.83 -1.03 1.58 0.74 -0.69 0.00 0.00 174.62 176.04 1ugl h THR 18 N -0.17 0.08 -0.75 -0.82 2.02 -1.89 -0.71 112.91 110.67 1ugl h THR 18 Ca -0.45 0.00 0.22 0.00 0.77 0.00 0.00 66.41 66.95 1ugl h THR 18 Cb 1.20 0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1ugl h THR 18 CO 0.62 0.00 0.78 0.25 0.37 0.00 0.00 175.52 177.54 1ugl h LEU 19 N -0.90 0.00 0.03 2.58 7.12 -1.94 0.43 115.31 122.63 1ugl h LEU 19 Ca -0.04 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 57.97 1ugl h LEU 19 Cb 0.81 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.94 1ugl h LEU 19 CO -0.09 0.00 -0.02 -0.08 -0.13 0.00 0.00 178.44 178.12 1ugl h GLU 20 N 0.00 -0.04 0.00 1.25 4.57 -1.45 -0.00 114.58 118.90 1ugl h GLU 20 Ca 0.36 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.53 1ugl h GLU 20 Cb 1.91 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 30.51 1ugl h GLU 20 CO -0.00 0.56 -0.03 1.05 -1.18 0.00 0.00 179.01 179.40 1ugl h GLU 21 N -0.95 0.00 -0.05 1.92 4.11 0.08 -0.89 114.58 118.80 1ugl h GLU 21 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 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 0.03 -0.28 0.93 0.07 0.00 0.00 179.01 179.77 1ugl h GLU 22 N 0.00 0.28 -1.00 1.06 5.08 -0.27 -2.76 114.58 116.97 1ugl h GLU 22 Ca -0.00 -0.23 0.19 0.00 -1.00 0.00 0.00 59.36 58.32 1ugl h GLU 22 Cb 0.07 0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.27 1ugl h GLU 22 CO 0.00 0.88 0.61 -0.22 -1.00 0.00 0.00 179.01 179.29 1ugl h LYS 23 N -0.25 0.71 -0.09 2.33 1.63 0.41 0.28 116.57 121.59 1ugl h LYS 23 Ca -0.02 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.73 1ugl h LYS 23 Cb 0.94 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 32.40 1ugl h LYS 23 CO 0.06 0.47 0.03 0.00 -3.45 0.00 0.00 179.45 176.56 1ugl h LYS 25 N -0.03 -0.03 -1.00 0.00 6.56 -0.82 -1.45 116.57 119.80 1ugl h LYS 25 Ca 0.03 0.00 0.30 0.00 -1.06 0.00 0.00 60.65 59.92 1ugl h LYS 25 Cb 0.20 0.01 -0.14 0.00 -0.57 0.00 0.00 32.23 31.72 1ugl h LYS 25 CO -0.00 -0.02 0.57 1.79 -2.06 0.00 0.00 179.45 179.73 1ugl h THR 26 N -0.10 0.37 0.23 -0.16 1.35 -0.69 -0.04 112.91 113.87 1ugl h THR 26 Ca -0.00 -0.14 -0.33 0.00 -0.55 0.00 0.00 66.41 65.39 1ugl h THR 26 Cb 0.02 -0.06 0.03 0.00 -1.73 0.00 0.00 68.15 66.41 1ugl h THR 26 CO 0.01 0.07 -1.44 -0.07 -0.25 0.00 0.00 175.52 173.84 1ugl h LEU 27 N 0.40 0.78 -7.69 3.87 -0.00 -1.53 -3.45 115.31 107.68 1ugl h LEU 27 Ca 0.70 -0.83 -0.49 0.00 -0.00 0.00 0.00 57.88 57.26 1ugl h LEU 27 Cb 1.53 -0.25 -0.36 0.00 -0.00 0.00 0.00 40.66 41.57 1ugl h LEU 27 CO -0.57 1.65 -0.79 -0.31 -0.00 0.00 0.00 178.44 178.42 1ugl s TYR 28 N -2.62 1.21 -0.11 1.13 2.02 -0.03 -5.02 117.35 113.93 1ugl s TYR 28 Ca -0.08 -0.53 -0.02 0.00 -0.37 0.00 0.00 57.07 56.07 1ugl s TYR 28 Cb 0.05 -1.05 -0.03 0.00 -0.40 0.00 0.00 41.96 40.53 1ugl s TYR 28 CO 0.94 -0.41 2.53 -0.35 -1.57 0.00 0.00 175.55 176.70 1ugl n PRO 29 N 4.74 1.58 -1.73 -1.71 -0.04 -1.23 -3.88 135.00 132.73 1ugl n PRO 29 Ca -0.14 -0.82 -0.31 0.00 -0.04 0.00 0.00 63.50 62.19 1ugl n PRO 29 Cb 0.50 -1.51 0.04 0.00 -0.04 0.00 0.00 33.50 32.48 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 -0.25 3.15 0.00 0.54 3.00 -1.26 -4.99 118.95 119.14 1ugl s ARG 30 Ca 0.31 0.80 0.17 0.00 -1.00 0.00 0.00 55.73 56.00 1ugl s ARG 30 Cb 0.18 -2.03 -0.14 0.00 0.00 0.00 0.00 34.95 32.96 1ugl s ARG 30 CO -0.02 -0.90 0.74 0.41 0.00 0.00 0.00 175.30 175.53 1ugl n GLY 31 N -2.42 -0.42 0.16 8.12 0.00 -1.26 -4.33 105.19 105.03 1ugl n GLY 31 Ca 0.07 -0.47 0.06 0.00 0.00 0.00 0.00 46.02 45.68 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 -1.08 1.12 -3.89 1.61 6.02 -1.26 -5.05 117.38 114.84 1ugl n GLN 32 Ca 0.04 -2.04 -0.31 0.00 -0.01 0.00 0.00 57.00 54.68 1ugl n GLN 32 Cb 0.28 -1.19 -0.04 0.00 1.02 0.00 0.00 30.24 30.31 1ugl n GLN 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ugl n THR 34 N 0.30 0.00 -3.51 0.00 5.66 -1.26 -4.89 114.28 110.57 1ugl n THR 34 Ca -0.05 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.58 1ugl n THR 34 Cb 0.51 0.00 -0.08 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 0.78 1.95 0.05 0.00 0.15 -0.15 -4.95 113.70 111.54 1ugl s SER 36 Ca 0.15 -0.33 -0.00 0.00 0.70 0.00 0.00 55.95 56.47 1ugl s SER 36 Cb -0.14 -0.90 -0.03 0.00 -1.71 0.00 0.00 66.02 63.24 1ugl s SER 36 CO 0.05 0.04 -0.04 -0.62 1.20 0.00 0.00 173.24 173.88 1ugl s ASP 37 N 0.66 0.53 0.00 5.45 2.15 -1.26 -2.35 116.67 121.85 1ugl s ASP 37 Ca -0.14 -0.82 0.00 0.00 0.43 0.00 0.00 52.55 52.02 1ugl s ASP 37 Cb -0.16 0.14 0.00 0.00 -0.30 0.00 0.00 42.92 42.60 1ugl s ASP 37 CO 0.04 -0.46 0.00 -1.54 -0.17 0.00 0.00 175.17 173.04 1ugl n SER 38 N 0.64 0.00 -2.40 -0.34 3.41 -1.26 -5.00 113.62 108.67 1ugl n SER 38 Ca -0.17 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.41 1ugl n SER 38 Cb 0.59 -0.33 0.06 0.00 -0.26 0.00 0.00 64.21 64.26 1ugl n SER 38 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1ugl n LYS 39 N -2.17 0.70 -1.55 4.33 2.85 -1.26 -5.15 118.16 115.91 1ugl n LYS 39 Ca 0.00 -0.93 0.00 0.00 -1.05 0.00 0.00 58.31 56.33 1ugl n LYS 39 Cb 0.00 0.11 0.00 0.00 -0.65 0.00 0.00 35.03 34.49 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 177.40 176.02 1ugl n MET 40 N -0.71 0.03 0.02 -1.58 2.81 -1.26 -5.06 117.12 111.37 1ugl n MET 40 Ca -0.13 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.72 1ugl n MET 40 Cb 0.72 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 33.13 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 0.00 0.00 -2.90 7.83 -0.73 -2.00 -3.42 115.58 114.36 1ugl h ASN 41 Ca 0.00 0.00 -0.66 0.00 1.87 0.00 0.00 56.30 57.51 1ugl h ASN 41 Cb 0.00 0.00 -0.09 0.00 0.27 0.00 0.00 38.32 38.50 1ugl h ASN 41 CO 0.00 0.80 -0.53 0.42 -0.37 0.00 0.00 177.43 177.75 1ugl s THR 42 N -2.76 5.09 0.17 -3.57 -4.23 -1.26 -1.52 115.64 107.56 1ugl s THR 42 Ca -0.03 -0.08 -0.02 0.00 -1.18 0.00 0.00 61.69 60.38 1ugl s THR 42 Cb 0.08 -3.26 0.01 0.00 1.34 0.00 0.00 72.50 70.68 1ugl s THR 42 CO 0.81 0.51 0.27 0.00 -0.54 0.00 0.00 174.62 175.67 1ugl n HIS 43 N 1.66 -1.09 -2.21 3.99 1.44 -0.11 -4.76 115.22 114.14 1ugl n HIS 43 Ca -0.17 -1.07 0.00 0.00 -2.01 0.00 0.00 57.72 54.47 1ugl n HIS 43 Cb 0.54 0.31 0.00 0.00 0.12 0.00 0.00 29.99 30.95 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 -1.74 0.00 -5.01 4.39 3.41 -0.99 -0.04 113.62 113.64 1ugl n SER 44 Ca -0.01 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.41 1ugl n SER 44 Cb 0.28 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.28 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 -2.18 -0.29 0.29 0.00 -0.08 -1.11 -4.19 116.55 108.99 1ugl n ASP 46 Ca 0.14 -2.53 0.16 0.00 -1.51 0.00 0.00 54.79 51.05 1ugl n ASP 46 Cb 0.61 0.27 0.88 0.00 2.34 0.00 0.00 41.12 45.22 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 -4.17 0.56 -0.93 0.00 2.20 -1.26 -4.53 119.74 111.61 1ugl s LYS 48 Ca -0.03 0.03 -0.20 0.00 -0.36 0.00 0.00 55.97 55.41 1ugl s LYS 48 Cb 0.13 -0.74 -0.25 0.00 -1.51 0.00 0.00 37.83 35.45 1ugl s LYS 48 CO 0.53 -0.16 2.39 0.45 -0.36 0.00 0.00 175.35 178.19 1ugl n SER 49 N 4.40 -0.19 0.00 1.43 2.88 -1.26 -4.67 113.62 116.21 1ugl n SER 49 Ca -0.20 -0.41 0.00 0.00 -1.33 0.00 0.00 58.87 56.93 1ugl n SER 49 Cb 0.50 -0.88 0.00 0.00 -0.75 0.00 0.00 64.21 63.09 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81