#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 4.32 -1.26 -5.18 117.00 118.29 1ugl n LEU 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1ugl n LEU 2 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1ugl n LEU 2 CO 0.00 0.00 0.00 0.23 -1.22 0.00 0.00 177.39 176.40 1ugl n MET 3 N -0.99 0.11 -0.01 3.23 2.81 -1.26 -5.08 117.12 115.93 1ugl n MET 3 Ca 0.00 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.88 1ugl n MET 3 Cb 0.00 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.49 1ugl n MET 3 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1ugl n LYS 4 N 0.00 3.48 -2.62 0.03 0.00 -1.26 -5.08 118.16 112.71 1ugl n LYS 4 Ca 0.00 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.29 1ugl n LYS 4 Cb 0.00 -1.06 0.00 0.00 -0.00 0.00 0.00 35.03 33.97 1ugl n LYS 4 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1ugl n ARG 5 N -2.11 -1.28 -1.58 -1.58 0.63 -1.26 -4.88 116.66 104.60 1ugl n ARG 5 Ca -0.04 1.42 -0.53 0.00 -0.92 0.00 0.00 57.85 57.78 1ugl n ARG 5 Cb 0.58 -4.70 -0.06 0.00 0.45 0.00 0.00 32.46 28.73 1ugl n ARG 5 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ugl n THR 7 N 2.47 -0.10 -1.51 0.00 -2.24 -1.26 -4.51 114.28 107.13 1ugl n THR 7 Ca 0.19 0.52 -0.19 0.00 -2.27 0.00 0.00 64.05 62.30 1ugl n THR 7 Cb 0.18 -0.98 0.13 0.00 -2.10 0.00 0.00 70.33 67.56 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 -4.21 2.45 0.00 -0.78 1.74 -1.26 -4.73 116.66 109.87 1ugl n ARG 8 Ca -0.04 -3.38 0.00 0.00 -0.77 0.00 0.00 57.85 53.65 1ugl n ARG 8 Cb 0.67 -2.08 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 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 -1.00 1.52 2.46 -0.13 0.00 -1.26 -4.83 105.19 101.94 1ugl n GLY 9 Ca 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.48 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 -1.03 -3.29 -2.70 1.61 7.35 -1.26 -5.04 117.46 113.09 1ugl n PHE 10 Ca 0.00 1.54 -0.07 0.00 -0.76 0.00 0.00 57.45 58.16 1ugl n PHE 10 Cb 0.00 -3.52 0.10 0.00 0.35 0.00 0.00 39.48 36.41 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 0.69 1.07 -4.27 -4.13 -4.01 -1.26 -5.01 116.66 99.74 1ugl n ARG 11 Ca -0.05 -1.71 -0.25 0.00 -1.04 0.00 0.00 57.85 54.80 1ugl n ARG 11 Cb 0.08 -0.16 -0.08 0.00 -3.04 0.00 0.00 32.46 29.26 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 0.19 2.28 0.06 2.89 3.01 0.14 -5.01 119.74 123.31 1ugl s LYS 12 Ca 0.20 -1.31 -0.13 0.00 -1.01 0.00 0.00 55.97 53.73 1ugl s LYS 12 Cb 0.35 -2.21 0.02 0.00 -1.01 0.00 0.00 37.83 34.98 1ugl s LYS 12 CO -0.08 0.40 0.30 -0.48 0.51 0.00 0.00 175.35 176.00 1ugl s LEU 13 N -3.32 0.91 0.00 3.17 0.05 -1.26 -1.05 118.68 117.17 1ugl s LEU 13 Ca 0.29 -0.28 0.00 0.00 0.05 0.00 0.00 54.13 54.19 1ugl s LEU 13 Cb -0.08 1.36 0.00 0.00 -2.05 0.00 0.00 46.19 45.43 1ugl s LEU 13 CO 0.19 -0.67 0.00 0.61 -0.55 0.00 0.00 176.35 175.93 1ugl n GLY 14 N 0.37 0.55 1.28 -3.48 0.00 -0.47 -4.28 105.19 99.15 1ugl n GLY 14 Ca -0.18 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.24 -3.57 1.61 5.02 -1.10 -0.34 118.16 119.55 1ugl n LYS 15 Ca 0.00 0.20 -0.24 0.00 -2.02 0.00 0.00 58.31 56.25 1ugl n LYS 15 Cb 0.00 -0.28 0.05 0.00 -0.02 0.00 0.00 35.03 34.78 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 -3.50 4.21 0.09 0.00 2.01 0.54 -4.88 115.64 114.11 1ugl s THR 17 Ca 0.34 0.86 -0.32 0.00 0.31 0.00 0.00 61.69 62.88 1ugl s THR 17 Cb -0.09 -3.55 -0.14 0.00 0.01 0.00 0.00 72.50 68.72 1ugl s THR 17 CO 0.81 -0.80 1.60 0.74 -0.69 0.00 0.00 174.62 176.28 1ugl h THR 18 N -0.03 0.19 -0.21 -0.82 2.02 -1.90 0.11 112.91 112.27 1ugl h THR 18 Ca -0.45 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.79 1ugl h THR 18 Cb 1.20 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1ugl h THR 18 CO 0.59 0.00 0.43 0.25 0.37 0.00 0.00 175.52 177.16 1ugl h LEU 19 N -0.82 0.00 0.01 2.58 7.12 -1.94 0.25 115.31 122.51 1ugl h LEU 19 Ca -0.03 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 57.98 1ugl h LEU 19 Cb 0.73 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.86 1ugl h LEU 19 CO -0.06 0.00 -0.01 -0.08 -0.13 0.00 0.00 178.44 178.16 1ugl h GLU 20 N 0.00 -0.02 0.00 1.25 4.57 -1.31 0.11 114.58 119.18 1ugl h GLU 20 Ca 0.10 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 1ugl h GLU 20 Cb 0.97 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.55 1ugl h GLU 20 CO -0.00 0.78 -0.17 1.05 -1.18 0.00 0.00 179.01 179.50 1ugl h GLU 21 N -0.90 0.00 0.12 1.92 4.11 0.25 -1.82 114.58 118.25 1ugl h GLU 21 Ca -0.00 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.15 1ugl h GLU 21 Cb 0.81 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.07 1ugl h GLU 21 CO 0.00 0.17 -1.22 0.93 0.07 0.00 0.00 179.01 178.96 1ugl h GLU 22 N 0.00 0.36 -0.41 1.06 4.39 -0.63 -2.53 114.58 116.81 1ugl h GLU 22 Ca -0.00 -0.55 0.05 0.00 0.34 0.00 0.00 59.36 59.20 1ugl h GLU 22 Cb 0.37 0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 29.17 1ugl h GLU 22 CO 0.02 1.24 0.13 -0.22 -1.16 0.00 0.00 179.01 179.02 1ugl h LYS 23 N 0.13 0.28 -0.33 2.33 1.63 0.08 0.32 116.57 121.01 1ugl h LYS 23 Ca -0.14 -0.02 -0.14 0.00 -0.85 0.00 0.00 60.65 59.50 1ugl h LYS 23 Cb 1.92 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 33.48 1ugl h LYS 23 CO 0.21 0.18 -0.37 0.00 -3.45 0.00 0.00 179.45 176.02 1ugl h LYS 25 N 0.63 -0.05 -0.93 0.00 6.56 -0.96 -0.94 116.57 120.88 1ugl h LYS 25 Ca 0.06 0.00 0.17 0.00 -1.06 0.00 0.00 60.65 59.82 1ugl h LYS 25 Cb 0.92 0.01 -0.10 0.00 -0.57 0.00 0.00 32.23 32.49 1ugl h LYS 25 CO 0.08 -0.03 0.52 1.79 -2.06 0.00 0.00 179.45 179.75 1ugl h THR 26 N -0.25 0.69 0.17 -0.16 1.35 -0.55 -2.67 112.91 111.50 1ugl h THR 26 Ca -0.01 -0.23 -0.34 0.00 -0.55 0.00 0.00 66.41 65.28 1ugl h THR 26 Cb 0.04 -0.04 0.01 0.00 -1.73 0.00 0.00 68.15 66.43 1ugl h THR 26 CO 0.01 0.12 -1.72 -0.07 -0.25 0.00 0.00 175.52 173.61 1ugl h LEU 27 N 0.67 0.57 -8.16 3.87 4.07 -1.56 -3.44 115.31 111.33 1ugl h LEU 27 Ca 0.53 -0.86 -0.69 0.00 0.08 0.00 0.00 57.88 56.95 1ugl h LEU 27 Cb 0.81 -0.19 -0.30 0.00 1.08 0.00 0.00 40.66 42.06 1ugl h LEU 27 CO -0.39 1.72 -0.66 -0.31 -1.08 0.00 0.00 178.44 177.73 1ugl s TYR 28 N -2.59 3.22 -1.52 1.13 2.02 -0.36 -5.01 117.35 114.24 1ugl s TYR 28 Ca -0.15 -1.53 -0.12 0.00 -0.37 0.00 0.00 57.07 54.90 1ugl s TYR 28 Cb 0.06 -2.19 -0.01 0.00 -0.40 0.00 0.00 41.96 39.42 1ugl s TYR 28 CO 0.85 -0.73 2.52 -0.35 -1.57 0.00 0.00 175.55 176.27 1ugl n PRO 29 N 4.74 3.25 -3.94 -1.71 -0.04 -1.25 -4.09 135.00 131.96 1ugl n PRO 29 Ca -0.13 -2.48 -0.22 0.00 -0.04 0.00 0.00 63.50 60.62 1ugl n PRO 29 Cb 0.45 -3.07 -0.05 0.00 -0.04 0.00 0.00 33.50 30.79 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 2.63 2.50 -0.02 0.54 1.81 -1.26 -5.04 118.95 120.11 1ugl s ARG 30 Ca 0.56 -1.49 0.14 0.00 -1.72 0.00 0.00 55.73 53.23 1ugl s ARG 30 Cb 0.16 -2.28 -0.21 0.00 -0.45 0.00 0.00 34.95 32.16 1ugl s ARG 30 CO -0.08 0.05 0.37 0.41 -0.68 0.00 0.00 175.30 175.38 1ugl n GLY 31 N -1.28 -0.59 0.63 -3.53 0.00 -1.26 -4.38 105.19 94.79 1ugl n GLY 31 Ca -0.02 -0.35 0.07 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.86 2.77 -3.92 1.61 1.13 -1.26 -5.00 117.38 110.84 1ugl n GLN 32 Ca -0.02 -2.38 -0.27 0.00 -1.94 0.00 0.00 57.00 52.40 1ugl n GLN 32 Cb 0.34 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.16 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 -0.41 0.00 -3.63 0.00 5.66 -1.26 -4.90 114.28 109.74 1ugl n THR 34 Ca -0.06 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.57 1ugl n THR 34 Cb 0.53 0.00 -0.07 0.00 -1.55 0.00 0.00 70.33 69.24 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 0.19 1.24 0.08 0.00 0.15 -0.36 -4.90 113.70 110.10 1ugl s SER 36 Ca 0.14 -0.12 0.02 0.00 0.70 0.00 0.00 55.95 56.69 1ugl s SER 36 Cb -0.12 -0.46 -0.04 0.00 -1.71 0.00 0.00 66.02 63.68 1ugl s SER 36 CO 0.03 -0.11 -0.08 -0.62 1.20 0.00 0.00 173.24 173.66 1ugl s ASP 37 N 1.34 1.15 0.00 5.45 2.15 -1.26 -2.25 116.67 123.25 1ugl s ASP 37 Ca -0.04 -0.85 0.00 0.00 0.43 0.00 0.00 52.55 52.09 1ugl s ASP 37 Cb -0.13 0.06 0.00 0.00 -0.30 0.00 0.00 42.92 42.54 1ugl s ASP 37 CO -0.02 -0.35 0.00 -0.24 -0.17 0.00 0.00 175.17 174.39 1ugl n SER 38 N 0.47 0.00 -2.16 -0.34 2.88 -1.26 -5.00 113.62 108.21 1ugl n SER 38 Ca -0.16 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.37 1ugl n SER 38 Cb 0.59 -0.36 0.07 0.00 -0.75 0.00 0.00 64.21 63.75 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 -2.37 0.70 -3.96 -1.46 4.81 -1.26 -5.15 118.16 109.47 1ugl n LYS 39 Ca 0.00 -0.68 -0.08 0.00 -0.87 0.00 0.00 58.31 56.68 1ugl n LYS 39 Cb 0.00 0.20 -0.09 0.00 0.02 0.00 0.00 35.03 35.17 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 0.07 0.72 0.56 1.64 -1.94 -1.26 -5.03 119.30 114.06 1ugl s MET 40 Ca 0.05 -1.06 0.25 0.00 -1.71 0.00 0.00 55.69 53.23 1ugl s MET 40 Cb 0.23 0.28 1.53 0.00 2.01 0.00 0.00 34.83 38.87 1ugl s MET 40 CO -0.07 -0.19 2.09 -0.97 -0.01 0.00 0.00 175.02 175.88 1ugl h ASN 41 N 3.00 0.00 -2.88 3.03 -0.73 -2.00 -3.41 115.58 112.59 1ugl h ASN 41 Ca -0.34 0.00 -0.67 0.00 1.87 0.00 0.00 56.30 57.16 1ugl h ASN 41 Cb 1.17 0.00 -0.09 0.00 0.27 0.00 0.00 38.32 39.67 1ugl h ASN 41 CO 0.60 0.00 -0.53 0.42 -0.37 0.00 0.00 177.43 177.55 1ugl s THR 42 N -4.81 5.12 0.11 -3.57 -4.23 -1.26 -1.37 115.64 105.63 1ugl s THR 42 Ca -0.05 -0.02 -0.01 0.00 -1.18 0.00 0.00 61.69 60.42 1ugl s THR 42 Cb 0.17 -3.25 0.01 0.00 1.34 0.00 0.00 72.50 70.76 1ugl s THR 42 CO 0.62 0.54 0.17 0.00 -0.54 0.00 0.00 174.62 175.41 1ugl n HIS 43 N 1.77 -0.90 -1.62 3.99 1.44 -0.22 -4.75 115.22 114.94 1ugl n HIS 43 Ca -0.18 -0.70 0.00 0.00 -2.01 0.00 0.00 57.72 54.84 1ugl n HIS 43 Cb 0.54 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 -1.79 0.00 -5.02 4.39 3.41 -0.96 0.28 113.62 113.94 1ugl n SER 44 Ca -0.00 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.42 1ugl n SER 44 Cb 0.18 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 -2.08 -0.40 0.24 0.00 2.03 -1.23 -4.37 116.55 110.74 1ugl n ASP 46 Ca 0.12 -2.55 0.13 0.00 0.52 0.00 0.00 54.79 53.01 1ugl n ASP 46 Cb 0.60 0.32 0.47 0.00 -0.72 0.00 0.00 41.12 41.80 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 -3.52 1.16 -0.87 0.00 2.36 -1.26 -4.54 119.74 113.06 1ugl s LYS 48 Ca 0.02 -0.30 -0.15 0.00 -2.55 0.00 0.00 55.97 52.99 1ugl s LYS 48 Cb 0.08 -1.05 -0.24 0.00 -1.05 0.00 0.00 37.83 35.57 1ugl s LYS 48 CO 0.61 0.06 2.19 0.45 1.55 0.00 0.00 175.35 180.20 1ugl n SER 49 N 3.58 -0.19 0.00 1.43 2.88 -1.26 -4.72 113.62 115.34 1ugl n SER 49 Ca -0.21 -1.02 0.00 0.00 -1.33 0.00 0.00 58.87 56.31 1ugl n SER 49 Cb 0.53 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.99 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81