#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 -0.71 -0.05 3.41 2.96 -1.26 -5.06 118.68 117.96 1ugl s LEU 2 Ca 0.00 0.95 -0.08 0.00 -0.22 0.00 0.00 54.13 54.78 1ugl s LEU 2 Cb 0.00 1.43 -0.03 0.00 0.50 0.00 0.00 46.19 48.09 1ugl s LEU 2 CO 0.00 -0.24 -0.15 0.23 -1.32 0.00 0.00 176.35 174.87 1ugl n MET 3 N 5.39 0.22 -0.79 1.98 2.81 -1.26 -5.10 117.12 120.38 1ugl n MET 3 Ca -0.08 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1ugl n MET 3 Cb 0.49 -0.83 0.00 0.00 -0.71 0.00 0.00 33.22 32.17 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 -3.55 3.16 -3.28 0.03 -0.00 -1.26 -5.14 118.16 108.11 1ugl n LYS 4 Ca -0.06 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.17 1ugl n LYS 4 Cb 0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 35.03 35.20 1ugl n LYS 4 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 1ugl s ARG 5 N -0.18 0.62 -0.04 -1.58 1.70 -1.26 -4.95 118.95 113.26 1ugl s ARG 5 Ca 0.00 -0.30 -0.36 0.00 -0.47 0.00 0.00 55.73 54.60 1ugl s ARG 5 Cb 0.00 -0.29 -0.14 0.00 -0.57 0.00 0.00 34.95 33.95 1ugl s ARG 5 CO 0.00 -1.14 1.66 0.00 -1.08 0.00 0.00 175.30 174.74 1ugl n THR 7 N 4.02 -0.15 -1.75 0.00 5.66 -1.25 -4.44 114.28 116.37 1ugl n THR 7 Ca 0.21 0.22 -0.38 0.00 -3.05 0.00 0.00 64.05 61.06 1ugl n THR 7 Cb 0.23 -0.37 0.05 0.00 -1.55 0.00 0.00 70.33 68.68 1ugl n THR 7 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1ugl n ARG 8 N -3.07 2.71 -1.42 1.09 1.74 -1.26 -4.64 116.66 111.81 1ugl n ARG 8 Ca -0.02 -3.40 0.00 0.00 -0.77 0.00 0.00 57.85 53.65 1ugl n ARG 8 Cb 0.38 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.56 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 -0.58 0.99 2.35 -0.13 0.00 -1.26 -4.69 105.19 101.86 1ugl n GLY 9 Ca 0.56 -0.42 -0.02 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.65 -3.15 -2.73 1.61 7.35 -1.26 -5.04 117.46 112.60 1ugl n PHE 10 Ca 0.00 1.62 -0.09 0.00 -0.76 0.00 0.00 57.45 58.21 1ugl n PHE 10 Cb 0.29 -3.34 0.06 0.00 0.35 0.00 0.00 39.48 36.84 1ugl n PHE 10 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 1ugl n ARG 11 N 0.87 1.13 -4.11 -4.13 0.00 -1.26 -5.01 116.66 104.17 1ugl n ARG 11 Ca -0.15 -2.68 -0.14 0.00 -0.00 0.00 0.00 57.85 54.88 1ugl n ARG 11 Cb 0.23 -0.87 -0.11 0.00 0.00 0.00 0.00 32.46 31.72 1ugl n ARG 11 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1ugl s LYS 12 N -1.68 0.65 0.04 -0.14 3.01 0.03 -4.98 119.74 116.67 1ugl s LYS 12 Ca 0.26 -0.90 -0.15 0.00 -1.01 0.00 0.00 55.97 54.17 1ugl s LYS 12 Cb 0.42 -0.40 0.03 0.00 -1.01 0.00 0.00 37.83 36.86 1ugl s LYS 12 CO -0.02 0.07 0.34 -0.48 0.51 0.00 0.00 175.35 175.77 1ugl s LEU 13 N -1.88 0.72 0.00 3.17 0.05 -1.26 -1.04 118.68 118.44 1ugl s LEU 13 Ca -0.04 -0.11 0.00 0.00 0.05 0.00 0.00 54.13 54.02 1ugl s LEU 13 Cb -0.07 1.48 0.00 0.00 -2.05 0.00 0.00 46.19 45.54 1ugl s LEU 13 CO 0.00 -0.62 0.00 0.61 -0.55 0.00 0.00 176.35 175.79 1ugl n GLY 14 N 0.59 0.64 1.63 -3.48 0.00 -0.03 -4.21 105.19 100.31 1ugl n GLY 14 Ca -0.19 -0.27 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 1ugl n GLY 14 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ugl n LYS 15 N 0.00 -0.45 -3.69 1.61 0.00 -1.03 -0.25 118.16 114.35 1ugl n LYS 15 Ca 0.00 0.37 -0.23 0.00 -0.00 0.00 0.00 58.31 58.44 1ugl n LYS 15 Cb 0.00 -0.51 0.03 0.00 -0.00 0.00 0.00 35.03 34.55 1ugl n LYS 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ugl s THR 17 N -3.64 3.79 0.13 0.00 2.01 0.65 -4.85 115.64 113.73 1ugl s THR 17 Ca 0.13 0.65 -0.25 0.00 0.31 0.00 0.00 61.69 62.53 1ugl s THR 17 Cb -0.04 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 1ugl s THR 17 CO 0.82 -0.70 1.64 0.74 -0.69 0.00 0.00 174.62 176.44 1ugl h THR 18 N -0.52 0.44 -0.30 -0.82 2.02 -1.89 0.11 112.91 111.94 1ugl h THR 18 Ca -0.45 0.00 0.09 0.00 0.77 0.00 0.00 66.41 66.82 1ugl h THR 18 Cb 1.22 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1ugl h THR 18 CO 0.56 0.00 0.53 0.25 0.37 0.00 0.00 175.52 177.23 1ugl h LEU 19 N -0.34 0.00 0.01 2.58 7.12 -1.93 0.46 115.31 123.21 1ugl h LEU 19 Ca 0.08 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.09 1ugl h LEU 19 Cb 0.45 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.58 1ugl h LEU 19 CO -0.26 0.00 -0.00 -0.08 -0.13 0.00 0.00 178.44 177.97 1ugl h GLU 20 N 0.00 -0.01 0.00 1.25 4.57 -1.10 0.15 114.58 119.44 1ugl h GLU 20 Ca 0.14 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.31 1ugl h GLU 20 Cb 1.21 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.80 1ugl h GLU 20 CO -0.00 0.73 -0.06 1.05 -1.18 0.00 0.00 179.01 179.54 1ugl h GLU 21 N -0.98 0.00 0.11 1.92 4.11 -0.28 -1.76 114.58 117.70 1ugl h GLU 21 Ca -0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.25 1ugl h GLU 21 Cb 0.74 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.01 1ugl h GLU 21 CO 0.00 0.06 -0.76 0.93 0.07 0.00 0.00 179.01 179.31 1ugl h GLU 22 N 0.00 0.32 -0.89 1.06 5.08 -0.22 -2.69 114.58 117.23 1ugl h GLU 22 Ca -0.00 -0.49 0.24 0.00 -1.00 0.00 0.00 59.36 58.10 1ugl h GLU 22 Cb 0.21 0.18 -0.14 0.00 0.50 0.00 0.00 28.75 29.50 1ugl h GLU 22 CO 0.01 1.21 0.31 -0.22 -1.00 0.00 0.00 179.01 179.32 1ugl h LYS 23 N -0.32 0.26 -0.14 2.33 1.63 0.19 0.26 116.57 120.79 1ugl h LYS 23 Ca -0.13 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.56 1ugl h LYS 23 Cb 1.57 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 33.14 1ugl h LYS 23 CO 0.14 0.17 -0.29 0.00 -3.45 0.00 0.00 179.45 176.03 1ugl h LYS 25 N 0.04 -0.64 -0.36 0.00 6.56 -0.65 0.17 116.57 121.69 1ugl h LYS 25 Ca 0.00 0.04 -0.01 0.00 -1.06 0.00 0.00 60.65 59.63 1ugl h LYS 25 Cb 0.88 0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 32.67 1ugl h LYS 25 CO 0.06 -0.43 0.20 1.79 -2.06 0.00 0.00 179.45 179.01 1ugl h THR 26 N -1.15 1.14 0.13 -0.16 1.35 -0.75 -3.22 112.91 110.25 1ugl h THR 26 Ca -0.07 -0.37 -0.33 0.00 -0.55 0.00 0.00 66.41 65.09 1ugl h THR 26 Cb 0.51 0.73 -0.01 0.00 -1.73 0.00 0.00 68.15 67.65 1ugl h THR 26 CO 0.11 0.15 -1.69 -0.07 -0.25 0.00 0.00 175.52 173.77 1ugl h LEU 27 N 0.46 0.44 -7.08 3.87 4.07 -1.55 -3.42 115.31 112.10 1ugl h LEU 27 Ca 0.13 -0.69 -0.66 0.00 0.08 0.00 0.00 57.88 56.74 1ugl h LEU 27 Cb 0.06 -0.14 -0.39 0.00 1.08 0.00 0.00 40.66 41.27 1ugl h LEU 27 CO -0.02 1.59 -0.34 -1.22 -1.08 0.00 0.00 178.44 177.36 1ugl n TYR 28 N -3.47 3.67 -1.55 1.13 4.01 0.59 -5.03 117.16 116.51 1ugl n TYR 28 Ca -0.21 -4.18 -0.15 0.00 -0.16 0.00 0.00 57.90 53.19 1ugl n TYR 28 Cb 1.06 -0.84 -0.08 0.00 -0.31 0.00 0.00 39.34 39.16 1ugl n TYR 28 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1ugl n PRO 29 N 1.95 0.54 -3.06 -0.72 -0.02 -1.22 -4.33 135.00 128.15 1ugl n PRO 29 Ca 0.22 -0.74 -0.10 0.00 -2.02 0.00 0.00 63.50 60.86 1ugl n PRO 29 Cb 0.36 -3.47 -0.04 0.00 -0.02 0.00 0.00 33.50 30.34 1ugl n PRO 29 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1ugl n ARG 30 N 8.56 0.32 -0.02 -0.52 5.12 -1.26 -5.08 116.66 123.78 1ugl n ARG 30 Ca 0.48 -1.57 -0.03 0.00 -1.93 0.00 0.00 57.85 54.80 1ugl n ARG 30 Cb 0.41 1.19 -0.03 0.00 -1.16 0.00 0.00 32.46 32.87 1ugl n ARG 30 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ugl n GLY 31 N -0.04 -0.15 1.63 -0.13 0.00 -1.26 -4.59 105.19 100.65 1ugl n GLY 31 Ca 0.02 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.38 3.80 -3.69 1.61 6.02 -1.26 -4.90 117.38 116.57 1ugl n GLN 32 Ca -0.08 -2.92 -0.36 0.00 -0.01 0.00 0.00 57.00 53.63 1ugl n GLN 32 Cb 0.62 -1.92 -0.08 0.00 1.02 0.00 0.00 30.24 29.88 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 3.76 0.00 -3.61 0.00 5.66 -1.26 -4.82 114.28 114.02 1ugl n THR 34 Ca -0.15 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.48 1ugl n THR 34 Cb 0.52 0.00 -0.06 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 -0.34 0.15 0.16 0.00 0.15 -0.80 -4.95 113.70 108.07 1ugl s SER 36 Ca 0.18 0.54 0.05 0.00 0.70 0.00 0.00 55.95 57.43 1ugl s SER 36 Cb -0.14 0.55 -0.04 0.00 -1.71 0.00 0.00 66.02 64.69 1ugl s SER 36 CO 0.07 -0.21 0.12 1.51 1.20 0.00 0.00 173.24 175.92 1ugl s ASP 37 N 1.97 5.44 0.00 5.45 1.47 -1.26 -2.28 116.67 127.45 1ugl s ASP 37 Ca -0.03 -0.15 0.00 0.00 1.18 0.00 0.00 52.55 53.55 1ugl s ASP 37 Cb -0.11 -1.40 0.00 0.00 -0.34 0.00 0.00 42.92 41.07 1ugl s ASP 37 CO -0.08 0.08 0.00 -0.24 0.68 0.00 0.00 175.17 175.61 1ugl n SER 38 N -0.26 0.00 0.00 2.11 2.88 -1.26 -5.02 113.62 112.07 1ugl n SER 38 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 1ugl n SER 38 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 1ugl n SER 38 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1ugl n LYS 39 N -1.24 1.44 0.00 -1.46 4.76 -1.25 -5.10 118.16 115.30 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 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1ugl n LYS 39 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1ugl n MET 40 N 0.00 0.00 0.11 1.97 2.81 -1.26 -4.87 117.12 115.88 1ugl n MET 40 Ca 0.00 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.02 1ugl n MET 40 Cb 0.00 0.00 0.31 0.00 -0.71 0.00 0.00 33.22 32.82 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 -2.69 7.83 -0.73 -1.99 -3.44 115.58 114.56 1ugl h ASN 41 Ca 0.00 -0.05 -0.66 0.00 1.87 0.00 0.00 56.30 57.46 1ugl h ASN 41 Cb 0.00 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 38.52 1ugl h ASN 41 CO 0.00 0.03 -0.48 0.42 -0.37 0.00 0.00 177.43 177.03 1ugl s THR 42 N -3.14 5.48 0.23 -3.57 -4.23 -1.26 -0.85 115.64 108.30 1ugl s THR 42 Ca 0.09 0.13 -0.02 0.00 -1.18 0.00 0.00 61.69 60.71 1ugl s THR 42 Cb 0.12 -3.44 0.01 0.00 1.34 0.00 0.00 72.50 70.52 1ugl s THR 42 CO 0.64 0.55 0.34 0.00 -0.54 0.00 0.00 174.62 175.61 1ugl n HIS 43 N 1.72 -1.17 -2.23 3.99 1.44 -0.21 -3.81 115.22 114.95 1ugl n HIS 43 Ca -0.18 -1.52 0.00 0.00 -2.01 0.00 0.00 57.72 54.01 1ugl n HIS 43 Cb 0.54 0.38 0.00 0.00 0.12 0.00 0.00 29.99 31.04 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 -5.00 4.39 3.41 -0.97 -0.79 113.62 112.90 1ugl n SER 44 Ca -0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 1ugl n SER 44 Cb 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 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 -1.76 -0.06 0.14 0.00 2.03 -1.25 -3.91 116.55 111.75 1ugl n ASP 46 Ca 0.03 -2.19 0.19 0.00 0.52 0.00 0.00 54.79 53.34 1ugl n ASP 46 Cb 0.58 0.15 0.78 0.00 -0.72 0.00 0.00 41.12 41.92 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 -4.62 1.56 -0.87 0.00 2.36 -1.26 -4.44 119.74 112.46 1ugl s LYS 48 Ca -0.04 -0.46 -0.19 0.00 -2.55 0.00 0.00 55.97 52.73 1ugl s LYS 48 Cb 0.15 -1.34 -0.23 0.00 -1.05 0.00 0.00 37.83 35.37 1ugl s LYS 48 CO 0.54 0.13 2.33 0.45 1.55 0.00 0.00 175.35 180.35 1ugl n SER 49 N 3.44 0.29 0.00 1.43 2.88 -1.26 -4.64 113.62 115.76 1ugl n SER 49 Ca -0.20 -0.84 0.00 0.00 -1.33 0.00 0.00 58.87 56.50 1ugl n SER 49 Cb 0.53 -1.10 0.00 0.00 -0.75 0.00 0.00 64.21 62.89 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81