#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 6.13 0.00 3.41 1.43 -1.26 -5.03 118.68 123.36 1ugl s LEU 2 Ca 0.00 -2.37 0.00 0.00 -1.03 0.00 0.00 54.13 50.73 1ugl s LEU 2 Cb 0.00 -2.10 0.00 0.00 0.03 0.00 0.00 46.19 44.12 1ugl s LEU 2 CO 0.00 -0.62 0.00 1.15 0.23 0.00 0.00 176.35 177.11 1ugl n MET 3 N 4.35 2.38 0.00 1.70 0.00 -1.26 -5.16 117.12 119.14 1ugl n MET 3 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.72 1ugl n MET 3 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.64 1ugl n MET 3 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1ugl n LYS 4 N 0.00 0.00 -1.25 3.17 4.01 -1.26 -5.08 118.16 117.75 1ugl n LYS 4 Ca 0.00 0.00 -0.02 0.00 -0.51 0.00 0.00 58.31 57.78 1ugl n LYS 4 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 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 0.25 -1.51 1.97 1.74 -1.26 -5.08 116.66 112.77 1ugl n ARG 5 Ca 0.00 -0.49 -0.57 0.00 -0.77 0.00 0.00 57.85 56.02 1ugl n ARG 5 Cb 0.00 0.38 -0.09 0.00 -1.02 0.00 0.00 32.46 31.73 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 5.91 -3.55 -1.22 0.00 -2.24 -1.26 -4.64 114.28 107.28 1ugl n THR 7 Ca 0.39 1.72 -0.27 0.00 -2.27 0.00 0.00 64.05 63.62 1ugl n THR 7 Cb 0.11 -2.71 0.14 0.00 -2.10 0.00 0.00 70.33 65.77 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 -2.26 2.36 -0.34 -0.78 1.74 -1.26 -4.68 116.66 111.44 1ugl n ARG 8 Ca 0.00 -3.04 0.00 0.00 -0.77 0.00 0.00 57.85 54.04 1ugl n ARG 8 Cb 0.39 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.64 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 -1.03 1.12 2.50 -0.13 0.00 -1.26 -4.69 105.19 101.69 1ugl n GLY 9 Ca 0.60 -0.10 -0.05 0.00 0.00 0.00 0.00 46.02 46.46 1ugl n GLY 9 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ugl n PHE 10 N -0.52 -2.68 -2.49 1.61 3.72 -1.26 -5.01 117.46 110.83 1ugl n PHE 10 Ca 0.00 1.10 -0.12 0.00 -0.05 0.00 0.00 57.45 58.38 1ugl n PHE 10 Cb 0.07 -3.44 0.03 0.00 -0.94 0.00 0.00 39.48 35.20 1ugl n PHE 10 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1ugl n ARG 11 N -0.22 2.50 -4.18 -1.08 0.00 -1.26 -4.97 116.66 107.45 1ugl n ARG 11 Ca 0.08 -3.81 -0.15 0.00 -0.00 0.00 0.00 57.85 53.97 1ugl n ARG 11 Cb 0.29 -1.87 -0.11 0.00 0.00 0.00 0.00 32.46 30.77 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 -3.64 0.86 0.07 -0.14 3.01 0.19 -4.99 119.74 115.11 1ugl s LYS 12 Ca 0.38 -1.15 -0.15 0.00 -1.01 0.00 0.00 55.97 54.03 1ugl s LYS 12 Cb 0.37 -0.59 0.03 0.00 -1.01 0.00 0.00 37.83 36.63 1ugl s LYS 12 CO -0.02 0.10 0.36 -0.48 0.51 0.00 0.00 175.35 175.82 1ugl s LEU 13 N -2.39 0.63 0.00 3.17 2.34 -1.26 -1.10 118.68 120.08 1ugl s LEU 13 Ca 0.05 -0.22 0.00 0.00 0.06 0.00 0.00 54.13 54.02 1ugl s LEU 13 Cb -0.04 1.60 0.00 0.00 -0.56 0.00 0.00 46.19 47.19 1ugl s LEU 13 CO 0.01 -0.72 0.00 0.61 -1.06 0.00 0.00 176.35 175.19 1ugl n GLY 14 N 0.23 0.75 0.92 -3.48 0.00 0.03 -4.20 105.19 99.44 1ugl n GLY 14 Ca -0.17 -0.48 -0.01 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.31 -0.08 -3.52 1.61 5.02 -1.16 -1.35 118.16 118.37 1ugl n LYS 15 Ca 0.00 0.09 -0.21 0.00 -2.02 0.00 0.00 58.31 56.17 1ugl n LYS 15 Cb 0.12 -0.13 0.03 0.00 -0.02 0.00 0.00 35.03 35.03 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 -3.25 4.62 0.11 0.00 2.01 -0.45 -4.93 115.64 113.74 1ugl s THR 17 Ca 0.27 1.01 -0.31 0.00 0.31 0.00 0.00 61.69 62.98 1ugl s THR 17 Cb -0.09 -3.69 -0.11 0.00 0.01 0.00 0.00 72.50 68.63 1ugl s THR 17 CO 0.83 -0.49 1.60 0.74 -0.69 0.00 0.00 174.62 176.61 1ugl h THR 18 N 1.31 0.22 -0.05 -0.82 2.02 -1.90 0.79 112.91 114.48 1ugl h THR 18 Ca -0.47 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.72 1ugl h THR 18 Cb 1.18 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1ugl h THR 18 CO 0.63 0.00 0.40 0.25 0.37 0.00 0.00 175.52 177.17 1ugl h LEU 19 N -0.68 0.00 0.00 2.58 7.12 -1.94 0.78 115.31 123.18 1ugl h LEU 19 Ca 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 1ugl h LEU 19 Cb 0.66 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.79 1ugl h LEU 19 CO -0.16 0.00 -0.06 -0.08 -0.13 0.00 0.00 178.44 178.00 1ugl h GLU 20 N 0.00 0.00 -0.85 1.25 4.57 -1.19 -0.81 114.58 117.56 1ugl h GLU 20 Ca 0.02 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 1ugl h GLU 20 Cb 0.82 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.37 1ugl h GLU 20 CO -0.00 0.96 0.50 1.05 -1.18 0.00 0.00 179.01 180.34 1ugl h GLU 21 N -1.00 1.15 -0.40 1.92 4.11 -0.02 -2.08 114.58 118.27 1ugl h GLU 21 Ca -0.02 -0.11 -0.13 0.00 0.07 0.00 0.00 59.36 59.17 1ugl h GLU 21 Cb 0.98 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1ugl h GLU 21 CO -0.01 0.82 -0.25 0.93 0.07 0.00 0.00 179.01 180.56 1ugl h GLU 22 N 1.17 0.87 -0.99 1.06 5.08 -1.04 -2.34 114.58 118.39 1ugl h GLU 22 Ca 0.30 -0.41 0.22 0.00 -1.00 0.00 0.00 59.36 58.47 1ugl h GLU 22 Cb -0.03 -0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.09 1ugl h GLU 22 CO -0.05 1.05 0.59 -0.22 -1.00 0.00 0.00 179.01 179.37 1ugl h LYS 23 N 0.68 0.64 -0.11 2.33 1.63 -0.46 0.36 116.57 121.64 1ugl h LYS 23 Ca 0.08 -0.04 -0.17 0.00 -0.85 0.00 0.00 60.65 59.68 1ugl h LYS 23 Cb 0.83 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.31 1ugl h LYS 23 CO 0.07 0.42 -0.64 0.00 -3.45 0.00 0.00 179.45 175.85 1ugl h LYS 25 N 0.30 -0.28 -0.73 0.00 1.79 0.12 0.17 116.57 117.94 1ugl h LYS 25 Ca -0.01 0.02 0.09 0.00 -2.18 0.00 0.00 60.65 58.57 1ugl h LYS 25 Cb 1.18 0.06 -0.07 0.00 -1.58 0.00 0.00 32.23 31.83 1ugl h LYS 25 CO 0.11 -0.18 0.38 1.79 -1.08 0.00 0.00 179.45 180.47 1ugl h THR 26 N -0.77 0.88 0.18 -0.16 1.35 -0.96 -3.11 112.91 110.32 1ugl h THR 26 Ca -0.03 -0.22 -0.35 0.00 -0.55 0.00 0.00 66.41 65.26 1ugl h THR 26 Cb 0.22 0.17 0.01 0.00 -1.73 0.00 0.00 68.15 66.81 1ugl h THR 26 CO 0.05 0.12 -1.77 -0.07 -0.25 0.00 0.00 175.52 173.59 1ugl h LEU 27 N 0.65 0.59 -8.17 3.87 4.07 -1.60 -3.45 115.31 111.27 1ugl h LEU 27 Ca 0.35 -0.94 -0.68 0.00 0.08 0.00 0.00 57.88 56.69 1ugl h LEU 27 Cb 0.34 -0.19 -0.30 0.00 1.08 0.00 0.00 40.66 41.59 1ugl h LEU 27 CO -0.25 1.80 -0.68 -0.31 -1.08 0.00 0.00 178.44 177.92 1ugl s TYR 28 N -2.57 3.19 -0.93 1.13 2.02 0.58 -5.05 117.35 115.72 1ugl s TYR 28 Ca -0.17 -1.51 -0.19 0.00 -0.37 0.00 0.00 57.07 54.83 1ugl s TYR 28 Cb 0.05 -2.16 0.13 0.00 -0.40 0.00 0.00 41.96 39.58 1ugl s TYR 28 CO 0.84 -0.72 1.14 -1.25 -1.57 0.00 0.00 175.55 173.99 1ugl s PRO 29 N 1.36 3.59 0.15 -1.71 0.04 -1.26 -4.04 135.00 133.13 1ugl s PRO 29 Ca -0.01 -1.71 0.02 0.00 0.04 0.00 0.00 61.00 59.34 1ugl s PRO 29 Cb -0.18 -4.92 -0.01 0.00 0.04 0.00 0.00 34.50 29.42 1ugl s PRO 29 CO -0.00 -1.80 0.15 0.54 0.04 0.00 0.00 177.00 175.93 1ugl n ARG 30 N 6.69 0.21 -0.04 4.56 5.12 -1.26 -5.08 116.66 126.87 1ugl n ARG 30 Ca 0.24 -1.41 -0.05 0.00 -1.93 0.00 0.00 57.85 54.70 1ugl n ARG 30 Cb 0.49 1.20 -0.05 0.00 -1.16 0.00 0.00 32.46 32.95 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 -0.27 -0.21 1.35 -0.13 0.00 -1.26 -4.53 105.19 100.14 1ugl n GLY 31 Ca 0.03 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.54 3.23 -3.76 1.61 6.02 -1.26 -4.88 117.38 115.79 1ugl n GLN 32 Ca -0.14 -2.34 -0.36 0.00 -0.01 0.00 0.00 57.00 54.15 1ugl n GLN 32 Cb 0.69 -1.78 -0.07 0.00 1.02 0.00 0.00 30.24 30.10 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 3.05 0.00 -3.68 0.00 5.66 -1.26 -4.90 114.28 113.15 1ugl n THR 34 Ca -0.17 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.46 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 -0.41 0.61 0.17 0.00 0.15 -0.44 -4.89 113.70 108.90 1ugl s SER 36 Ca 0.16 0.19 0.09 0.00 0.70 0.00 0.00 55.95 57.09 1ugl s SER 36 Cb -0.13 0.06 -0.04 0.00 -1.71 0.00 0.00 66.02 64.20 1ugl s SER 36 CO 0.05 -0.21 -0.18 -0.62 1.20 0.00 0.00 173.24 173.48 1ugl s ASP 37 N 1.85 2.70 0.00 5.45 2.15 -1.26 -2.16 116.67 125.39 1ugl s ASP 37 Ca -0.00 -0.88 0.00 0.00 0.43 0.00 0.00 52.55 52.09 1ugl s ASP 37 Cb -0.12 -0.16 0.00 0.00 -0.30 0.00 0.00 42.92 42.34 1ugl s ASP 37 CO -0.04 -0.05 0.00 -0.24 -0.17 0.00 0.00 175.17 174.67 1ugl n SER 38 N 0.19 0.00 -2.09 -0.34 2.88 -1.26 -5.01 113.62 107.99 1ugl n SER 38 Ca -0.12 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.41 1ugl n SER 38 Cb 0.57 -0.29 0.06 0.00 -0.75 0.00 0.00 64.21 63.81 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 -2.10 0.68 -3.93 -1.46 4.81 -1.26 -5.16 118.16 109.74 1ugl n LYS 39 Ca 0.00 -0.61 -0.15 0.00 -0.87 0.00 0.00 58.31 56.67 1ugl n LYS 39 Cb 0.00 0.21 -0.04 0.00 0.02 0.00 0.00 35.03 35.22 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 -0.77 0.58 0.12 1.64 2.81 -1.26 -5.05 117.12 115.18 1ugl n MET 40 Ca -0.09 -2.81 -0.03 0.00 -1.81 0.00 0.00 57.70 52.96 1ugl n MET 40 Cb 0.69 2.56 0.14 0.00 -0.71 0.00 0.00 33.22 35.91 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 1.89 0.08 -2.66 7.83 -0.00 -2.00 -3.42 115.58 117.30 1ugl h ASN 41 Ca -0.25 -0.05 -0.67 0.00 -0.00 0.00 0.00 56.30 55.34 1ugl h ASN 41 Cb 1.13 -0.02 -0.07 0.00 -0.00 0.00 0.00 38.32 39.36 1ugl h ASN 41 CO 0.34 0.69 -0.47 0.42 -0.00 0.00 0.00 177.43 178.41 1ugl s THR 42 N -3.61 5.49 0.28 -3.57 -4.23 -1.26 -0.79 115.64 107.96 1ugl s THR 42 Ca -0.02 0.22 -0.03 0.00 -1.18 0.00 0.00 61.69 60.68 1ugl s THR 42 Cb 0.12 -3.42 0.01 0.00 1.34 0.00 0.00 72.50 70.56 1ugl s THR 42 CO 0.78 0.61 0.42 0.00 -0.54 0.00 0.00 174.62 175.88 1ugl n HIS 43 N 1.94 -1.37 -0.39 3.99 1.44 -0.26 -4.71 115.22 115.86 1ugl n HIS 43 Ca -0.19 -1.76 0.00 0.00 -2.01 0.00 0.00 57.72 53.76 1ugl n HIS 43 Cb 0.55 0.48 0.00 0.00 0.12 0.00 0.00 29.99 31.14 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 -1.68 2.40 -5.02 4.39 3.41 -0.92 -0.63 113.62 115.56 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 0.46 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.46 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 -0.10 0.17 0.00 2.03 -1.26 -4.25 116.55 110.97 1ugl n ASP 46 Ca 0.14 -1.73 0.19 0.00 0.52 0.00 0.00 54.79 53.91 1ugl n ASP 46 Cb 0.61 -0.01 0.79 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 -4.52 0.90 -0.86 0.00 2.47 -1.26 -4.56 119.74 111.91 1ugl s LYS 48 Ca -0.04 -0.12 -0.22 0.00 -1.56 0.00 0.00 55.97 54.02 1ugl s LYS 48 Cb 0.14 -0.91 -0.19 0.00 -1.46 0.00 0.00 37.83 35.42 1ugl s LYS 48 CO 0.50 -0.09 2.17 0.45 0.16 0.00 0.00 175.35 178.54 1ugl n SER 49 N 4.10 0.99 0.00 1.43 2.88 -1.26 -4.73 113.62 117.03 1ugl n SER 49 Ca -0.24 -1.75 0.00 0.00 -1.33 0.00 0.00 58.87 55.55 1ugl n SER 49 Cb 0.51 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.48 1ugl n SER 49 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81