#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ujl s ILE 2 N 0.00 5.03 0.00 0.00 1.09 -1.26 -5.07 121.20 121.00 1ujl s ILE 2 Ca 0.00 -0.01 0.00 0.00 -1.10 0.00 0.00 60.65 59.54 1ujl s ILE 2 Cb 0.00 -3.76 0.00 0.00 -1.06 0.00 0.00 42.46 37.64 1ujl s ILE 2 CO 0.00 -0.37 0.02 0.61 -0.10 0.00 0.00 174.94 175.10 1ujl n GLY 3 N -1.10 0.93 2.57 6.18 0.00 -1.26 -4.91 105.19 107.60 1ujl n GLY 3 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1ujl n GLY 3 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ujl n ASN 4 N -0.96 -5.45 -4.49 1.61 5.15 -1.26 -4.83 115.26 105.03 1ujl n ASN 4 Ca 0.00 0.46 -0.43 0.00 -0.60 0.00 0.00 54.58 54.02 1ujl n ASN 4 Cb 0.00 -4.71 -0.09 0.00 -0.53 0.00 0.00 39.78 34.45 1ujl n ASN 4 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 1ujl n MET 5 N -2.45 0.67 -0.53 1.20 2.81 -1.26 -4.71 117.12 112.85 1ujl n MET 5 Ca -0.20 0.08 0.03 0.00 -1.81 0.00 0.00 57.70 55.80 1ujl n MET 5 Cb 0.66 -2.44 0.05 0.00 -0.71 0.00 0.00 33.22 30.79 1ujl n MET 5 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1ujl n GLU 6 N 8.55 0.40 -4.04 0.03 2.13 -1.26 -5.03 120.64 121.42 1ujl n GLU 6 Ca 0.49 -1.65 -0.36 0.00 0.66 0.00 0.00 57.16 56.30 1ujl n GLU 6 Cb 0.26 -0.74 -0.02 0.00 0.27 0.00 0.00 31.44 31.21 1ujl n GLU 6 CO 0.00 0.00 0.00 0.94 -0.41 0.00 0.00 177.13 177.66 1ujl n GLN 7 N -0.35 -0.53 -0.57 5.31 7.27 -1.26 -4.80 117.38 122.44 1ujl n GLN 7 Ca 0.06 0.00 -0.11 0.00 0.07 0.00 0.00 57.00 57.02 1ujl n GLN 7 Cb 0.74 -2.29 0.08 0.00 2.41 0.00 0.00 30.24 31.18 1ujl n GLN 7 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1ujl n PRO 8 N -4.33 1.58 -3.39 3.69 -0.04 -1.26 -4.69 135.00 126.56 1ujl n PRO 8 Ca -0.16 -1.39 -0.15 0.00 -0.04 0.00 0.00 63.50 61.76 1ujl n PRO 8 Cb 0.51 -1.54 -0.09 0.00 -0.04 0.00 0.00 33.50 32.34 1ujl n PRO 8 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1ujl s HIS 9 N -1.53 -0.56 -0.22 0.54 -3.43 -1.26 -5.00 115.29 103.83 1ujl s HIS 9 Ca 0.26 0.02 0.12 0.00 -0.80 0.00 0.00 55.06 54.67 1ujl s HIS 9 Cb 0.22 -0.36 0.44 0.00 -1.43 0.00 0.00 32.58 31.45 1ujl s HIS 9 CO 0.05 -0.89 1.20 -1.33 -2.00 0.00 0.00 174.74 171.77 1ujl n MET 10 N 5.32 2.18 0.00 -0.38 2.81 -1.26 -5.00 117.12 120.80 1ujl n MET 10 Ca -0.02 -3.51 0.00 0.00 -1.81 0.00 0.00 57.70 52.36 1ujl n MET 10 Cb 0.47 -1.71 0.00 0.00 -0.71 0.00 0.00 33.22 31.28 1ujl n MET 10 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1ujl n ASP 11 N -0.79 0.00 -3.67 7.83 9.92 -1.26 -4.61 116.55 123.97 1ujl n ASP 11 Ca 0.26 0.00 -0.08 0.00 -0.53 0.00 0.00 54.79 54.44 1ujl n ASP 11 Cb 0.84 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 41.23 1ujl n ASP 11 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1ujl s SER 12 N 0.00 -0.60 -0.04 -2.24 0.15 -1.26 -5.06 113.70 104.65 1ujl s SER 12 Ca 0.00 1.14 -0.24 0.00 0.70 0.00 0.00 55.95 57.55 1ujl s SER 12 Cb 0.00 1.29 -0.19 0.00 -1.71 0.00 0.00 66.02 65.41 1ujl s SER 12 CO 0.00 -0.22 1.06 -0.09 1.20 0.00 0.00 173.24 175.19 1ujl h ARG 13 N 7.56 -0.12 -7.35 5.44 9.65 -2.02 -3.45 114.38 124.08 1ujl h ARG 13 Ca -0.26 0.01 -0.51 0.00 -1.10 0.00 0.00 59.98 58.12 1ujl h ARG 13 Cb 1.16 0.03 0.07 0.00 -1.39 0.00 0.00 29.97 29.84 1ujl h ARG 13 CO 0.19 0.37 0.40 -1.50 2.80 0.00 0.00 179.97 182.23 1ujl s ILE 14 N -3.78 4.44 0.00 1.20 2.07 -1.26 -4.79 121.20 119.08 1ujl s ILE 14 Ca -0.15 0.79 0.00 0.00 -1.41 0.00 0.00 60.65 59.89 1ujl s ILE 14 Cb 0.01 -3.70 0.00 0.00 0.13 0.00 0.00 42.46 38.90 1ujl s ILE 14 CO 0.58 -1.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.19 1ujl n GLY 15 N -2.49 -0.45 0.38 1.50 0.00 -1.26 -5.01 105.19 97.86 1ujl n GLY 15 Ca 0.07 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.24 1ujl n GLY 15 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1ujl h TRP 16 N 0.00 0.84 0.00 1.61 5.08 -1.99 1.20 115.95 122.69 1ujl h TRP 16 Ca 0.00 0.03 -0.03 0.00 1.08 0.00 0.00 58.89 59.97 1ujl h TRP 16 Cb 0.00 -0.25 -0.00 0.00 -3.00 0.00 0.00 29.16 25.90 1ujl h TRP 16 CO 0.00 0.21 -0.14 -0.07 -1.28 0.00 0.00 178.44 177.15 1ujl h LEU 17 N 0.62 0.00 -2.83 0.11 3.38 -2.00 -2.40 115.31 112.19 1ujl h LEU 17 Ca 0.53 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.47 1ujl h LEU 17 Cb 1.01 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 1ujl h LEU 17 CO -0.28 0.14 0.04 1.41 0.09 0.00 0.00 178.44 179.84 1ujl n HIS 18 N -3.26 1.51 0.00 1.13 8.25 0.41 -3.67 115.22 119.59 1ujl n HIS 18 Ca 0.01 -0.59 0.00 0.00 -0.26 0.00 0.00 57.72 56.88 1ujl n HIS 18 Cb 0.42 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.10 1ujl n HIS 18 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1ujl n ASN 19 N 0.33 0.55 0.24 0.41 5.15 -0.86 -4.79 115.26 116.29 1ujl n ASN 19 Ca 0.21 0.00 0.10 0.00 -0.60 0.00 0.00 54.58 54.29 1ujl n ASN 19 Cb 0.95 0.00 0.59 0.00 -0.53 0.00 0.00 39.78 40.78 1ujl n ASN 19 CO 0.00 0.00 0.00 0.17 1.40 0.00 0.00 177.26 178.83 1ujl h LEU 20 N 0.00 0.00 -1.57 1.20 8.10 -1.61 -2.12 115.31 119.31 1ujl h LEU 20 Ca 0.00 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.94 1ujl h LEU 20 Cb 0.43 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.64 1ujl h LEU 20 CO 0.00 0.20 -0.23 1.23 -4.11 0.00 0.00 178.44 175.53 1ujl h GLY 21 N 1.15 0.00 0.57 0.17 0.00 -1.83 -1.42 103.07 101.71 1ujl h GLY 21 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.99 1ujl h GLY 21 CO 0.03 0.00 -2.01 1.34 0.00 0.00 0.00 176.54 175.90 1ujl n ASP 22 N -3.99 1.12 -0.06 0.19 2.03 -0.96 -3.57 116.55 111.31 1ujl n ASP 22 Ca -0.02 0.22 -0.06 0.00 0.52 0.00 0.00 54.79 55.45 1ujl n ASP 22 Cb 0.31 -0.07 0.14 0.00 -0.72 0.00 0.00 41.12 40.77 1ujl n ASP 22 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1ujl h GLN 23 N 0.02 0.69 -0.20 -0.67 4.20 -1.27 -3.06 115.11 114.81 1ujl h GLN 23 Ca -0.41 -0.25 -0.21 0.00 0.06 0.00 0.00 58.65 57.84 1ujl h GLN 23 Cb 2.06 -0.04 0.01 0.00 0.30 0.00 0.00 27.48 29.80 1ujl h GLN 23 CO 0.05 0.83 -0.70 0.97 -0.67 0.00 0.00 178.83 179.31 1ujl h ILE 24 N 0.61 1.27 -2.91 2.54 2.10 -1.43 -3.50 117.51 116.19 1ujl h ILE 24 Ca 0.09 -1.89 0.00 0.00 1.08 0.00 0.00 64.86 64.15 1ujl h ILE 24 Cb 0.66 1.85 0.00 0.00 -1.09 0.00 0.00 36.82 38.24 1ujl h ILE 24 CO 0.05 0.61 -0.57 0.61 -1.08 0.00 0.00 178.15 177.76 1ujl n GLY 25 N 0.59 -4.64 3.66 8.18 0.00 -1.16 -5.02 105.19 106.79 1ujl n GLY 25 Ca -0.06 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 1ujl n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ujl s LYS 26 N -1.82 2.78 0.09 1.61 -2.85 -1.26 -5.05 119.74 113.25 1ujl s LYS 26 Ca 0.00 -0.59 -0.34 0.00 -1.00 0.00 0.00 55.97 54.04 1ujl s LYS 26 Cb 0.00 -2.65 -0.15 0.00 -2.06 0.00 0.00 37.83 32.97 1ujl s LYS 26 CO 0.00 0.64 1.58 -1.35 0.10 0.00 0.00 175.35 176.32 1ujl h PRO 27 N 4.62 -0.84 0.00 1.78 0.11 -2.02 -3.45 132.00 132.20 1ujl h PRO 27 Ca -0.49 0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1ujl h PRO 27 Cb 1.18 0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.48 1ujl h PRO 27 CO 0.56 -0.56 0.00 2.48 -0.21 0.00 0.00 178.00 180.26 1ujl n TYR 28 N -5.52 0.00 -1.47 0.65 0.18 -1.26 -5.05 117.16 104.68 1ujl n TYR 28 Ca -0.10 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.54 1ujl n TYR 28 Cb 0.43 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.28 1ujl n TYR 28 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 1ujl n ASN 29 N 0.00 0.98 -2.54 9.48 5.15 -1.26 -3.45 115.26 123.61 1ujl n ASN 29 Ca 0.00 -2.38 -0.08 0.00 -0.60 0.00 0.00 54.58 51.52 1ujl n ASN 29 Cb 0.00 -1.57 -0.00 0.00 -0.53 0.00 0.00 39.78 37.68 1ujl n ASN 29 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1ujl n SER 30 N 18.06 -2.61 -4.75 1.20 7.64 -1.26 -4.90 113.62 127.01 1ujl n SER 30 Ca 0.37 0.28 -0.36 0.00 1.01 0.00 0.00 58.87 60.16 1ujl n SER 30 Cb 0.47 -2.28 -0.07 0.00 -1.01 0.00 0.00 64.21 61.32 1ujl n SER 30 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ujl s SER 31 N -2.07 6.43 0.37 6.43 0.01 -1.22 -4.98 113.70 118.67 1ujl s SER 31 Ca 0.03 0.50 0.20 0.00 1.31 0.00 0.00 55.95 57.99 1ujl s SER 31 Cb -0.02 -2.17 0.49 0.00 0.21 0.00 0.00 66.02 64.53 1ujl s SER 31 CO 0.04 0.14 1.64 1.23 0.41 0.00 0.00 173.24 176.70 1ujl h GLY 32 N 6.43 0.00 -1.26 3.44 0.00 -1.94 -3.46 103.07 106.28 1ujl h GLY 32 Ca -0.43 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.44 1ujl h GLY 32 CO 0.74 0.00 -0.13 -0.10 0.00 0.00 0.00 176.54 177.04 1ujl n LEU 33 N -3.30 -0.35 0.00 3.11 0.00 -1.26 -4.73 117.00 110.47 1ujl n LEU 33 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 56.01 56.03 1ujl n LEU 33 Cb 0.57 -1.27 0.00 0.00 0.00 0.00 0.00 43.42 42.72 1ujl n LEU 33 CO 0.37 -3.03 0.00 0.61 0.00 0.00 0.00 177.39 175.34 1ujl n GLY 34 N 1.00 0.84 3.28 -3.96 0.00 -1.26 -5.06 105.19 100.03 1ujl n GLY 34 Ca 0.05 -0.87 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 1ujl n GLY 34 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ujl s GLY 35 N 0.00 -0.20 0.18 -0.02 0.00 -1.26 -5.06 107.32 100.95 1ujl s GLY 35 Ca 0.00 0.30 -0.07 0.00 0.00 0.00 0.00 44.72 44.94 1ujl s GLY 35 CO 0.00 0.06 1.54 -0.56 0.00 0.00 0.00 173.10 174.14 1ujl h PRO 36 N 3.40 0.84 -0.46 2.90 0.13 -1.97 -2.03 132.00 134.81 1ujl h PRO 36 Ca -0.30 -0.41 0.04 0.00 -0.87 0.00 0.00 66.00 64.45 1ujl h PRO 36 Cb 1.19 -0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1ujl h PRO 36 CO 0.43 1.05 0.24 1.03 -0.23 0.00 0.00 178.00 180.51 1ujl h SER 37 N 0.70 0.35 0.52 1.44 0.87 -1.98 -0.43 113.55 115.02 1ujl h SER 37 Ca 0.07 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 1ujl h SER 37 Cb 0.90 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 62.82 1ujl h SER 37 CO 0.08 0.25 -0.25 0.40 -0.53 0.00 0.00 176.83 176.78 1ujl h ILE 38 N 0.47 0.12 -1.12 2.23 5.03 -1.97 -0.24 117.51 122.02 1ujl h ILE 38 Ca 0.20 -0.50 0.33 0.00 -0.12 0.00 0.00 64.86 64.76 1ujl h ILE 38 Cb 0.09 0.19 -0.04 0.00 -3.03 0.00 0.00 36.82 34.03 1ujl h ILE 38 CO -0.13 0.02 0.84 0.11 -0.68 0.00 0.00 178.15 178.31 1ujl h LYS 39 N -1.14 0.00 0.00 2.37 1.79 -1.33 1.08 116.57 119.35 1ujl h LYS 39 Ca -0.07 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.23 1ujl h LYS 39 Cb 0.57 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.19 1ujl h LYS 39 CO 0.12 0.00 -1.18 -0.44 -1.08 0.00 0.00 179.45 176.87 1ujl h ASP 40 N 0.00 0.00 1.13 0.86 3.32 -1.00 -3.26 116.42 117.47 1ujl h ASP 40 Ca 0.53 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.58 1ujl h ASP 40 Cb 2.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.75 1ujl h ASP 40 CO -0.01 0.63 0.00 0.50 -1.72 0.00 0.00 179.24 178.65 1ujl h LYS 41 N 0.00 0.00 0.00 3.56 1.63 0.30 -3.51 116.57 118.56 1ujl h LYS 41 Ca -0.12 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 1ujl h LYS 41 Cb 1.59 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.22 1ujl h LYS 41 CO 0.06 0.00 0.00 0.66 -3.45 0.00 0.00 179.45 176.72