#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 0.97 0.00 0.00 -1.09 -1.26 -5.05 121.20 114.77 1ujl s ILE 2 Ca 0.00 -0.92 0.00 0.00 -2.23 0.00 0.00 60.65 57.50 1ujl s ILE 2 Cb 0.00 -0.89 0.00 0.00 -1.58 0.00 0.00 42.46 39.99 1ujl s ILE 2 CO 0.00 -0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.30 1ujl n GLY 3 N 1.97 0.00 2.39 6.18 0.00 -1.26 -5.05 105.19 109.42 1ujl n GLY 3 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 1ujl n GLY 3 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ujl n ASN 4 N -2.40 -3.30 -4.51 1.61 3.02 -1.26 -4.87 115.26 103.54 1ujl n ASN 4 Ca 0.00 -0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 53.85 1ujl n ASN 4 Cb 0.48 -2.74 -0.07 0.00 -0.61 0.00 0.00 39.78 36.85 1ujl n ASN 4 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1ujl n MET 5 N -2.64 0.88 -3.58 3.52 1.56 -1.26 -1.59 117.12 114.01 1ujl n MET 5 Ca -0.05 0.11 -0.19 0.00 -0.27 0.00 0.00 57.70 57.30 1ujl n MET 5 Cb 0.55 -2.72 0.06 0.00 2.15 0.00 0.00 33.22 33.26 1ujl n MET 5 CO 0.00 0.00 0.00 -1.91 -0.73 0.00 0.00 175.97 173.33 1ujl n GLU 6 N 8.65 -5.56 -2.73 2.12 2.13 -1.26 -5.00 120.64 118.99 1ujl n GLU 6 Ca 0.44 0.72 -0.20 0.00 0.66 0.00 0.00 57.16 58.78 1ujl n GLU 6 Cb 0.33 -5.46 0.04 0.00 0.27 0.00 0.00 31.44 26.62 1ujl n GLU 6 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 1ujl s GLN 7 N -5.70 2.51 -0.64 5.31 -0.21 -0.62 -5.03 119.66 115.28 1ujl s GLN 7 Ca 0.01 -0.95 -0.27 0.00 0.02 0.00 0.00 55.36 54.16 1ujl s GLN 7 Cb -0.00 -2.54 0.02 0.00 1.00 0.00 0.00 33.01 31.49 1ujl s GLN 7 CO 0.78 -0.70 1.35 -1.25 -2.12 0.00 0.00 175.29 173.35 1ujl s PRO 8 N -4.71 3.25 -0.80 2.91 0.04 -1.26 -4.95 135.00 129.48 1ujl s PRO 8 Ca 0.58 0.17 -0.02 0.00 0.04 0.00 0.00 61.00 61.77 1ujl s PRO 8 Cb -0.10 -4.14 0.20 0.00 0.04 0.00 0.00 34.50 30.50 1ujl s PRO 8 CO 0.38 -2.03 0.66 -1.01 0.04 0.00 0.00 177.00 175.04 1ujl s HIS 9 N 5.96 3.72 -0.75 0.56 3.76 -1.26 -4.93 115.29 122.35 1ujl s HIS 9 Ca 0.45 -2.95 0.02 0.00 -0.15 0.00 0.00 55.06 52.43 1ujl s HIS 9 Cb -0.09 -3.20 0.34 0.00 1.11 0.00 0.00 32.58 30.74 1ujl s HIS 9 CO 0.21 -0.76 1.39 0.00 -0.85 0.00 0.00 174.74 174.74 1ujl n MET 10 N 2.66 3.99 -3.14 1.40 0.00 -1.26 -4.82 117.12 115.95 1ujl n MET 10 Ca 0.17 -4.61 -0.19 0.00 0.00 0.00 0.00 57.70 53.07 1ujl n MET 10 Cb 0.37 -2.32 -0.05 0.00 0.00 0.00 0.00 33.22 31.21 1ujl n MET 10 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1ujl n ASP 11 N -0.24 -1.21 -4.68 3.17 8.00 -1.26 -5.12 116.55 115.20 1ujl n ASP 11 Ca 0.40 -2.67 -0.36 0.00 0.71 0.00 0.00 54.79 52.87 1ujl n ASP 11 Cb 0.36 0.17 -0.09 0.00 -0.02 0.00 0.00 41.12 41.55 1ujl n ASP 11 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1ujl s SER 12 N -0.29 6.18 -0.10 -2.24 1.04 -1.26 -4.95 113.70 112.08 1ujl s SER 12 Ca 0.33 0.19 0.06 0.00 0.48 0.00 0.00 55.95 57.00 1ujl s SER 12 Cb 0.09 -2.11 -0.10 0.00 0.10 0.00 0.00 66.02 64.00 1ujl s SER 12 CO -0.15 0.09 -0.01 -1.14 0.98 0.00 0.00 173.24 173.01 1ujl n ARG 13 N 4.04 1.82 -1.89 4.02 0.63 -1.26 -5.02 116.66 118.99 1ujl n ARG 13 Ca -0.15 0.02 -0.32 0.00 -0.92 0.00 0.00 57.85 56.48 1ujl n ARG 13 Cb 0.52 -1.23 0.02 0.00 0.45 0.00 0.00 32.46 32.23 1ujl n ARG 13 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 1ujl s ILE 14 N -2.22 3.82 0.00 5.15 1.10 -1.26 -4.57 121.20 123.22 1ujl s ILE 14 Ca -0.08 0.78 0.00 0.00 -0.51 0.00 0.00 60.65 60.85 1ujl s ILE 14 Cb 0.03 -3.36 0.00 0.00 0.15 0.00 0.00 42.46 39.28 1ujl s ILE 14 CO 0.33 -0.59 0.00 0.61 -2.11 0.00 0.00 174.94 173.18 1ujl n GLY 15 N -1.21 1.02 0.29 1.50 0.00 -1.26 -5.02 105.19 100.52 1ujl n GLY 15 Ca 0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.18 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 0.58 0.00 1.61 5.08 -2.01 1.24 115.95 122.45 1ujl h TRP 16 Ca 0.00 0.04 -0.01 0.00 1.08 0.00 0.00 58.89 59.99 1ujl h TRP 16 Cb 0.00 -0.13 -0.00 0.00 -3.00 0.00 0.00 29.16 26.03 1ujl h TRP 16 CO 0.00 0.05 -0.06 -0.07 -1.28 0.00 0.00 178.44 177.08 1ujl h LEU 17 N 0.46 0.00 -2.67 0.11 3.38 -1.99 -0.95 115.31 113.65 1ujl h LEU 17 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 1ujl h LEU 17 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1ujl h LEU 17 CO -0.44 0.06 0.00 1.41 0.09 0.00 0.00 178.44 179.56 1ujl n HIS 18 N -3.30 1.36 0.00 1.13 8.25 0.42 -3.61 115.22 119.47 1ujl n HIS 18 Ca -0.01 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.98 1ujl n HIS 18 Cb 0.24 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 30.98 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 0.41 0.29 -0.06 0.41 2.85 -0.40 -4.76 115.26 114.01 1ujl n ASN 19 Ca 0.18 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.65 1ujl n ASN 19 Cb 0.87 0.00 0.28 0.00 1.24 0.00 0.00 39.78 42.17 1ujl n ASN 19 CO 0.00 0.00 0.00 0.17 -2.11 0.00 0.00 177.26 175.32 1ujl h LEU 20 N 0.00 0.60 -2.57 1.20 8.10 -1.61 -1.43 115.31 119.60 1ujl h LEU 20 Ca 0.00 -0.09 0.00 0.00 0.11 0.00 0.00 57.88 57.90 1ujl h LEU 20 Cb 0.65 -0.16 0.00 0.00 -0.44 0.00 0.00 40.66 40.71 1ujl h LEU 20 CO 0.00 0.59 0.00 1.23 -4.11 0.00 0.00 178.44 176.15 1ujl h GLY 21 N 0.85 0.00 0.31 0.17 0.00 -1.83 -2.18 103.07 100.38 1ujl h GLY 21 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 47.10 1ujl h GLY 21 CO -0.01 0.00 -2.20 1.22 0.00 0.00 0.00 176.54 175.55 1ujl n ASP 22 N -2.94 2.05 -0.02 0.19 9.92 -0.59 -3.91 116.55 121.24 1ujl n ASP 22 Ca -0.02 0.07 0.05 0.00 -0.53 0.00 0.00 54.79 54.36 1ujl n ASP 22 Cb 0.09 -0.67 0.43 0.00 -0.64 0.00 0.00 41.12 40.33 1ujl n ASP 22 CO 0.00 0.00 0.00 0.06 0.13 0.00 0.00 177.20 177.39 1ujl h GLN 23 N -0.01 0.53 0.29 -1.24 3.07 -0.97 -3.13 115.11 113.65 1ujl h GLN 23 Ca -0.50 -0.03 -0.01 0.00 0.09 0.00 0.00 58.65 58.20 1ujl h GLN 23 Cb 1.95 -0.12 0.00 0.00 0.08 0.00 0.00 27.48 29.39 1ujl h GLN 23 CO -0.01 0.35 -0.14 0.82 0.09 0.00 0.00 178.83 179.94 1ujl h ILE 24 N 0.55 0.00 0.00 1.86 1.08 -1.59 -3.50 117.51 115.91 1ujl h ILE 24 Ca 0.18 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1ujl h ILE 24 Cb 0.04 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.79 1ujl h ILE 24 CO -0.04 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.03 1ujl n GLY 25 N -0.14 -1.01 3.25 5.37 0.00 -1.18 -5.06 105.19 106.42 1ujl n GLY 25 Ca -0.05 0.41 -0.43 0.00 0.00 0.00 0.00 46.02 45.94 1ujl n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ujl s LYS 26 N 0.00 3.03 0.04 1.61 2.47 -1.26 -4.73 119.74 120.90 1ujl s LYS 26 Ca 0.00 -2.17 -0.26 0.00 -1.56 0.00 0.00 55.97 51.98 1ujl s LYS 26 Cb 0.00 -4.16 -0.14 0.00 -1.46 0.00 0.00 37.83 32.07 1ujl s LYS 26 CO 0.00 -1.25 1.32 -1.00 0.16 0.00 0.00 175.35 174.58 1ujl h PRO 27 N 8.01 -0.90 0.00 4.03 0.13 -1.98 -3.44 132.00 137.85 1ujl h PRO 27 Ca -0.07 0.06 -0.07 0.00 -0.87 0.00 0.00 66.00 65.06 1ujl h PRO 27 Cb 1.04 0.21 -0.07 0.00 0.13 0.00 0.00 31.00 32.31 1ujl h PRO 27 CO 0.83 -0.60 -0.15 2.48 -0.23 0.00 0.00 178.00 180.32 1ujl n TYR 28 N -4.65 0.00 -2.55 1.56 4.11 -1.26 -5.06 117.16 109.31 1ujl n TYR 28 Ca -0.12 -0.26 -0.01 0.00 -0.00 0.00 0.00 57.90 57.51 1ujl n TYR 28 Cb 0.37 0.37 0.00 0.00 -0.00 0.00 0.00 39.34 40.08 1ujl n TYR 28 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 1ujl n ASN 29 N 0.00 -0.20 -3.10 9.48 5.15 -1.26 -2.17 115.26 123.16 1ujl n ASN 29 Ca -0.15 -0.04 -0.10 0.00 -0.60 0.00 0.00 54.58 53.69 1ujl n ASN 29 Cb 0.51 -0.07 0.01 0.00 -0.53 0.00 0.00 39.78 39.70 1ujl n ASN 29 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1ujl n SER 30 N 0.37 -6.89 0.00 1.20 2.88 -1.26 -3.25 113.62 106.66 1ujl n SER 30 Ca -0.01 0.55 0.00 0.00 -1.33 0.00 0.00 58.87 58.07 1ujl n SER 30 Cb 0.03 -3.09 0.00 0.00 -0.75 0.00 0.00 64.21 60.40 1ujl n SER 30 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1ujl n SER 31 N 0.57 0.00 0.00 -3.46 2.88 -0.92 -3.61 113.62 109.08 1ujl n SER 31 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ujl n SER 31 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 1ujl n SER 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ujl n GLY 32 N 0.00 0.27 3.43 0.46 0.00 -1.17 -4.91 105.19 103.27 1ujl n GLY 32 Ca 0.00 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1ujl n GLY 32 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ujl n LEU 33 N 0.00 -0.57 -3.66 0.99 0.00 -1.24 -4.95 117.00 107.57 1ujl n LEU 33 Ca 0.00 0.09 -0.08 0.00 0.00 0.00 0.00 56.01 56.02 1ujl n LEU 33 Cb 0.00 -1.19 -0.08 0.00 0.00 0.00 0.00 43.42 42.15 1ujl n LEU 33 CO 0.00 -3.14 0.21 -0.83 0.00 0.00 0.00 177.39 173.63 1ujl s GLY 34 N -2.15 -0.52 -0.42 -3.96 0.00 -1.26 -4.82 107.32 94.18 1ujl s GLY 34 Ca 0.61 2.04 0.07 0.00 0.00 0.00 0.00 44.72 47.43 1ujl s GLY 34 CO 0.65 2.20 0.58 0.61 0.00 0.00 0.00 173.10 177.14 1ujl n GLY 35 N 4.46 1.93 0.31 0.20 0.00 -1.26 -4.99 105.19 105.84 1ujl n GLY 35 Ca -0.20 -1.04 0.06 0.00 0.00 0.00 0.00 46.02 44.84 1ujl n GLY 35 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ujl h PRO 36 N 4.34 0.69 -0.50 1.61 0.11 -1.99 -1.71 132.00 134.55 1ujl h PRO 36 Ca 0.06 -0.04 0.09 0.00 0.11 0.00 0.00 66.00 66.21 1ujl h PRO 36 Cb 0.93 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 31.82 1ujl h PRO 36 CO 0.39 0.45 0.10 1.03 -0.21 0.00 0.00 178.00 179.76 1ujl h SER 37 N 0.71 -0.00 0.49 -2.05 0.87 -1.99 -1.52 113.55 110.05 1ujl h SER 37 Ca 0.45 0.09 -0.02 0.00 -1.23 0.00 0.00 61.79 61.08 1ujl h SER 37 Cb 0.56 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1ujl h SER 37 CO -0.32 0.03 -0.23 0.40 -0.53 0.00 0.00 176.83 176.17 1ujl h ILE 38 N 0.24 0.43 -1.21 2.23 5.03 -1.76 -0.23 117.51 122.23 1ujl h ILE 38 Ca 0.25 -0.37 0.35 0.00 -0.12 0.00 0.00 64.86 64.97 1ujl h ILE 38 Cb 0.34 0.58 -0.05 0.00 -3.03 0.00 0.00 36.82 34.66 1ujl h ILE 38 CO -0.33 0.06 0.93 0.50 -0.68 0.00 0.00 178.15 178.62 1ujl h LYS 39 N -0.91 0.00 0.00 2.37 3.64 -1.12 1.34 116.57 121.89 1ujl h LYS 39 Ca -0.07 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.18 1ujl h LYS 39 Cb 0.59 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 1ujl h LYS 39 CO 0.11 0.00 -1.23 0.22 -2.27 0.00 0.00 179.45 176.28 1ujl h ASP 40 N 0.00 0.00 0.96 4.20 1.82 -1.02 -3.29 116.42 119.10 1ujl h ASP 40 Ca 0.58 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.21 1ujl h ASP 40 Cb 2.42 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 42.43 1ujl h ASP 40 CO -0.01 0.46 -0.05 0.50 -1.61 0.00 0.00 179.24 178.53 1ujl h LYS 41 N 0.00 0.00 -0.02 0.28 1.63 0.36 -3.51 116.57 115.31 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 1.45 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.08 1ujl h LYS 41 CO 0.04 0.05 0.00 0.66 -3.45 0.00 0.00 179.45 176.75