#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 4.94 0.00 0.00 1.09 -1.26 -5.01 121.20 120.97 1ujl s ILE 2 Ca 0.00 0.96 0.00 0.00 -1.10 0.00 0.00 60.65 60.51 1ujl s ILE 2 Cb 0.00 -3.77 0.00 0.00 -1.06 0.00 0.00 42.46 37.63 1ujl s ILE 2 CO 0.00 0.57 0.00 0.61 -0.10 0.00 0.00 174.94 176.02 1ujl n GLY 3 N 1.80 -1.32 1.55 6.18 0.00 -1.26 -5.02 105.19 107.12 1ujl n GLY 3 Ca -0.13 0.84 0.09 0.00 0.00 0.00 0.00 46.02 46.83 1ujl n GLY 3 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ujl n ASN 4 N 0.00 4.60 -4.53 1.61 6.94 -1.26 -4.93 115.26 117.69 1ujl n ASN 4 Ca 0.00 -2.40 -0.23 0.00 -0.02 0.00 0.00 54.58 51.93 1ujl n ASN 4 Cb 0.00 -0.57 -0.13 0.00 -2.36 0.00 0.00 39.78 36.72 1ujl n ASN 4 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 1ujl n MET 5 N 1.15 0.34 0.00 -3.83 1.56 -1.26 -4.88 117.12 110.20 1ujl n MET 5 Ca 0.25 -0.32 0.00 0.00 -0.27 0.00 0.00 57.70 57.36 1ujl n MET 5 Cb 0.85 -2.38 0.00 0.00 2.15 0.00 0.00 33.22 33.84 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 7.57 1.97 -2.60 2.12 2.13 -1.26 -5.02 120.64 125.54 1ujl n GLU 6 Ca 0.56 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 58.12 1ujl n GLU 6 Cb 0.29 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.99 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 0.00 3.23 -1.08 5.31 7.27 -1.26 -4.94 117.38 125.91 1ujl n GLN 7 Ca 0.00 -4.51 -0.25 0.00 0.07 0.00 0.00 57.00 52.32 1ujl n GLN 7 Cb 0.00 -2.19 -0.09 0.00 2.41 0.00 0.00 30.24 30.38 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 -0.39 2.70 -3.23 3.69 -0.04 -1.26 -4.57 135.00 131.89 1ujl n PRO 8 Ca 0.35 -1.54 -0.20 0.00 -0.04 0.00 0.00 63.50 62.08 1ujl n PRO 8 Cb 0.61 -2.38 -0.07 0.00 -0.04 0.00 0.00 33.50 31.62 1ujl n PRO 8 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1ujl s HIS 9 N 1.81 0.15 -0.56 0.54 3.76 -1.26 -5.00 115.29 114.73 1ujl s HIS 9 Ca 0.64 -1.59 -0.02 0.00 -0.15 0.00 0.00 55.06 53.93 1ujl s HIS 9 Cb 0.23 -0.51 0.27 0.00 1.11 0.00 0.00 32.58 33.67 1ujl s HIS 9 CO -0.03 -0.97 2.21 -1.33 -0.85 0.00 0.00 174.74 173.77 1ujl n MET 10 N 3.17 2.39 -1.01 1.40 2.81 -1.26 -4.46 117.12 120.16 1ujl n MET 10 Ca 0.23 -2.64 -0.13 0.00 -1.81 0.00 0.00 57.70 53.35 1ujl n MET 10 Cb 0.49 -2.07 0.19 0.00 -0.71 0.00 0.00 33.22 31.12 1ujl n MET 10 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1ujl n ASP 11 N -0.06 3.06 -4.04 7.83 -0.08 -1.26 -4.95 116.55 117.05 1ujl n ASP 11 Ca 0.49 -3.72 -0.10 0.00 -1.51 0.00 0.00 54.79 49.95 1ujl n ASP 11 Cb 0.52 -0.73 -0.07 0.00 2.34 0.00 0.00 41.12 43.19 1ujl n ASP 11 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1ujl s SER 12 N -2.03 -0.01 0.00 1.67 0.01 -1.26 -4.93 113.70 107.15 1ujl s SER 12 Ca 0.50 -1.07 0.00 0.00 1.31 0.00 0.00 55.95 56.69 1ujl s SER 12 Cb 0.44 0.53 0.00 0.00 0.21 0.00 0.00 66.02 67.20 1ujl s SER 12 CO 0.04 -1.06 0.00 0.54 0.41 0.00 0.00 173.24 173.17 1ujl n ARG 13 N -0.35 0.00 -1.03 12.44 5.12 -1.26 -4.96 116.66 126.61 1ujl n ARG 13 Ca -0.01 0.00 -0.34 0.00 -1.93 0.00 0.00 57.85 55.58 1ujl n ARG 13 Cb 0.63 0.00 0.12 0.00 -1.16 0.00 0.00 32.46 32.05 1ujl n ARG 13 CO 0.00 0.00 0.00 1.51 -1.93 0.00 0.00 177.63 177.21 1ujl n ILE 14 N 0.00 1.45 0.00 0.55 0.13 -1.26 -4.45 119.36 115.78 1ujl n ILE 14 Ca 0.00 -0.21 0.00 0.00 -1.10 0.00 0.00 62.75 61.44 1ujl n ILE 14 Cb 0.00 -1.01 0.00 0.00 -0.84 0.00 0.00 39.64 37.79 1ujl n ILE 14 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ujl n GLY 15 N 0.84 1.71 0.37 4.50 0.00 -1.26 -5.01 105.19 106.34 1ujl n GLY 15 Ca 0.12 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.29 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 0.90 0.00 1.61 5.08 -2.01 1.22 115.95 122.75 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 -0.27 -0.00 0.00 -3.00 0.00 0.00 29.16 25.89 1ujl h TRP 16 CO 0.00 0.21 -0.12 -0.07 -1.28 0.00 0.00 178.44 177.18 1ujl h LEU 17 N 0.65 0.00 -2.84 0.11 3.38 -1.98 -2.40 115.31 112.24 1ujl h LEU 17 Ca 0.54 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.48 1ujl h LEU 17 Cb 0.99 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1ujl h LEU 17 CO -0.31 0.12 0.04 1.41 0.09 0.00 0.00 178.44 179.79 1ujl n HIS 18 N -3.25 1.52 0.00 1.13 8.25 0.41 -3.84 115.22 119.45 1ujl n HIS 18 Ca 0.01 -0.58 0.00 0.00 -0.26 0.00 0.00 57.72 56.88 1ujl n HIS 18 Cb 0.40 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.09 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 0.35 0.48 0.27 0.41 5.15 -0.85 -4.75 115.26 116.32 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 0.71 0.00 -0.53 0.00 0.00 39.78 40.91 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 -0.99 1.20 8.10 -1.61 -1.44 115.31 120.57 1ujl h LEU 20 Ca 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 57.88 57.89 1ujl h LEU 20 Cb 0.48 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.69 1ujl h LEU 20 CO 0.00 0.03 -0.41 1.23 -4.11 0.00 0.00 178.44 175.18 1ujl h GLY 21 N 0.13 0.21 1.25 0.17 0.00 -1.84 -2.35 103.07 100.64 1ujl h GLY 21 Ca -0.00 -0.20 -0.33 0.00 0.00 0.00 0.00 47.33 46.80 1ujl h GLY 21 CO 0.00 0.18 -1.44 -1.80 0.00 0.00 0.00 176.54 173.48 1ujl h ASP 22 N 0.16 0.86 -0.63 0.19 3.58 -1.58 -1.77 116.42 117.23 1ujl h ASP 22 Ca 0.01 -0.90 -0.01 0.00 0.42 0.00 0.00 57.03 56.56 1ujl h ASP 22 Cb 0.80 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 41.54 1ujl h ASP 22 CO 0.06 1.70 0.37 1.56 -2.88 0.00 0.00 179.24 180.05 1ujl h GLN 23 N 0.17 0.86 0.04 0.28 1.08 -1.36 -3.31 115.11 112.87 1ujl h GLN 23 Ca -0.25 -0.08 -0.00 0.00 -1.45 0.00 0.00 58.65 56.87 1ujl h GLN 23 Cb 2.13 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 29.38 1ujl h GLN 23 CO 0.27 0.62 -0.02 0.82 -0.95 0.00 0.00 178.83 179.57 1ujl h ILE 24 N 0.86 0.00 0.00 2.54 2.04 -1.52 -3.51 117.51 117.91 1ujl h ILE 24 Ca 0.23 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1ujl h ILE 24 Cb -0.01 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.07 1ujl h ILE 24 CO -0.04 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.72 1ujl n GLY 25 N 1.48 2.16 3.51 5.37 0.00 -0.67 -5.01 105.19 112.04 1ujl n GLY 25 Ca -0.01 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.24 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 -4.96 3.27 0.07 1.61 2.20 -1.26 -4.95 119.74 115.72 1ujl s LYS 26 Ca 0.00 -0.42 -0.19 0.00 -0.36 0.00 0.00 55.97 55.00 1ujl s LYS 26 Cb 0.00 -3.94 -0.11 0.00 -1.51 0.00 0.00 37.83 32.27 1ujl s LYS 26 CO 0.00 -0.96 1.44 -1.00 -0.36 0.00 0.00 175.35 174.47 1ujl h PRO 27 N 8.82 0.42 0.00 4.03 0.13 -2.00 -3.48 132.00 139.92 1ujl h PRO 27 Ca -0.26 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1ujl h PRO 27 Cb 1.10 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1ujl h PRO 27 CO 0.87 0.69 0.00 2.48 -0.23 0.00 0.00 178.00 181.80 1ujl n TYR 28 N -4.58 0.00 -0.07 1.56 0.18 -1.26 -5.06 117.16 107.93 1ujl n TYR 28 Ca -0.05 0.00 -0.20 0.00 1.88 0.00 0.00 57.90 59.53 1ujl n TYR 28 Cb 0.30 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.14 1ujl n TYR 28 CO 0.00 0.00 0.00 -0.91 -2.08 0.00 0.00 176.86 173.87 1ujl h ASN 29 N 0.00 0.08 -4.71 9.48 2.35 -2.03 -3.51 115.58 117.24 1ujl h ASN 29 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 56.30 55.07 1ujl h ASN 29 Cb 0.00 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1ujl h ASN 29 CO 0.00 1.44 -1.02 -0.24 -1.65 0.00 0.00 177.43 175.96 1ujl n SER 30 N -4.33 -8.64 -2.86 5.81 2.88 -1.26 -4.76 113.62 100.46 1ujl n SER 30 Ca -0.27 1.79 -0.04 0.00 -1.33 0.00 0.00 58.87 59.02 1ujl n SER 30 Cb 0.70 -5.14 0.01 0.00 -0.75 0.00 0.00 64.21 59.02 1ujl n SER 30 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1ujl n SER 31 N 1.78 -7.57 0.00 -3.46 7.64 -1.26 -5.03 113.62 105.72 1ujl n SER 31 Ca -0.04 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1ujl n SER 31 Cb 0.06 -5.13 0.00 0.00 -1.01 0.00 0.00 64.21 58.13 1ujl n SER 31 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ujl n GLY 32 N -0.94 -0.22 3.91 0.23 0.00 -1.26 -5.06 105.19 101.84 1ujl n GLY 32 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 1ujl n GLY 32 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ujl s LEU 33 N -4.64 2.86 0.06 0.99 0.20 -1.26 -5.01 118.68 111.88 1ujl s LEU 33 Ca 0.00 0.74 -0.17 0.00 0.69 0.00 0.00 54.13 55.39 1ujl s LEU 33 Cb 0.00 -3.43 -0.14 0.00 -0.43 0.00 0.00 46.19 42.19 1ujl s LEU 33 CO 0.00 -1.49 1.31 1.23 -0.29 0.00 0.00 176.35 177.11 1ujl h GLY 34 N -0.62 0.63 0.00 7.98 0.00 -2.06 -3.48 103.07 105.52 1ujl h GLY 34 Ca -0.45 -0.77 0.00 0.00 0.00 0.00 0.00 47.33 46.11 1ujl h GLY 34 CO 0.62 0.69 0.00 0.61 0.00 0.00 0.00 176.54 178.47 1ujl n GLY 35 N 0.46 1.02 0.33 4.60 0.00 -1.26 -4.98 105.19 105.37 1ujl n GLY 35 Ca -0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 1.05 -0.43 1.61 0.11 -1.98 -1.28 132.00 131.07 1ujl h PRO 36 Ca 0.00 -0.06 0.06 0.00 0.11 0.00 0.00 66.00 66.11 1ujl h PRO 36 Cb 0.00 -0.24 -0.05 0.00 0.11 0.00 0.00 31.00 30.82 1ujl h PRO 36 CO 0.00 0.69 0.11 0.77 -0.21 0.00 0.00 178.00 179.36 1ujl h SER 37 N 1.08 0.07 0.52 -2.05 0.02 -1.98 -0.33 113.55 110.87 1ujl h SER 37 Ca 0.36 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.35 1ujl h SER 37 Cb 0.05 0.08 0.01 0.00 0.14 0.00 0.00 62.40 62.67 1ujl h SER 37 CO -0.13 0.07 -0.25 0.40 -1.14 0.00 0.00 176.83 175.78 1ujl h ILE 38 N 0.26 0.17 -1.10 3.27 5.03 -1.86 -0.30 117.51 122.98 1ujl h ILE 38 Ca 0.21 -0.49 0.32 0.00 -0.12 0.00 0.00 64.86 64.78 1ujl h ILE 38 Cb 0.24 0.25 -0.04 0.00 -3.03 0.00 0.00 36.82 34.24 1ujl h ILE 38 CO -0.25 0.03 0.85 0.50 -0.68 0.00 0.00 178.15 178.60 1ujl h LYS 39 N -1.11 0.00 0.00 2.37 3.64 -1.16 0.99 116.57 121.29 1ujl h LYS 39 Ca -0.07 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.16 1ujl h LYS 39 Cb 0.59 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1ujl h LYS 39 CO 0.12 0.00 -1.28 0.22 -2.27 0.00 0.00 179.45 176.24 1ujl h ASP 40 N 0.00 0.00 1.19 4.20 1.82 -0.97 -3.28 116.42 119.37 1ujl h ASP 40 Ca 0.52 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.16 1ujl h ASP 40 Cb 2.22 0.00 0.00 0.00 0.68 0.00 0.00 39.33 42.23 1ujl h ASP 40 CO -0.01 0.54 0.00 0.50 -1.61 0.00 0.00 179.24 178.66 1ujl h LYS 41 N 0.00 0.00 0.00 0.28 1.63 0.28 -3.51 116.57 115.25 1ujl h LYS 41 Ca -0.13 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 1ujl h LYS 41 Cb 1.53 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.16 1ujl h LYS 41 CO 0.05 0.00 0.00 0.66 -3.45 0.00 0.00 179.45 176.71