#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 3.87 -0.19 0.00 1.01 -1.26 -5.06 121.20 119.58 1ujl s ILE 2 Ca 0.00 -1.37 -0.15 0.00 0.00 0.00 0.00 60.65 59.13 1ujl s ILE 2 Cb 0.00 -2.95 -0.21 0.00 0.01 0.00 0.00 42.46 39.31 1ujl s ILE 2 CO 0.00 -0.12 0.20 0.61 0.00 0.00 0.00 174.94 175.63 1ujl n GLY 3 N -0.19 -0.70 2.32 6.18 0.00 -1.26 -5.00 105.19 106.55 1ujl n GLY 3 Ca -0.09 -0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 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 -4.06 -3.75 -4.68 1.61 3.02 -1.26 -4.92 115.26 101.21 1ujl n ASN 4 Ca -0.34 -0.10 -0.48 0.00 -0.03 0.00 0.00 54.58 53.63 1ujl n ASN 4 Cb 0.83 -2.77 -0.05 0.00 -0.61 0.00 0.00 39.78 37.18 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 -2.28 2.19 -3.44 3.52 1.56 -1.26 -2.24 117.12 115.16 1ujl n MET 5 Ca -0.08 0.80 -0.19 0.00 -0.27 0.00 0.00 57.70 57.95 1ujl n MET 5 Cb 0.57 -2.63 0.06 0.00 2.15 0.00 0.00 33.22 33.38 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 5.90 -3.65 -2.87 2.12 2.13 -1.26 -5.01 120.64 118.00 1ujl n GLU 6 Ca 0.21 0.76 -0.20 0.00 0.66 0.00 0.00 57.16 58.59 1ujl n GLU 6 Cb 0.30 -5.47 0.02 0.00 0.27 0.00 0.00 31.44 26.56 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 -5.16 2.76 -0.96 5.31 -0.21 -0.95 -5.01 119.66 115.44 1ujl s GLN 7 Ca 0.27 -0.87 -0.24 0.00 0.02 0.00 0.00 55.36 54.54 1ujl s GLN 7 Cb -0.05 -2.60 0.00 0.00 1.00 0.00 0.00 33.01 31.36 1ujl s GLN 7 CO 0.77 -0.45 1.69 -1.25 -2.12 0.00 0.00 175.29 173.93 1ujl s PRO 8 N -4.57 3.08 -0.97 2.91 0.04 -1.26 -4.89 135.00 129.34 1ujl s PRO 8 Ca 0.54 -0.70 -0.03 0.00 0.04 0.00 0.00 61.00 60.85 1ujl s PRO 8 Cb -0.10 -5.20 0.27 0.00 0.04 0.00 0.00 34.50 29.51 1ujl s PRO 8 CO 0.36 -2.78 1.09 0.72 0.04 0.00 0.00 177.00 176.43 1ujl n HIS 9 N 11.38 3.71 -1.46 0.56 8.25 -1.26 -4.78 115.22 131.62 1ujl n HIS 9 Ca 0.36 -3.57 -0.03 0.00 -0.26 0.00 0.00 57.72 54.22 1ujl n HIS 9 Cb 0.49 -1.21 0.20 0.00 1.12 0.00 0.00 29.99 30.59 1ujl n HIS 9 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ujl n MET 10 N 1.83 1.83 -0.00 -0.41 0.00 -1.26 -4.73 117.12 114.38 1ujl n MET 10 Ca 0.25 -3.19 -0.00 0.00 0.00 0.00 0.00 57.70 54.75 1ujl n MET 10 Cb 0.37 -1.79 -0.00 0.00 0.00 0.00 0.00 33.22 31.79 1ujl n MET 10 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 1ujl n ASP 11 N -1.11 0.17 0.00 3.17 -0.08 -1.26 -4.98 116.55 112.46 1ujl n ASP 11 Ca 0.31 0.03 0.00 0.00 -1.51 0.00 0.00 54.79 53.62 1ujl n ASP 11 Cb 0.99 -0.26 0.00 0.00 2.34 0.00 0.00 41.12 44.19 1ujl n ASP 11 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1ujl n SER 12 N -2.66 0.00 0.00 1.67 3.41 -1.26 -4.53 113.62 110.24 1ujl n SER 12 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1ujl n SER 12 Cb 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.98 1ujl n SER 12 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ujl n ARG 13 N 0.00 -0.76 -4.50 4.33 1.74 -1.26 -4.97 116.66 111.24 1ujl n ARG 13 Ca 0.00 0.19 -0.23 0.00 -0.77 0.00 0.00 57.85 57.04 1ujl n ARG 13 Cb 0.00 -3.85 -0.11 0.00 -1.02 0.00 0.00 32.46 27.48 1ujl n ARG 13 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1ujl s ILE 14 N -1.74 1.48 0.00 0.55 2.07 -1.26 -4.90 121.20 117.40 1ujl s ILE 14 Ca 0.00 -2.01 0.00 0.00 -1.41 0.00 0.00 60.65 57.23 1ujl s ILE 14 Cb 0.00 -2.82 0.00 0.00 0.13 0.00 0.00 42.46 39.77 1ujl s ILE 14 CO 0.00 -0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.61 1ujl n GLY 15 N -0.76 1.60 0.34 1.50 0.00 -1.26 -5.01 105.19 101.60 1ujl n GLY 15 Ca -0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.09 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 0.98 0.00 1.61 5.08 -2.00 1.18 115.95 122.80 1ujl h TRP 16 Ca 0.00 0.03 -0.03 0.00 1.08 0.00 0.00 58.89 59.98 1ujl h TRP 16 Cb 0.00 -0.29 -0.00 0.00 -3.00 0.00 0.00 29.16 25.87 1ujl h TRP 16 CO 0.00 0.23 -0.13 -0.07 -1.28 0.00 0.00 178.44 177.19 1ujl h LEU 17 N 0.73 0.00 -2.69 0.11 3.38 -2.01 -1.59 115.31 113.24 1ujl h LEU 17 Ca 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.49 1ujl h LEU 17 Cb 0.80 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1ujl h LEU 17 CO -0.37 0.13 0.02 1.41 0.09 0.00 0.00 178.44 179.71 1ujl n HIS 18 N -3.40 1.39 0.00 1.13 8.25 0.40 -3.80 115.22 119.18 1ujl n HIS 18 Ca -0.01 -0.51 0.00 0.00 -0.26 0.00 0.00 57.72 56.94 1ujl n HIS 18 Cb 0.31 -0.39 0.00 0.00 1.12 0.00 0.00 29.99 31.04 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 0.36 0.00 0.27 0.41 5.15 -0.64 -4.76 115.26 116.06 1ujl n ASN 19 Ca 0.19 0.00 0.11 0.00 -0.60 0.00 0.00 54.58 54.28 1ujl n ASN 19 Cb 0.89 -0.00 0.73 0.00 -0.53 0.00 0.00 39.78 40.87 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 -1.94 1.20 8.10 -1.62 -0.74 115.31 120.31 1ujl h LEU 20 Ca 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.97 1ujl h LEU 20 Cb 0.62 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.84 1ujl h LEU 20 CO 0.00 0.02 -0.08 1.23 -4.11 0.00 0.00 178.44 175.50 1ujl h GLY 21 N 0.10 0.00 0.35 0.17 0.00 -1.84 -2.22 103.07 99.63 1ujl h GLY 21 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.97 1ujl h GLY 21 CO 0.00 0.00 -2.09 1.22 0.00 0.00 0.00 176.54 175.67 1ujl n ASP 22 N -3.41 2.05 -0.06 0.19 9.92 -0.33 -3.56 116.55 121.35 1ujl n ASP 22 Ca -0.01 0.14 0.03 0.00 -0.53 0.00 0.00 54.79 54.42 1ujl n ASP 22 Cb 0.24 -0.75 0.38 0.00 -0.64 0.00 0.00 41.12 40.35 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 -0.12 0.66 0.16 -1.24 3.07 -1.32 -3.20 115.11 113.11 1ujl h GLN 23 Ca -0.48 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.22 1ujl h GLN 23 Cb 1.90 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 29.31 1ujl h GLN 23 CO -0.02 0.43 -0.07 0.82 0.09 0.00 0.00 178.83 180.08 1ujl h ILE 24 N 0.68 0.00 0.00 1.86 1.08 -1.58 -3.51 117.51 116.04 1ujl h ILE 24 Ca 0.19 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1ujl h ILE 24 Cb -0.06 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.69 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 0.72 -1.26 3.14 5.37 0.00 -1.21 -5.12 105.19 106.83 1ujl n GLY 25 Ca -0.03 0.65 -0.32 0.00 0.00 0.00 0.00 46.02 46.32 1ujl n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ujl s LYS 26 N 0.00 2.94 -0.02 1.61 3.01 -1.26 -4.59 119.74 121.43 1ujl s LYS 26 Ca 0.00 -0.82 -0.25 0.00 -1.01 0.00 0.00 55.97 53.89 1ujl s LYS 26 Cb 0.00 -2.44 -0.20 0.00 -1.01 0.00 0.00 37.83 34.19 1ujl s LYS 26 CO 0.00 -0.09 1.27 -1.00 0.51 0.00 0.00 175.35 176.04 1ujl h PRO 27 N 7.56 0.04 0.00 -1.68 0.13 -2.00 -3.44 132.00 132.61 1ujl h PRO 27 Ca -0.37 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.70 1ujl h PRO 27 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 1ujl h PRO 27 CO 0.58 0.52 -0.09 2.48 -0.23 0.00 0.00 178.00 181.26 1ujl n TYR 28 N -4.82 -0.22 -4.16 1.56 0.18 -1.26 -5.01 117.16 103.42 1ujl n TYR 28 Ca -0.08 -0.29 -0.30 0.00 1.88 0.00 0.00 57.90 59.11 1ujl n TYR 28 Cb 0.26 0.51 -0.06 0.00 -0.38 0.00 0.00 39.34 39.67 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 -0.17 0.16 -3.37 9.48 2.85 -1.26 0.11 115.26 123.06 1ujl n ASN 29 Ca -0.08 -1.18 -0.17 0.00 -0.11 0.00 0.00 54.58 53.04 1ujl n ASN 29 Cb 0.47 -2.16 0.04 0.00 1.24 0.00 0.00 39.78 39.37 1ujl n ASN 29 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 1ujl n SER 30 N -2.89 -6.41 -1.07 1.20 2.88 -1.26 -1.71 113.62 104.36 1ujl n SER 30 Ca -0.31 -0.68 -0.14 0.00 -1.33 0.00 0.00 58.87 56.41 1ujl n SER 30 Cb 0.69 -4.48 -0.06 0.00 -0.75 0.00 0.00 64.21 59.61 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 -2.71 -5.35 0.00 -3.46 2.88 -0.70 -2.13 113.62 102.16 1ujl n SER 31 Ca -0.08 0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 1ujl n SER 31 Cb 0.59 -4.07 0.00 0.00 -0.75 0.00 0.00 64.21 59.98 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 -0.38 2.70 3.89 0.46 0.00 0.30 -5.02 105.19 107.15 1ujl n GLY 32 Ca -0.14 -0.26 -0.29 0.00 0.00 0.00 0.00 46.02 45.32 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 0.00 2.80 0.00 0.99 0.20 -0.90 -4.93 118.68 116.84 1ujl s LEU 33 Ca 0.00 0.99 0.00 0.00 0.69 0.00 0.00 54.13 55.81 1ujl s LEU 33 Cb 0.00 -3.70 0.00 0.00 -0.43 0.00 0.00 46.19 42.06 1ujl s LEU 33 CO 0.00 -1.49 0.00 0.61 -0.29 0.00 0.00 176.35 175.18 1ujl n GLY 34 N -3.07 0.92 3.86 7.98 0.00 -1.26 -4.30 105.19 109.33 1ujl n GLY 34 Ca 0.07 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 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 2.13 0.36 -0.02 0.00 -1.26 -5.00 107.32 103.52 1ujl s GLY 35 Ca 0.00 -0.82 0.09 0.00 0.00 0.00 0.00 44.72 43.98 1ujl s GLY 35 CO 0.00 -0.73 1.89 -2.55 0.00 0.00 0.00 173.10 171.71 1ujl h PRO 36 N 3.73 0.67 -0.12 2.90 0.11 -2.00 -1.96 132.00 135.33 1ujl h PRO 36 Ca -0.48 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.62 1ujl h PRO 36 Cb 1.18 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.10 1ujl h PRO 36 CO 0.68 0.44 -0.12 1.03 -0.21 0.00 0.00 178.00 179.83 1ujl h SER 37 N 0.69 -0.37 0.69 -2.05 0.87 -1.98 -1.24 113.55 110.17 1ujl h SER 37 Ca 0.42 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 61.02 1ujl h SER 37 Cb 0.65 0.18 0.01 0.00 -0.44 0.00 0.00 62.40 62.80 1ujl h SER 37 CO -0.18 -0.16 -0.33 0.40 -0.53 0.00 0.00 176.83 176.03 1ujl h ILE 38 N -0.14 0.13 -1.20 2.23 5.03 -1.82 -0.13 117.51 121.61 1ujl h ILE 38 Ca 0.08 -0.27 0.35 0.00 -0.12 0.00 0.00 64.86 64.90 1ujl h ILE 38 Cb 0.26 0.17 -0.05 0.00 -3.03 0.00 0.00 36.82 34.18 1ujl h ILE 38 CO -0.20 0.02 0.98 0.50 -0.68 0.00 0.00 178.15 178.76 1ujl h LYS 39 N -1.17 0.00 0.00 2.37 3.64 -1.32 1.35 116.57 121.44 1ujl h LYS 39 Ca -0.10 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.20 1ujl h LYS 39 Cb 0.74 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 1ujl h LYS 39 CO 0.16 0.00 -1.35 -3.47 -2.27 0.00 0.00 179.45 172.51 1ujl n ASP 40 N -3.87 0.71 0.25 4.20 2.03 -0.47 -3.83 116.55 115.58 1ujl n ASP 40 Ca 0.26 0.29 0.15 0.00 0.52 0.00 0.00 54.79 56.01 1ujl n ASP 40 Cb 1.37 0.54 0.53 0.00 -0.72 0.00 0.00 41.12 42.84 1ujl n ASP 40 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1ujl h LYS 41 N 0.00 0.00 -0.01 -0.67 3.64 0.37 -3.51 116.57 116.40 1ujl h LYS 41 Ca -0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1ujl h LYS 41 Cb 1.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 1ujl h LYS 41 CO 0.02 0.05 0.00 0.66 -2.27 0.00 0.00 179.45 177.91