#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 1.65 0.00 0.00 1.09 -1.26 -5.11 121.20 117.57 1ujl s ILE 2 Ca 0.00 -1.00 0.00 0.00 -1.10 0.00 0.00 60.65 58.55 1ujl s ILE 2 Cb 0.00 -1.39 0.00 0.00 -1.06 0.00 0.00 42.46 40.01 1ujl s ILE 2 CO 0.00 0.37 0.00 0.61 -0.10 0.00 0.00 174.94 175.82 1ujl n GLY 3 N 2.30 -1.90 0.00 6.18 0.00 -1.26 -4.90 105.19 105.61 1ujl n GLY 3 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.00 4.18 -4.56 1.61 2.85 -1.26 -5.05 115.26 113.03 1ujl n ASN 4 Ca 0.00 0.00 -0.51 0.00 -0.11 0.00 0.00 54.58 53.96 1ujl n ASN 4 Cb 0.00 0.10 -0.05 0.00 1.24 0.00 0.00 39.78 41.06 1ujl n ASN 4 CO 0.00 0.00 0.00 0.80 -2.11 0.00 0.00 177.26 175.95 1ujl n MET 5 N -2.40 0.92 -0.11 1.20 1.56 -1.26 -4.90 117.12 112.12 1ujl n MET 5 Ca 0.00 0.33 -0.22 0.00 -0.27 0.00 0.00 57.70 57.54 1ujl n MET 5 Cb 0.50 -1.85 -0.12 0.00 2.15 0.00 0.00 33.22 33.90 1ujl n MET 5 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1ujl n GLU 6 N 1.95 0.65 -2.16 2.12 1.02 -1.26 -4.94 120.64 118.01 1ujl n GLU 6 Ca 0.17 0.22 -0.41 0.00 -0.02 0.00 0.00 57.16 57.12 1ujl n GLU 6 Cb 0.20 -1.55 -0.03 0.00 -0.02 0.00 0.00 31.44 30.04 1ujl n GLU 6 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 1ujl s GLN 7 N -2.51 4.36 -0.07 3.49 0.74 -1.26 -5.00 119.66 119.41 1ujl s GLN 7 Ca -0.34 2.12 -0.24 0.00 0.05 0.00 0.00 55.36 56.96 1ujl s GLN 7 Cb 0.10 -3.16 -0.04 0.00 1.10 0.00 0.00 33.01 31.01 1ujl s GLN 7 CO 0.60 -0.28 0.72 -1.25 -0.55 0.00 0.00 175.29 174.53 1ujl s PRO 8 N -0.30 4.44 0.00 1.67 0.04 -1.26 -4.83 135.00 134.76 1ujl s PRO 8 Ca 0.57 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.52 1ujl s PRO 8 Cb -0.38 -3.45 0.00 0.00 0.04 0.00 0.00 34.50 30.71 1ujl s PRO 8 CO 0.40 0.04 0.00 -2.39 0.04 0.00 0.00 177.00 175.10 1ujl n HIS 9 N 3.83 -0.38 -2.43 0.56 1.44 -1.26 -5.02 115.22 111.96 1ujl n HIS 9 Ca -0.01 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.55 1ujl n HIS 9 Cb 0.51 0.08 -0.01 0.00 0.12 0.00 0.00 29.99 30.69 1ujl n HIS 9 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1ujl n MET 10 N -1.15 -2.05 -1.05 -1.40 2.81 -1.26 -4.84 117.12 108.18 1ujl n MET 10 Ca 0.00 0.75 -0.15 0.00 -1.81 0.00 0.00 57.70 56.48 1ujl n MET 10 Cb 0.00 -5.38 0.19 0.00 -0.71 0.00 0.00 33.22 27.33 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 -1.89 3.24 -2.95 7.83 -0.08 -1.26 -4.96 116.55 116.48 1ujl n ASP 11 Ca -0.18 -3.67 -0.09 0.00 -1.51 0.00 0.00 54.79 49.33 1ujl n ASP 11 Cb 0.64 -0.75 0.01 0.00 2.34 0.00 0.00 41.12 43.35 1ujl n ASP 11 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1ujl n SER 12 N -1.11 -7.71 -0.09 1.67 2.88 -1.26 -5.00 113.62 102.99 1ujl n SER 12 Ca 0.49 0.36 -0.19 0.00 -1.33 0.00 0.00 58.87 58.20 1ujl n SER 12 Cb 1.41 -5.05 -0.06 0.00 -0.75 0.00 0.00 64.21 59.75 1ujl n SER 12 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ujl n ARG 13 N -0.58 0.40 0.00 -1.46 5.12 -1.26 -5.10 116.66 113.78 1ujl n ARG 13 Ca 0.08 0.17 0.00 0.00 -1.93 0.00 0.00 57.85 56.17 1ujl n ARG 13 Cb 0.49 -1.17 0.00 0.00 -1.16 0.00 0.00 32.46 30.62 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 -3.89 0.00 0.00 0.55 3.06 -1.26 -4.94 119.36 112.88 1ujl n ILE 14 Ca -0.34 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 59.91 1ujl n ILE 14 Cb 0.72 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.90 1ujl n ILE 14 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1ujl n GLY 15 N 0.00 1.25 0.29 4.50 0.00 -1.26 -5.00 105.19 104.97 1ujl n GLY 15 Ca 0.00 0.00 0.07 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 0.58 0.00 1.61 5.08 -2.00 1.13 115.95 122.35 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 26.02 1ujl h TRP 16 CO 0.00 0.06 -0.07 -0.07 -1.28 0.00 0.00 178.44 177.08 1ujl h LEU 17 N 0.47 0.00 -2.82 0.11 3.38 -2.01 -0.86 115.31 113.58 1ujl h LEU 17 Ca 0.45 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.37 1ujl h LEU 17 Cb 0.70 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 1ujl h LEU 17 CO -0.42 0.07 0.06 1.41 0.09 0.00 0.00 178.44 179.65 1ujl n HIS 18 N -3.37 1.51 0.00 1.13 8.25 0.39 -3.64 115.22 119.49 1ujl n HIS 18 Ca -0.01 -0.61 0.00 0.00 -0.26 0.00 0.00 57.72 56.83 1ujl n HIS 18 Cb 0.23 -0.43 0.00 0.00 1.12 0.00 0.00 29.99 30.91 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 0.29 0.17 0.21 0.41 2.85 -0.37 -4.76 115.26 114.06 1ujl n ASN 19 Ca 0.22 0.00 0.05 0.00 -0.11 0.00 0.00 54.58 54.74 1ujl n ASN 19 Cb 0.95 0.00 0.47 0.00 1.24 0.00 0.00 39.78 42.44 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 0.00 -1.02 1.20 8.10 -1.61 -2.04 115.31 119.94 1ujl h LEU 20 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 57.88 57.93 1ujl h LEU 20 Cb 0.55 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.75 1ujl h LEU 20 CO 0.00 0.26 0.06 1.23 -4.11 0.00 0.00 178.44 175.89 1ujl h GLY 21 N 0.94 0.82 1.13 0.17 0.00 -1.83 -1.33 103.07 102.98 1ujl h GLY 21 Ca -0.00 -0.50 -0.34 0.00 0.00 0.00 0.00 47.33 46.48 1ujl h GLY 21 CO 0.03 0.47 -1.57 -0.55 0.00 0.00 0.00 176.54 174.93 1ujl h ASP 22 N 0.73 0.77 0.16 0.19 5.19 -1.78 -3.29 116.42 118.39 1ujl h ASP 22 Ca 0.15 -0.93 -0.03 0.00 -0.62 0.00 0.00 57.03 55.61 1ujl h ASP 22 Cb 0.35 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.61 1ujl h ASP 22 CO 0.01 1.74 -0.12 1.56 -3.12 0.00 0.00 179.24 179.30 1ujl h GLN 23 N 0.12 0.00 -6.61 3.56 1.08 -1.29 -3.47 115.11 108.50 1ujl h GLN 23 Ca -0.29 0.00 -0.44 0.00 -1.45 0.00 0.00 58.65 56.47 1ujl h GLN 23 Cb 2.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.57 1ujl h GLN 23 CO 0.24 0.12 -1.00 -0.89 -0.95 0.00 0.00 178.83 176.36 1ujl n ILE 24 N -4.22 -4.03 0.92 2.54 2.08 -0.51 -4.84 119.36 111.30 1ujl n ILE 24 Ca -0.03 -0.03 0.13 0.00 0.56 0.00 0.00 62.75 63.39 1ujl n ILE 24 Cb 0.20 -3.35 0.57 0.00 -0.75 0.00 0.00 39.64 36.32 1ujl n ILE 24 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ujl n GLY 25 N -1.61 -1.48 3.66 7.39 0.00 -1.26 -4.76 105.19 107.13 1ujl n GLY 25 Ca -0.28 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 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 -3.01 4.27 0.26 1.61 1.02 -1.26 -4.94 119.74 117.68 1ujl s LYS 26 Ca 0.13 1.22 -0.01 0.00 0.02 0.00 0.00 55.97 57.32 1ujl s LYS 26 Cb 0.18 -3.62 0.51 0.00 -0.52 0.00 0.00 37.83 34.38 1ujl s LYS 26 CO 0.52 -0.52 1.78 -1.35 -0.92 0.00 0.00 175.35 174.85 1ujl h PRO 27 N 7.44 0.68 0.00 -1.68 0.11 -2.02 -3.37 132.00 133.17 1ujl h PRO 27 Ca -0.23 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.70 1ujl h PRO 27 Cb 1.09 -0.15 -0.12 0.00 0.11 0.00 0.00 31.00 31.93 1ujl h PRO 27 CO 0.92 0.45 -0.18 2.48 -0.21 0.00 0.00 178.00 181.45 1ujl n TYR 28 N -4.82 -1.62 -2.96 0.65 0.18 -1.26 -5.07 117.16 102.26 1ujl n TYR 28 Ca 0.17 -1.36 -0.00 0.00 1.88 0.00 0.00 57.90 58.59 1ujl n TYR 28 Cb 0.40 1.36 -0.00 0.00 -0.38 0.00 0.00 39.34 40.72 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 -0.89 -7.24 0.00 9.48 2.85 -1.26 -5.04 115.26 113.16 1ujl n ASN 29 Ca -0.12 0.90 0.00 0.00 -0.11 0.00 0.00 54.58 55.25 1ujl n ASN 29 Cb 0.78 -3.38 0.00 0.00 1.24 0.00 0.00 39.78 38.42 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 1.03 0.00 -1.57 1.20 2.88 -1.26 -5.10 113.62 110.79 1ujl n SER 30 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1ujl n SER 30 Cb 0.26 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.72 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 0.00 -6.02 0.00 -3.46 2.88 -1.26 -5.06 113.62 100.70 1ujl n SER 31 Ca 0.00 0.90 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 1ujl n SER 31 Cb 0.00 -3.28 0.00 0.00 -0.75 0.00 0.00 64.21 60.18 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 1.03 0.00 3.56 0.46 0.00 -1.26 -5.16 105.19 103.82 1ujl n GLY 32 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 1.44 0.00 0.99 0.20 -1.26 -4.77 118.68 115.28 1ujl s LEU 33 Ca 0.00 1.64 0.00 0.00 0.69 0.00 0.00 54.13 56.46 1ujl s LEU 33 Cb 0.00 -3.72 0.00 0.00 -0.43 0.00 0.00 46.19 42.04 1ujl s LEU 33 CO 0.00 -3.76 0.00 0.61 -0.29 0.00 0.00 176.35 172.91 1ujl n GLY 34 N 0.36 2.42 3.06 7.98 0.00 -1.26 -5.13 105.19 112.62 1ujl n GLY 34 Ca 0.05 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.62 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 0.55 0.08 -0.02 0.00 -1.26 -5.05 107.32 101.62 1ujl s GLY 35 Ca 0.00 -0.48 -0.15 0.00 0.00 0.00 0.00 44.72 44.08 1ujl s GLY 35 CO 0.00 -0.39 1.32 -0.56 0.00 0.00 0.00 173.10 173.47 1ujl h PRO 36 N 5.88 0.66 -0.55 2.90 0.13 -2.00 -2.41 132.00 136.61 1ujl h PRO 36 Ca -0.32 -0.45 0.04 0.00 -0.87 0.00 0.00 66.00 64.40 1ujl h PRO 36 Cb 1.17 0.07 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 1ujl h PRO 36 CO 0.49 1.07 0.30 1.03 -0.23 0.00 0.00 178.00 180.66 1ujl h SER 37 N 0.35 0.44 0.61 1.44 0.87 -1.98 -1.24 113.55 114.04 1ujl h SER 37 Ca -0.00 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1ujl h SER 37 Cb 1.08 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.99 1ujl h SER 37 CO 0.10 0.30 -0.30 0.40 -0.53 0.00 0.00 176.83 176.81 1ujl h ILE 38 N 0.57 0.17 -1.03 2.23 5.03 -1.98 -0.35 117.51 122.14 1ujl h ILE 38 Ca 0.24 -0.36 0.30 0.00 -0.12 0.00 0.00 64.86 64.92 1ujl h ILE 38 Cb 0.12 0.24 -0.04 0.00 -3.03 0.00 0.00 36.82 34.11 1ujl h ILE 38 CO -0.15 0.03 0.81 0.50 -0.68 0.00 0.00 178.15 178.65 1ujl h LYS 39 N -1.13 0.00 0.00 2.37 3.64 -1.34 1.12 116.57 121.23 1ujl h LYS 39 Ca -0.08 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.12 1ujl h LYS 39 Cb 0.67 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.47 1ujl h LYS 39 CO 0.14 0.00 -1.14 0.22 -2.27 0.00 0.00 179.45 176.40 1ujl h ASP 40 N 0.00 0.00 1.17 4.20 3.58 -1.04 -3.24 116.42 121.09 1ujl h ASP 40 Ca 0.49 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.94 1ujl h ASP 40 Cb 2.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 43.15 1ujl h ASP 40 CO -0.01 0.69 0.00 0.50 -2.88 0.00 0.00 179.24 177.55 1ujl h LYS 41 N 0.00 0.00 0.00 0.28 3.64 0.30 -3.51 116.57 117.28 1ujl h LYS 41 Ca -0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 1ujl h LYS 41 Cb 1.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.45 1ujl h LYS 41 CO 0.07 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.91