#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 1.01 -1.26 -4.96 121.20 120.93 1ujl s ILE 2 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.16 1ujl s ILE 2 Cb 0.00 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.83 1ujl s ILE 2 CO 0.00 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.56 1ujl n GLY 3 N 0.09 0.00 1.31 6.18 0.00 -1.26 -5.01 105.19 106.51 1ujl n GLY 3 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.03 -3.94 1.61 4.05 -1.26 -5.15 115.26 109.53 1ujl n ASN 4 Ca 0.00 -1.93 -0.26 0.00 0.45 0.00 0.00 54.58 52.83 1ujl n ASN 4 Cb 0.00 0.36 0.13 0.00 1.23 0.00 0.00 39.78 41.50 1ujl n ASN 4 CO 0.00 0.00 0.00 0.80 -3.05 0.00 0.00 177.26 175.01 1ujl n MET 5 N -0.31 -1.47 -0.92 1.20 1.56 -1.26 -4.64 117.12 111.29 1ujl n MET 5 Ca -0.24 -0.43 -0.34 0.00 -0.27 0.00 0.00 57.70 56.42 1ujl n MET 5 Cb 0.71 -1.44 -0.04 0.00 2.15 0.00 0.00 33.22 34.60 1ujl n MET 5 CO 0.00 0.00 0.00 -0.85 -0.73 0.00 0.00 175.97 174.39 1ujl n GLU 6 N -0.86 1.55 -2.83 2.12 0.28 -1.26 -4.88 120.64 114.77 1ujl n GLU 6 Ca 0.02 -1.61 -0.19 0.00 -0.16 0.00 0.00 57.16 55.22 1ujl n GLU 6 Cb 0.52 -2.70 0.02 0.00 1.43 0.00 0.00 31.44 30.71 1ujl n GLU 6 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 177.13 176.32 1ujl s GLN 7 N 4.57 2.69 -1.19 3.44 1.11 -1.26 -4.99 119.66 124.03 1ujl s GLN 7 Ca 0.49 -0.98 -0.22 0.00 0.01 0.00 0.00 55.36 54.67 1ujl s GLN 7 Cb 0.12 -2.61 -0.04 0.00 -1.01 0.00 0.00 33.01 29.47 1ujl s GLN 7 CO 0.07 -0.50 1.86 -1.25 0.01 0.00 0.00 175.29 175.49 1ujl s PRO 8 N -4.57 2.94 -0.98 2.91 0.04 -1.26 -4.86 135.00 129.23 1ujl s PRO 8 Ca 0.56 -1.33 -0.04 0.00 0.04 0.00 0.00 61.00 60.23 1ujl s PRO 8 Cb -0.10 -5.31 0.25 0.00 0.04 0.00 0.00 34.50 29.37 1ujl s PRO 8 CO 0.36 -3.41 0.94 0.72 0.04 0.00 0.00 177.00 175.65 1ujl n HIS 9 N 12.54 4.47 -2.59 0.56 8.25 -1.26 -4.67 115.22 132.51 1ujl n HIS 9 Ca 0.45 -3.97 -0.21 0.00 -0.26 0.00 0.00 57.72 53.72 1ujl n HIS 9 Cb 0.47 -1.32 0.00 0.00 1.12 0.00 0.00 29.99 30.26 1ujl n HIS 9 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 1ujl n MET 10 N 2.32 -2.70 0.00 -0.41 2.81 -1.26 -4.88 117.12 113.00 1ujl n MET 10 Ca 0.23 0.99 -0.01 0.00 -1.81 0.00 0.00 57.70 57.10 1ujl n MET 10 Cb 0.38 -5.72 -0.00 0.00 -0.71 0.00 0.00 33.22 27.16 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 -2.18 0.44 -3.64 7.83 2.03 -1.26 -5.14 116.55 114.63 1ujl n ASP 11 Ca -0.21 0.07 -0.03 0.00 0.52 0.00 0.00 54.79 55.14 1ujl n ASP 11 Cb 0.67 -0.27 -0.02 0.00 -0.72 0.00 0.00 41.12 40.77 1ujl n ASP 11 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1ujl s SER 12 N -5.06 -0.04 0.05 1.67 0.15 -1.26 -5.09 113.70 104.11 1ujl s SER 12 Ca -0.03 0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.62 1ujl s SER 12 Cb 0.00 0.04 0.00 0.00 -1.71 0.00 0.00 66.02 64.35 1ujl s SER 12 CO 0.05 -0.06 0.00 0.54 1.20 0.00 0.00 173.24 174.97 1ujl n ARG 13 N 0.04 0.00 0.00 5.44 5.12 -1.26 -4.62 116.66 121.38 1ujl n ARG 13 Ca 0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.96 1ujl n ARG 13 Cb 0.57 -0.26 0.00 0.00 -1.16 0.00 0.00 32.46 31.61 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 -2.94 0.00 -0.30 0.55 0.13 -1.26 -4.91 119.36 110.64 1ujl n ILE 14 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1ujl n ILE 14 Cb 0.20 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 39.00 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 0.00 0.83 0.37 4.50 0.00 -1.26 -4.96 105.19 104.67 1ujl n GLY 15 Ca 0.00 -0.20 0.15 0.00 0.00 0.00 0.00 46.02 45.97 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 0.93 0.00 1.61 5.08 -2.00 1.20 115.95 122.78 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 -0.28 -0.00 0.00 -3.00 0.00 0.00 29.16 25.87 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 0.67 0.00 -2.88 0.11 3.38 -2.00 -2.44 115.31 112.15 1ujl h LEU 17 Ca 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.50 1ujl h LEU 17 Cb 1.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1ujl h LEU 17 CO -0.33 0.12 0.03 1.41 0.09 0.00 0.00 178.44 179.76 1ujl n HIS 18 N -3.23 1.55 0.00 1.13 8.25 0.41 -3.73 115.22 119.60 1ujl n HIS 18 Ca 0.01 -0.58 0.00 0.00 -0.26 0.00 0.00 57.72 56.89 1ujl n HIS 18 Cb 0.41 -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 0.37 0.01 0.28 0.41 5.15 -0.79 -4.78 115.26 115.92 1ujl n ASN 19 Ca 0.21 0.01 0.14 0.00 -0.60 0.00 0.00 54.58 54.35 1ujl n ASN 19 Cb 0.96 0.00 0.80 0.00 -0.53 0.00 0.00 39.78 41.01 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 0.05 1.20 8.10 -1.63 -1.18 115.31 121.85 1ujl h LEU 20 Ca 0.00 0.00 0.03 0.00 0.11 0.00 0.00 57.88 58.02 1ujl h LEU 20 Cb 0.46 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 40.64 1ujl h LEU 20 CO 0.00 0.08 -0.27 1.23 -4.11 0.00 0.00 178.44 175.37 1ujl h GLY 21 N 0.72 -0.46 1.56 0.17 0.00 -1.83 -1.93 103.07 101.29 1ujl h GLY 21 Ca -0.00 0.32 -0.12 0.00 0.00 0.00 0.00 47.33 47.53 1ujl h GLY 21 CO 0.01 -0.22 -0.88 -1.80 0.00 0.00 0.00 176.54 173.65 1ujl h ASP 22 N -0.45 0.00 -0.73 0.19 1.82 -1.86 -2.99 116.42 112.40 1ujl h ASP 22 Ca 0.05 0.00 0.09 0.00 -0.39 0.00 0.00 57.03 56.77 1ujl h ASP 22 Cb 0.51 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 40.47 1ujl h ASP 22 CO -0.20 0.51 0.48 -0.61 -1.61 0.00 0.00 179.24 177.81 1ujl h GLN 23 N 0.00 0.66 0.00 0.28 5.75 -0.91 -3.22 115.11 117.67 1ujl h GLN 23 Ca -0.07 -0.04 -0.08 0.00 -0.15 0.00 0.00 58.65 58.32 1ujl h GLN 23 Cb 1.44 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.83 1ujl h GLN 23 CO 0.05 0.44 -0.82 -0.89 -2.65 0.00 0.00 178.83 174.96 1ujl n ILE 24 N -4.49 1.46 0.00 2.39 2.08 -0.75 -5.03 119.36 115.01 1ujl n ILE 24 Ca 0.12 0.13 0.00 0.00 0.56 0.00 0.00 62.75 63.55 1ujl n ILE 24 Cb 0.30 -2.28 0.00 0.00 -0.75 0.00 0.00 39.64 36.91 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 1.54 1.57 3.65 7.39 0.00 -1.13 -5.07 105.19 113.15 1ujl n GLY 25 Ca -0.16 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.32 1ujl n GLY 25 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ujl n LYS 26 N -0.62 1.22 0.30 1.61 0.00 -1.25 -4.90 118.16 114.52 1ujl n LYS 26 Ca 0.00 0.44 -0.13 0.00 -0.00 0.00 0.00 58.31 58.62 1ujl n LYS 26 Cb 0.00 -2.12 -0.07 0.00 -0.00 0.00 0.00 35.03 32.85 1ujl n LYS 26 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 1ujl h PRO 27 N 5.97 -0.79 -1.13 -1.58 0.11 -1.95 -3.38 132.00 129.26 1ujl h PRO 27 Ca -0.47 0.05 -0.42 0.00 0.11 0.00 0.00 66.00 65.27 1ujl h PRO 27 Cb 1.32 0.18 -0.41 0.00 0.11 0.00 0.00 31.00 32.21 1ujl h PRO 27 CO 0.87 -0.53 -1.08 2.48 -0.21 0.00 0.00 178.00 179.53 1ujl n TYR 28 N -4.45 1.74 -3.38 0.65 4.11 -1.26 -5.00 117.16 109.58 1ujl n TYR 28 Ca -0.10 -2.87 -0.12 0.00 -0.00 0.00 0.00 57.90 54.82 1ujl n TYR 28 Cb 0.34 -0.30 0.01 0.00 -0.00 0.00 0.00 39.34 39.39 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 -0.18 -6.53 -3.84 9.48 5.15 -1.26 -4.96 115.26 113.13 1ujl n ASN 29 Ca 0.17 -0.49 -0.29 0.00 -0.60 0.00 0.00 54.58 53.37 1ujl n ASN 29 Cb 0.78 -3.88 -0.10 0.00 -0.53 0.00 0.00 39.78 36.05 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 -2.19 3.38 -2.50 1.20 7.64 -1.26 -4.95 113.62 114.94 1ujl n SER 30 Ca -0.12 -3.25 -0.04 0.00 1.01 0.00 0.00 58.87 56.46 1ujl n SER 30 Cb 0.58 -0.79 -0.04 0.00 -1.01 0.00 0.00 64.21 62.95 1ujl n SER 30 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1ujl n SER 31 N 1.78 -2.23 -2.01 6.43 7.64 -1.26 -4.87 113.62 119.09 1ujl n SER 31 Ca 0.22 1.41 -0.19 0.00 1.01 0.00 0.00 58.87 61.32 1ujl n SER 31 Cb 0.36 -5.12 0.15 0.00 -1.01 0.00 0.00 64.21 58.60 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 1.68 4.04 3.61 0.23 0.00 -1.26 -4.98 105.19 108.51 1ujl n GLY 32 Ca -0.33 -0.90 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 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 -2.72 1.17 -0.34 0.99 0.20 -1.26 -5.01 118.68 111.71 1ujl s LEU 33 Ca 0.47 1.15 -0.06 0.00 0.69 0.00 0.00 54.13 56.38 1ujl s LEU 33 Cb 0.40 -3.17 0.04 0.00 -0.43 0.00 0.00 46.19 43.02 1ujl s LEU 33 CO 0.09 -3.60 0.10 -0.83 -0.29 0.00 0.00 176.35 171.82 1ujl s GLY 34 N -3.31 1.84 0.00 7.98 0.00 -1.26 -4.87 107.32 107.70 1ujl s GLY 34 Ca 0.67 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.63 1ujl s GLY 34 CO 0.59 0.77 0.00 0.61 0.00 0.00 0.00 173.10 175.07 1ujl n GLY 35 N 4.79 -1.14 0.10 0.20 0.00 -1.26 -5.06 105.19 102.82 1ujl n GLY 35 Ca -0.12 0.40 -0.12 0.00 0.00 0.00 0.00 46.02 46.17 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 0.22 -0.87 1.61 0.11 -1.99 -1.93 132.00 129.14 1ujl h PRO 36 Ca 0.00 -0.09 0.12 0.00 0.11 0.00 0.00 66.00 66.14 1ujl h PRO 36 Cb 0.00 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 31.02 1ujl h PRO 36 CO 0.00 0.54 0.49 1.03 -0.21 0.00 0.00 178.00 179.85 1ujl h SER 37 N -0.12 0.68 0.51 -2.05 0.87 -1.98 -0.34 113.55 111.12 1ujl h SER 37 Ca 0.03 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 1ujl h SER 37 Cb 0.46 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.36 1ujl h SER 37 CO 0.01 0.35 -0.25 0.40 -0.53 0.00 0.00 176.83 176.81 1ujl h ILE 38 N 0.77 0.00 -1.02 2.23 5.03 -1.96 -0.30 117.51 122.26 1ujl h ILE 38 Ca 0.44 -0.40 0.30 0.00 -0.12 0.00 0.00 64.86 65.08 1ujl h ILE 38 Cb 0.50 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 34.25 1ujl h ILE 38 CO -0.29 0.00 0.82 0.11 -0.68 0.00 0.00 178.15 178.11 1ujl h LYS 39 N -1.09 0.00 0.00 2.37 1.79 -1.17 1.02 116.57 119.49 1ujl h LYS 39 Ca -0.07 0.00 -0.19 0.00 -2.18 0.00 0.00 60.65 58.21 1ujl h LYS 39 Cb 0.53 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.15 1ujl h LYS 39 CO 0.12 0.00 -1.22 -0.44 -1.08 0.00 0.00 179.45 176.82 1ujl h ASP 40 N 0.00 0.00 1.20 0.86 3.32 -1.00 -3.26 116.42 117.54 1ujl h ASP 40 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 1ujl h ASP 40 Cb 2.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.67 1ujl h ASP 40 CO -0.01 0.71 0.00 0.50 -1.72 0.00 0.00 179.24 178.72 1ujl h LYS 41 N 0.00 0.00 0.00 3.56 3.64 0.29 -3.51 116.57 120.55 1ujl h LYS 41 Ca -0.13 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1ujl h LYS 41 Cb 1.66 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.48 1ujl h LYS 41 CO 0.07 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.91