#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bkt n GLY 2 N 0.00 3.99 0.00 7.63 0.00 -1.26 0.07 105.19 115.63 1bkt n GLY 2 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.09 1bkt n GLY 2 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1bkt n ILE 3 N -0.11 0.00 -2.18 -0.61 -5.35 -1.15 -4.74 119.36 105.22 1bkt n ILE 3 Ca -0.01 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.46 1bkt n ILE 3 Cb 0.08 0.00 0.02 0.00 -1.74 0.00 0.00 39.64 37.99 1bkt n ILE 3 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1bkt n ASN 4 N 0.00 -0.43 -4.38 7.28 2.85 -1.26 -5.02 115.26 114.30 1bkt n ASN 4 Ca 0.00 -1.10 -0.19 0.00 -0.11 0.00 0.00 54.58 53.17 1bkt n ASN 4 Cb 0.00 0.18 -0.10 0.00 1.24 0.00 0.00 39.78 41.10 1bkt n ASN 4 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1bkt s VAL 5 N 0.03 1.46 -0.01 3.44 1.01 -1.26 -5.02 120.40 120.05 1bkt s VAL 5 Ca 0.02 -2.11 -0.02 0.00 0.00 0.00 0.00 61.98 59.87 1bkt s VAL 5 Cb 0.09 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 1bkt s VAL 5 CO -0.03 -0.38 0.15 -0.75 0.00 0.00 0.00 175.10 174.09 1bkt s LYS 6 N -3.75 3.32 0.28 2.72 2.36 -1.26 -0.79 119.74 122.62 1bkt s LYS 6 Ca 0.27 -0.36 0.04 0.00 -2.55 0.00 0.00 55.97 53.37 1bkt s LYS 6 Cb 0.03 -3.03 -0.06 0.00 -1.05 0.00 0.00 37.83 33.73 1bkt s LYS 6 CO 0.09 0.67 0.01 0.00 1.55 0.00 0.00 175.35 177.67 1bkt n LYS 8 N -0.58 0.00 -4.53 0.00 5.02 -1.26 -4.74 118.16 112.08 1bkt n LYS 8 Ca -0.04 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.00 1bkt n LYS 8 Cb 0.65 -0.83 -0.09 0.00 -0.02 0.00 0.00 35.03 34.74 1bkt n LYS 8 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1bkt s HIS 9 N -1.96 1.83 -0.24 2.13 3.76 -1.26 -5.02 115.29 114.53 1bkt s HIS 9 Ca 0.00 -1.18 0.02 0.00 -0.15 0.00 0.00 55.06 53.75 1bkt s HIS 9 Cb 0.00 -1.23 0.27 0.00 1.11 0.00 0.00 32.58 32.73 1bkt s HIS 9 CO 0.00 -0.18 1.32 0.43 -0.85 0.00 0.00 174.74 175.46 1bkt n SER 10 N -1.17 3.25 0.01 1.40 7.64 -1.26 -2.83 113.62 120.65 1bkt n SER 10 Ca -0.07 -2.60 0.00 0.00 1.01 0.00 0.00 58.87 57.21 1bkt n SER 10 Cb 0.65 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1bkt n SER 10 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bkt n GLY 11 N -0.10 -0.00 0.45 0.23 0.00 -1.26 -4.08 105.19 100.41 1bkt n GLY 11 Ca 0.22 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.48 1bkt n GLY 11 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1bkt h GLN 12 N 0.00 0.00 0.04 1.61 -0.00 -1.92 0.28 115.11 115.12 1bkt h GLN 12 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 58.65 58.27 1bkt h GLN 12 Cb 0.86 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 28.29 1bkt h GLN 12 CO 0.00 0.00 -2.30 0.00 0.00 0.00 0.00 178.83 176.53 1bkt h LEU 14 N 0.02 0.37 0.74 0.00 6.46 -0.63 -0.41 115.31 121.85 1bkt h LEU 14 Ca -0.52 0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.24 1bkt h LEU 14 Cb 1.97 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.86 1bkt h LEU 14 CO -0.02 0.25 -0.48 0.11 -0.62 0.00 0.00 178.44 177.68 1bkt h LYS 15 N 0.50 -1.12 -0.21 1.25 6.56 -1.51 -1.14 116.57 120.91 1bkt h LYS 15 Ca 0.24 0.08 -0.08 0.00 -1.06 0.00 0.00 60.65 59.83 1bkt h LYS 15 Cb 0.16 0.25 -0.01 0.00 -0.57 0.00 0.00 32.23 32.06 1bkt h LYS 15 CO -0.17 -0.74 -0.20 -1.00 -2.06 0.00 0.00 179.45 175.27 1bkt h PRO 16 N -1.16 0.37 0.48 3.15 0.13 -1.76 -0.70 132.00 132.52 1bkt h PRO 16 Ca -0.10 -0.12 -0.02 0.00 -0.87 0.00 0.00 66.00 64.89 1bkt h PRO 16 Cb 0.94 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 1bkt h PRO 16 CO 0.08 0.56 -0.29 0.00 -0.23 0.00 0.00 178.00 178.13 1bkt h LYS 18 N -0.71 0.55 0.00 0.00 5.09 -1.17 0.94 116.57 121.27 1bkt h LYS 18 Ca -0.06 -0.03 0.00 0.00 0.09 0.00 0.00 60.65 60.64 1bkt h LYS 18 Cb 0.57 -0.13 0.00 0.00 0.10 0.00 0.00 32.23 32.77 1bkt h LYS 18 CO 0.07 0.37 0.00 -0.44 -2.09 0.00 0.00 179.45 177.36 1bkt h ASP 19 N 0.57 0.00 0.02 7.07 3.32 -0.99 -0.32 116.42 126.09 1bkt h ASP 19 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 1bkt h ASP 19 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1bkt h ASP 19 CO -0.13 0.00 -0.35 0.00 -1.72 0.00 0.00 179.24 177.04 1bkt n ALA 20 N -2.00 3.28 0.00 3.45 0.00 0.25 -4.94 120.51 120.56 1bkt n ALA 20 Ca -0.01 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1bkt n ALA 20 Cb 0.16 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1bkt n ALA 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bkt n GLY 21 N 1.39 0.97 0.00 0.00 0.00 -0.14 -5.04 105.19 102.37 1bkt n GLY 21 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1bkt n GLY 21 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1bkt n MET 22 N 0.00 1.90 0.00 1.61 2.81 0.16 -4.93 117.12 118.68 1bkt n MET 22 Ca 0.00 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.87 1bkt n MET 22 Cb 0.00 0.00 -0.01 0.00 -0.71 0.00 0.00 33.22 32.50 1bkt n MET 22 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1bkt n ARG 23 N 0.00 0.10 -4.63 0.03 1.74 -1.26 -4.17 116.66 108.47 1bkt n ARG 23 Ca 0.00 0.04 -0.29 0.00 -0.77 0.00 0.00 57.85 56.83 1bkt n ARG 23 Cb 0.00 -0.54 -0.08 0.00 -1.02 0.00 0.00 32.46 30.83 1bkt n ARG 23 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1bkt s PHE 24 N -1.76 1.79 0.08 -1.55 0.08 -1.23 -4.47 117.98 110.92 1bkt s PHE 24 Ca -0.06 -1.18 0.05 0.00 0.12 0.00 0.00 56.93 55.87 1bkt s PHE 24 Cb 0.01 -1.34 -0.03 0.00 -0.57 0.00 0.00 43.02 41.08 1bkt s PHE 24 CO 0.08 -0.10 -0.15 0.20 -0.10 0.00 0.00 175.22 175.15 1bkt s GLY 25 N -3.74 0.93 -0.05 4.36 0.00 -1.26 -1.33 107.32 106.23 1bkt s GLY 25 Ca 0.14 -1.07 -0.04 0.00 0.00 0.00 0.00 44.72 43.74 1bkt s GLY 25 CO 0.09 -1.11 0.13 0.54 0.00 0.00 0.00 173.10 172.75 1bkt s LYS 26 N -1.93 0.14 -0.17 2.90 1.02 0.16 -4.49 119.74 117.37 1bkt s LYS 26 Ca 0.01 0.21 -0.09 0.00 0.02 0.00 0.00 55.97 56.11 1bkt s LYS 26 Cb -0.09 0.03 -0.05 0.00 -0.52 0.00 0.00 37.83 37.20 1bkt s LYS 26 CO 0.02 -0.04 0.14 0.00 -0.92 0.00 0.00 175.35 174.55 1bkt n ILE 28 N 2.98 0.00 -1.55 0.00 2.08 -0.86 -4.90 119.36 117.10 1bkt n ILE 28 Ca -0.17 0.04 -0.19 0.00 0.56 0.00 0.00 62.75 62.98 1bkt n ILE 28 Cb 0.53 -0.77 0.12 0.00 -0.75 0.00 0.00 39.64 38.77 1bkt n ILE 28 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 1bkt n ASN 29 N -1.49 4.47 0.00 4.38 0.23 -1.26 -4.83 115.26 116.77 1bkt n ASN 29 Ca 0.00 -3.77 0.00 0.00 -0.53 0.00 0.00 54.58 50.28 1bkt n ASN 29 Cb 0.00 -0.67 0.00 0.00 -2.08 0.00 0.00 39.78 37.03 1bkt n ASN 29 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bkt n GLY 30 N -0.98 3.39 3.87 4.83 0.00 -1.26 -5.03 105.19 110.02 1bkt n GLY 30 Ca 0.46 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.27 1bkt n GLY 30 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bkt s LYS 31 N -1.00 2.60 0.27 1.61 2.20 -1.26 -1.34 119.74 122.82 1bkt s LYS 31 Ca 0.00 -1.46 -0.13 0.00 -0.36 0.00 0.00 55.97 54.03 1bkt s LYS 31 Cb 0.00 -2.42 -0.08 0.00 -1.51 0.00 0.00 37.83 33.82 1bkt s LYS 31 CO 0.00 -0.11 0.64 0.00 -0.36 0.00 0.00 175.35 175.52 1bkt s ASP 33 N -2.28 1.35 0.28 0.00 -1.08 0.33 -2.92 116.67 112.35 1bkt s ASP 33 Ca 0.50 -0.11 0.06 0.00 -0.52 0.00 0.00 52.55 52.48 1bkt s ASP 33 Cb -0.11 -0.45 -0.02 0.00 -1.46 0.00 0.00 42.92 40.88 1bkt s ASP 33 CO 0.19 -0.14 0.41 0.00 0.52 0.00 0.00 175.17 176.15 1bkt n THR 35 N -1.51 2.51 -1.13 0.00 -1.04 -0.44 -4.73 114.28 107.94 1bkt n THR 35 Ca -0.05 -5.34 -0.30 0.00 -2.04 0.00 0.00 64.05 56.33 1bkt n THR 35 Cb 0.57 -1.68 0.22 0.00 -1.82 0.00 0.00 70.33 67.63 1bkt n THR 35 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1bkt s PRO 36 N -2.92 -0.81 0.00 -2.82 0.04 -1.26 -3.53 135.00 123.70 1bkt s PRO 36 Ca 0.44 0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.52 1bkt s PRO 36 Cb 0.22 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 33.13 1bkt s PRO 36 CO -0.08 -3.46 0.00 0.36 0.04 0.00 0.00 177.00 173.86