#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 4.13 0.00 7.63 0.00 -1.26 0.56 105.19 116.25 1bkt n GLY 2 Ca 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 43.96 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 -0.03 0.00 -2.27 -0.61 -5.35 -1.16 -4.73 119.36 105.21 1bkt n ILE 3 Ca -0.00 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.46 1bkt n ILE 3 Cb 0.02 0.00 0.02 0.00 -1.74 0.00 0.00 39.64 37.94 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 -0.41 -4.40 7.28 2.85 -1.26 -5.01 115.26 114.31 1bkt n ASN 4 Ca 0.00 -1.14 -0.20 0.00 -0.11 0.00 0.00 54.58 53.13 1bkt n ASN 4 Cb 0.00 0.18 -0.10 0.00 1.24 0.00 0.00 39.78 41.09 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 1.69 -0.05 3.44 1.01 -1.26 -5.01 120.40 120.25 1bkt s VAL 5 Ca 0.02 -2.16 -0.04 0.00 0.00 0.00 0.00 61.98 59.80 1bkt s VAL 5 Cb 0.09 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 1bkt s VAL 5 CO -0.03 -0.39 0.14 -0.75 0.00 0.00 0.00 175.10 174.07 1bkt s LYS 6 N -3.70 3.34 0.28 2.72 2.36 -1.26 -0.83 119.74 122.65 1bkt s LYS 6 Ca 0.27 -0.30 0.04 0.00 -2.55 0.00 0.00 55.97 53.44 1bkt s LYS 6 Cb 0.02 -3.06 -0.06 0.00 -1.05 0.00 0.00 37.83 33.68 1bkt s LYS 6 CO 0.10 0.71 0.02 0.00 1.55 0.00 0.00 175.35 177.73 1bkt n LYS 8 N -0.57 0.00 -4.57 0.00 4.76 -1.26 -4.72 118.16 111.80 1bkt n LYS 8 Ca -0.04 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.13 1bkt n LYS 8 Cb 0.65 -0.82 -0.08 0.00 -1.84 0.00 0.00 35.03 32.94 1bkt n LYS 8 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1bkt s HIS 9 N -1.93 1.84 -0.28 2.13 3.76 -1.26 -5.00 115.29 114.54 1bkt s HIS 9 Ca 0.00 -1.17 0.03 0.00 -0.15 0.00 0.00 55.06 53.77 1bkt s HIS 9 Cb 0.00 -1.29 0.30 0.00 1.11 0.00 0.00 32.58 32.70 1bkt s HIS 9 CO 0.00 -0.13 1.33 0.43 -0.85 0.00 0.00 174.74 175.52 1bkt n SER 10 N -1.25 3.28 0.00 1.40 7.64 -1.26 -2.93 113.62 120.50 1bkt n SER 10 Ca -0.09 -2.64 0.00 0.00 1.01 0.00 0.00 58.87 57.15 1bkt n SER 10 Cb 0.66 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 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 -0.12 -0.00 0.42 0.23 0.00 -1.26 -4.10 105.19 100.35 1bkt n GLY 11 Ca 0.23 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.47 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 0.03 1.61 -0.00 -1.92 0.24 115.11 115.06 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 0.89 0.00 -0.06 0.00 0.00 0.00 0.00 27.48 28.31 1bkt h GLN 12 CO 0.00 0.00 -2.35 0.00 0.00 0.00 0.00 178.83 176.48 1bkt h LEU 14 N 0.02 0.37 0.73 0.00 6.46 -0.72 -0.34 115.31 121.83 1bkt h LEU 14 Ca -0.54 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.23 1bkt h LEU 14 Cb 1.95 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 41.85 1bkt h LEU 14 CO -0.04 0.25 -0.45 0.11 -0.62 0.00 0.00 178.44 177.69 1bkt h LYS 15 N 0.52 -1.07 -0.09 1.25 6.56 -1.51 -1.01 116.57 121.22 1bkt h LYS 15 Ca 0.27 0.07 -0.08 0.00 -1.06 0.00 0.00 60.65 59.85 1bkt h LYS 15 Cb 0.22 0.24 -0.01 0.00 -0.57 0.00 0.00 32.23 32.11 1bkt h LYS 15 CO -0.20 -0.71 -0.31 -1.00 -2.06 0.00 0.00 179.45 175.17 1bkt h PRO 16 N -1.11 0.17 0.73 3.15 0.13 -1.75 -0.71 132.00 132.61 1bkt h PRO 16 Ca -0.09 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 64.94 1bkt h PRO 16 Cb 0.89 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.02 1bkt h PRO 16 CO 0.09 0.47 -0.35 0.00 -0.23 0.00 0.00 178.00 177.98 1bkt h LYS 18 N -1.04 -0.31 -0.19 0.00 1.63 -1.14 0.15 116.57 115.68 1bkt h LYS 18 Ca -0.10 0.02 0.05 0.00 -0.85 0.00 0.00 60.65 59.77 1bkt h LYS 18 Cb 0.75 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.44 1bkt h LYS 18 CO 0.16 -0.20 0.18 0.22 -3.45 0.00 0.00 179.45 176.36 1bkt h ASP 19 N -0.32 0.00 -0.17 4.20 1.82 -1.06 0.14 116.42 121.04 1bkt h ASP 19 Ca 0.13 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.77 1bkt h ASP 19 Cb 0.52 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.53 1bkt h ASP 19 CO -0.42 0.00 0.00 0.00 -1.61 0.00 0.00 179.24 177.21 1bkt n ALA 20 N -2.39 2.46 0.00 -0.78 0.00 0.20 -4.93 120.51 115.07 1bkt n ALA 20 Ca 0.02 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1bkt n ALA 20 Cb 0.31 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 1.37 1.04 0.00 0.00 0.00 0.02 -5.03 105.19 102.59 1bkt n GLY 21 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.02 2.34 0.03 1.61 2.81 0.20 -4.93 117.12 119.15 1bkt n MET 22 Ca 0.00 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.88 1bkt n MET 22 Cb 0.00 0.00 -0.00 0.00 -0.71 0.00 0.00 33.22 32.51 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 0.05 -4.64 0.03 1.74 -1.25 -4.26 116.66 108.33 1bkt n ARG 23 Ca 0.00 0.02 -0.30 0.00 -0.77 0.00 0.00 57.85 56.81 1bkt n ARG 23 Cb 0.00 -0.51 -0.08 0.00 -1.02 0.00 0.00 32.46 30.86 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 -1.89 1.81 0.07 -1.55 0.40 -1.22 -4.56 117.98 111.04 1bkt s PHE 24 Ca -0.03 -1.15 0.04 0.00 -0.60 0.00 0.00 56.93 55.20 1bkt s PHE 24 Cb 0.00 -1.37 -0.03 0.00 0.51 0.00 0.00 43.02 42.13 1bkt s PHE 24 CO 0.04 -0.06 -0.13 0.20 0.70 0.00 0.00 175.22 175.98 1bkt s GLY 25 N -3.75 0.80 -0.06 4.36 0.00 -1.26 -1.35 107.32 106.06 1bkt s GLY 25 Ca 0.14 -0.99 -0.07 0.00 0.00 0.00 0.00 44.72 43.80 1bkt s GLY 25 CO 0.09 -1.02 0.18 0.54 0.00 0.00 0.00 173.10 172.88 1bkt s LYS 26 N -1.86 0.24 -0.12 2.90 1.02 0.13 -4.45 119.74 117.59 1bkt s LYS 26 Ca -0.02 0.21 -0.07 0.00 0.02 0.00 0.00 55.97 56.10 1bkt s LYS 26 Cb -0.09 0.11 -0.04 0.00 -0.52 0.00 0.00 37.83 37.29 1bkt s LYS 26 CO 0.02 -0.03 0.14 0.00 -0.92 0.00 0.00 175.35 174.56 1bkt n ILE 28 N 2.07 0.00 -1.56 0.00 5.41 -0.73 -4.92 119.36 119.63 1bkt n ILE 28 Ca -0.20 0.01 -0.20 0.00 1.00 0.00 0.00 62.75 63.37 1bkt n ILE 28 Cb 0.55 -0.63 0.12 0.00 -0.71 0.00 0.00 39.64 38.96 1bkt n ILE 28 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1bkt n ASN 29 N -1.24 4.61 0.00 4.38 0.23 -1.26 -4.82 115.26 117.16 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 -0.66 0.00 0.00 -2.08 0.00 0.00 39.78 37.04 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 -0.96 3.28 3.89 4.83 0.00 -1.26 -5.03 105.19 109.93 1bkt n GLY 30 Ca 0.46 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.77 2.75 0.33 1.61 2.20 -1.26 -1.22 119.74 123.37 1bkt s LYS 31 Ca 0.00 -1.30 -0.16 0.00 -0.36 0.00 0.00 55.97 54.15 1bkt s LYS 31 Cb 0.00 -2.52 -0.09 0.00 -1.51 0.00 0.00 37.83 33.71 1bkt s LYS 31 CO 0.00 0.01 0.77 0.00 -0.36 0.00 0.00 175.35 175.77 1bkt s ASP 33 N -2.21 1.59 0.36 0.00 2.15 0.50 -2.98 116.67 116.08 1bkt s ASP 33 Ca 0.54 -0.11 0.07 0.00 0.43 0.00 0.00 52.55 53.47 1bkt s ASP 33 Cb -0.11 -0.49 -0.01 0.00 -0.30 0.00 0.00 42.92 42.02 1bkt s ASP 33 CO 0.17 -0.17 0.50 0.00 -0.17 0.00 0.00 175.17 175.50 1bkt n THR 35 N -1.70 2.44 -1.98 0.00 -1.04 -0.46 -4.71 114.28 106.84 1bkt n THR 35 Ca 0.01 -5.28 -0.29 0.00 -2.04 0.00 0.00 64.05 56.45 1bkt n THR 35 Cb 0.58 -1.90 0.16 0.00 -1.82 0.00 0.00 70.33 67.35 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 -2.70 0.98 0.00 -2.82 0.04 -1.26 -3.41 135.00 125.83 1bkt s PRO 36 Ca 0.42 -0.36 0.12 0.00 0.04 0.00 0.00 61.00 61.22 1bkt s PRO 36 Cb 0.19 -1.90 0.09 0.00 0.04 0.00 0.00 34.50 32.91 1bkt s PRO 36 CO -0.05 -2.18 0.87 1.17 0.04 0.00 0.00 177.00 176.85