#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 -0.93 0.00 7.55 0.00 -1.26 -4.73 105.19 105.82 1bkt n GLY 2 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.15 0.00 -2.29 -0.61 -5.35 -1.22 -4.64 119.36 103.09 1bkt n ILE 3 Ca 0.00 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.48 1bkt n ILE 3 Cb 0.21 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.13 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 -0.23 -4.46 7.28 5.15 -1.26 -5.00 115.26 116.74 1bkt n ASN 4 Ca 0.00 -0.99 -0.22 0.00 -0.60 0.00 0.00 54.58 52.77 1bkt n ASN 4 Cb 0.00 0.10 -0.10 0.00 -0.53 0.00 0.00 39.78 39.24 1bkt n ASN 4 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1bkt s VAL 5 N 0.02 1.74 -0.13 3.44 1.01 -1.26 -5.00 120.40 120.22 1bkt s VAL 5 Ca 0.01 -2.13 -0.08 0.00 0.00 0.00 0.00 61.98 59.79 1bkt s VAL 5 Cb 0.06 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 1bkt s VAL 5 CO -0.02 -0.24 0.15 -0.75 0.00 0.00 0.00 175.10 174.24 1bkt s LYS 6 N -3.72 3.57 0.36 2.72 2.20 -1.26 -0.77 119.74 122.84 1bkt s LYS 6 Ca 0.31 -0.13 0.07 0.00 -0.36 0.00 0.00 55.97 55.87 1bkt s LYS 6 Cb 0.04 -3.23 -0.07 0.00 -1.51 0.00 0.00 37.83 33.07 1bkt s LYS 6 CO 0.13 0.71 -0.03 0.00 -0.36 0.00 0.00 175.35 175.80 1bkt n LYS 8 N -0.81 0.07 -4.46 0.00 5.02 -1.26 -4.72 118.16 111.99 1bkt n LYS 8 Ca -0.05 0.02 -0.24 0.00 -2.02 0.00 0.00 58.31 56.02 1bkt n LYS 8 Cb 0.65 -0.98 -0.08 0.00 -0.02 0.00 0.00 35.03 34.59 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 -2.06 1.76 -0.35 2.13 3.76 -1.26 -5.02 115.29 114.26 1bkt s HIS 9 Ca -0.04 -1.32 0.02 0.00 -0.15 0.00 0.00 55.06 53.58 1bkt s HIS 9 Cb 0.01 -1.07 0.24 0.00 1.11 0.00 0.00 32.58 32.87 1bkt s HIS 9 CO 0.06 -0.38 1.17 0.43 -0.85 0.00 0.00 174.74 175.18 1bkt n SER 10 N -1.25 3.02 0.01 1.40 7.64 -1.26 -2.88 113.62 120.30 1bkt n SER 10 Ca -0.03 -2.46 0.00 0.00 1.01 0.00 0.00 58.87 57.39 1bkt n SER 10 Cb 0.65 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 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 0.04 -0.01 0.39 0.23 0.00 -1.26 -4.01 105.19 100.57 1bkt n GLY 11 Ca 0.16 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.37 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 0.02 1.61 -0.00 -1.93 0.15 115.11 114.95 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 0.87 0.00 -0.06 0.00 0.00 0.00 0.00 27.48 28.29 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 0.01 0.51 0.42 0.00 6.46 -0.87 -0.64 115.31 121.20 1bkt h LEU 14 Ca -0.54 0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.22 1bkt h LEU 14 Cb 2.01 -0.08 0.00 0.00 -0.73 0.00 0.00 40.66 41.86 1bkt h LEU 14 CO -0.03 0.35 -0.20 0.11 -0.62 0.00 0.00 178.44 178.05 1bkt h LYS 15 N 0.64 -0.55 -0.32 1.25 1.79 -1.60 -1.17 116.57 116.62 1bkt h LYS 15 Ca 0.25 0.04 -0.10 0.00 -2.18 0.00 0.00 60.65 58.66 1bkt h LYS 15 Cb 0.11 0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1bkt h LYS 15 CO -0.14 -0.33 -0.20 -1.00 -1.08 0.00 0.00 179.45 176.69 1bkt h PRO 16 N -0.62 0.60 0.53 3.15 0.13 -1.77 -0.50 132.00 133.53 1bkt h PRO 16 Ca -0.06 -0.22 -0.02 0.00 -0.87 0.00 0.00 66.00 64.83 1bkt h PRO 16 Cb 0.46 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.55 1bkt h PRO 16 CO 0.09 0.76 -0.34 0.00 -0.23 0.00 0.00 178.00 178.29 1bkt h LYS 18 N -0.82 0.26 -0.05 0.00 2.10 -1.24 0.16 116.57 116.98 1bkt h LYS 18 Ca -0.07 -0.02 0.01 0.00 -2.00 0.00 0.00 60.65 58.58 1bkt h LYS 18 Cb 0.66 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 31.93 1bkt h LYS 18 CO 0.06 0.17 0.09 0.22 -2.00 0.00 0.00 179.45 177.99 1bkt h ASP 19 N 0.26 0.00 0.02 7.07 3.58 -0.94 0.59 116.42 127.01 1bkt h ASP 19 Ca 0.13 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.58 1bkt h ASP 19 Cb 0.09 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.14 1bkt h ASP 19 CO -0.12 0.00 -0.42 0.00 -2.88 0.00 0.00 179.24 175.82 1bkt n ALA 20 N -2.20 3.44 0.00 -0.78 0.00 0.18 -4.94 120.51 116.20 1bkt n ALA 20 Ca -0.02 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1bkt n ALA 20 Cb 0.17 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 1.40 1.01 0.00 0.00 0.00 0.19 -5.05 105.19 102.73 1bkt n GLY 21 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 1.88 -0.00 1.61 2.81 -0.09 -4.93 117.12 118.40 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 0.09 -4.33 0.03 1.74 -1.26 -4.19 116.66 108.74 1bkt n ARG 23 Ca 0.00 0.04 -0.26 0.00 -0.77 0.00 0.00 57.85 56.86 1bkt n ARG 23 Cb 0.00 -0.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.88 1bkt n ARG 23 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1bkt n PHE 24 N -3.08 0.45 -4.38 -1.55 3.72 -1.24 -4.45 117.46 106.93 1bkt n PHE 24 Ca -0.02 -2.42 -0.22 0.00 -0.05 0.00 0.00 57.45 54.74 1bkt n PHE 24 Cb 0.09 -0.11 -0.11 0.00 -0.94 0.00 0.00 39.48 38.42 1bkt n PHE 24 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1bkt s GLY 25 N -3.43 1.54 -0.15 1.37 0.00 -1.26 -1.23 107.32 104.15 1bkt s GLY 25 Ca 0.13 -1.64 -0.10 0.00 0.00 0.00 0.00 44.72 43.11 1bkt s GLY 25 CO 0.09 -1.71 0.38 1.25 0.00 0.00 0.00 173.10 173.12 1bkt s LYS 26 N -3.17 0.39 -0.10 2.90 2.20 0.13 -4.60 119.74 117.49 1bkt s LYS 26 Ca 0.21 0.67 -0.07 0.00 -0.36 0.00 0.00 55.97 56.42 1bkt s LYS 26 Cb -0.04 0.05 -0.04 0.00 -1.51 0.00 0.00 37.83 36.28 1bkt s LYS 26 CO 0.09 -0.12 0.17 0.00 -0.36 0.00 0.00 175.35 175.12 1bkt n ILE 28 N 1.91 0.00 -1.54 0.00 2.08 -0.71 -4.91 119.36 116.18 1bkt n ILE 28 Ca -0.19 0.00 -0.18 0.00 0.56 0.00 0.00 62.75 62.94 1bkt n ILE 28 Cb 0.55 -0.51 0.13 0.00 -0.75 0.00 0.00 39.64 39.05 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 -0.85 4.40 0.00 4.38 0.23 -1.26 -4.82 115.26 117.34 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 2.93 3.97 4.83 0.00 -1.26 -5.05 105.19 109.63 1bkt n GLY 30 Ca 0.46 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.29 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 -0.51 3.03 0.27 1.61 2.20 -1.26 -0.92 119.74 124.17 1bkt s LYS 31 Ca 0.00 -1.08 -0.12 0.00 -0.36 0.00 0.00 55.97 54.41 1bkt s LYS 31 Cb 0.00 -2.76 -0.08 0.00 -1.51 0.00 0.00 37.83 33.48 1bkt s LYS 31 CO 0.00 0.04 0.64 0.00 -0.36 0.00 0.00 175.35 175.67 1bkt s ASP 33 N -2.34 0.93 0.36 0.00 2.15 0.71 -3.42 116.67 115.05 1bkt s ASP 33 Ca 0.50 -0.28 0.08 0.00 0.43 0.00 0.00 52.55 53.29 1bkt s ASP 33 Cb -0.11 -0.06 -0.05 0.00 -0.30 0.00 0.00 42.92 42.41 1bkt s ASP 33 CO 0.20 0.00 0.13 0.00 -0.17 0.00 0.00 175.17 175.33 1bkt n THR 35 N -1.14 2.51 -1.52 0.00 -1.04 -0.37 -4.35 114.28 108.37 1bkt n THR 35 Ca -0.03 -5.40 -0.29 0.00 -2.04 0.00 0.00 64.05 56.29 1bkt n THR 35 Cb 0.62 -1.27 0.17 0.00 -1.82 0.00 0.00 70.33 68.03 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 -3.24 0.51 0.00 -2.82 0.04 -1.26 -3.71 135.00 124.52 1bkt s PRO 36 Ca 0.47 0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.58 1bkt s PRO 36 Cb 0.28 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 33.04 1bkt s PRO 36 CO -0.12 -2.58 0.00 1.63 0.04 0.00 0.00 177.00 175.96