#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 -0.13 0.00 7.55 0.00 -1.26 -4.71 105.19 106.63 1bkt n GLY 2 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.55 0.00 -2.20 -0.61 -5.35 -1.23 -4.63 119.36 104.80 1bkt n ILE 3 Ca 0.00 0.00 -0.01 0.00 -0.27 0.00 0.00 62.75 62.47 1bkt n ILE 3 Cb 0.03 0.00 0.01 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 -0.22 -4.43 7.28 5.15 -1.26 -5.02 115.26 116.76 1bkt n ASN 4 Ca 0.00 -0.90 -0.21 0.00 -0.60 0.00 0.00 54.58 52.87 1bkt n ASN 4 Cb 0.00 0.09 -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 0.01 1.46 -0.14 3.44 1.01 -1.26 -5.01 120.40 119.92 1bkt s VAL 5 Ca 0.01 -2.07 -0.08 0.00 0.00 0.00 0.00 61.98 59.84 1bkt s VAL 5 Cb 0.05 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 1bkt s VAL 5 CO -0.01 -0.21 0.14 -0.75 0.00 0.00 0.00 175.10 174.27 1bkt s LYS 6 N -3.79 3.59 0.30 2.72 2.20 -1.26 -0.79 119.74 122.71 1bkt s LYS 6 Ca 0.31 -0.15 0.08 0.00 -0.36 0.00 0.00 55.97 55.86 1bkt s LYS 6 Cb 0.06 -3.24 -0.06 0.00 -1.51 0.00 0.00 37.83 33.08 1bkt s LYS 6 CO 0.13 0.68 -0.08 0.00 -0.36 0.00 0.00 175.35 175.72 1bkt n LYS 8 N -0.66 0.14 -4.57 0.00 4.76 -1.26 -4.70 118.16 111.88 1bkt n LYS 8 Ca -0.05 0.04 -0.27 0.00 -2.87 0.00 0.00 58.31 55.16 1bkt n LYS 8 Cb 0.63 -1.07 -0.09 0.00 -1.84 0.00 0.00 35.03 32.66 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 -2.11 1.92 -0.42 2.13 3.76 -1.26 -5.02 115.29 114.29 1bkt s HIS 9 Ca -0.08 -1.06 0.05 0.00 -0.15 0.00 0.00 55.06 53.82 1bkt s HIS 9 Cb 0.02 -1.36 0.43 0.00 1.11 0.00 0.00 32.58 32.78 1bkt s HIS 9 CO 0.13 -0.02 1.36 -1.13 -0.85 0.00 0.00 174.74 174.23 1bkt n SER 10 N -1.11 3.58 0.00 1.40 3.41 -1.26 -3.32 113.62 116.33 1bkt n SER 10 Ca -0.08 -2.71 0.00 0.00 -0.26 0.00 0.00 58.87 55.81 1bkt n SER 10 Cb 0.66 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1bkt n SER 10 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bkt n GLY 11 N -0.02 0.00 0.00 5.00 0.00 -1.26 -4.16 105.19 104.75 1bkt n GLY 11 Ca 0.25 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.32 1bkt n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1bkt n GLN 12 N -2.58 0.72 -0.03 1.61 6.02 -1.21 -1.75 117.38 120.16 1bkt n GLN 12 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 57.00 56.94 1bkt n GLN 12 Cb 0.46 -1.23 -0.03 0.00 1.02 0.00 0.00 30.24 30.45 1bkt n GLN 12 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1bkt h LEU 14 N 0.00 1.04 0.50 0.00 6.46 -1.50 -0.74 115.31 121.07 1bkt h LEU 14 Ca -0.16 -0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 57.41 1bkt h LEU 14 Cb 1.26 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 40.91 1bkt h LEU 14 CO -0.02 0.95 -0.43 0.11 -0.62 0.00 0.00 178.44 178.42 1bkt h LYS 15 N 1.08 -0.88 -0.40 1.25 6.56 -1.65 -0.92 116.57 121.61 1bkt h LYS 15 Ca 0.24 0.06 -0.10 0.00 -1.06 0.00 0.00 60.65 59.79 1bkt h LYS 15 Cb 0.27 0.20 -0.02 0.00 -0.57 0.00 0.00 32.23 32.11 1bkt h LYS 15 CO -0.01 -0.59 -0.16 -1.00 -2.06 0.00 0.00 179.45 175.63 1bkt h PRO 16 N -0.92 0.74 0.30 3.15 0.13 -1.82 -0.43 132.00 133.16 1bkt h PRO 16 Ca -0.06 -0.27 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 1bkt h PRO 16 Cb 0.78 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1bkt h PRO 16 CO -0.02 0.86 -0.27 0.00 -0.23 0.00 0.00 178.00 178.34 1bkt h LYS 18 N -0.56 0.58 -0.04 0.00 5.09 -1.20 -0.37 116.57 120.07 1bkt h LYS 18 Ca -0.04 -0.03 0.01 0.00 0.09 0.00 0.00 60.65 60.68 1bkt h LYS 18 Cb 0.48 -0.13 -0.00 0.00 0.10 0.00 0.00 32.23 32.68 1bkt h LYS 18 CO -0.02 0.38 0.09 -0.44 -2.09 0.00 0.00 179.45 177.37 1bkt h ASP 19 N 0.59 0.00 0.06 7.07 3.32 -0.89 0.59 116.42 127.16 1bkt h ASP 19 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1bkt h ASP 19 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1bkt h ASP 19 CO -0.04 0.00 -0.60 0.00 -1.72 0.00 0.00 179.24 176.88 1bkt n ALA 20 N -2.18 3.85 0.00 3.45 0.00 0.17 -4.95 120.51 120.86 1bkt n ALA 20 Ca -0.02 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.84 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 1.44 1.00 0.00 0.00 0.00 0.19 -5.06 105.19 102.75 1bkt n GLY 21 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 1.73 -0.01 1.61 2.81 -0.26 -4.93 117.12 118.08 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 0.14 -4.66 0.03 1.74 -1.26 -4.21 116.66 108.44 1bkt n ARG 23 Ca 0.00 0.05 -0.30 0.00 -0.77 0.00 0.00 57.85 56.83 1bkt n ARG 23 Cb 0.00 -0.62 -0.07 0.00 -1.02 0.00 0.00 32.46 30.75 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 -1.82 1.76 0.16 -1.55 0.08 -1.24 -4.52 117.98 110.86 1bkt s PHE 24 Ca -0.07 -1.19 0.09 0.00 0.12 0.00 0.00 56.93 55.87 1bkt s PHE 24 Cb 0.01 -1.35 -0.04 0.00 -0.57 0.00 0.00 43.02 41.07 1bkt s PHE 24 CO 0.11 -0.10 -0.19 0.20 -0.10 0.00 0.00 175.22 175.14 1bkt s GLY 25 N -3.77 1.40 -0.17 4.36 0.00 -1.26 -1.27 107.32 106.61 1bkt s GLY 25 Ca 0.11 -1.47 -0.12 0.00 0.00 0.00 0.00 44.72 43.24 1bkt s GLY 25 CO 0.08 -1.51 0.44 1.25 0.00 0.00 0.00 173.10 173.36 1bkt s LYS 26 N -2.65 0.46 -0.11 2.90 2.47 0.81 -4.63 119.74 118.99 1bkt s LYS 26 Ca 0.15 0.73 -0.08 0.00 -1.56 0.00 0.00 55.97 55.21 1bkt s LYS 26 Cb -0.07 0.11 -0.04 0.00 -1.46 0.00 0.00 37.83 36.37 1bkt s LYS 26 CO 0.07 -0.11 0.16 0.00 0.16 0.00 0.00 175.35 175.62 1bkt n ILE 28 N 2.03 0.00 -1.54 0.00 2.08 -0.79 -4.91 119.36 116.22 1bkt n ILE 28 Ca -0.19 0.01 -0.18 0.00 0.56 0.00 0.00 62.75 62.94 1bkt n ILE 28 Cb 0.55 -0.66 0.13 0.00 -0.75 0.00 0.00 39.64 38.91 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 -1.23 4.37 0.00 4.38 0.23 -1.26 -4.83 115.26 116.92 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 -0.99 3.21 3.99 4.83 0.00 -1.26 -5.04 105.19 109.94 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 -0.67 3.07 0.26 1.61 2.20 -1.26 -0.98 119.74 123.97 1bkt s LYS 31 Ca 0.00 -1.05 -0.10 0.00 -0.36 0.00 0.00 55.97 54.46 1bkt s LYS 31 Cb 0.00 -2.80 -0.07 0.00 -1.51 0.00 0.00 37.83 33.45 1bkt s LYS 31 CO 0.00 0.02 0.59 0.00 -0.36 0.00 0.00 175.35 175.60 1bkt s ASP 33 N -2.54 1.17 0.31 0.00 -1.08 0.92 -3.49 116.67 111.96 1bkt s ASP 33 Ca 0.48 -0.45 0.10 0.00 -0.52 0.00 0.00 52.55 52.16 1bkt s ASP 33 Cb -0.11 -0.04 -0.05 0.00 -1.46 0.00 0.00 42.92 41.26 1bkt s ASP 33 CO 0.23 -0.07 -0.09 0.00 0.52 0.00 0.00 175.17 175.76 1bkt n THR 35 N -0.79 2.72 -1.01 0.00 -1.04 -0.39 -4.17 114.28 109.60 1bkt n THR 35 Ca -0.05 -5.44 -0.30 0.00 -2.04 0.00 0.00 64.05 56.22 1bkt n THR 35 Cb 0.61 -1.48 0.23 0.00 -1.82 0.00 0.00 70.33 67.88 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 -3.20 -1.07 0.00 -2.82 0.04 -1.26 -3.62 135.00 123.06 1bkt s PRO 36 Ca 0.47 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.60 1bkt s PRO 36 Cb 0.26 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 33.20 1bkt s PRO 36 CO -0.11 -3.64 0.00 0.36 0.04 0.00 0.00 177.00 173.65