#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 -2.07 0.00 7.63 0.00 -1.26 -3.07 105.19 106.42 1bkt n GLY 2 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -3.04 0.00 -2.13 -0.61 -5.35 -1.17 -4.64 119.36 102.41 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 0.44 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.35 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 -0.30 -4.45 7.28 5.15 -1.26 -5.01 115.26 116.67 1bkt n ASN 4 Ca 0.00 -0.93 -0.22 0.00 -0.60 0.00 0.00 54.58 52.83 1bkt n ASN 4 Cb 0.00 0.12 -0.10 0.00 -0.53 0.00 0.00 39.78 39.27 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 1.67 -0.08 3.44 1.01 -1.26 -5.01 120.40 120.19 1bkt s VAL 5 Ca 0.01 -2.11 -0.06 0.00 0.00 0.00 0.00 61.98 59.82 1bkt s VAL 5 Cb 0.06 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1bkt s VAL 5 CO -0.02 -0.24 0.16 -0.75 0.00 0.00 0.00 175.10 174.26 1bkt s LYS 6 N -3.73 3.45 0.33 2.72 2.36 -1.26 -1.05 119.74 122.55 1bkt s LYS 6 Ca 0.31 -0.18 0.07 0.00 -2.55 0.00 0.00 55.97 53.62 1bkt s LYS 6 Cb 0.04 -3.16 -0.06 0.00 -1.05 0.00 0.00 37.83 33.60 1bkt s LYS 6 CO 0.13 0.74 -0.04 0.00 1.55 0.00 0.00 175.35 177.73 1bkt n LYS 8 N -0.72 0.00 -4.43 0.00 5.02 -1.26 -4.76 118.16 112.00 1bkt n LYS 8 Ca -0.05 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.00 1bkt n LYS 8 Cb 0.65 -0.93 -0.08 0.00 -0.02 0.00 0.00 35.03 34.65 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 -1.92 1.79 -0.15 2.13 3.76 -1.26 -5.01 115.29 114.64 1bkt s HIS 9 Ca 0.00 -1.48 0.01 0.00 -0.15 0.00 0.00 55.06 53.44 1bkt s HIS 9 Cb 0.00 -0.98 0.16 0.00 1.11 0.00 0.00 32.58 32.87 1bkt s HIS 9 CO 0.00 -0.57 1.19 0.45 -0.85 0.00 0.00 174.74 174.96 1bkt n SER 10 N -1.53 3.12 0.01 1.40 2.88 -1.26 -2.90 113.62 115.32 1bkt n SER 10 Ca -0.01 -2.37 0.00 0.00 -1.33 0.00 0.00 58.87 55.16 1bkt n SER 10 Cb 0.64 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 1bkt n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bkt n GLY 11 N 0.11 -0.01 0.43 0.46 0.00 -1.26 -4.33 105.19 100.59 1bkt n GLY 11 Ca 0.14 0.00 0.22 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 0.03 1.61 -0.00 -1.90 0.13 115.11 114.98 1bkt h GLN 12 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 58.65 58.26 1bkt h GLN 12 Cb 0.64 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 28.07 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 -0.19 0.28 0.60 0.00 6.46 -0.95 -0.44 115.31 121.08 1bkt h LEU 14 Ca -0.55 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.25 1bkt h LEU 14 Cb 1.86 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 41.79 1bkt h LEU 14 CO -0.10 0.18 -0.46 0.11 -0.62 0.00 0.00 178.44 177.55 1bkt h LYS 15 N 0.44 -0.99 -0.15 1.25 6.56 -1.51 -0.94 116.57 121.23 1bkt h LYS 15 Ca 0.26 0.07 -0.10 0.00 -1.06 0.00 0.00 60.65 59.82 1bkt h LYS 15 Cb 0.25 0.22 -0.01 0.00 -0.57 0.00 0.00 32.23 32.12 1bkt h LYS 15 CO -0.23 -0.66 -0.35 -1.00 -2.06 0.00 0.00 179.45 175.14 1bkt h PRO 16 N -1.02 0.31 0.49 3.15 0.13 -1.76 -0.51 132.00 132.78 1bkt h PRO 16 Ca -0.07 -0.13 -0.02 0.00 -0.87 0.00 0.00 66.00 64.90 1bkt h PRO 16 Cb 0.86 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1bkt h PRO 16 CO 0.02 0.63 -0.24 0.00 -0.23 0.00 0.00 178.00 178.18 1bkt h LYS 18 N -0.66 0.53 0.00 0.00 5.09 -1.20 0.74 116.57 121.07 1bkt h LYS 18 Ca -0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 60.65 60.64 1bkt h LYS 18 Cb 0.51 -0.12 -0.00 0.00 0.10 0.00 0.00 32.23 32.72 1bkt h LYS 18 CO 0.11 0.35 -0.02 0.22 -2.09 0.00 0.00 179.45 178.02 1bkt h ASP 19 N 0.54 0.00 -0.03 7.07 3.58 -0.98 -0.04 116.42 126.56 1bkt h ASP 19 Ca 0.26 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.71 1bkt h ASP 19 Cb 0.19 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.24 1bkt h ASP 19 CO -0.19 0.02 -0.00 0.00 -2.88 0.00 0.00 179.24 176.19 1bkt n ALA 20 N -2.30 2.49 0.00 -0.78 0.00 0.19 -4.93 120.51 115.18 1bkt n ALA 20 Ca -0.03 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1bkt n ALA 20 Cb 0.11 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.68 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 1.31 1.07 0.00 0.00 0.00 -0.04 -5.04 105.19 102.49 1bkt n GLY 21 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.03 2.52 0.04 1.61 2.81 -0.05 -4.91 117.12 119.10 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 0.04 -4.59 0.03 1.74 -1.25 -4.23 116.66 108.40 1bkt n ARG 23 Ca 0.00 0.01 -0.27 0.00 -0.77 0.00 0.00 57.85 56.82 1bkt n ARG 23 Cb 0.00 -0.52 -0.08 0.00 -1.02 0.00 0.00 32.46 30.84 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 -1.97 1.88 0.01 -1.55 0.40 -1.23 -4.55 117.98 110.98 1bkt s PHE 24 Ca -0.02 -1.11 0.00 0.00 -0.60 0.00 0.00 56.93 55.21 1bkt s PHE 24 Cb 0.00 -1.35 -0.01 0.00 0.51 0.00 0.00 43.02 42.17 1bkt s PHE 24 CO 0.03 -0.05 -0.02 0.20 0.70 0.00 0.00 175.22 176.07 1bkt s GLY 25 N -3.68 0.17 0.02 4.36 0.00 -1.26 -1.33 107.32 105.59 1bkt s GLY 25 Ca 0.21 -0.34 0.00 0.00 0.00 0.00 0.00 44.72 44.59 1bkt s GLY 25 CO 0.11 -0.37 -0.03 0.54 0.00 0.00 0.00 173.10 173.35 1bkt s LYS 26 N -0.77 0.31 -0.13 2.90 3.01 0.34 -4.15 119.74 121.24 1bkt s LYS 26 Ca -0.08 -0.57 -0.08 0.00 -1.01 0.00 0.00 55.97 54.23 1bkt s LYS 26 Cb -0.05 0.07 -0.04 0.00 -1.01 0.00 0.00 37.83 36.79 1bkt s LYS 26 CO -0.00 -0.04 0.14 0.00 0.51 0.00 0.00 175.35 175.96 1bkt n ILE 28 N 2.31 0.00 -1.55 0.00 5.41 -0.70 -4.90 119.36 119.92 1bkt n ILE 28 Ca -0.19 0.02 -0.19 0.00 1.00 0.00 0.00 62.75 63.39 1bkt n ILE 28 Cb 0.54 -0.70 0.12 0.00 -0.71 0.00 0.00 39.64 38.90 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 -1.33 4.49 0.00 4.38 0.23 -1.26 -4.82 115.26 116.95 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 -0.97 3.14 3.89 4.83 0.00 -1.26 -5.03 105.19 109.79 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 -0.60 2.95 0.36 1.61 2.20 -1.26 -1.22 119.74 123.78 1bkt s LYS 31 Ca 0.00 -1.11 -0.20 0.00 -0.36 0.00 0.00 55.97 54.30 1bkt s LYS 31 Cb 0.00 -2.63 -0.10 0.00 -1.51 0.00 0.00 37.83 33.59 1bkt s LYS 31 CO 0.00 0.21 0.87 0.00 -0.36 0.00 0.00 175.35 176.06 1bkt s ASP 33 N -2.05 1.34 0.32 0.00 2.15 0.04 -3.07 116.67 115.40 1bkt s ASP 33 Ca 0.56 -0.20 0.08 0.00 0.43 0.00 0.00 52.55 53.41 1bkt s ASP 33 Cb -0.12 -0.62 -0.03 0.00 -0.30 0.00 0.00 42.92 41.86 1bkt s ASP 33 CO 0.17 -0.02 0.26 0.00 -0.17 0.00 0.00 175.17 175.40 1bkt n THR 35 N -1.31 2.16 -1.91 0.00 -1.04 -0.44 -2.57 114.28 109.16 1bkt n THR 35 Ca -0.03 -5.16 -0.30 0.00 -2.04 0.00 0.00 64.05 56.52 1bkt n THR 35 Cb 0.60 -1.96 0.18 0.00 -1.82 0.00 0.00 70.33 67.33 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 -2.51 0.64 0.00 -2.82 0.04 -1.26 -3.47 135.00 125.62 1bkt s PRO 36 Ca 0.41 -0.38 0.12 0.00 0.04 0.00 0.00 61.00 61.19 1bkt s PRO 36 Cb 0.17 -1.84 0.09 0.00 0.04 0.00 0.00 34.50 32.96 1bkt s PRO 36 CO -0.04 -2.42 0.88 1.17 0.04 0.00 0.00 177.00 176.63