#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 -1.03 0.00 7.55 0.00 -1.26 -4.72 105.19 105.72 1bkt n GLY 2 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.40 0.00 -2.15 -0.61 -5.35 -1.22 -4.63 119.36 103.00 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 0.27 0.00 0.01 0.00 -1.74 0.00 0.00 39.64 38.18 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 -0.28 -4.44 7.28 5.15 -1.26 -5.03 115.26 116.69 1bkt n ASN 4 Ca 0.00 -0.92 -0.21 0.00 -0.60 0.00 0.00 54.58 52.85 1bkt n ASN 4 Cb 0.00 0.12 -0.10 0.00 -0.53 0.00 0.00 39.78 39.26 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 1.54 -0.10 3.44 1.01 -1.26 -5.01 120.40 120.02 1bkt s VAL 5 Ca 0.01 -2.09 -0.06 0.00 0.00 0.00 0.00 61.98 59.84 1bkt s VAL 5 Cb 0.06 -2.53 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1bkt s VAL 5 CO -0.02 -0.23 0.14 -0.75 0.00 0.00 0.00 175.10 174.24 1bkt s LYS 6 N -3.77 3.41 0.31 2.72 2.20 -1.26 -0.89 119.74 122.46 1bkt s LYS 6 Ca 0.31 -0.17 0.06 0.00 -0.36 0.00 0.00 55.97 55.81 1bkt s LYS 6 Cb 0.05 -3.15 -0.06 0.00 -1.51 0.00 0.00 37.83 33.16 1bkt s LYS 6 CO 0.13 0.76 -0.02 0.00 -0.36 0.00 0.00 175.35 175.86 1bkt n LYS 8 N -0.67 0.00 -4.61 0.00 4.81 -1.26 -4.72 118.16 111.71 1bkt n LYS 8 Ca -0.04 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.12 1bkt n LYS 8 Cb 0.65 -0.93 -0.09 0.00 0.02 0.00 0.00 35.03 34.68 1bkt n LYS 8 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 1bkt s HIS 9 N -1.96 2.00 -0.40 5.64 3.76 -1.26 -5.00 115.29 118.07 1bkt s HIS 9 Ca 0.00 -0.98 0.01 0.00 -0.15 0.00 0.00 55.06 53.94 1bkt s HIS 9 Cb 0.00 -1.47 0.42 0.00 1.11 0.00 0.00 32.58 32.65 1bkt s HIS 9 CO 0.00 0.10 1.82 -1.13 -0.85 0.00 0.00 174.74 174.68 1bkt n SER 10 N -1.11 5.02 0.00 1.40 3.41 -1.26 -3.72 113.62 117.36 1bkt n SER 10 Ca -0.10 -3.28 0.00 0.00 -0.26 0.00 0.00 58.87 55.23 1bkt n SER 10 Cb 0.66 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.75 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 -0.53 0.00 0.00 5.00 0.00 -1.26 -4.38 105.19 104.02 1bkt n GLY 11 Ca 0.45 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.50 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 -2.48 0.66 -0.04 1.61 6.02 -1.24 -1.71 117.38 120.20 1bkt n GLN 12 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.93 1bkt n GLN 12 Cb 0.33 -1.12 -0.03 0.00 1.02 0.00 0.00 30.24 30.43 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 -0.03 0.62 0.42 0.00 6.46 -1.52 -0.22 115.31 121.03 1bkt h LEU 14 Ca -0.17 -0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.50 1bkt h LEU 14 Cb 1.25 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 41.03 1bkt h LEU 14 CO -0.04 0.55 -0.20 0.11 -0.62 0.00 0.00 178.44 178.24 1bkt h LYS 15 N 0.68 -0.54 -0.12 1.25 1.57 -1.70 -0.40 116.57 117.31 1bkt h LYS 15 Ca 0.17 0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.91 1bkt h LYS 15 Cb 0.11 0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 1bkt h LYS 15 CO -0.02 -0.23 -0.25 -1.00 -0.57 0.00 0.00 179.45 177.38 1bkt h PRO 16 N -0.90 0.21 0.53 3.15 0.13 -1.78 -0.90 132.00 132.43 1bkt h PRO 16 Ca -0.06 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 64.98 1bkt h PRO 16 Cb 0.56 -0.02 0.01 0.00 0.13 0.00 0.00 31.00 31.67 1bkt h PRO 16 CO 0.09 0.45 -0.25 0.00 -0.23 0.00 0.00 178.00 178.06 1bkt h LYS 18 N -0.89 -0.50 -0.23 0.00 1.79 -0.97 0.26 116.57 116.04 1bkt h LYS 18 Ca -0.07 0.03 0.07 0.00 -2.18 0.00 0.00 60.65 58.50 1bkt h LYS 18 Cb 0.61 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.36 1bkt h LYS 18 CO 0.12 -0.33 0.25 0.22 -1.08 0.00 0.00 179.45 178.62 1bkt h ASP 19 N -0.52 0.00 -0.14 0.86 3.58 -1.07 0.70 116.42 119.83 1bkt h ASP 19 Ca 0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1bkt h ASP 19 Cb 0.65 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.70 1bkt h ASP 19 CO -0.45 0.00 0.00 0.00 -2.88 0.00 0.00 179.24 175.91 1bkt n ALA 20 N -2.35 2.47 0.00 -0.78 0.00 0.21 -4.94 120.51 115.13 1bkt n ALA 20 Ca 0.03 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.73 1bkt n ALA 20 Cb 0.38 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.94 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 1.36 0.85 0.00 0.00 0.00 0.22 -5.03 105.19 102.60 1bkt n GLY 21 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 1.45 -0.00 1.61 2.81 0.70 -4.95 117.12 118.74 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 0.07 -4.75 0.03 1.74 -1.26 -4.20 116.66 108.29 1bkt n ARG 23 Ca 0.00 0.03 -0.33 0.00 -0.77 0.00 0.00 57.85 56.78 1bkt n ARG 23 Cb 0.00 -0.41 -0.07 0.00 -1.02 0.00 0.00 32.46 30.96 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 -1.47 1.80 0.03 -1.55 0.40 -1.24 -4.54 117.98 111.40 1bkt s PHE 24 Ca -0.04 -1.03 0.01 0.00 -0.60 0.00 0.00 56.93 55.28 1bkt s PHE 24 Cb 0.01 -1.54 -0.02 0.00 0.51 0.00 0.00 43.02 41.98 1bkt s PHE 24 CO 0.05 0.14 -0.05 0.20 0.70 0.00 0.00 175.22 176.26 1bkt s GLY 25 N -3.86 0.35 -0.02 4.36 0.00 -1.26 -0.95 107.32 105.94 1bkt s GLY 25 Ca 0.05 -0.59 -0.11 0.00 0.00 0.00 0.00 44.72 44.07 1bkt s GLY 25 CO 0.03 -0.63 0.24 -1.59 0.00 0.00 0.00 173.10 171.14 1bkt s LYS 26 N -1.26 0.55 -0.11 2.90 -2.85 0.03 -4.32 119.74 114.68 1bkt s LYS 26 Ca -0.10 -0.21 -0.07 0.00 -1.00 0.00 0.00 55.97 54.59 1bkt s LYS 26 Cb -0.08 0.24 -0.04 0.00 -2.06 0.00 0.00 37.83 35.89 1bkt s LYS 26 CO -0.00 -0.14 0.16 0.00 0.10 0.00 0.00 175.35 175.47 1bkt n ILE 28 N 1.95 0.00 -1.52 0.00 2.08 -0.84 -4.90 119.36 116.12 1bkt n ILE 28 Ca -0.19 0.03 -0.16 0.00 0.56 0.00 0.00 62.75 62.98 1bkt n ILE 28 Cb 0.55 -0.74 0.14 0.00 -0.75 0.00 0.00 39.64 38.84 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 -1.44 4.02 0.00 4.38 0.23 -1.26 -4.83 115.26 116.36 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 -1.01 3.29 3.93 4.83 0.00 -1.26 -5.03 105.19 109.93 1bkt n GLY 30 Ca 0.44 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.26 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 -0.75 2.94 0.21 1.61 2.20 -1.26 -1.02 119.74 123.67 1bkt s LYS 31 Ca 0.00 -1.14 -0.12 0.00 -0.36 0.00 0.00 55.97 54.35 1bkt s LYS 31 Cb 0.00 -2.67 -0.07 0.00 -1.51 0.00 0.00 37.83 33.57 1bkt s LYS 31 CO 0.00 0.06 0.57 0.00 -0.36 0.00 0.00 175.35 175.62 1bkt s ASP 33 N -2.14 1.51 0.47 0.00 2.15 -0.16 -3.38 116.67 115.11 1bkt s ASP 33 Ca 0.45 -0.47 0.06 0.00 0.43 0.00 0.00 52.55 53.03 1bkt s ASP 33 Cb -0.12 -0.08 -0.01 0.00 -0.30 0.00 0.00 42.92 42.41 1bkt s ASP 33 CO 0.20 -0.01 0.28 0.00 -0.17 0.00 0.00 175.17 175.48 1bkt n THR 35 N -1.49 2.58 -0.41 0.00 -1.04 -0.12 -4.40 114.28 109.40 1bkt n THR 35 Ca -0.02 -5.36 -0.28 0.00 -2.04 0.00 0.00 64.05 56.35 1bkt n THR 35 Cb 0.64 -1.71 0.25 0.00 -1.82 0.00 0.00 70.33 67.69 1bkt n THR 35 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1bkt n PRO 36 N 0.31 -3.33 0.00 -2.82 -0.04 -1.26 -3.59 135.00 124.26 1bkt n PRO 36 Ca 0.30 -0.97 0.00 0.00 -0.04 0.00 0.00 63.50 62.79 1bkt n PRO 36 Cb 0.41 -1.91 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1bkt n PRO 36 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63