#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sis n MET 3 N -4.11 0.00 -2.42 0.00 0.00 -1.24 -5.05 117.12 104.30 1sis n MET 3 Ca -0.21 0.00 -0.24 0.00 0.00 0.00 0.00 57.70 57.26 1sis n MET 3 Cb 0.81 0.00 0.06 0.00 0.00 0.00 0.00 33.22 34.09 1sis n MET 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 1sis s PRO 4 N -0.89 2.28 -0.01 3.17 0.04 -1.26 -1.00 135.00 137.34 1sis s PRO 4 Ca 0.00 -0.55 0.07 0.00 0.04 0.00 0.00 61.00 60.56 1sis s PRO 4 Cb 0.00 -2.32 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 1sis s PRO 4 CO 0.00 -1.05 -0.23 0.00 0.04 0.00 0.00 177.00 175.76 1sis s PHE 6 N -0.70 1.25 0.00 0.00 0.08 -1.26 -4.16 117.98 113.18 1sis s PHE 6 Ca 0.11 -1.42 -0.00 0.00 0.12 0.00 0.00 56.93 55.74 1sis s PHE 6 Cb -0.10 -1.42 -0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1sis s PHE 6 CO 0.01 -0.84 1.42 0.25 -0.10 0.00 0.00 175.22 175.95 1sis n THR 7 N 4.98 1.38 -0.08 0.64 -2.24 -1.26 -3.38 114.28 114.33 1sis n THR 7 Ca -0.04 -0.38 -0.22 0.00 -2.27 0.00 0.00 64.05 61.15 1sis n THR 7 Cb 0.42 -1.37 -0.12 0.00 -2.10 0.00 0.00 70.33 67.16 1sis n THR 7 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1sis n THR 8 N 1.72 1.61 -3.41 4.28 5.66 -1.26 -4.91 114.28 117.97 1sis n THR 8 Ca 0.02 -0.49 -0.38 0.00 -3.05 0.00 0.00 64.05 60.15 1sis n THR 8 Cb 0.35 -1.70 -0.08 0.00 -1.55 0.00 0.00 70.33 67.35 1sis n THR 8 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1sis s ASP 9 N -6.91 6.40 0.31 1.09 2.15 -1.22 -4.96 116.67 113.53 1sis s ASP 9 Ca -0.30 0.47 0.21 0.00 0.43 0.00 0.00 52.55 53.36 1sis s ASP 9 Cb 0.09 -2.22 1.14 0.00 -0.30 0.00 0.00 42.92 41.62 1sis s ASP 9 CO 0.64 -0.07 1.65 -0.81 -0.17 0.00 0.00 175.17 176.42 1sis n PRO 10 N 4.48 0.14 0.00 4.34 -0.04 -1.26 -1.69 135.00 140.97 1sis n PRO 10 Ca -0.09 0.62 0.07 0.00 -0.04 0.00 0.00 63.50 64.07 1sis n PRO 10 Cb 0.51 -1.94 -0.07 0.00 -0.04 0.00 0.00 33.50 31.96 1sis n PRO 10 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1sis n ASN 11 N -2.24 0.95 -0.28 3.54 5.15 -1.26 -4.15 115.26 116.96 1sis n ASN 11 Ca -0.01 -0.97 -0.02 0.00 -0.60 0.00 0.00 54.58 52.98 1sis n ASN 11 Cb 0.04 0.87 0.10 0.00 -0.53 0.00 0.00 39.78 40.26 1sis n ASN 11 CO 0.00 0.00 0.00 -0.03 1.40 0.00 0.00 177.26 178.63 1sis h MET 12 N 0.45 0.92 -0.94 1.20 4.05 -1.62 -1.01 114.93 117.98 1sis h MET 12 Ca 0.00 -0.06 0.16 0.00 -0.28 0.00 0.00 59.70 59.52 1sis h MET 12 Cb 0.41 -0.21 -0.08 0.00 -0.80 0.00 0.00 31.60 30.92 1sis h MET 12 CO 0.00 0.61 0.60 0.00 0.23 0.00 0.00 176.91 178.35 1sis h ALA 13 N 1.34 1.80 -0.14 0.39 0.00 -1.72 0.12 119.26 121.04 1sis h ALA 13 Ca 0.32 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.24 1sis h ALA 13 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1sis h ALA 13 CO -0.13 -0.07 0.02 0.87 0.00 0.00 0.00 179.25 179.94 1sis h LYS 14 N 0.72 0.24 -0.44 0.00 1.57 -1.53 -2.34 116.57 114.79 1sis h LYS 14 Ca 0.49 -0.06 0.04 0.00 -1.87 0.00 0.00 60.65 59.25 1sis h LYS 14 Cb 0.78 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.02 1sis h LYS 14 CO -0.25 0.42 0.20 0.87 -0.57 0.00 0.00 179.45 180.12 1sis h LYS 15 N 0.01 0.38 -0.89 3.15 1.57 0.40 -0.11 116.57 121.08 1sis h LYS 15 Ca 0.04 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1sis h LYS 15 Cb 0.30 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 1sis h LYS 15 CO 0.00 0.25 0.48 0.00 -0.57 0.00 0.00 179.45 179.62 1sis h ARG 17 N 1.26 -0.54 -0.05 0.00 9.65 -0.66 -2.90 114.38 121.14 1sis h ARG 17 Ca 0.31 0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 59.22 1sis h ARG 17 Cb 0.04 0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.74 1sis h ARG 17 CO -0.05 -0.36 -0.03 -0.44 2.80 0.00 0.00 179.97 181.90 1sis h ASP 18 N -0.56 0.06 -0.47 -3.80 5.19 -1.01 0.13 116.42 115.97 1sis h ASP 18 Ca -0.03 -0.00 0.03 0.00 -0.62 0.00 0.00 57.03 56.41 1sis h ASP 18 Cb 0.48 -0.02 -0.04 0.00 0.18 0.00 0.00 39.33 39.94 1sis h ASP 18 CO 0.00 0.10 0.25 0.00 -3.12 0.00 0.00 179.24 176.48 1sis n GLY 21 N 0.43 0.35 0.00 0.00 0.00 -0.52 -3.69 105.19 101.78 1sis n GLY 21 Ca 0.13 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1sis n GLY 21 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sis n GLY 22 N -0.99 2.52 2.68 -0.02 0.00 -0.35 -4.94 105.19 104.09 1sis n GLY 22 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 1sis n GLY 22 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1sis n ASN 23 N 0.00 4.84 -4.34 1.61 2.04 -1.24 -4.84 115.26 113.33 1sis n ASN 23 Ca 0.00 -3.71 -0.18 0.00 -0.44 0.00 0.00 54.58 50.25 1sis n ASN 23 Cb 0.00 -0.55 0.08 0.00 -2.53 0.00 0.00 39.78 36.78 1sis n ASN 23 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1sis n GLY 24 N -0.38 1.28 3.26 4.83 0.00 -1.26 -1.53 105.19 111.39 1sis n GLY 24 Ca 0.37 -2.11 -0.13 0.00 0.00 0.00 0.00 46.02 44.15 1sis n GLY 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sis s LYS 25 N -4.49 0.42 -0.08 1.61 1.02 -0.53 -4.06 119.74 113.62 1sis s LYS 25 Ca 0.54 0.57 -0.20 0.00 0.02 0.00 0.00 55.97 56.90 1sis s LYS 25 Cb -0.04 0.16 -0.04 0.00 -0.52 0.00 0.00 37.83 37.39 1sis s LYS 25 CO 0.35 -0.07 0.58 0.00 -0.92 0.00 0.00 175.35 175.29 1sis n PHE 27 N 3.55 3.58 0.00 0.00 3.01 -0.17 -4.99 117.46 122.45 1sis n PHE 27 Ca -0.05 -3.82 0.00 0.00 1.01 0.00 0.00 57.45 54.59 1sis n PHE 27 Cb 0.51 -0.66 0.00 0.00 -0.01 0.00 0.00 39.48 39.33 1sis n PHE 27 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1sis n GLY 28 N 0.47 1.89 0.00 1.37 0.00 -1.26 -2.30 105.19 105.35 1sis n GLY 28 Ca 0.31 0.09 0.09 0.00 0.00 0.00 0.00 46.02 46.51 1sis n GLY 28 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1sis n PRO 29 N 2.74 0.04 -4.61 1.61 -0.04 -1.26 -4.18 135.00 129.30 1sis n PRO 29 Ca 0.00 0.16 -0.32 0.00 -0.04 0.00 0.00 63.50 63.30 1sis n PRO 29 Cb 0.00 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.84 1sis n PRO 29 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1sis s GLN 30 N -2.95 2.33 -0.40 0.54 -1.52 -0.97 -1.30 119.66 115.39 1sis s GLN 30 Ca 0.11 -0.83 -0.15 0.00 -1.95 0.00 0.00 55.36 52.53 1sis s GLN 30 Cb 0.13 -2.34 0.02 0.00 -0.22 0.00 0.00 33.01 30.59 1sis s GLN 30 CO 0.35 0.58 0.33 0.00 -0.25 0.00 0.00 175.29 176.29 1sis n LEU 32 N 5.26 0.00 -4.98 0.00 4.32 -0.78 -1.49 117.00 119.33 1sis n LEU 32 Ca -0.10 -2.84 -0.24 0.00 -0.02 0.00 0.00 56.01 52.81 1sis n LEU 32 Cb 0.47 0.29 0.10 0.00 -1.62 0.00 0.00 43.42 42.67 1sis n LEU 32 CO 0.42 -0.42 0.55 0.00 -1.22 0.00 0.00 177.39 176.72 1sis h ASN 34 N -0.54 0.68 0.00 0.00 -1.24 -1.42 -3.32 115.58 109.75 1sis h ASN 34 Ca -0.38 -0.90 0.00 0.00 0.71 0.00 0.00 56.30 55.74 1sis h ASN 34 Cb 1.27 -0.22 0.00 0.00 0.73 0.00 0.00 38.32 40.10 1sis h ASN 34 CO 0.42 1.74 0.00 -2.11 -1.29 0.00 0.00 177.43 176.19