#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 -4.02 0.62 -1.65 0.00 0.00 -1.09 -5.07 117.12 105.91 1sis n MET 3 Ca -0.20 -1.40 -0.30 0.00 0.00 0.00 0.00 57.70 55.79 1sis n MET 3 Cb 0.86 1.89 0.06 0.00 0.00 0.00 0.00 33.22 36.04 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 -2.05 2.67 -0.05 3.17 0.04 -1.26 -0.95 135.00 136.58 1sis s PRO 4 Ca 0.21 0.73 0.06 0.00 0.04 0.00 0.00 61.00 62.04 1sis s PRO 4 Cb -0.03 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 1sis s PRO 4 CO 0.05 -1.23 -0.25 0.00 0.04 0.00 0.00 177.00 175.62 1sis s PHE 6 N -0.28 1.73 0.00 0.00 0.40 -1.26 -4.36 117.98 114.21 1sis s PHE 6 Ca 0.00 -2.20 -0.01 0.00 -0.60 0.00 0.00 56.93 54.12 1sis s PHE 6 Cb -0.12 -1.70 -0.03 0.00 0.51 0.00 0.00 43.02 41.68 1sis s PHE 6 CO 0.02 -0.80 1.51 0.25 0.70 0.00 0.00 175.22 176.90 1sis n THR 7 N 3.79 1.43 -0.08 0.64 -2.24 -1.26 -3.33 114.28 113.23 1sis n THR 7 Ca 0.08 -0.43 -0.19 0.00 -2.27 0.00 0.00 64.05 61.24 1sis n THR 7 Cb 0.36 -1.41 -0.13 0.00 -2.10 0.00 0.00 70.33 67.05 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 1.81 1.58 -3.23 4.28 5.66 -1.26 -4.93 114.28 118.19 1sis n THR 8 Ca 0.04 -0.61 -0.39 0.00 -3.05 0.00 0.00 64.05 60.03 1sis n THR 8 Cb 0.37 -1.48 -0.07 0.00 -1.55 0.00 0.00 70.33 67.61 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 -6.64 6.53 0.00 1.09 2.15 -1.21 -4.95 116.67 113.64 1sis s ASP 9 Ca -0.29 0.63 0.07 0.00 0.43 0.00 0.00 52.55 53.39 1sis s ASP 9 Cb 0.08 -2.29 0.40 0.00 -0.30 0.00 0.00 42.92 40.81 1sis s ASP 9 CO 0.67 -0.23 1.00 -0.81 -0.17 0.00 0.00 175.17 175.64 1sis n PRO 10 N 5.07 0.16 -0.01 4.34 -0.04 -1.26 -1.56 135.00 141.71 1sis n PRO 10 Ca -0.04 0.12 0.04 0.00 -0.04 0.00 0.00 63.50 63.58 1sis n PRO 10 Cb 0.50 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.16 2.63 -0.35 3.54 5.15 -1.26 -4.54 115.26 119.27 1sis n ASN 11 Ca 0.04 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 54.03 1sis n ASN 11 Cb 0.04 1.41 0.15 0.00 -0.53 0.00 0.00 39.78 40.85 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 0.00 1.14 -0.84 1.20 4.05 -1.59 -1.13 114.93 117.75 1sis h MET 12 Ca -0.02 -0.07 0.19 0.00 -0.28 0.00 0.00 59.70 59.51 1sis h MET 12 Cb 0.58 -0.26 -0.06 0.00 -0.80 0.00 0.00 31.60 31.06 1sis h MET 12 CO 0.00 0.75 0.56 0.00 0.23 0.00 0.00 176.91 178.45 1sis h ALA 13 N 1.41 2.22 -0.20 0.39 0.00 -1.80 0.20 119.26 121.49 1sis h ALA 13 Ca 0.40 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.25 1sis h ALA 13 Cb 0.07 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1sis h ALA 13 CO -0.14 -0.47 -0.14 0.87 0.00 0.00 0.00 179.25 179.36 1sis h LYS 14 N 0.37 0.44 -0.56 0.00 1.57 -1.49 -2.52 116.57 114.38 1sis h LYS 14 Ca 0.43 -0.21 0.04 0.00 -1.87 0.00 0.00 60.65 59.03 1sis h LYS 14 Cb 1.09 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.35 1sis h LYS 14 CO -0.14 0.76 0.31 0.87 -0.57 0.00 0.00 179.45 180.68 1sis h LYS 15 N 0.12 0.59 -0.99 3.15 1.57 -0.13 -0.77 116.57 120.11 1sis h LYS 15 Ca 0.04 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1sis h LYS 15 Cb 0.66 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.78 1sis h LYS 15 CO 0.04 0.39 0.66 0.00 -0.57 0.00 0.00 179.45 179.96 1sis h ARG 17 N 1.33 -0.33 -0.45 0.00 -0.00 -0.88 -3.05 114.38 111.00 1sis h ARG 17 Ca 0.37 0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.87 1sis h ARG 17 Cb -0.13 0.08 -0.02 0.00 0.00 0.00 0.00 29.97 29.89 1sis h ARG 17 CO -0.09 -0.22 0.26 -0.44 0.00 0.00 0.00 179.97 179.48 1sis h ASP 18 N -0.35 0.54 -0.67 7.04 3.32 -0.84 -1.45 116.42 124.01 1sis h ASP 18 Ca 0.02 -0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.11 1sis h ASP 18 Cb 0.35 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 1sis h ASP 18 CO -0.08 0.43 0.34 0.00 -1.72 0.00 0.00 179.24 178.21 1sis n GLY 21 N 0.17 0.23 0.00 0.00 0.00 -0.22 -3.54 105.19 101.83 1sis n GLY 21 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.18 3.09 2.43 -0.02 0.00 -0.60 -4.95 105.19 103.95 1sis n GLY 22 Ca -0.02 -0.91 -0.20 0.00 0.00 0.00 0.00 46.02 44.89 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 0.96 3.88 -2.75 1.61 2.04 -0.85 -4.09 115.26 116.05 1sis n ASN 23 Ca 0.00 -3.38 -0.06 0.00 -0.44 0.00 0.00 54.58 50.70 1sis n ASN 23 Cb 0.00 -0.44 0.05 0.00 -2.53 0.00 0.00 39.78 36.85 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 -0.47 -2.67 3.06 4.83 0.00 -1.07 -4.57 105.19 104.30 1sis n GLY 24 Ca 0.32 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.78 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 -3.47 0.20 -0.10 1.61 1.02 -0.29 -4.79 119.74 113.93 1sis s LYS 25 Ca 0.13 0.68 -0.24 0.00 0.02 0.00 0.00 55.97 56.56 1sis s LYS 25 Cb -0.01 -0.05 -0.03 0.00 -0.52 0.00 0.00 37.83 37.21 1sis s LYS 25 CO 0.10 -0.23 0.76 0.00 -0.92 0.00 0.00 175.35 175.06 1sis n PHE 27 N 4.26 3.09 0.00 0.00 3.72 -0.35 -4.99 117.46 123.19 1sis n PHE 27 Ca 0.01 -4.13 0.00 0.00 -0.05 0.00 0.00 57.45 53.28 1sis n PHE 27 Cb 0.51 -0.54 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 1sis n PHE 27 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sis n GLY 28 N 1.29 3.02 0.14 1.37 0.00 -1.26 -3.09 105.19 106.66 1sis n GLY 28 Ca 0.26 -0.21 0.12 0.00 0.00 0.00 0.00 46.02 46.19 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 12.95 0.19 -4.76 1.61 -0.04 -1.26 -4.46 135.00 139.23 1sis n PRO 29 Ca 0.00 0.48 -0.32 0.00 -0.04 0.00 0.00 63.50 63.63 1sis n PRO 29 Cb 0.00 -1.91 -0.13 0.00 -0.04 0.00 0.00 33.50 31.42 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 -3.39 2.27 -0.29 0.54 -0.21 -1.18 -1.41 119.66 116.00 1sis s GLN 30 Ca 0.02 -0.85 -0.13 0.00 0.02 0.00 0.00 55.36 54.42 1sis s GLN 30 Cb 0.09 -2.28 -0.04 0.00 1.00 0.00 0.00 33.01 31.78 1sis s GLN 30 CO 0.35 0.58 0.28 0.00 -2.12 0.00 0.00 175.29 174.38 1sis s LEU 32 N 1.91 2.62 0.43 0.00 2.01 -0.74 -1.58 118.68 123.33 1sis s LEU 32 Ca 0.11 -0.49 -0.01 0.00 0.01 0.00 0.00 54.13 53.74 1sis s LEU 32 Cb -0.16 -1.51 -0.02 0.00 0.01 0.00 0.00 46.19 44.51 1sis s LEU 32 CO 0.11 0.22 0.66 0.00 1.01 0.00 0.00 176.35 178.35 1sis n ASN 34 N -2.03 6.43 0.00 0.00 0.23 -1.26 -4.90 115.26 113.73 1sis n ASN 34 Ca -0.01 -2.99 0.11 0.00 -0.53 0.00 0.00 54.58 51.17 1sis n ASN 34 Cb 0.57 -1.31 0.68 0.00 -2.08 0.00 0.00 39.78 37.64 1sis n ASN 34 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19