#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 -3.59 0.09 -2.76 0.00 0.00 -1.24 -5.02 117.12 104.61 1sis n MET 3 Ca -0.25 -0.18 -0.25 0.00 0.00 0.00 0.00 57.70 57.01 1sis n MET 3 Cb 1.07 0.24 0.01 0.00 0.00 0.00 0.00 33.22 34.55 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 -2.01 3.17 -0.07 3.17 0.04 -1.26 -1.14 135.00 136.90 1sis s PRO 4 Ca 0.02 -0.16 0.05 0.00 0.04 0.00 0.00 61.00 60.95 1sis s PRO 4 Cb -0.00 -2.43 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 1sis s PRO 4 CO 0.01 -0.35 -0.23 0.00 0.04 0.00 0.00 177.00 176.47 1sis s PHE 6 N 0.07 1.66 0.00 0.00 0.40 -1.26 -4.26 117.98 114.60 1sis s PHE 6 Ca -0.09 -2.08 -0.02 0.00 -0.60 0.00 0.00 56.93 54.13 1sis s PHE 6 Cb -0.15 -1.66 -0.10 0.00 0.51 0.00 0.00 43.02 41.62 1sis s PHE 6 CO 0.05 -0.82 2.09 0.25 0.70 0.00 0.00 175.22 177.49 1sis n THR 7 N 3.99 1.76 -0.09 0.64 -2.24 -1.26 -3.51 114.28 113.58 1sis n THR 7 Ca 0.06 -0.72 -0.19 0.00 -2.27 0.00 0.00 64.05 60.93 1sis n THR 7 Cb 0.37 -1.62 -0.13 0.00 -2.10 0.00 0.00 70.33 66.85 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 2.20 1.59 -3.27 4.28 5.66 -1.26 -4.95 114.28 118.52 1sis n THR 8 Ca 0.16 -0.60 -0.38 0.00 -3.05 0.00 0.00 64.05 60.18 1sis n THR 8 Cb 0.51 -1.52 -0.06 0.00 -1.55 0.00 0.00 70.33 67.71 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 -6.68 6.70 0.00 1.09 -1.08 -1.23 -4.95 116.67 110.51 1sis s ASP 9 Ca -0.31 0.83 0.05 0.00 -0.52 0.00 0.00 52.55 52.61 1sis s ASP 9 Cb 0.08 -2.30 0.24 0.00 -1.46 0.00 0.00 42.92 39.48 1sis s ASP 9 CO 0.66 -0.04 1.06 -0.81 0.52 0.00 0.00 175.17 176.56 1sis n PRO 10 N 3.87 0.05 -0.00 4.34 -0.04 -1.26 -1.89 135.00 140.06 1sis n PRO 10 Ca -0.06 0.30 0.04 0.00 -0.04 0.00 0.00 63.50 63.74 1sis n PRO 10 Cb 0.51 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 1sis n PRO 10 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1sis n ASN 11 N -1.37 1.47 -0.30 3.54 0.23 -1.26 -4.57 115.26 113.01 1sis n ASN 11 Ca 0.02 -0.41 -0.00 0.00 -0.53 0.00 0.00 54.58 53.66 1sis n ASN 11 Cb 0.05 1.14 0.13 0.00 -2.08 0.00 0.00 39.78 39.01 1sis n ASN 11 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1sis h MET 12 N 0.00 0.92 -0.88 -3.83 4.05 -1.68 -0.66 114.93 112.86 1sis h MET 12 Ca 0.00 -0.06 0.17 0.00 -0.28 0.00 0.00 59.70 59.54 1sis h MET 12 Cb 0.24 -0.21 -0.07 0.00 -0.80 0.00 0.00 31.60 30.77 1sis h MET 12 CO 0.00 0.61 0.57 0.00 0.23 0.00 0.00 176.91 178.32 1sis h ALA 13 N 1.38 2.03 -0.34 0.39 0.00 -1.81 0.11 119.26 121.03 1sis h ALA 13 Ca 0.36 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 1sis h ALA 13 Cb 0.14 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1sis h ALA 13 CO -0.16 -0.29 -0.19 0.87 0.00 0.00 0.00 179.25 179.48 1sis h LYS 14 N 0.53 0.72 -0.55 0.00 1.57 -1.42 -2.28 116.57 115.14 1sis h LYS 14 Ca 0.45 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1sis h LYS 14 Cb 0.95 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.22 1sis h LYS 14 CO -0.19 0.93 0.35 0.87 -0.57 0.00 0.00 179.45 180.84 1sis h LYS 15 N 0.50 0.73 -0.98 3.15 1.57 -0.07 -0.65 116.57 120.82 1sis h LYS 15 Ca 0.07 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1sis h LYS 15 Cb 0.73 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.83 1sis h LYS 15 CO 0.05 0.51 0.65 0.00 -0.57 0.00 0.00 179.45 180.09 1sis h ARG 17 N 1.32 -0.19 -0.88 0.00 3.08 -0.95 -2.95 114.38 113.81 1sis h ARG 17 Ca 0.36 0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.49 1sis h ARG 17 Cb -0.13 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 29.90 1sis h ARG 17 CO -0.08 -0.13 0.57 0.22 -1.07 0.00 0.00 179.97 179.48 1sis h ASP 18 N -0.20 0.88 -0.47 7.04 1.82 -0.80 -0.21 116.42 124.48 1sis h ASP 18 Ca 0.04 0.00 0.08 0.00 -0.39 0.00 0.00 57.03 56.76 1sis h ASP 18 Cb 0.24 -0.19 -0.07 0.00 0.68 0.00 0.00 39.33 40.00 1sis h ASP 18 CO -0.10 0.58 0.09 0.00 -1.61 0.00 0.00 179.24 178.20 1sis n GLY 21 N 1.06 -0.03 0.26 0.00 0.00 0.03 -2.15 105.19 104.36 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 -1.22 2.97 2.45 -0.02 0.00 -0.22 -4.93 105.19 104.23 1sis n GLY 22 Ca -0.07 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 1sis n GLY 22 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sis n ASN 23 N 0.09 3.77 -4.10 1.61 3.02 -0.44 -4.07 115.26 115.14 1sis n ASN 23 Ca 0.00 -3.44 -0.25 0.00 -0.03 0.00 0.00 54.58 50.86 1sis n ASN 23 Cb 0.00 -0.68 -0.08 0.00 -0.61 0.00 0.00 39.78 38.41 1sis n ASN 23 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1sis s GLY 24 N -2.42 2.60 0.04 7.41 0.00 -1.16 -1.42 107.32 112.37 1sis s GLY 24 Ca 0.39 -1.27 -0.11 0.00 0.00 0.00 0.00 44.72 43.73 1sis s GLY 24 CO -0.02 -1.82 0.23 0.54 0.00 0.00 0.00 173.10 172.03 1sis s LYS 25 N -3.71 0.73 -0.05 2.90 1.02 -0.35 -4.25 119.74 116.03 1sis s LYS 25 Ca 0.24 -0.61 -0.21 0.00 0.02 0.00 0.00 55.97 55.41 1sis s LYS 25 Cb 0.03 0.31 -0.04 0.00 -0.52 0.00 0.00 37.83 37.60 1sis s LYS 25 CO 0.15 -0.22 0.59 0.00 -0.92 0.00 0.00 175.35 174.95 1sis n PHE 27 N 3.31 3.19 -3.22 0.00 3.01 -0.29 -4.97 117.46 118.49 1sis n PHE 27 Ca -0.05 -4.13 0.00 0.00 1.01 0.00 0.00 57.45 54.28 1sis n PHE 27 Cb 0.51 -0.54 0.00 0.00 -0.01 0.00 0.00 39.48 39.44 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 1.13 1.68 0.00 1.37 0.00 -1.26 -3.09 105.19 105.02 1sis n GLY 28 Ca 0.27 -0.59 0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 0.50 -4.46 1.61 -0.04 -1.26 -4.40 135.00 139.90 1sis n PRO 29 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 1sis n PRO 29 Cb 0.00 -1.49 -0.11 0.00 -0.04 0.00 0.00 33.50 31.86 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 -2.00 2.34 -0.23 0.54 1.11 -1.18 -1.53 119.66 118.71 1sis s GLN 30 Ca 0.24 -0.85 -0.13 0.00 0.01 0.00 0.00 55.36 54.63 1sis s GLN 30 Cb 0.11 -2.38 -0.05 0.00 -1.01 0.00 0.00 33.01 29.68 1sis s GLN 30 CO 0.18 0.57 0.26 0.00 0.01 0.00 0.00 175.29 176.31 1sis s LEU 32 N 1.25 2.26 0.67 0.00 1.02 -0.49 -1.18 118.68 122.22 1sis s LEU 32 Ca 0.12 -1.67 -0.02 0.00 0.02 0.00 0.00 54.13 52.59 1sis s LEU 32 Cb -0.14 -0.70 0.09 0.00 0.02 0.00 0.00 46.19 45.45 1sis s LEU 32 CO 0.06 -0.87 0.94 0.00 0.02 0.00 0.00 176.35 176.50 1sis n ASN 34 N -2.73 5.99 0.00 0.00 5.03 -0.51 -4.40 115.26 118.65 1sis n ASN 34 Ca 0.11 -2.91 0.00 0.00 0.87 0.00 0.00 54.58 52.65 1sis n ASN 34 Cb 0.60 -1.30 0.00 0.00 -1.02 0.00 0.00 39.78 38.07 1sis n ASN 34 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29