#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bbg n ASP 2 N 0.00 5.58 0.00 -2.24 9.92 -1.26 -4.85 116.55 123.70 3bbg n ASP 2 Ca 0.00 -3.04 0.00 0.00 -0.53 0.00 0.00 54.79 51.22 3bbg n ASP 2 Cb 0.00 -1.50 0.00 0.00 -0.64 0.00 0.00 41.12 38.98 3bbg n ASP 2 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3bbg n GLY 3 N 2.89 -0.86 3.46 0.44 0.00 -1.26 -4.89 105.19 104.96 3bbg n GLY 3 Ca 0.48 -0.96 -0.24 0.00 0.00 0.00 0.00 46.02 45.30 3bbg n GLY 3 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bbg s LEU 4 N 0.00 1.92 -0.17 0.99 1.43 -1.26 -5.05 118.68 116.54 3bbg s LEU 4 Ca 0.00 -1.73 -0.09 0.00 -1.03 0.00 0.00 54.13 51.28 3bbg s LEU 4 Cb 0.00 0.11 0.06 0.00 0.03 0.00 0.00 46.19 46.38 3bbg s LEU 4 CO 0.00 -1.00 0.40 0.00 0.23 0.00 0.00 176.35 175.98 3bbg n TYR 6 N 4.31 -0.79 -4.40 0.00 0.18 -0.98 -5.00 117.16 110.48 3bbg n TYR 6 Ca -0.23 -2.48 -0.28 0.00 1.88 0.00 0.00 57.90 56.79 3bbg n TYR 6 Cb 0.55 0.29 -0.13 0.00 -0.38 0.00 0.00 39.34 39.67 3bbg n TYR 6 CO 0.00 0.00 0.00 -1.83 -2.08 0.00 0.00 176.86 172.95 3bbg s GLU 7 N -3.16 1.43 0.00 -3.48 -1.05 -1.26 -2.59 118.70 108.59 3bbg s GLU 7 Ca 0.35 -1.41 0.00 0.00 -0.15 0.00 0.00 54.97 53.76 3bbg s GLU 7 Cb 0.01 -1.86 0.00 0.00 -0.44 0.00 0.00 34.13 31.84 3bbg s GLU 7 CO 0.25 0.43 0.00 0.41 0.95 0.00 0.00 175.26 177.29 3bbg n GLY 8 N 0.69 -0.48 0.80 -3.83 0.00 -1.26 -4.98 105.19 96.13 3bbg n GLY 8 Ca -0.16 0.12 -0.03 0.00 0.00 0.00 0.00 46.02 45.94 3bbg n GLY 8 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3bbg n THR 9 N 0.00 0.00 0.41 2.61 -1.04 -1.26 -4.43 114.28 110.57 3bbg n THR 9 Ca 0.00 -0.04 0.13 0.00 -2.04 0.00 0.00 64.05 62.10 3bbg n THR 9 Cb 0.00 0.31 0.49 0.00 -1.82 0.00 0.00 70.33 69.31 3bbg n THR 9 CO 0.00 0.00 0.00 -1.13 -0.64 0.00 0.00 175.07 173.30 3bbg h ASN 10 N 0.04 0.00 0.00 8.00 -1.24 -1.95 -3.21 115.58 117.22 3bbg h ASN 10 Ca -0.30 0.00 -0.10 0.00 0.71 0.00 0.00 56.30 56.61 3bbg h ASN 10 Cb 1.26 0.00 -0.21 0.00 0.73 0.00 0.00 38.32 40.10 3bbg h ASN 10 CO -0.14 0.00 -0.76 0.00 -1.29 0.00 0.00 177.43 175.24 3bbg n GLY 12 N -0.11 0.35 2.18 0.00 0.00 -1.21 -4.91 105.19 101.48 3bbg n GLY 12 Ca 0.09 -0.62 -0.20 0.00 0.00 0.00 0.00 46.02 45.29 3bbg n GLY 12 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3bbg n LYS 13 N -2.05 2.08 -1.95 1.61 2.85 -1.26 -4.93 118.16 114.51 3bbg n LYS 13 Ca -0.08 -1.77 -0.43 0.00 -1.05 0.00 0.00 58.31 54.98 3bbg n LYS 13 Cb 0.46 -1.90 -0.03 0.00 -0.65 0.00 0.00 35.03 32.92 3bbg n LYS 13 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3bbg s VAL 14 N -1.63 3.45 0.00 0.58 1.01 -1.26 -2.03 120.40 120.53 3bbg s VAL 14 Ca 0.48 0.50 0.00 0.00 0.00 0.00 0.00 61.98 62.96 3bbg s VAL 14 Cb 0.31 -3.50 0.00 0.00 0.00 0.00 0.00 36.38 33.19 3bbg s VAL 14 CO -0.11 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.36 3bbg n GLY 15 N 4.99 2.56 0.00 4.51 0.00 -1.26 -5.03 105.19 110.96 3bbg n GLY 15 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3bbg n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3bbg n LYS 16 N -0.66 1.27 -4.23 1.61 5.02 -0.86 -5.03 118.16 115.27 3bbg n LYS 16 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 58.31 56.14 3bbg n LYS 16 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 34.92 3bbg n LYS 16 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3bbg s TYR 17 N 2.07 1.42 0.20 2.13 2.02 -1.05 -4.68 117.35 119.47 3bbg s TYR 17 Ca 0.00 -1.50 -0.01 0.00 -0.37 0.00 0.00 57.07 55.19 3bbg s TYR 17 Cb 0.00 -0.61 -0.04 0.00 -0.40 0.00 0.00 41.96 40.91 3bbg s TYR 17 CO 0.00 -0.76 0.14 0.00 -1.57 0.00 0.00 175.55 173.36 3bbg s SER 20 N 2.01 -1.04 0.34 0.00 1.04 -1.25 -2.56 113.70 112.24 3bbg s SER 20 Ca 0.05 0.50 0.16 0.00 0.48 0.00 0.00 55.95 57.13 3bbg s SER 20 Cb -0.13 1.81 0.58 0.00 0.10 0.00 0.00 66.02 68.39 3bbg s SER 20 CO -0.05 -0.19 1.70 1.55 0.98 0.00 0.00 173.24 177.23 3bbg h PRO 21 N 7.92 0.00 0.00 4.02 0.13 -1.94 -3.42 132.00 138.71 3bbg h PRO 21 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 3bbg h PRO 21 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3bbg h PRO 21 CO 0.10 0.45 0.00 1.51 -0.23 0.00 0.00 178.00 179.83 3bbg n ILE 22 N -3.65 0.00 0.00 -3.56 3.06 -1.26 -5.07 119.36 108.88 3bbg n ILE 22 Ca -0.01 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.24 3bbg n ILE 22 Cb 0.54 -0.35 0.00 0.00 0.54 0.00 0.00 39.64 40.36 3bbg n ILE 22 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3bbg n GLY 23 N 0.63 0.27 0.38 4.50 0.00 -1.26 -4.98 105.19 104.72 3bbg n GLY 23 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 3bbg n GLY 23 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3bbg h LYS 24 N 0.00 0.00 0.00 1.61 2.10 -1.97 -3.06 116.57 115.25 3bbg h LYS 24 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3bbg h LYS 24 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 3bbg h LYS 24 CO 0.00 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.11 3bbg n TYR 25 N -3.17 0.00 -3.84 0.07 4.01 -1.26 -5.01 117.16 107.96 3bbg n TYR 25 Ca 0.05 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.41 3bbg n TYR 25 Cb 0.69 -0.03 0.03 0.00 -0.31 0.00 0.00 39.34 39.73 3bbg n TYR 25 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3bbg s VAL 27 N -3.48 2.61 0.20 0.00 1.01 -1.06 -4.93 120.40 114.75 3bbg s VAL 27 Ca 0.48 -0.81 0.10 0.00 0.00 0.00 0.00 61.98 61.76 3bbg s VAL 27 Cb -0.21 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 3bbg s VAL 27 CO 0.91 0.45 -0.15 0.00 0.00 0.00 0.00 175.10 176.31 3bbg s TYR 29 N -1.79 0.47 0.06 0.00 1.51 -0.98 -4.99 117.35 111.62 3bbg s TYR 29 Ca 0.24 -0.85 -0.09 0.00 -1.01 0.00 0.00 57.07 55.36 3bbg s TYR 29 Cb -0.08 0.26 -0.31 0.00 -0.11 0.00 0.00 41.96 41.73 3bbg s TYR 29 CO 0.13 -1.15 1.10 0.38 -1.11 0.00 0.00 175.55 174.90 3bbg h ASP 30 N 2.15 0.59 -3.24 2.29 2.03 -1.96 -2.79 116.42 115.50 3bbg h ASP 30 Ca -0.27 -0.63 -0.56 0.00 -0.73 0.00 0.00 57.03 54.84 3bbg h ASP 30 Cb 1.25 -0.19 -0.08 0.00 -0.83 0.00 0.00 39.33 39.48 3bbg h ASP 30 CO 0.36 1.49 0.95 -0.44 -1.03 0.00 0.00 179.24 180.57 3bbg s SER 31 N -7.32 6.45 0.53 4.15 0.01 -1.26 -4.72 113.70 111.55 3bbg s SER 31 Ca -0.06 0.10 0.36 0.00 1.31 0.00 0.00 55.95 57.66 3bbg s SER 31 Cb 0.06 -2.55 1.53 0.00 0.21 0.00 0.00 66.02 65.27 3bbg s SER 31 CO 0.91 -1.45 1.80 0.07 0.41 0.00 0.00 173.24 174.98 3bbg h LYS 32 N 9.50 0.03 -0.27 12.44 2.10 -1.96 0.92 116.57 139.33 3bbg h LYS 32 Ca -0.25 -0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.38 3bbg h LYS 32 Cb 1.06 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 32.37 3bbg h LYS 32 CO 1.18 0.02 0.11 0.00 -2.00 0.00 0.00 179.45 178.75 3bbg h ALA 33 N 1.42 0.35 -0.08 0.07 0.00 -1.96 -2.38 119.26 116.68 3bbg h ALA 33 Ca 0.57 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.37 3bbg h ALA 33 Cb 2.24 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.92 3bbg h ALA 33 CO -0.03 -0.06 0.05 0.82 0.00 0.00 0.00 179.25 180.04 3bbg h ILE 34 N 0.29 1.01 0.78 0.00 2.04 0.48 0.78 117.51 122.88 3bbg h ILE 34 Ca 0.09 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 3bbg h ILE 34 Cb 0.17 0.92 0.01 0.00 -0.74 0.00 0.00 36.82 37.18 3bbg h ILE 34 CO -0.01 0.02 -0.37 0.00 0.00 0.00 0.00 178.15 177.78 3bbg h ASN 36 N -1.15 -0.33 0.00 0.00 -0.73 -1.15 -2.90 115.58 109.32 3bbg h ASN 36 Ca -0.11 0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.13 3bbg h ASN 36 Cb 0.80 0.16 0.00 0.00 0.27 0.00 0.00 38.32 39.56 3bbg h ASN 36 CO 0.18 -0.14 0.00 1.17 -0.37 0.00 0.00 177.43 178.26 3bbg n LYS 37 N -5.25 0.00 0.31 6.67 0.00 0.23 -2.49 118.16 117.63 3bbg n LYS 37 Ca -0.04 0.00 0.18 0.00 0.00 0.00 0.00 58.31 58.45 3bbg n LYS 37 Cb 0.17 -0.80 0.99 0.00 0.00 0.00 0.00 35.03 35.39 3bbg n LYS 37 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 3bbg h ASN 38 N 0.00 0.00 -0.58 3.14 2.35 -0.92 -3.31 115.58 116.26 3bbg h ASN 38 Ca 0.00 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.87 3bbg h ASN 38 Cb 0.00 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.27 3bbg h ASN 38 CO 0.00 0.02 -0.03 0.00 -1.65 0.00 0.00 177.43 175.77