#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bgk n ARG 3 N -1.15 -0.41 -0.76 0.00 -4.01 -1.26 -5.02 116.66 104.04 1bgk n ARG 3 Ca -0.02 0.00 -0.33 0.00 -1.04 0.00 0.00 57.85 56.45 1bgk n ARG 3 Cb 0.64 0.00 0.14 0.00 -3.04 0.00 0.00 32.46 30.20 1bgk n ARG 3 CO 0.00 0.00 0.00 -0.40 -3.04 0.00 0.00 177.63 174.19 1bgk n ASP 4 N 0.00 -2.58 0.00 2.89 5.75 -1.24 -4.33 116.55 117.04 1bgk n ASP 4 Ca 0.00 0.05 0.00 0.00 -0.01 0.00 0.00 54.79 54.83 1bgk n ASP 4 Cb 0.00 -0.98 0.00 0.00 -1.03 0.00 0.00 41.12 39.11 1bgk n ASP 4 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bgk n TRP 5 N -3.96 0.00 0.00 2.11 7.02 0.79 -4.86 117.44 118.54 1bgk n TRP 5 Ca 0.02 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.50 1bgk n TRP 5 Cb 0.60 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.49 1bgk n TRP 5 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1bgk n PHE 6 N 0.00 0.00 -0.51 -5.99 3.72 -1.26 -4.78 117.46 108.64 1bgk n PHE 6 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 1bgk n PHE 6 Cb 0.00 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.58 1bgk n PHE 6 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1bgk n LYS 7 N 0.00 1.61 0.00 -1.08 4.76 -1.26 -4.82 118.16 117.37 1bgk n LYS 7 Ca 0.00 -1.26 0.00 0.00 -2.87 0.00 0.00 58.31 54.18 1bgk n LYS 7 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 1bgk n LYS 7 CO 0.00 0.00 0.00 -1.91 -1.37 0.00 0.00 177.40 174.12 1bgk n GLU 8 N 0.31 0.00 -0.10 1.97 2.13 -1.26 -4.51 120.64 119.17 1bgk n GLU 8 Ca 0.25 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.96 1bgk n GLU 8 Cb 0.70 -2.11 -0.14 0.00 0.27 0.00 0.00 31.44 30.15 1bgk n GLU 8 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1bgk n THR 9 N -1.04 1.32 -0.34 6.31 -2.24 -1.26 -3.70 114.28 113.34 1bgk n THR 9 Ca 0.00 -0.77 0.13 0.00 -2.27 0.00 0.00 64.05 61.14 1bgk n THR 9 Cb 0.00 -0.63 0.31 0.00 -2.10 0.00 0.00 70.33 67.91 1bgk n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bgk h ALA 10 N 0.79 1.59 -1.15 6.98 0.00 -1.92 -0.82 119.26 124.73 1bgk h ALA 10 Ca -0.52 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1bgk h ALA 10 Cb 2.13 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.89 1bgk h ALA 10 CO 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.13 1bgk n ARG 12 N -1.51 -0.01 0.33 0.00 0.63 -0.56 0.13 116.66 115.67 1bgk n ARG 12 Ca 0.00 0.77 -0.14 0.00 -0.92 0.00 0.00 57.85 57.56 1bgk n ARG 12 Cb 0.00 -1.68 -0.07 0.00 0.45 0.00 0.00 32.46 31.16 1bgk n ARG 12 CO 0.00 0.00 0.00 1.25 -2.51 0.00 0.00 177.63 176.37 1bgk h HIS 13 N 0.00 -0.91 -0.66 -0.14 2.76 -0.60 -2.38 115.15 113.23 1bgk h HIS 13 Ca 0.62 -0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.85 1bgk h HIS 13 Cb 2.34 0.31 -0.10 0.00 1.55 0.00 0.00 27.41 31.52 1bgk h HIS 13 CO -0.00 -0.53 -0.54 0.00 -1.30 0.00 0.00 177.93 175.56 1bgk h ALA 14 N -1.46 -0.58 -0.65 5.26 0.00 0.11 0.81 119.26 122.75 1bgk h ALA 14 Ca -0.08 0.07 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1bgk h ALA 14 Cb 0.70 1.17 -0.05 0.00 0.00 0.00 0.00 17.79 19.60 1bgk h ALA 14 CO 0.11 -0.96 0.36 -0.22 0.00 0.00 0.00 179.25 178.53 1bgk h LYS 15 N -0.22 0.64 -0.51 0.00 3.64 -1.56 -1.74 116.57 116.82 1bgk h LYS 15 Ca 0.13 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1bgk h LYS 15 Cb 0.53 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1bgk h LYS 15 CO -0.74 0.42 0.00 0.45 -2.27 0.00 0.00 179.45 177.31 1bgk n SER 16 N -4.80 2.47 -0.02 4.20 2.88 -0.31 -4.35 113.62 113.69 1bgk n SER 16 Ca 0.08 -2.15 -0.03 0.00 -1.33 0.00 0.00 58.87 55.44 1bgk n SER 16 Cb 0.17 -0.36 -0.02 0.00 -0.75 0.00 0.00 64.21 63.25 1bgk n SER 16 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bgk n LEU 17 N 0.53 1.87 0.00 2.46 -0.00 0.27 -5.01 117.00 117.11 1bgk n LEU 17 Ca 0.13 -0.02 0.00 0.00 -0.00 0.00 0.00 56.01 56.13 1bgk n LEU 17 Cb 0.45 -0.07 0.00 0.00 -0.00 0.00 0.00 43.42 43.80 1bgk n LEU 17 CO 0.11 0.40 0.00 0.61 -0.00 0.00 0.00 177.39 178.51 1bgk n GLY 18 N 3.08 0.51 0.00 1.47 0.00 -1.07 -5.05 105.19 104.13 1bgk n GLY 18 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1bgk n GLY 18 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bgk n ASN 19 N 0.00 0.00 -1.89 1.61 3.02 -1.15 -4.67 115.26 112.19 1bgk n ASN 19 Ca 0.00 0.17 -0.01 0.00 -0.03 0.00 0.00 54.58 54.71 1bgk n ASN 19 Cb 0.00 -0.06 -0.00 0.00 -0.61 0.00 0.00 39.78 39.11 1bgk n ASN 19 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bgk n ARG 21 N -1.70 0.00 0.00 0.00 1.74 -1.26 -4.86 116.66 110.58 1bgk n ARG 21 Ca 0.00 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.22 1bgk n ARG 21 Cb 0.33 0.00 0.54 0.00 -1.02 0.00 0.00 32.46 32.32 1bgk n ARG 21 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1bgk n THR 22 N 0.00 0.00 -3.85 0.55 -2.24 -0.56 -4.64 114.28 103.54 1bgk n THR 22 Ca 0.00 -0.22 -0.28 0.00 -2.27 0.00 0.00 64.05 61.28 1bgk n THR 22 Cb 0.00 0.41 -0.16 0.00 -2.10 0.00 0.00 70.33 68.47 1bgk n THR 22 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1bgk s SER 23 N -2.05 3.08 0.51 3.42 0.15 -1.26 -5.01 113.70 112.54 1bgk s SER 23 Ca 0.37 -0.83 0.34 0.00 0.70 0.00 0.00 55.95 56.54 1bgk s SER 23 Cb 0.21 -0.87 1.48 0.00 -1.71 0.00 0.00 66.02 65.13 1bgk s SER 23 CO 0.36 -0.24 1.78 1.56 1.20 0.00 0.00 173.24 177.90 1bgk h GLN 24 N 8.12 0.07 0.12 5.44 1.08 -1.98 0.14 115.11 128.10 1bgk h GLN 24 Ca -0.20 -0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.73 1bgk h GLN 24 Cb 1.10 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 1bgk h GLN 24 CO 0.38 0.05 -1.32 -0.22 -0.95 0.00 0.00 178.83 176.76 1bgk h LYS 25 N 0.07 0.26 0.00 1.46 3.64 -1.95 -0.62 116.57 119.43 1bgk h LYS 25 Ca 0.60 -0.44 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1bgk h LYS 25 Cb 2.23 0.17 0.00 0.00 -0.41 0.00 0.00 32.23 34.22 1bgk h LYS 25 CO -0.08 1.21 0.00 1.88 -2.27 0.00 0.00 179.45 180.20 1bgk h TYR 26 N -0.30 0.00 0.00 1.91 -1.99 -1.50 2.26 116.97 117.34 1bgk h TYR 26 Ca -0.28 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.21 1bgk h TYR 26 Cb 1.75 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 40.44 1bgk h TYR 26 CO 0.14 0.00 -1.84 2.89 -0.00 0.00 0.00 178.16 179.34 1bgk n ARG 27 N -2.96 0.34 -0.09 4.88 1.85 0.34 -4.06 116.66 116.96 1bgk n ARG 27 Ca -0.02 0.12 -0.15 0.00 -1.00 0.00 0.00 57.85 56.80 1bgk n ARG 27 Cb 0.13 -1.15 -0.08 0.00 -1.05 0.00 0.00 32.46 30.31 1bgk n ARG 27 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1bgk h ALA 28 N -0.33 0.16 0.00 2.89 0.00 -1.05 -2.96 119.26 117.97 1bgk h ALA 28 Ca -0.36 -0.90 0.00 0.00 0.00 0.00 0.00 54.91 53.65 1bgk h ALA 28 Cb 1.41 0.58 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1bgk h ALA 28 CO -0.16 0.55 0.00 0.09 0.00 0.00 0.00 179.25 179.73 1bgk n ASN 29 N -4.52 0.00 -2.58 0.00 3.02 0.64 -2.90 115.26 108.92 1bgk n ASN 29 Ca -0.22 0.32 -0.15 0.00 -0.03 0.00 0.00 54.58 54.50 1bgk n ASN 29 Cb 0.52 -0.42 0.02 0.00 -0.61 0.00 0.00 39.78 39.29 1bgk n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bgk n ALA 31 N -0.27 1.97 0.02 0.00 0.00 -1.12 -1.39 120.51 119.72 1bgk n ALA 31 Ca 0.21 -0.08 -0.14 0.00 0.00 0.00 0.00 53.44 53.43 1bgk n ALA 31 Cb 0.77 -1.32 -0.14 0.00 0.00 0.00 0.00 19.45 18.77 1bgk n ALA 31 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1bgk h LYS 32 N 0.00 0.14 0.06 0.00 2.10 -1.84 -0.44 116.57 116.60 1bgk h LYS 32 Ca 0.00 -0.24 -0.28 0.00 -2.00 0.00 0.00 60.65 58.13 1bgk h LYS 32 Cb 0.25 0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.65 1bgk h LYS 32 CO 0.00 0.91 -1.42 1.15 -2.00 0.00 0.00 179.45 178.08 1bgk h THR 33 N 0.04 1.24 0.00 0.07 2.02 -1.82 -3.32 112.91 111.14 1bgk h THR 33 Ca -0.27 -2.95 0.00 0.00 0.77 0.00 0.00 66.41 63.96 1bgk h THR 33 Cb 2.00 2.71 0.00 0.00 -1.74 0.00 0.00 68.15 71.12 1bgk h THR 33 CO 0.12 0.79 -1.20 0.00 0.37 0.00 0.00 175.52 175.60 1bgk n GLU 35 N -1.80 -1.51 0.00 0.00 1.02 -0.30 -4.87 120.64 113.18 1bgk n GLU 35 Ca 0.02 0.53 0.12 0.00 -0.02 0.00 0.00 57.16 57.80 1bgk n GLU 35 Cb 0.41 -4.61 0.22 0.00 -0.02 0.00 0.00 31.44 27.44 1bgk n GLU 35 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1bgk n LEU 36 N -1.85 0.61 0.00 -4.62 4.77 -0.47 -5.00 117.00 110.44 1bgk n LEU 36 Ca -0.11 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1bgk n LEU 36 Cb 0.59 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1bgk n LEU 36 CO 0.19 0.15 0.00 0.00 -1.33 0.00 0.00 177.39 176.40