#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 -3.00 -1.49 -1.14 0.00 1.85 -1.26 -4.98 116.66 106.64 1bgk n ARG 3 Ca 0.10 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.80 1bgk n ARG 3 Cb 0.60 0.00 0.10 0.00 -1.05 0.00 0.00 32.46 32.11 1bgk n ARG 3 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1bgk n ASP 4 N 2.95 0.19 0.00 2.89 5.75 -1.26 -3.68 116.55 123.39 1bgk n ASP 4 Ca 0.00 -1.33 0.00 0.00 -0.01 0.00 0.00 54.79 53.45 1bgk n ASP 4 Cb 0.00 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 39.59 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 -2.81 0.00 -0.19 2.11 7.02 0.42 -4.80 117.44 119.20 1bgk n TRP 5 Ca 0.09 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.57 1bgk n TRP 5 Cb 0.31 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.20 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 -0.95 0.00 -2.71 -5.99 3.72 -1.25 -4.96 117.46 105.32 1bgk n PHE 6 Ca 0.00 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.04 1bgk n PHE 6 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 1bgk n PHE 6 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1bgk s LYS 7 N 1.31 4.33 0.44 -1.08 -0.14 -1.26 -4.85 119.74 118.49 1bgk s LYS 7 Ca 0.00 1.33 0.16 0.00 -1.36 0.00 0.00 55.97 56.10 1bgk s LYS 7 Cb 0.00 -2.53 0.88 0.00 -1.68 0.00 0.00 37.83 34.50 1bgk s LYS 7 CO 0.00 0.04 1.42 0.93 -0.76 0.00 0.00 175.35 176.98 1bgk h GLU 8 N 2.57 0.00 0.01 1.68 5.08 -1.97 0.13 114.58 122.07 1bgk h GLU 8 Ca -0.48 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 57.57 1bgk h GLU 8 Cb 1.20 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.40 1bgk h GLU 8 CO 0.63 0.00 -1.83 0.25 -1.00 0.00 0.00 179.01 177.06 1bgk n THR 9 N -2.30 1.60 -0.34 1.13 -2.24 -1.26 -2.85 114.28 108.03 1bgk n THR 9 Ca -0.01 -0.79 0.14 0.00 -2.27 0.00 0.00 64.05 61.13 1bgk n THR 9 Cb 0.41 -1.05 0.34 0.00 -2.10 0.00 0.00 70.33 67.92 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 0.89 1.66 0.41 6.98 0.00 -1.09 -0.17 119.26 127.93 1bgk h ALA 10 Ca -0.33 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1bgk h ALA 10 Cb 2.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1bgk h ALA 10 CO 0.07 -0.16 -0.20 0.00 0.00 0.00 0.00 179.25 178.96 1bgk n ARG 12 N -3.85 0.01 0.24 0.00 0.63 -0.24 0.13 116.66 113.58 1bgk n ARG 12 Ca -0.07 1.01 -0.10 0.00 -0.92 0.00 0.00 57.85 57.77 1bgk n ARG 12 Cb 0.22 -2.41 -0.05 0.00 0.45 0.00 0.00 32.46 30.67 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 -0.60 -0.91 -0.14 2.76 -0.80 -1.91 115.15 113.55 1bgk h HIS 13 Ca 0.70 -0.01 0.25 0.00 -2.20 0.00 0.00 60.37 59.11 1bgk h HIS 13 Cb 3.24 0.20 -0.14 0.00 1.55 0.00 0.00 27.41 32.26 1bgk h HIS 13 CO 0.00 -0.37 0.34 0.00 -1.30 0.00 0.00 177.93 176.59 1bgk h ALA 14 N -1.29 1.45 -0.03 5.26 0.00 0.12 1.43 119.26 126.22 1bgk h ALA 14 Ca -0.07 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1bgk h ALA 14 Cb 0.50 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1bgk h ALA 14 CO 0.11 -0.46 -0.01 -0.22 0.00 0.00 0.00 179.25 178.67 1bgk h LYS 15 N 0.27 0.05 -0.53 0.00 1.63 -1.40 0.11 116.57 116.70 1bgk h LYS 15 Ca 0.59 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.37 1bgk h LYS 15 Cb 1.22 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.85 1bgk h LYS 15 CO -0.62 0.42 0.00 0.43 -3.45 0.00 0.00 179.45 176.23 1bgk n SER 16 N -4.87 2.29 -0.03 4.20 7.64 -0.25 -4.30 113.62 118.30 1bgk n SER 16 Ca -0.08 -2.17 -0.04 0.00 1.01 0.00 0.00 58.87 57.60 1bgk n SER 16 Cb 0.21 -0.37 -0.04 0.00 -1.01 0.00 0.00 64.21 63.01 1bgk n SER 16 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bgk n LEU 17 N 0.38 1.66 0.00 -3.43 -0.00 0.48 -4.99 117.00 111.09 1bgk n LEU 17 Ca 0.11 -0.02 0.00 0.00 -0.00 0.00 0.00 56.01 56.10 1bgk n LEU 17 Cb 0.44 -0.07 0.00 0.00 -0.00 0.00 0.00 43.42 43.78 1bgk n LEU 17 CO 0.10 0.40 0.00 0.61 -0.00 0.00 0.00 177.39 178.50 1bgk n GLY 18 N 2.95 0.62 0.00 1.47 0.00 -1.18 -5.04 105.19 104.01 1bgk n GLY 18 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.87 1.61 3.02 -1.10 -4.76 115.26 111.16 1bgk n ASN 19 Ca 0.00 0.38 -0.12 0.00 -0.03 0.00 0.00 54.58 54.80 1bgk n ASN 19 Cb 0.00 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 38.97 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 -1.15 0.00 -0.09 0.00 0.00 -1.26 -4.92 116.66 109.24 1bgk n ARG 21 Ca -0.12 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 57.81 1bgk n ARG 21 Cb 0.31 -0.77 0.13 0.00 0.00 0.00 0.00 32.46 32.13 1bgk n ARG 21 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1bgk n THR 22 N -2.00 0.33 -4.36 5.15 -2.24 0.06 -4.87 114.28 106.35 1bgk n THR 22 Ca 0.00 -0.67 -0.24 0.00 -2.27 0.00 0.00 64.05 60.87 1bgk n THR 22 Cb 0.00 1.07 -0.12 0.00 -2.10 0.00 0.00 70.33 69.19 1bgk n THR 22 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1bgk s SER 23 N -1.28 2.94 0.00 3.42 0.01 -1.26 -5.00 113.70 112.53 1bgk s SER 23 Ca 0.25 -0.83 -0.00 0.00 1.31 0.00 0.00 55.95 56.67 1bgk s SER 23 Cb 0.16 -0.19 -0.00 0.00 0.21 0.00 0.00 66.02 66.19 1bgk s SER 23 CO 0.22 0.04 0.64 1.56 0.41 0.00 0.00 173.24 176.11 1bgk h GLN 24 N 3.38 -0.01 0.57 12.44 1.08 -1.99 -1.24 115.11 129.34 1bgk h GLN 24 Ca -0.45 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.73 1bgk h GLN 24 Cb 1.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 1bgk h GLN 24 CO 0.48 -0.01 -0.31 -0.22 -0.95 0.00 0.00 178.83 177.82 1bgk h LYS 25 N -0.02 -0.78 -0.94 1.46 3.64 -1.98 -1.99 116.57 115.96 1bgk h LYS 25 Ca -0.00 0.05 0.27 0.00 -1.27 0.00 0.00 60.65 59.70 1bgk h LYS 25 Cb 0.01 0.18 -0.17 0.00 -0.41 0.00 0.00 32.23 31.84 1bgk h LYS 25 CO 0.00 -0.52 0.13 1.88 -2.27 0.00 0.00 179.45 178.68 1bgk h TYR 26 N -0.81 0.15 0.26 1.91 0.05 -1.89 2.31 116.97 118.95 1bgk h TYR 26 Ca -0.07 0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1bgk h TYR 26 Cb 0.64 0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.47 1bgk h TYR 26 CO -0.06 -0.37 -0.13 0.07 -1.05 0.00 0.00 178.16 176.62 1bgk h ARG 27 N 0.07 -0.34 0.00 4.88 0.11 -0.80 -1.19 114.38 117.10 1bgk h ARG 27 Ca 0.60 0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.70 1bgk h ARG 27 Cb 1.28 0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.43 1bgk h ARG 27 CO -0.82 -0.01 -0.02 0.00 0.10 0.00 0.00 179.97 179.22 1bgk h ALA 28 N -0.13 0.00 0.00 0.08 0.00 -0.42 -2.32 119.26 116.47 1bgk h ALA 28 Ca -0.04 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1bgk h ALA 28 Cb 0.49 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1bgk h ALA 28 CO 0.06 0.02 0.41 -0.91 0.00 0.00 0.00 179.25 178.84 1bgk h ASN 29 N -0.22 0.00 -0.90 0.00 -0.26 0.37 0.17 115.58 114.73 1bgk h ASN 29 Ca 0.00 0.00 -0.34 0.00 -0.56 0.00 0.00 56.30 55.40 1bgk h ASN 29 Cb 0.02 0.00 -0.40 0.00 -1.06 0.00 0.00 38.32 36.88 1bgk h ASN 29 CO 0.00 0.00 -1.18 0.00 -1.06 0.00 0.00 177.43 175.19 1bgk n ALA 31 N -0.16 2.65 0.05 0.00 0.00 0.05 -2.88 120.51 120.22 1bgk n ALA 31 Ca 0.09 -0.23 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 1bgk n ALA 31 Cb 0.82 -1.45 -0.15 0.00 0.00 0.00 0.00 19.45 18.67 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 0.37 0.35 -0.07 0.00 2.10 -1.83 0.45 116.57 117.94 1bgk h LYS 32 Ca 0.00 -0.60 -0.17 0.00 -2.00 0.00 0.00 60.65 57.88 1bgk h LYS 32 Cb 0.15 0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 31.69 1bgk h LYS 32 CO 0.00 1.29 -0.70 1.15 -2.00 0.00 0.00 179.45 179.19 1bgk h THR 33 N 0.07 1.40 0.00 0.07 2.02 -1.88 -3.18 112.91 111.40 1bgk h THR 33 Ca -0.37 -2.14 0.00 0.00 0.77 0.00 0.00 66.41 64.67 1bgk h THR 33 Cb 2.06 2.11 0.00 0.00 -1.74 0.00 0.00 68.15 70.58 1bgk h THR 33 CO 0.14 0.64 -1.05 0.00 0.37 0.00 0.00 175.52 175.62 1bgk n GLU 35 N -1.57 -0.81 0.00 0.00 1.02 0.62 -4.88 120.64 115.03 1bgk n GLU 35 Ca 0.02 0.50 0.15 0.00 -0.02 0.00 0.00 57.16 57.80 1bgk n GLU 35 Cb 0.32 -4.56 0.67 0.00 -0.02 0.00 0.00 31.44 27.85 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 -1.46 0.67 -0.71 -4.62 4.77 0.13 -4.96 117.00 110.82 1bgk n LEU 36 Ca -0.12 -0.16 0.13 0.00 -0.03 0.00 0.00 56.01 55.83 1bgk n LEU 36 Cb 0.59 -0.07 0.32 0.00 -2.33 0.00 0.00 43.42 41.93 1bgk n LEU 36 CO 0.14 0.12 0.76 0.00 -1.33 0.00 0.00 177.39 177.07