#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 -3.90 -1.87 -0.11 0.00 1.85 -1.26 -5.04 116.66 106.34 1bgk n ARG 3 Ca 0.14 0.00 -0.06 0.00 -1.00 0.00 0.00 57.85 56.93 1bgk n ARG 3 Cb 0.60 0.00 0.06 0.00 -1.05 0.00 0.00 32.46 32.06 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 0.00 -1.97 0.00 2.89 5.68 -1.26 -4.34 116.55 117.55 1bgk n ASP 4 Ca 0.00 -0.35 0.00 0.00 -0.50 0.00 0.00 54.79 53.94 1bgk n ASP 4 Cb 0.00 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 39.78 1bgk n ASP 4 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1bgk n TRP 5 N -3.34 0.00 -0.04 2.11 7.02 0.70 -4.77 117.44 119.12 1bgk n TRP 5 Ca 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.51 1bgk n TRP 5 Cb 0.12 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.01 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 -0.91 0.00 -2.84 -5.99 3.72 -1.25 -4.96 117.46 105.23 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 0.21 -0.05 0.00 0.00 176.76 176.92 1bgk s LYS 7 N 1.45 4.50 0.53 -1.08 2.36 -1.26 -4.86 119.74 121.38 1bgk s LYS 7 Ca 0.00 1.23 0.18 0.00 -2.55 0.00 0.00 55.97 54.83 1bgk s LYS 7 Cb 0.00 -2.77 1.00 0.00 -1.05 0.00 0.00 37.83 35.02 1bgk s LYS 7 CO 0.00 0.28 1.51 0.93 1.55 0.00 0.00 175.35 179.62 1bgk h GLU 8 N 3.12 0.00 0.03 4.03 5.08 -1.98 0.18 114.58 125.04 1bgk h GLU 8 Ca -0.47 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 57.58 1bgk h GLU 8 Cb 1.19 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 1bgk h GLU 8 CO 0.65 0.00 -1.78 0.25 -1.00 0.00 0.00 179.01 177.13 1bgk n THR 9 N -2.48 1.65 -0.35 1.13 -2.24 -1.26 -2.94 114.28 107.79 1bgk n THR 9 Ca -0.01 -0.77 0.15 0.00 -2.27 0.00 0.00 64.05 61.15 1bgk n THR 9 Cb 0.46 -1.18 0.36 0.00 -2.10 0.00 0.00 70.33 67.87 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 0.80 1.75 0.73 6.98 0.00 -0.99 -0.43 119.26 128.10 1bgk h ALA 10 Ca -0.32 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1bgk h ALA 10 Cb 2.02 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.78 1bgk h ALA 10 CO 0.08 -0.17 -0.35 0.00 0.00 0.00 0.00 179.25 178.82 1bgk h ARG 12 N -1.21 0.00 0.43 0.00 2.43 -1.02 0.54 114.38 115.55 1bgk h ARG 12 Ca -0.10 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.05 1bgk h ARG 12 Cb 0.75 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1bgk h ARG 12 CO 0.16 0.00 -0.21 1.25 -1.51 0.00 0.00 179.97 179.67 1bgk h HIS 13 N 0.00 -0.54 0.00 2.20 2.76 -0.90 -1.90 115.15 116.77 1bgk h HIS 13 Ca 0.35 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.51 1bgk h HIS 13 Cb 1.90 0.18 -0.00 0.00 1.55 0.00 0.00 27.41 31.03 1bgk h HIS 13 CO 0.00 -0.21 -0.00 0.00 -1.30 0.00 0.00 177.93 176.42 1bgk h ALA 14 N -0.59 1.02 0.07 5.26 0.00 0.12 0.19 119.26 125.33 1bgk h ALA 14 Ca -0.06 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1bgk h ALA 14 Cb 0.57 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1bgk h ALA 14 CO 0.10 0.00 -0.53 -0.22 0.00 0.00 0.00 179.25 178.60 1bgk h LYS 15 N 0.00 0.24 -0.55 0.00 3.64 -0.63 1.21 116.57 120.48 1bgk h LYS 15 Ca -0.00 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1bgk h LYS 15 Cb 0.04 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1bgk h LYS 15 CO 0.00 1.12 0.00 0.45 -2.27 0.00 0.00 179.45 178.75 1bgk n SER 16 N -4.30 3.00 -0.05 4.20 2.88 -0.75 -4.41 113.62 114.20 1bgk n SER 16 Ca -0.12 -2.08 -0.06 0.00 -1.33 0.00 0.00 58.87 55.28 1bgk n SER 16 Cb 0.68 -0.39 -0.05 0.00 -0.75 0.00 0.00 64.21 63.70 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 0.96 2.03 0.00 2.46 -0.00 0.61 -5.03 117.00 118.03 1bgk n LEU 17 Ca 0.18 -0.04 0.00 0.00 -0.00 0.00 0.00 56.01 56.15 1bgk n LEU 17 Cb 0.50 -0.17 0.00 0.00 -0.00 0.00 0.00 43.42 43.75 1bgk n LEU 17 CO 0.13 0.51 0.00 0.61 -0.00 0.00 0.00 177.39 178.65 1bgk n GLY 18 N 2.87 1.08 0.00 1.47 0.00 -1.22 -4.96 105.19 104.43 1bgk n GLY 18 Ca -0.16 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.27 1.61 3.02 -1.21 -3.87 115.26 114.55 1bgk n ASN 19 Ca 0.00 -0.30 0.05 0.00 -0.03 0.00 0.00 54.58 54.30 1bgk n ASN 19 Cb 0.00 -0.22 0.11 0.00 -0.61 0.00 0.00 39.78 39.06 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 -5.22 0.60 0.00 0.00 1.74 -1.26 -3.38 116.66 109.14 1bgk n ARG 21 Ca 0.12 -0.71 0.10 0.00 -0.77 0.00 0.00 57.85 56.59 1bgk n ARG 21 Cb 0.39 -0.82 -0.07 0.00 -1.02 0.00 0.00 32.46 30.95 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 -0.15 0.00 -4.50 0.55 -2.24 -0.72 -4.89 114.28 102.32 1bgk n THR 22 Ca 0.00 -0.03 -0.30 0.00 -2.27 0.00 0.00 64.05 61.46 1bgk n THR 22 Cb 0.21 0.95 -0.13 0.00 -2.10 0.00 0.00 70.33 69.26 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 -2.95 3.62 -0.01 3.42 0.15 -0.72 -4.97 113.70 112.25 1bgk s SER 23 Ca 0.09 -0.58 -0.03 0.00 0.70 0.00 0.00 55.95 56.14 1bgk s SER 23 Cb 0.16 -0.44 -0.02 0.00 -1.71 0.00 0.00 66.02 64.01 1bgk s SER 23 CO 0.82 0.21 0.40 1.56 1.20 0.00 0.00 173.24 177.44 1bgk h GLN 24 N 4.12 -0.11 -0.34 5.44 1.08 -1.90 -2.28 115.11 121.11 1bgk h GLN 24 Ca -0.49 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 56.76 1bgk h GLN 24 Cb 1.16 0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.57 1bgk h GLN 24 CO 0.44 -0.07 0.08 -0.22 -0.95 0.00 0.00 178.83 178.11 1bgk h LYS 25 N -0.26 0.19 -0.31 1.46 3.64 -1.96 -1.00 116.57 118.33 1bgk h LYS 25 Ca -0.01 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.45 1bgk h LYS 25 Cb 0.09 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1bgk h LYS 25 CO 0.02 0.13 0.49 1.88 -2.27 0.00 0.00 179.45 179.70 1bgk h TYR 26 N 0.20 0.00 0.00 1.91 -1.99 -1.87 1.94 116.97 117.16 1bgk h TYR 26 Ca 0.16 0.00 -0.23 0.00 2.00 0.00 0.00 58.73 60.66 1bgk h TYR 26 Cb 0.17 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 38.87 1bgk h TYR 26 CO -0.18 0.00 -1.74 2.89 -0.00 0.00 0.00 178.16 179.13 1bgk n ARG 27 N -3.36 0.55 -0.05 4.88 1.85 -0.49 -3.85 116.66 116.18 1bgk n ARG 27 Ca 0.05 0.23 -0.05 0.00 -1.00 0.00 0.00 57.85 57.08 1bgk n ARG 27 Cb 0.63 -1.44 -0.05 0.00 -1.05 0.00 0.00 32.46 30.55 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 -0.98 -0.02 0.00 2.89 0.00 -1.07 0.12 119.26 120.20 1bgk h ALA 28 Ca -0.34 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1bgk h ALA 28 Cb 1.29 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1bgk h ALA 28 CO -0.21 -0.02 0.00 0.09 0.00 0.00 0.00 179.25 179.11 1bgk n ASN 29 N -4.74 0.12 -2.61 0.00 5.03 0.63 -1.15 115.26 112.54 1bgk n ASN 29 Ca -0.04 0.55 -0.03 0.00 0.87 0.00 0.00 54.58 55.93 1bgk n ASN 29 Cb 0.18 -0.57 0.05 0.00 -1.02 0.00 0.00 39.78 38.42 1bgk n ASN 29 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1bgk n ALA 31 N -0.56 2.07 0.09 0.00 0.00 0.41 -2.27 120.51 120.25 1bgk n ALA 31 Ca 0.13 -0.09 0.05 0.00 0.00 0.00 0.00 53.44 53.52 1bgk n ALA 31 Cb 0.84 -1.35 -0.01 0.00 0.00 0.00 0.00 19.45 18.94 1bgk n ALA 31 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1bgk h LYS 32 N 0.00 0.00 0.00 0.00 3.11 -1.82 0.48 116.57 118.34 1bgk h LYS 32 Ca 0.00 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.75 1bgk h LYS 32 Cb 0.25 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.47 1bgk h LYS 32 CO 0.00 0.22 -0.99 0.00 -2.81 0.00 0.00 179.45 175.88 1bgk h THR 33 N 0.00 0.38 -0.00 1.00 1.03 -1.78 -3.35 112.91 110.19 1bgk h THR 33 Ca -0.07 -1.66 0.00 0.00 -0.01 0.00 0.00 66.41 64.67 1bgk h THR 33 Cb 1.32 1.95 0.00 0.00 -1.07 0.00 0.00 68.15 70.35 1bgk h THR 33 CO 0.03 0.22 -0.00 0.00 -0.01 0.00 0.00 175.52 175.76 1bgk n GLU 35 N -0.02 -1.31 0.00 0.00 1.02 0.14 -4.86 120.64 115.61 1bgk n GLU 35 Ca 0.00 0.61 0.15 0.00 -0.02 0.00 0.00 57.16 57.90 1bgk n GLU 35 Cb 0.00 -4.81 0.71 0.00 -0.02 0.00 0.00 31.44 27.32 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 -1.94 0.69 0.00 -4.62 4.77 0.56 -4.98 117.00 111.47 1bgk n LEU 36 Ca -0.14 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 1bgk n LEU 36 Cb 0.61 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1bgk n LEU 36 CO 0.19 0.12 0.18 0.00 -1.33 0.00 0.00 177.39 176.54