#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 -1.65 -2.22 -0.02 0.00 1.85 -1.26 -5.05 116.66 108.31 1bgk n ARG 3 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 1bgk n ARG 3 Cb 0.60 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.01 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 3.00 0.00 0.00 2.89 5.68 -1.26 -4.07 116.55 122.79 1bgk n ASP 4 Ca 0.00 -0.71 0.00 0.00 -0.50 0.00 0.00 54.79 53.58 1bgk n ASP 4 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 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 -1.40 0.00 -0.10 2.11 7.02 0.44 -4.81 117.44 120.70 1bgk n TRP 5 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1bgk n TRP 5 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 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 -0.29 0.00 0.70 -5.99 3.72 -1.26 -4.81 117.46 109.53 1bgk n PHE 6 Ca 0.00 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.38 1bgk n PHE 6 Cb 0.00 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.57 1bgk n PHE 6 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1bgk n LYS 7 N 0.00 1.26 0.00 -1.08 3.00 -1.26 -4.83 118.16 115.25 1bgk n LYS 7 Ca 0.00 -0.43 0.00 0.00 -0.00 0.00 0.00 58.31 57.88 1bgk n LYS 7 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 35.03 33.76 1bgk n LYS 7 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 1bgk n GLU 8 N 0.23 0.00 0.04 1.64 0.28 -1.26 -4.54 120.64 117.02 1bgk n GLU 8 Ca 0.07 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.95 1bgk n GLU 8 Cb 0.60 -0.22 -0.14 0.00 1.43 0.00 0.00 31.44 33.11 1bgk n GLU 8 CO 0.00 0.00 0.00 1.79 -0.16 0.00 0.00 177.13 178.76 1bgk h THR 9 N 0.00 1.17 -1.02 3.84 1.35 -1.99 -3.09 112.91 113.16 1bgk h THR 9 Ca 0.00 -2.89 0.25 0.00 -0.55 0.00 0.00 66.41 63.23 1bgk h THR 9 Cb 0.00 2.67 -0.09 0.00 -1.73 0.00 0.00 68.15 69.00 1bgk h THR 9 CO 0.00 0.76 0.65 0.00 -0.25 0.00 0.00 175.52 176.69 1bgk h ALA 10 N 0.72 2.15 0.63 6.62 0.00 -1.92 0.00 119.26 127.46 1bgk h ALA 10 Ca -0.21 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1bgk h ALA 10 Cb 1.96 0.01 0.01 0.00 0.00 0.00 0.00 17.79 19.77 1bgk h ALA 10 CO 0.13 -0.54 -0.30 0.00 0.00 0.00 0.00 179.25 178.53 1bgk h ARG 12 N -1.20 0.00 -0.02 0.00 2.43 -1.02 0.70 114.38 115.28 1bgk h ARG 12 Ca -0.09 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.08 1bgk h ARG 12 Cb 0.65 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.20 1bgk h ARG 12 CO 0.14 0.00 -0.01 1.25 -1.51 0.00 0.00 179.97 179.84 1bgk h HIS 13 N 0.00 0.04 0.00 2.20 2.76 -0.84 -1.93 115.15 117.39 1bgk h HIS 13 Ca 0.00 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.15 1bgk h HIS 13 Cb 0.70 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.64 1bgk h HIS 13 CO 0.00 0.47 -0.06 0.00 -1.30 0.00 0.00 177.93 177.04 1bgk h ALA 14 N 0.56 1.01 0.01 5.26 0.00 0.48 -1.34 119.26 125.24 1bgk h ALA 14 Ca 0.00 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 1bgk h ALA 14 Cb 0.46 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.26 1bgk h ALA 14 CO 0.00 0.08 -0.76 -0.22 0.00 0.00 0.00 179.25 178.36 1bgk h LYS 15 N 0.00 0.49 -0.52 0.00 1.63 -0.76 0.67 116.57 118.08 1bgk h LYS 15 Ca -0.00 -0.54 0.00 0.00 -0.85 0.00 0.00 60.65 59.26 1bgk h LYS 15 Cb 0.59 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 1bgk h LYS 15 CO 0.01 1.18 0.00 0.43 -3.45 0.00 0.00 179.45 177.62 1bgk n SER 16 N -4.10 2.82 -0.05 4.20 7.64 -0.75 -4.42 113.62 118.96 1bgk n SER 16 Ca -0.11 -1.99 -0.06 0.00 1.01 0.00 0.00 58.87 57.72 1bgk n SER 16 Cb 0.75 -0.34 -0.05 0.00 -1.01 0.00 0.00 64.21 63.56 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 1.04 2.23 0.00 -3.43 -0.00 -0.51 -5.03 117.00 111.29 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 0.45 -0.21 0.00 0.00 -0.00 0.00 0.00 43.42 43.66 1bgk n LEU 17 CO 0.12 0.54 0.00 0.61 -0.00 0.00 0.00 177.39 178.66 1bgk n GLY 18 N 2.91 0.92 0.00 1.47 0.00 -1.20 -4.96 105.19 104.31 1bgk n GLY 18 Ca -0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.23 1.61 3.02 -1.19 -3.97 115.26 114.50 1bgk n ASN 19 Ca 0.00 0.12 0.11 0.00 -0.03 0.00 0.00 54.58 54.78 1bgk n ASN 19 Cb 0.00 -0.37 0.21 0.00 -0.61 0.00 0.00 39.78 39.01 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 -4.86 -0.13 -0.00 0.00 1.74 -1.26 -3.48 116.66 108.67 1bgk n ARG 21 Ca 0.16 -0.43 0.09 0.00 -0.77 0.00 0.00 57.85 56.91 1bgk n ARG 21 Cb 0.53 -0.78 -0.11 0.00 -1.02 0.00 0.00 32.46 31.08 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 -0.05 0.00 -3.74 0.55 -2.24 -0.62 -4.93 114.28 103.25 1bgk n THR 22 Ca 0.00 -0.04 -0.22 0.00 -2.27 0.00 0.00 64.05 61.52 1bgk n THR 22 Cb 0.16 0.98 -0.04 0.00 -2.10 0.00 0.00 70.33 69.33 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 -2.88 4.90 -0.22 3.42 0.15 -0.71 -4.99 113.70 113.37 1bgk s SER 23 Ca 0.07 -0.81 -0.16 0.00 0.70 0.00 0.00 55.95 55.75 1bgk s SER 23 Cb 0.15 -0.58 -0.12 0.00 -1.71 0.00 0.00 66.02 63.76 1bgk s SER 23 CO 0.81 -0.59 -0.14 0.00 1.20 0.00 0.00 173.24 174.52 1bgk n GLN 24 N -1.45 0.55 -0.13 5.44 1.13 -1.26 -3.58 117.38 118.08 1bgk n GLN 24 Ca 0.02 0.40 -0.12 0.00 -1.94 0.00 0.00 57.00 55.37 1bgk n GLN 24 Cb 0.62 -1.60 -0.02 0.00 0.11 0.00 0.00 30.24 29.35 1bgk n GLN 24 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1bgk h LYS 25 N -1.00 0.79 -0.00 -1.09 3.64 -1.96 -1.60 116.57 115.35 1bgk h LYS 25 Ca -0.36 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 58.69 1bgk h LYS 25 Cb 1.23 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1bgk h LYS 25 CO -0.22 0.95 0.22 1.88 -2.27 0.00 0.00 179.45 180.02 1bgk h TYR 26 N 0.60 0.00 0.00 1.91 -1.99 -1.87 2.30 116.97 117.91 1bgk h TYR 26 Ca 0.09 0.00 -0.27 0.00 2.00 0.00 0.00 58.73 60.55 1bgk h TYR 26 Cb 0.70 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.38 1bgk h TYR 26 CO 0.05 0.00 -1.93 2.89 -0.00 0.00 0.00 178.16 179.18 1bgk n ARG 27 N -2.96 0.37 -0.07 4.88 1.85 -1.06 -4.07 116.66 115.59 1bgk n ARG 27 Ca -0.02 0.14 -0.06 0.00 -1.00 0.00 0.00 57.85 56.91 1bgk n ARG 27 Cb 0.28 -1.17 -0.03 0.00 -1.05 0.00 0.00 32.46 30.49 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 -0.41 0.03 0.00 2.89 0.00 -1.13 -1.13 119.26 119.51 1bgk h ALA 28 Ca -0.40 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.07 1bgk h ALA 28 Cb 1.43 0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.57 1bgk h ALA 28 CO -0.20 0.35 0.00 0.09 0.00 0.00 0.00 179.25 179.49 1bgk n ASN 29 N -4.64 0.21 -2.27 0.00 3.02 0.71 -1.09 115.26 111.19 1bgk n ASN 29 Ca -0.08 0.58 -0.07 0.00 -0.03 0.00 0.00 54.58 54.98 1bgk n ASN 29 Cb 0.24 -0.61 0.05 0.00 -0.61 0.00 0.00 39.78 38.85 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 -0.56 2.06 0.07 0.00 0.00 -0.25 -2.14 120.51 119.68 1bgk n ALA 31 Ca 0.20 -0.09 0.01 0.00 0.00 0.00 0.00 53.44 53.57 1bgk n ALA 31 Cb 0.89 -1.36 -0.05 0.00 0.00 0.00 0.00 19.45 18.93 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 0.61 116.57 118.47 1bgk h LYS 32 Ca 0.00 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.78 1bgk h LYS 32 Cb 0.30 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.52 1bgk h LYS 32 CO 0.00 0.35 -0.72 0.00 -2.81 0.00 0.00 179.45 176.27 1bgk h THR 33 N 0.00 0.29 0.00 1.00 1.03 -1.76 -3.34 112.91 110.13 1bgk h THR 33 Ca -0.11 -1.48 0.00 0.00 -0.01 0.00 0.00 66.41 64.81 1bgk h THR 33 Cb 1.51 1.94 0.00 0.00 -1.07 0.00 0.00 68.15 70.53 1bgk h THR 33 CO 0.05 0.17 0.00 0.00 -0.01 0.00 0.00 175.52 175.73 1bgk n GLU 35 N -0.09 -1.27 0.00 0.00 1.02 0.18 -4.87 120.64 115.61 1bgk n GLU 35 Ca 0.00 0.56 0.14 0.00 -0.02 0.00 0.00 57.16 57.85 1bgk n GLU 35 Cb 0.02 -4.70 0.62 0.00 -0.02 0.00 0.00 31.44 27.35 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 -1.82 0.53 0.00 -4.62 4.77 0.45 -4.98 117.00 111.33 1bgk n LEU 36 Ca -0.13 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1bgk n LEU 36 Cb 0.60 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.53 1bgk n LEU 36 CO 0.18 0.10 0.22 0.00 -1.33 0.00 0.00 177.39 176.56