#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bjb n ALA 2 N 0.00 2.10 -2.16 2.24 0.00 -1.26 -4.95 120.51 116.49 1bjb n ALA 2 Ca 0.00 -0.53 -0.06 0.00 0.00 0.00 0.00 53.44 52.85 1bjb n ALA 2 Cb 0.00 -0.92 -0.01 0.00 0.00 0.00 0.00 19.45 18.52 1bjb n ALA 2 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1bjb n GLU 3 N -2.78 -1.94 0.00 0.00 0.00 -1.26 -4.73 120.64 109.94 1bjb n GLU 3 Ca -0.09 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.09 1bjb n GLU 3 Cb 0.78 -2.90 0.00 0.00 0.00 0.00 0.00 31.44 29.32 1bjb n GLU 3 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.13 179.10 1bjb n PHE 4 N -1.86 0.00 -2.19 -1.84 1.16 -1.26 -4.75 117.46 106.71 1bjb n PHE 4 Ca 0.02 0.00 -0.17 0.00 -1.87 0.00 0.00 57.45 55.43 1bjb n PHE 4 Cb 0.31 -0.03 -0.02 0.00 -1.61 0.00 0.00 39.48 38.13 1bjb n PHE 4 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1bjb n ARG 5 N -0.23 -1.81 -1.17 3.97 1.74 -1.26 -0.65 116.66 117.24 1bjb n ARG 5 Ca 0.00 0.85 -0.10 0.00 -0.77 0.00 0.00 57.85 57.83 1bjb n ARG 5 Cb 0.08 -5.40 -0.04 0.00 -1.02 0.00 0.00 32.46 26.07 1bjb n ARG 5 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1bjb n HIS 6 N -3.31 -0.25 0.00 -1.55 8.25 -1.26 -0.10 115.22 116.99 1bjb n HIS 6 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 1bjb n HIS 6 Cb 0.62 -2.28 0.00 0.00 1.12 0.00 0.00 29.99 29.46 1bjb n HIS 6 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1bjb n ASP 7 N -0.26 0.00 -2.74 0.41 5.75 0.18 -4.80 116.55 115.09 1bjb n ASP 7 Ca -0.10 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.47 1bjb n ASP 7 Cb 0.41 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.51 1bjb n ASP 7 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1bjb n SER 8 N 0.00 -5.99 -2.70 -1.12 3.41 -0.29 -4.84 113.62 102.09 1bjb n SER 8 Ca 0.00 -0.16 -0.06 0.00 -0.26 0.00 0.00 58.87 58.39 1bjb n SER 8 Cb 0.00 -4.90 0.07 0.00 -0.26 0.00 0.00 64.21 59.12 1bjb n SER 8 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1bjb n GLY 9 N -1.29 -0.99 3.60 5.00 0.00 -0.41 -5.05 105.19 106.06 1bjb n GLY 9 Ca -0.17 0.64 -0.29 0.00 0.00 0.00 0.00 46.02 46.20 1bjb n GLY 9 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bjb s TYR 10 N 0.32 1.75 -0.01 1.61 1.13 0.85 -4.74 117.35 118.26 1bjb s TYR 10 Ca 0.27 1.24 0.01 0.00 -1.41 0.00 0.00 57.07 57.19 1bjb s TYR 10 Cb 0.23 -3.18 0.00 0.00 -1.10 0.00 0.00 41.96 37.91 1bjb s TYR 10 CO -0.15 -3.22 -0.05 -1.83 -2.51 0.00 0.00 175.55 167.79 1bjb s GLU 11 N -4.69 0.44 0.40 -3.49 1.03 -1.26 -4.99 118.70 106.14 1bjb s GLU 11 Ca 0.66 -0.16 0.00 0.00 0.03 0.00 0.00 54.97 55.51 1bjb s GLU 11 Cb -0.22 -0.45 0.00 0.00 -0.80 0.00 0.00 34.13 32.66 1bjb s GLU 11 CO 0.61 0.08 0.00 0.28 -1.33 0.00 0.00 175.26 174.89 1bjb n VAL 12 N 3.14 0.00 0.00 1.83 0.31 -1.26 -5.04 118.33 117.31 1bjb n VAL 12 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1bjb n VAL 12 Cb 0.57 -0.14 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 1bjb n VAL 12 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1bjb n HIS 13 N -3.42 0.00 -0.25 3.52 8.25 -1.26 -4.80 115.22 117.26 1bjb n HIS 13 Ca 0.00 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.45 1bjb n HIS 13 Cb 0.00 -0.15 0.10 0.00 1.12 0.00 0.00 29.99 31.06 1bjb n HIS 13 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1bjb h HIS 14 N 0.00 0.79 0.00 4.41 3.86 -1.99 -3.10 115.15 119.13 1bjb h HIS 14 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1bjb h HIS 14 Cb 0.00 -0.25 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1bjb h HIS 14 CO 0.00 0.40 -0.60 1.04 0.86 0.00 0.00 177.93 179.64 1bjb n GLN 15 N -4.72 2.23 -0.19 2.45 3.00 -1.26 -4.59 117.38 114.31 1bjb n GLN 15 Ca 0.09 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1bjb n GLN 15 Cb 0.15 -0.80 0.09 0.00 0.00 0.00 0.00 30.24 29.68 1bjb n GLN 15 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.06 178.55 1bjb h GLU 16 N 0.00 0.12 0.00 -1.09 4.81 -1.91 0.18 114.58 116.69 1bjb h GLU 16 Ca 0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1bjb h GLU 16 Cb 0.60 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.95 1bjb h GLU 16 CO 0.00 0.08 -0.04 1.37 -0.73 0.00 0.00 179.01 179.69 1bjb h LEU 17 N 0.13 0.00 -1.33 1.64 8.10 -1.84 -2.92 115.31 119.08 1bjb h LEU 17 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.29 1bjb h LEU 17 Cb 0.47 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.69 1bjb h LEU 17 CO -0.48 0.04 0.00 0.58 -4.11 0.00 0.00 178.44 174.47 1bjb h VAL 18 N 0.00 0.00 0.00 0.15 2.07 -0.88 0.14 116.25 117.72 1bjb h VAL 18 Ca -0.00 -0.49 -0.07 0.00 0.82 0.00 0.00 66.70 66.96 1bjb h VAL 18 Cb 1.00 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 32.22 1bjb h VAL 18 CO 0.01 0.00 -0.31 -0.26 0.02 0.00 0.00 177.57 177.02 1bjb h PHE 19 N 0.00 0.00 0.04 1.57 0.04 -0.95 0.32 116.94 117.96 1bjb h PHE 19 Ca 0.00 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 1bjb h PHE 19 Cb 0.51 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.66 1bjb h PHE 19 CO 0.00 0.31 -0.51 0.35 -0.60 0.00 0.00 178.31 177.86 1bjb h PHE 20 N 0.00 0.16 0.00 -0.55 3.57 -1.15 -2.26 116.94 116.71 1bjb h PHE 20 Ca -0.00 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 1bjb h PHE 20 Cb 0.86 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.59 1bjb h PHE 20 CO 0.00 1.20 -0.00 0.00 -2.23 0.00 0.00 178.31 177.28 1bjb h ALA 21 N -0.06 1.53 -0.04 2.41 0.00 -0.94 0.15 119.26 122.31 1bjb h ALA 21 Ca -0.12 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.55 1bjb h ALA 21 Cb 1.26 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.06 1bjb h ALA 21 CO 0.01 0.00 -0.94 1.49 0.00 0.00 0.00 179.25 179.81 1bjb h GLU 22 N 0.00 0.63 -0.14 0.00 4.22 -0.34 0.41 114.58 119.36 1bjb h GLU 22 Ca -0.00 -0.62 -0.02 0.00 0.08 0.00 0.00 59.36 58.80 1bjb h GLU 22 Cb 0.01 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1bjb h GLU 22 CO 0.00 1.23 0.02 0.38 -2.18 0.00 0.00 179.01 178.46 1bjb h ASP 23 N 0.38 0.21 0.89 1.04 3.04 -0.16 -1.83 116.42 119.99 1bjb h ASP 23 Ca -0.09 -0.25 0.00 0.00 -3.24 0.00 0.00 57.03 53.44 1bjb h ASP 23 Cb 1.58 -0.06 0.00 0.00 -1.04 0.00 0.00 39.33 39.81 1bjb h ASP 23 CO 0.18 0.41 0.00 0.58 -2.04 0.00 0.00 179.24 178.37 1bjb h VAL 24 N 0.00 0.00 -5.84 4.15 2.07 -1.08 -3.47 116.25 112.09 1bjb h VAL 24 Ca 0.04 -0.39 -0.36 0.00 0.82 0.00 0.00 66.70 66.82 1bjb h VAL 24 Cb 0.29 1.27 0.12 0.00 -1.52 0.00 0.00 31.29 31.45 1bjb h VAL 24 CO 0.00 0.00 -0.83 0.61 0.02 0.00 0.00 177.57 177.38 1bjb n GLY 25 N 0.01 -0.54 2.49 2.17 0.00 0.03 -1.61 105.19 107.75 1bjb n GLY 25 Ca 0.01 0.23 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 1bjb n GLY 25 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1bjb n SER 26 N -3.08 -4.28 -2.05 1.61 2.88 -0.58 -2.00 113.62 106.12 1bjb n SER 26 Ca -0.24 0.12 -0.06 0.00 -1.33 0.00 0.00 58.87 57.37 1bjb n SER 26 Cb 0.66 -3.61 0.03 0.00 -0.75 0.00 0.00 64.21 60.54 1bjb n SER 26 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1bjb n ASN 27 N -1.88 -3.06 0.00 -3.46 3.02 -0.71 -5.18 115.26 103.99 1bjb n ASN 27 Ca -0.16 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 1bjb n ASN 27 Cb 0.62 -2.23 0.00 0.00 -0.61 0.00 0.00 39.78 37.56 1bjb n ASN 27 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93