#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 -0.13 -1.42 -1.67 0.00 -1.26 -4.92 120.51 111.11 1bjb n ALA 2 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1bjb n ALA 2 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -1.50 0.00 -0.10 0.00 0.28 -1.26 -5.00 120.64 113.07 1bjb n GLU 3 Ca 0.00 -0.05 -0.17 0.00 -0.16 0.00 0.00 57.16 56.78 1bjb n GLU 3 Cb 0.00 0.07 -0.08 0.00 1.43 0.00 0.00 31.44 32.85 1bjb n GLU 3 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1bjb n PHE 4 N 0.00 0.00 1.02 -1.84 -1.74 -1.26 -4.40 117.46 109.23 1bjb n PHE 4 Ca -0.01 0.00 0.06 0.00 -0.56 0.00 0.00 57.45 56.93 1bjb n PHE 4 Cb 0.22 -0.75 0.34 0.00 1.52 0.00 0.00 39.48 40.81 1bjb n PHE 4 CO 0.00 0.00 0.00 -2.13 -0.56 0.00 0.00 176.76 174.07 1bjb n ARG 5 N -3.45 0.51 -0.01 3.97 0.63 -1.26 0.20 116.66 117.25 1bjb n ARG 5 Ca -0.38 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.39 1bjb n ARG 5 Cb 0.84 -1.35 -0.11 0.00 0.45 0.00 0.00 32.46 32.28 1bjb n ARG 5 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1bjb h HIS 6 N 0.00 0.41 0.00 -0.14 3.86 -1.96 -3.45 115.15 113.88 1bjb h HIS 6 Ca 0.00 -0.23 -0.01 0.00 -1.16 0.00 0.00 60.37 58.97 1bjb h HIS 6 Cb 0.00 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.41 1bjb h HIS 6 CO 0.00 1.05 -0.03 -0.40 0.86 0.00 0.00 177.93 179.41 1bjb n ASP 7 N -4.37 -0.11 -2.64 2.45 5.68 -1.08 -5.00 116.55 111.49 1bjb n ASP 7 Ca -0.10 -0.29 -0.05 0.00 -0.50 0.00 0.00 54.79 53.85 1bjb n ASP 7 Cb 0.59 0.03 0.11 0.00 -1.14 0.00 0.00 41.12 40.72 1bjb n ASP 7 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1bjb n SER 8 N 0.00 -1.63 0.00 -1.12 2.88 0.15 -4.94 113.62 108.96 1bjb n SER 8 Ca -0.03 -2.27 0.00 0.00 -1.33 0.00 0.00 58.87 55.24 1bjb n SER 8 Cb 0.23 0.85 0.00 0.00 -0.75 0.00 0.00 64.21 64.54 1bjb n SER 8 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bjb n GLY 9 N -0.96 0.04 0.00 0.46 0.00 0.13 -4.64 105.19 100.23 1bjb n GLY 9 Ca -0.10 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1bjb n GLY 9 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1bjb n TYR 10 N -1.66 -0.44 -2.01 1.61 4.11 -1.26 -4.93 117.16 112.59 1bjb n TYR 10 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.90 57.89 1bjb n TYR 10 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 39.33 1bjb n TYR 10 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.86 176.01 1bjb n GLU 11 N 0.00 0.00 0.00 -3.48 0.00 -1.26 -4.85 120.64 111.05 1bjb n GLU 11 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 57.16 56.95 1bjb n GLU 11 Cb 0.00 0.02 0.00 0.00 0.00 0.00 0.00 31.44 31.46 1bjb n GLU 11 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1bjb n VAL 12 N 0.01 0.00 -2.65 3.84 0.31 -1.26 -3.83 118.33 114.75 1bjb n VAL 12 Ca -0.03 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.24 1bjb n VAL 12 Cb 0.54 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.49 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 0.00 -0.65 0.00 3.52 -0.00 -1.26 -4.91 115.22 111.92 1bjb n HIS 13 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 57.72 57.93 1bjb n HIS 13 Cb 0.00 -1.99 0.00 0.00 -0.00 0.00 0.00 29.99 28.00 1bjb n HIS 13 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1bjb n HIS 14 N -3.31 0.00 -0.18 4.41 8.25 -1.25 -4.86 115.22 118.28 1bjb n HIS 14 Ca -0.01 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.44 1bjb n HIS 14 Cb 0.52 0.02 0.08 0.00 1.12 0.00 0.00 29.99 31.73 1bjb n HIS 14 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1bjb h GLN 15 N 0.00 0.18 -1.02 -0.41 7.50 -1.91 0.12 115.11 119.57 1bjb h GLN 15 Ca 0.00 -0.01 0.26 0.00 0.50 0.00 0.00 58.65 59.40 1bjb h GLN 15 Cb 0.00 -0.04 -0.08 0.00 0.05 0.00 0.00 27.48 27.41 1bjb h GLN 15 CO 0.00 0.12 0.68 1.49 -1.50 0.00 0.00 178.83 179.62 1bjb h GLU 16 N 0.18 0.30 0.00 1.46 4.81 -1.92 0.28 114.58 119.69 1bjb h GLU 16 Ca 0.28 -0.02 -0.18 0.00 -0.13 0.00 0.00 59.36 59.31 1bjb h GLU 16 Cb 0.42 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 1bjb h GLU 16 CO -0.41 0.20 -0.94 -0.07 -0.73 0.00 0.00 179.01 177.06 1bjb h LEU 17 N 0.31 0.00 -1.65 1.64 3.38 -1.28 -3.13 115.31 114.59 1bjb h LEU 17 Ca 0.55 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.48 1bjb h LEU 17 Cb 1.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 1bjb h LEU 17 CO -0.21 0.83 -0.20 0.58 0.09 0.00 0.00 178.44 179.54 1bjb h VAL 18 N 0.00 0.83 0.00 1.22 2.07 0.27 0.19 116.25 120.83 1bjb h VAL 18 Ca -0.04 -0.76 -0.08 0.00 0.82 0.00 0.00 66.70 66.63 1bjb h VAL 18 Cb 1.67 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.88 1bjb h VAL 18 CO 0.10 0.19 -0.40 -0.26 0.02 0.00 0.00 177.57 177.23 1bjb h PHE 19 N 0.00 0.00 0.04 1.57 0.04 -1.33 0.31 116.94 117.57 1bjb h PHE 19 Ca -0.00 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 1bjb h PHE 19 Cb 0.44 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.59 1bjb h PHE 19 CO 0.00 0.40 -0.28 0.35 -0.60 0.00 0.00 178.31 178.18 1bjb h PHE 20 N 0.00 0.20 0.00 -0.55 3.04 -0.82 -3.08 116.94 115.73 1bjb h PHE 20 Ca -0.00 -0.14 -0.02 0.00 3.98 0.00 0.00 57.97 61.79 1bjb h PHE 20 Cb 0.87 -0.01 -0.00 0.00 2.56 0.00 0.00 35.95 39.37 1bjb h PHE 20 CO 0.00 1.07 -0.10 0.00 -2.02 0.00 0.00 178.31 177.26 1bjb h ALA 21 N 0.08 1.53 0.00 2.41 0.00 -0.57 0.84 119.26 123.55 1bjb h ALA 21 Ca -0.05 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1bjb h ALA 21 Cb 1.17 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1bjb h ALA 21 CO 0.05 0.12 -0.17 0.93 0.00 0.00 0.00 179.25 180.19 1bjb h GLU 22 N 0.00 0.00 0.01 0.00 5.08 -0.34 0.26 114.58 119.59 1bjb h GLU 22 Ca -0.00 0.00 -0.41 0.00 -1.00 0.00 0.00 59.36 57.95 1bjb h GLU 22 Cb 0.22 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 1bjb h GLU 22 CO 0.01 0.17 -2.45 -0.25 -1.00 0.00 0.00 179.01 175.49 1bjb n ASP 23 N -3.28 1.98 -0.07 1.42 9.92 -0.26 -4.70 116.55 121.54 1bjb n ASP 23 Ca 0.01 0.07 -0.06 0.00 -0.53 0.00 0.00 54.79 54.28 1bjb n ASP 23 Cb 0.43 -0.60 -0.14 0.00 -0.64 0.00 0.00 41.12 40.17 1bjb n ASP 23 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1bjb n VAL 24 N -3.67 1.01 -4.01 2.53 0.31 0.13 -5.04 118.33 109.58 1bjb n VAL 24 Ca -0.48 -0.69 -0.43 0.00 -0.01 0.00 0.00 64.34 62.72 1bjb n VAL 24 Cb 0.95 -0.44 0.02 0.00 -0.91 0.00 0.00 33.84 33.46 1bjb n VAL 24 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bjb n GLY 25 N 1.84 -0.91 0.00 2.92 0.00 0.93 -4.83 105.19 105.14 1bjb n GLY 25 Ca -0.25 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1bjb n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bjb n SER 26 N -2.24 0.00 -0.06 1.61 3.41 -1.26 -4.92 113.62 110.15 1bjb n SER 26 Ca -0.13 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.63 1bjb n SER 26 Cb 0.58 0.00 0.81 0.00 -0.26 0.00 0.00 64.21 65.34 1bjb n SER 26 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1bjb n ASN 27 N -0.59 0.22 0.00 4.04 6.94 -1.26 -5.11 115.26 119.50 1bjb n ASN 27 Ca 0.00 -0.80 0.00 0.00 -0.02 0.00 0.00 54.58 53.76 1bjb n ASN 27 Cb 0.00 -0.07 0.00 0.00 -2.36 0.00 0.00 39.78 37.35 1bjb n ASN 27 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52