#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kx6 n SER 2 N 0.00 0.00 -4.92 0.26 2.88 -1.26 -4.83 113.62 105.75 1kx6 n SER 2 Ca 0.00 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.24 1kx6 n SER 2 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 1kx6 n SER 2 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1kx6 s GLN 3 N 0.00 3.46 -1.32 -1.46 -0.21 -1.26 -5.00 119.66 113.88 1kx6 s GLN 3 Ca 0.00 -0.41 -0.17 0.00 0.02 0.00 0.00 55.36 54.80 1kx6 s GLN 3 Cb 0.00 -3.00 0.03 0.00 1.00 0.00 0.00 33.01 31.04 1kx6 s GLN 3 CO 0.00 0.57 1.98 0.41 -2.12 0.00 0.00 175.29 176.13 1kx6 n GLY 4 N 0.13 3.25 3.05 3.09 0.00 -1.26 -4.96 105.19 108.49 1kx6 n GLY 4 Ca -0.05 -1.45 -0.36 0.00 0.00 0.00 0.00 46.02 44.17 1kx6 n GLY 4 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1kx6 n THR 5 N 5.92 0.01 -0.30 2.61 -2.24 -1.26 -4.75 114.28 114.27 1kx6 n THR 5 Ca 0.50 -0.47 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 1kx6 n THR 5 Cb 0.43 -0.07 0.29 0.00 -2.10 0.00 0.00 70.33 68.87 1kx6 n THR 5 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 1kx6 h PHE 6 N -1.05 0.39 -2.50 4.78 -5.15 -2.00 -3.42 116.94 107.99 1kx6 h PHE 6 Ca -0.44 0.05 -0.57 0.00 -0.20 0.00 0.00 57.97 56.81 1kx6 h PHE 6 Cb 1.30 -0.03 0.20 0.00 0.22 0.00 0.00 35.95 37.64 1kx6 h PHE 6 CO 0.23 -0.18 -1.04 -2.37 -2.00 0.00 0.00 178.31 172.95 1kx6 n THR 7 N -5.20 0.65 -4.01 0.88 5.66 -1.26 -0.65 114.28 110.35 1kx6 n THR 7 Ca 0.21 -0.45 -0.43 0.00 -3.05 0.00 0.00 64.05 60.33 1kx6 n THR 7 Cb 0.67 -0.29 0.02 0.00 -1.55 0.00 0.00 70.33 69.18 1kx6 n THR 7 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1kx6 n SER 8 N 1.58 -4.33 0.00 1.09 3.41 -1.26 -4.47 113.62 109.65 1kx6 n SER 8 Ca 0.06 -1.24 0.00 0.00 -0.26 0.00 0.00 58.87 57.44 1kx6 n SER 8 Cb 0.51 -1.76 0.00 0.00 -0.26 0.00 0.00 64.21 62.70 1kx6 n SER 8 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1kx6 n ASP 9 N -2.24 0.00 -3.19 4.04 2.03 -1.07 -5.02 116.55 111.10 1kx6 n ASP 9 Ca -0.14 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.06 1kx6 n ASP 9 Cb 0.58 0.00 0.11 0.00 -0.72 0.00 0.00 41.12 41.09 1kx6 n ASP 9 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1kx6 n TYR 10 N 0.00 -2.30 -1.41 -0.67 4.11 0.18 -4.50 117.16 112.57 1kx6 n TYR 10 Ca 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 57.90 57.69 1kx6 n TYR 10 Cb 0.00 -0.66 0.00 0.00 -0.00 0.00 0.00 39.34 38.68 1kx6 n TYR 10 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.86 177.29 1kx6 n SER 11 N -2.82 -1.88 -0.14 9.48 7.64 -1.26 -4.52 113.62 120.11 1kx6 n SER 11 Ca 0.05 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.91 1kx6 n SER 11 Cb 0.22 -0.94 -0.01 0.00 -1.01 0.00 0.00 64.21 62.47 1kx6 n SER 11 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1kx6 n LYS 12 N -0.10 -0.26 -2.72 1.43 4.76 -1.26 -4.85 118.16 115.16 1kx6 n LYS 12 Ca 0.00 0.39 -0.02 0.00 -2.87 0.00 0.00 58.31 55.81 1kx6 n LYS 12 Cb 0.00 -3.86 0.10 0.00 -1.84 0.00 0.00 35.03 29.43 1kx6 n LYS 12 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1kx6 n TYR 13 N -2.88 -1.01 -3.50 2.13 9.36 -1.26 -5.03 117.16 114.96 1kx6 n TYR 13 Ca -0.02 -1.89 -0.40 0.00 3.32 0.00 0.00 57.90 58.91 1kx6 n TYR 13 Cb 0.09 0.98 -0.04 0.00 -0.63 0.00 0.00 39.34 39.74 1kx6 n TYR 13 CO 0.00 0.00 0.00 -0.51 0.22 0.00 0.00 176.86 176.57 1kx6 s LEU 14 N -3.94 5.92 0.26 2.98 1.43 -1.26 -4.56 118.68 119.50 1kx6 s LEU 14 Ca 0.16 -3.64 -0.31 0.00 -1.03 0.00 0.00 54.13 49.31 1kx6 s LEU 14 Cb 0.41 -2.04 -0.12 0.00 0.03 0.00 0.00 46.19 44.46 1kx6 s LEU 14 CO -0.09 -0.24 1.55 -0.67 0.23 0.00 0.00 176.35 177.13 1kx6 n ASP 15 N 2.54 3.46 -3.14 2.29 2.03 -1.26 -4.94 116.55 117.53 1kx6 n ASP 15 Ca 0.22 1.13 -0.22 0.00 0.52 0.00 0.00 54.79 56.44 1kx6 n ASP 15 Cb 0.38 -1.53 -0.05 0.00 -0.72 0.00 0.00 41.12 39.20 1kx6 n ASP 15 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1kx6 n SER 16 N 2.46 -0.29 -3.82 1.67 2.88 -1.26 -4.92 113.62 110.34 1kx6 n SER 16 Ca 0.11 -2.76 -0.28 0.00 -1.33 0.00 0.00 58.87 54.61 1kx6 n SER 16 Cb 0.34 -0.29 -0.05 0.00 -0.75 0.00 0.00 64.21 63.46 1kx6 n SER 16 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1kx6 n ARG 17 N 1.50 -1.71 -0.13 -1.46 0.63 -1.26 -4.77 116.66 109.45 1kx6 n ARG 17 Ca 0.20 0.13 -0.09 0.00 -0.92 0.00 0.00 57.85 57.17 1kx6 n ARG 17 Cb 0.54 -4.71 -0.03 0.00 0.45 0.00 0.00 32.46 28.71 1kx6 n ARG 17 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1kx6 h ARG 18 N -0.64 -0.28 0.00 -0.14 1.12 -1.95 -3.39 114.38 109.10 1kx6 h ARG 18 Ca -0.40 0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.49 1kx6 h ARG 18 Cb 1.26 0.06 0.00 0.00 -0.01 0.00 0.00 29.97 31.29 1kx6 h ARG 18 CO 0.59 -0.19 0.00 0.00 -3.11 0.00 0.00 179.97 177.27 1kx6 n ALA 19 N -3.06 0.00 -1.00 2.80 0.00 -1.26 -4.72 120.51 113.27 1kx6 n ALA 19 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1kx6 n ALA 19 Cb 0.35 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.80 1kx6 n ALA 19 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1kx6 n GLN 20 N 0.00 -0.08 0.00 0.00 0.00 -1.26 -4.75 117.38 111.30 1kx6 n GLN 20 Ca 0.00 0.06 0.00 0.00 -0.00 0.00 0.00 57.00 57.06 1kx6 n GLN 20 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 30.24 27.07 1kx6 n GLN 20 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1kx6 n ASP 21 N 0.13 0.48 -0.00 1.69 9.92 -1.26 -4.68 116.55 122.84 1kx6 n ASP 21 Ca -0.00 0.00 0.08 0.00 -0.53 0.00 0.00 54.79 54.34 1kx6 n ASP 21 Cb 0.02 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.40 1kx6 n ASP 21 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 1kx6 n PHE 22 N -2.12 0.00 0.23 1.24 3.72 -1.26 -4.27 117.46 114.99 1kx6 n PHE 22 Ca 0.00 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.51 1kx6 n PHE 22 Cb 0.11 -0.09 -0.10 0.00 -0.94 0.00 0.00 39.48 38.46 1kx6 n PHE 22 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1kx6 n VAL 23 N -1.55 0.14 1.49 -4.37 0.31 -1.26 -3.97 118.33 109.12 1kx6 n VAL 23 Ca 0.02 -0.41 0.06 0.00 -0.01 0.00 0.00 64.34 64.00 1kx6 n VAL 23 Cb 0.30 0.09 0.37 0.00 -0.91 0.00 0.00 33.84 33.69 1kx6 n VAL 23 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1kx6 n GLN 24 N -2.19 0.74 -0.05 5.55 6.02 -1.26 -1.57 117.38 124.62 1kx6 n GLN 24 Ca -0.01 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.87 1kx6 n GLN 24 Cb 0.52 -1.26 -0.04 0.00 1.02 0.00 0.00 30.24 30.47 1kx6 n GLN 24 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 1kx6 n TRP 25 N -0.76 0.00 0.30 1.08 -0.00 -1.25 -4.49 117.44 112.31 1kx6 n TRP 25 Ca 0.09 0.00 0.06 0.00 -0.00 0.00 0.00 57.50 57.66 1kx6 n TRP 25 Cb 0.04 -0.39 0.29 0.00 -0.00 0.00 0.00 31.31 31.25 1kx6 n TRP 25 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1kx6 n LEU 26 N -3.68 0.19 -2.93 5.87 7.99 -1.19 -4.90 117.00 118.36 1kx6 n LEU 26 Ca -0.20 0.56 -0.03 0.00 -0.01 0.00 0.00 56.01 56.33 1kx6 n LEU 26 Cb 0.56 -0.55 0.00 0.00 -0.11 0.00 0.00 43.42 43.32 1kx6 n LEU 26 CO 0.04 -0.46 0.21 0.23 -1.51 0.00 0.00 177.39 175.90 1kx6 n MET 27 N -1.73 -1.75 0.00 3.23 2.81 -0.61 -4.99 117.12 114.07 1kx6 n MET 27 Ca 0.02 1.75 0.00 0.00 -1.81 0.00 0.00 57.70 57.66 1kx6 n MET 27 Cb 0.12 -5.63 0.00 0.00 -0.71 0.00 0.00 33.22 27.00 1kx6 n MET 27 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1kx6 n ASN 28 N -1.10 3.06 0.00 7.83 5.15 -1.11 -5.08 115.26 124.01 1kx6 n ASN 28 Ca 0.05 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.03 1kx6 n ASN 28 Cb 0.48 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.73 1kx6 n ASN 28 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07