#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 -0.98 -2.59 4.39 7.64 -1.26 -4.71 113.62 116.11 1kx6 n SER 2 Ca 0.00 1.33 -0.05 0.00 1.01 0.00 0.00 58.87 61.15 1kx6 n SER 2 Cb 0.00 -4.96 0.01 0.00 -1.01 0.00 0.00 64.21 58.25 1kx6 n SER 2 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1kx6 n GLN 3 N 1.81 -2.13 0.00 1.43 7.27 -1.26 -4.88 117.38 119.62 1kx6 n GLN 3 Ca -0.39 1.94 0.00 0.00 0.07 0.00 0.00 57.00 58.61 1kx6 n GLN 3 Cb 0.61 -4.88 0.00 0.00 2.41 0.00 0.00 30.24 28.38 1kx6 n GLN 3 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1kx6 n GLY 4 N -0.17 -1.05 3.04 1.69 0.00 -1.26 -5.15 105.19 102.29 1kx6 n GLY 4 Ca 0.08 0.44 -0.36 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 0.01 -0.31 2.61 -2.24 -1.26 -4.78 114.28 108.31 1kx6 n THR 5 Ca 0.00 -0.48 0.08 0.00 -2.27 0.00 0.00 64.05 61.38 1kx6 n THR 5 Cb 0.00 -0.04 0.24 0.00 -2.10 0.00 0.00 70.33 68.44 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 -0.97 0.86 -2.53 4.78 -5.15 -2.02 -3.43 116.94 108.48 1kx6 h PHE 6 Ca -0.44 0.03 -0.54 0.00 -0.20 0.00 0.00 57.97 56.83 1kx6 h PHE 6 Cb 1.31 -0.25 0.23 0.00 0.22 0.00 0.00 35.95 37.46 1kx6 h PHE 6 CO 0.22 0.22 -1.36 -2.37 -2.00 0.00 0.00 178.31 173.02 1kx6 n THR 7 N -4.83 0.00 -1.27 0.88 5.66 -1.26 -4.32 114.28 109.14 1kx6 n THR 7 Ca 0.18 -0.34 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 1kx6 n THR 7 Cb 0.45 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 68.96 1kx6 n THR 7 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1kx6 n SER 8 N 1.35 -7.04 -1.49 1.09 2.88 -1.26 -4.62 113.62 104.53 1kx6 n SER 8 Ca 0.02 1.08 -0.16 0.00 -1.33 0.00 0.00 58.87 58.48 1kx6 n SER 8 Cb 0.56 -3.69 -0.06 0.00 -0.75 0.00 0.00 64.21 60.27 1kx6 n SER 8 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1kx6 n ASP 9 N -1.15 -4.12 -3.71 -3.46 2.03 -1.26 -4.88 116.55 100.00 1kx6 n ASP 9 Ca 0.00 0.37 -0.10 0.00 0.52 0.00 0.00 54.79 55.58 1kx6 n ASP 9 Cb 0.06 -3.75 -0.06 0.00 -0.72 0.00 0.00 41.12 36.66 1kx6 n ASP 9 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 1kx6 s TYR 10 N -2.34 -0.11 -0.05 -0.67 5.04 -1.26 -4.53 117.35 113.43 1kx6 s TYR 10 Ca 0.00 -0.19 -0.01 0.00 -2.44 0.00 0.00 57.07 54.43 1kx6 s TYR 10 Cb 0.00 0.16 0.00 0.00 0.35 0.00 0.00 41.96 42.47 1kx6 s TYR 10 CO 0.00 -0.62 0.05 0.45 -1.34 0.00 0.00 175.55 174.08 1kx6 n SER 11 N -0.01 -2.77 0.00 4.32 2.88 -1.26 -4.29 113.62 112.49 1kx6 n SER 11 Ca -0.16 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.49 1kx6 n SER 11 Cb 0.62 -1.56 0.00 0.00 -0.75 0.00 0.00 64.21 62.53 1kx6 n SER 11 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1kx6 n LYS 12 N -0.26 0.00 -0.31 -1.46 4.81 -1.26 -4.58 118.16 115.11 1kx6 n LYS 12 Ca 0.01 0.00 0.34 0.00 -0.87 0.00 0.00 58.31 57.79 1kx6 n LYS 12 Cb 0.04 0.00 0.61 0.00 0.02 0.00 0.00 35.03 35.69 1kx6 n LYS 12 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 1kx6 h TYR 13 N 0.00 0.00 -1.38 5.64 0.05 -1.92 -3.41 116.97 115.95 1kx6 h TYR 13 Ca 0.00 0.00 -0.71 0.00 0.05 0.00 0.00 58.73 58.07 1kx6 h TYR 13 Cb 0.00 0.00 0.07 0.00 1.01 0.00 0.00 36.73 37.81 1kx6 h TYR 13 CO 0.00 0.00 0.06 1.28 -1.05 0.00 0.00 178.16 178.45 1kx6 n LEU 14 N -3.57 0.44 0.09 3.88 4.77 -1.26 -4.85 117.00 116.50 1kx6 n LEU 14 Ca 0.27 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.39 1kx6 n LEU 14 Cb 1.50 -1.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1kx6 n LEU 14 CO 0.31 -1.81 0.00 -0.67 -1.33 0.00 0.00 177.39 173.89 1kx6 n ASP 15 N 1.88 0.23 -4.73 -1.43 -0.08 -1.26 -5.05 116.55 106.10 1kx6 n ASP 15 Ca 0.18 0.29 -0.41 0.00 -1.51 0.00 0.00 54.79 53.34 1kx6 n ASP 15 Cb 0.18 0.11 -0.05 0.00 2.34 0.00 0.00 41.12 43.70 1kx6 n ASP 15 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1kx6 s SER 16 N -5.15 7.37 0.00 1.67 0.01 -1.26 -4.92 113.70 111.42 1kx6 s SER 16 Ca 0.00 1.65 0.02 0.00 1.31 0.00 0.00 55.95 58.93 1kx6 s SER 16 Cb 0.00 -2.54 0.02 0.00 0.21 0.00 0.00 66.02 63.72 1kx6 s SER 16 CO 0.00 -0.05 0.64 -2.11 0.41 0.00 0.00 173.24 172.13 1kx6 n ARG 17 N 2.88 -0.17 0.00 12.44 1.85 -1.26 -4.81 116.66 127.58 1kx6 n ARG 17 Ca 0.01 -0.77 0.00 0.00 -1.00 0.00 0.00 57.85 56.08 1kx6 n ARG 17 Cb 0.50 -1.05 0.00 0.00 -1.05 0.00 0.00 32.46 30.86 1kx6 n ARG 17 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1kx6 n ARG 18 N 0.07 0.00 -2.30 2.89 1.74 -1.26 -4.70 116.66 113.10 1kx6 n ARG 18 Ca 0.02 0.04 -0.42 0.00 -0.77 0.00 0.00 57.85 56.72 1kx6 n ARG 18 Cb 0.09 -0.92 -0.03 0.00 -1.02 0.00 0.00 32.46 30.58 1kx6 n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1kx6 s ALA 19 N -2.55 3.48 0.00 7.54 0.00 -1.26 -4.96 121.76 124.01 1kx6 s ALA 19 Ca 0.00 1.01 0.00 0.00 0.00 0.00 0.00 51.96 52.97 1kx6 s ALA 19 Cb 0.00 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.66 1kx6 s ALA 19 CO 0.00 -0.47 0.00 1.04 0.00 0.00 0.00 175.76 176.33 1kx6 n GLN 20 N 3.05 0.00 0.00 0.00 6.02 -1.26 -4.92 117.38 120.26 1kx6 n GLN 20 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.06 1kx6 n GLN 20 Cb 0.44 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.70 1kx6 n GLN 20 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1kx6 n ASP 21 N 0.00 0.00 -0.10 1.08 -0.08 -1.26 -4.75 116.55 111.44 1kx6 n ASP 21 Ca 0.00 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.18 1kx6 n ASP 21 Cb 0.00 0.00 -0.16 0.00 2.34 0.00 0.00 41.12 43.30 1kx6 n ASP 21 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1kx6 n PHE 22 N -2.00 0.05 0.26 -0.67 -0.00 -1.26 -4.15 117.46 109.69 1kx6 n PHE 22 Ca 0.00 0.02 0.18 0.00 -0.00 0.00 0.00 57.45 57.64 1kx6 n PHE 22 Cb 0.00 -1.01 0.95 0.00 -0.00 0.00 0.00 39.48 39.42 1kx6 n PHE 22 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1kx6 h VAL 23 N 0.00 0.00 -0.01 -2.13 2.07 -1.89 0.18 116.25 114.48 1kx6 h VAL 23 Ca -0.54 0.00 0.00 0.00 0.82 0.00 0.00 66.70 66.98 1kx6 h VAL 23 Cb 2.22 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 1kx6 h VAL 23 CO 0.03 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.62 1kx6 n GLN 24 N -2.72 1.03 0.00 1.57 6.02 -1.23 -1.80 117.38 120.25 1kx6 n GLN 24 Ca -0.02 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 1kx6 n GLN 24 Cb 0.06 -1.19 0.00 0.00 1.02 0.00 0.00 30.24 30.13 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 -0.30 0.00 0.41 1.08 -0.00 0.61 -3.60 117.44 115.63 1kx6 n TRP 25 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 57.50 57.58 1kx6 n TRP 25 Cb 0.10 0.30 0.35 0.00 -0.00 0.00 0.00 31.31 32.07 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 -2.67 0.24 -0.79 5.87 7.99 -0.95 -3.68 117.00 123.01 1kx6 n LEU 26 Ca 0.00 0.57 -0.04 0.00 -0.01 0.00 0.00 56.01 56.52 1kx6 n LEU 26 Cb 0.19 -0.54 -0.04 0.00 -0.11 0.00 0.00 43.42 42.92 1kx6 n LEU 26 CO 0.00 -0.41 0.21 0.23 -1.51 0.00 0.00 177.39 175.91 1kx6 n MET 27 N -1.77 0.00 0.00 3.23 2.81 -0.75 -5.07 117.12 115.57 1kx6 n MET 27 Ca 0.03 -0.58 0.00 0.00 -1.81 0.00 0.00 57.70 55.33 1kx6 n MET 27 Cb 0.17 0.49 0.00 0.00 -0.71 0.00 0.00 33.22 33.17 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 0.00 -0.02 0.00 7.83 5.15 -0.89 -4.80 115.26 122.53 1kx6 n ASN 28 Ca -0.16 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.82 1kx6 n ASN 28 Cb 0.51 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.76 1kx6 n ASN 28 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01