#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 -1.15 0.26 7.64 -1.26 -4.83 113.62 114.28 1kx6 n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1kx6 n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 0.00 -3.10 -3.49 1.43 7.27 -1.26 -4.92 117.38 113.32 1kx6 n GLN 3 Ca 0.00 2.38 -0.37 0.00 0.07 0.00 0.00 57.00 59.08 1kx6 n GLN 3 Cb 0.00 -2.90 -0.06 0.00 2.41 0.00 0.00 30.24 29.69 1kx6 n GLN 3 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1kx6 s GLY 4 N -4.33 2.46 0.92 1.69 0.00 -1.26 -5.04 107.32 101.77 1kx6 s GLY 4 Ca 0.00 -0.22 -0.16 0.00 0.00 0.00 0.00 44.72 44.33 1kx6 s GLY 4 CO 0.00 0.11 -0.72 -1.30 0.00 0.00 0.00 173.10 171.18 1kx6 n THR 5 N 1.53 0.00 -0.03 0.90 -2.24 -1.26 -4.35 114.28 108.82 1kx6 n THR 5 Ca -0.12 -0.48 -0.12 0.00 -2.27 0.00 0.00 64.05 61.07 1kx6 n THR 5 Cb 0.52 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.69 1kx6 n THR 5 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1kx6 h PHE 6 N -0.88 0.21 -1.72 4.78 3.57 -1.98 -2.91 116.94 118.00 1kx6 h PHE 6 Ca -0.42 -0.03 -0.33 0.00 3.53 0.00 0.00 57.97 60.73 1kx6 h PHE 6 Cb 1.26 -0.06 0.18 0.00 2.79 0.00 0.00 35.95 40.12 1kx6 h PHE 6 CO 0.20 0.36 -1.07 -2.37 -2.23 0.00 0.00 178.31 173.21 1kx6 n THR 7 N -4.85 0.00 -1.50 4.41 5.66 -1.26 -4.10 114.28 112.64 1kx6 n THR 7 Ca -0.05 -0.10 -0.35 0.00 -3.05 0.00 0.00 64.05 60.49 1kx6 n THR 7 Cb 0.16 -0.35 -0.17 0.00 -1.55 0.00 0.00 70.33 68.41 1kx6 n THR 7 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1kx6 n SER 8 N 0.21 -0.18 0.00 1.09 7.64 -1.26 -2.84 113.62 118.27 1kx6 n SER 8 Ca 0.02 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.84 1kx6 n SER 8 Cb 0.49 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1kx6 n SER 8 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1kx6 n ASP 9 N 9.18 0.00 -3.38 6.43 -0.08 -1.26 -5.03 116.55 122.41 1kx6 n ASP 9 Ca 0.66 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.94 1kx6 n ASP 9 Cb 0.07 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.53 1kx6 n ASP 9 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1kx6 n TYR 10 N 0.00 -1.02 -3.81 -0.67 4.11 -1.10 -2.02 117.16 112.65 1kx6 n TYR 10 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.90 57.67 1kx6 n TYR 10 Cb 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 39.34 39.35 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 -0.59 -0.89 -1.31 9.48 7.64 -1.26 0.12 113.62 126.80 1kx6 n SER 11 Ca 0.00 -0.91 -0.16 0.00 1.01 0.00 0.00 58.87 58.82 1kx6 n SER 11 Cb 0.00 -3.61 -0.07 0.00 -1.01 0.00 0.00 64.21 59.52 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 -4.32 -1.48 -1.66 1.43 5.02 -1.26 0.33 118.16 116.22 1kx6 n LYS 12 Ca -0.30 0.98 -0.08 0.00 -2.02 0.00 0.00 58.31 56.89 1kx6 n LYS 12 Cb 0.68 -5.31 -0.02 0.00 -0.02 0.00 0.00 35.03 30.36 1kx6 n LYS 12 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1kx6 n TYR 13 N -2.14 -0.18 -1.76 2.13 4.19 0.32 -5.01 117.16 114.71 1kx6 n TYR 13 Ca -0.16 0.00 -0.31 0.00 3.31 0.00 0.00 57.90 60.74 1kx6 n TYR 13 Cb 0.57 -1.92 0.02 0.00 0.49 0.00 0.00 39.34 38.51 1kx6 n TYR 13 CO 0.00 0.00 0.00 -0.48 0.91 0.00 0.00 176.86 177.29 1kx6 s LEU 14 N -2.13 3.20 0.00 2.98 0.05 0.15 -4.88 118.68 118.06 1kx6 s LEU 14 Ca 0.00 1.50 0.07 0.00 0.05 0.00 0.00 54.13 55.76 1kx6 s LEU 14 Cb 0.00 -4.48 -0.03 0.00 -2.05 0.00 0.00 46.19 39.63 1kx6 s LEU 14 CO 0.00 -1.09 0.26 0.47 -0.55 0.00 0.00 176.35 175.44 1kx6 n ASP 15 N -2.87 -0.59 -4.48 1.48 8.00 -1.26 -4.75 116.55 112.09 1kx6 n ASP 15 Ca 0.07 -3.06 -0.57 0.00 0.71 0.00 0.00 54.79 51.93 1kx6 n ASP 15 Cb 0.54 1.55 -0.09 0.00 -0.02 0.00 0.00 41.12 43.10 1kx6 n ASP 15 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1kx6 n SER 16 N -1.75 1.63 0.13 -2.24 7.64 -1.26 -4.43 113.62 113.33 1kx6 n SER 16 Ca 0.07 0.75 0.00 0.00 1.01 0.00 0.00 58.87 60.69 1kx6 n SER 16 Cb 0.57 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.70 1kx6 n SER 16 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1kx6 n ARG 17 N 6.83 0.00 0.04 1.43 0.00 -1.26 -4.85 116.66 118.85 1kx6 n ARG 17 Ca 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 58.24 1kx6 n ARG 17 Cb 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 32.46 32.53 1kx6 n ARG 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1kx6 h ARG 18 N 0.00 -0.10 0.00 -0.14 3.08 -2.04 -2.09 114.38 113.09 1kx6 h ARG 18 Ca 0.00 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1kx6 h ARG 18 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1kx6 h ARG 18 CO 0.00 -0.07 0.00 0.00 -1.07 0.00 0.00 179.97 178.83 1kx6 n ALA 19 N -2.17 1.22 -1.54 0.04 0.00 -1.26 -4.69 120.51 112.11 1kx6 n ALA 19 Ca -0.01 0.12 -0.54 0.00 0.00 0.00 0.00 53.44 53.01 1kx6 n ALA 19 Cb 0.04 -1.26 -0.06 0.00 0.00 0.00 0.00 19.45 18.17 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 -2.04 0.61 0.00 0.00 7.27 -0.79 -0.23 117.38 122.20 1kx6 n GLN 20 Ca 0.00 0.22 0.00 0.00 0.07 0.00 0.00 57.00 57.29 1kx6 n GLN 20 Cb 0.08 -1.72 0.00 0.00 2.41 0.00 0.00 30.24 31.01 1kx6 n GLN 20 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1kx6 n ASP 21 N 1.98 0.00 0.00 1.69 2.03 -1.26 -4.57 116.55 116.42 1kx6 n ASP 21 Ca 0.18 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.55 1kx6 n ASP 21 Cb 0.16 0.00 0.45 0.00 -0.72 0.00 0.00 41.12 41.02 1kx6 n ASP 21 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 1kx6 h PHE 22 N 0.00 0.47 0.00 -0.67 -1.00 -0.94 0.90 116.94 115.70 1kx6 h PHE 22 Ca 0.00 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.79 1kx6 h PHE 22 Cb 0.00 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 39.40 1kx6 h PHE 22 CO 0.00 0.28 0.15 0.28 -1.61 0.00 0.00 178.31 177.41 1kx6 h VAL 23 N 0.49 0.00 0.00 -0.55 2.07 -0.85 0.51 116.25 117.93 1kx6 h VAL 23 Ca 0.16 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.68 1kx6 h VAL 23 Cb 0.04 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1kx6 h VAL 23 CO -0.04 0.00 0.00 1.67 0.02 0.00 0.00 177.57 179.22 1kx6 n GLN 24 N -2.71 0.96 0.00 1.57 0.00 0.31 -1.89 117.38 115.61 1kx6 n GLN 24 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.98 1kx6 n GLN 24 Cb 0.20 -1.01 0.00 0.00 0.00 0.00 0.00 30.24 29.42 1kx6 n GLN 24 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.06 178.93 1kx6 n TRP 25 N -0.49 0.00 0.31 3.69 -0.00 0.18 -4.65 117.44 116.48 1kx6 n TRP 25 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.50 57.60 1kx6 n TRP 25 Cb 0.01 0.09 0.47 0.00 -0.00 0.00 0.00 31.31 31.88 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 -2.91 0.53 -2.24 5.87 7.99 -1.10 -4.91 117.00 120.23 1kx6 n LEU 26 Ca 0.00 0.67 -0.04 0.00 -0.01 0.00 0.00 56.01 56.63 1kx6 n LEU 26 Cb 0.41 -0.64 0.00 0.00 -0.11 0.00 0.00 43.42 43.09 1kx6 n LEU 26 CO 0.00 -0.65 -0.03 0.23 -1.51 0.00 0.00 177.39 175.44 1kx6 n MET 27 N -2.13 -1.44 -0.32 3.23 2.81 -0.79 -4.90 117.12 113.57 1kx6 n MET 27 Ca 0.01 1.47 -0.08 0.00 -1.81 0.00 0.00 57.70 57.29 1kx6 n MET 27 Cb 0.15 -3.76 -0.08 0.00 -0.71 0.00 0.00 33.22 28.82 1kx6 n MET 27 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1kx6 n ASN 28 N -0.25 -0.82 0.00 7.83 6.94 -1.04 -5.07 115.26 122.86 1kx6 n ASN 28 Ca 0.05 1.59 0.00 0.00 -0.02 0.00 0.00 54.58 56.21 1kx6 n ASN 28 Cb 0.21 -0.29 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 1kx6 n ASN 28 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58