#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kx6 h SER 2 N 0.00 -0.53 -1.35 0.41 0.87 -2.10 -3.46 113.55 107.40 1kx6 h SER 2 Ca 0.00 -0.04 0.05 0.00 -1.23 0.00 0.00 61.79 60.57 1kx6 h SER 2 Cb 0.00 0.14 -0.22 0.00 -0.44 0.00 0.00 62.40 61.88 1kx6 h SER 2 CO 0.00 -0.11 -0.27 -1.58 -0.53 0.00 0.00 176.83 174.34 1kx6 s GLN 3 N -3.93 0.53 0.00 2.24 0.74 -1.26 -5.02 119.66 112.96 1kx6 s GLN 3 Ca -0.11 1.03 0.00 0.00 0.05 0.00 0.00 55.36 56.33 1kx6 s GLN 3 Cb 0.01 0.48 0.00 0.00 1.10 0.00 0.00 33.01 34.60 1kx6 s GLN 3 CO 0.36 -0.53 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 1kx6 n GLY 4 N 5.42 -0.28 2.91 2.59 0.00 -1.26 -5.12 105.19 109.45 1kx6 n GLY 4 Ca -0.04 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 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 0.00 -0.10 2.61 -2.24 -1.26 -4.60 114.28 108.70 1kx6 n THR 5 Ca 0.00 -0.48 -0.20 0.00 -2.27 0.00 0.00 64.05 61.10 1kx6 n THR 5 Cb 0.00 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 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 -0.87 0.00 -2.62 4.78 3.57 -1.97 -3.48 116.94 116.36 1kx6 h PHE 6 Ca -0.42 0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.54 1kx6 h PHE 6 Cb 1.26 0.00 0.23 0.00 2.79 0.00 0.00 35.95 40.23 1kx6 h PHE 6 CO 0.20 1.38 -1.30 -2.37 -2.23 0.00 0.00 178.31 174.00 1kx6 n THR 7 N -4.47 0.01 -1.05 4.41 5.66 -1.26 -4.37 114.28 113.22 1kx6 n THR 7 Ca -0.28 -0.36 0.13 0.00 -3.05 0.00 0.00 64.05 60.49 1kx6 n THR 7 Cb 0.64 -0.27 -0.05 0.00 -1.55 0.00 0.00 70.33 69.10 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 1.38 -6.29 -4.38 1.09 2.88 -1.26 -4.63 113.62 102.41 1kx6 n SER 8 Ca 0.02 0.75 -0.60 0.00 -1.33 0.00 0.00 58.87 57.70 1kx6 n SER 8 Cb 0.55 -3.39 -0.11 0.00 -0.75 0.00 0.00 64.21 60.51 1kx6 n SER 8 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1kx6 n ASP 9 N -3.82 1.05 -3.15 -3.46 9.92 -1.26 -4.86 116.55 110.98 1kx6 n ASP 9 Ca -0.03 0.77 0.04 0.00 -0.53 0.00 0.00 54.79 55.04 1kx6 n ASP 9 Cb 0.49 -0.94 -0.01 0.00 -0.64 0.00 0.00 41.12 40.02 1kx6 n ASP 9 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1kx6 s TYR 10 N 5.47 -1.35 0.00 1.24 2.02 -1.26 -4.99 117.35 118.47 1kx6 s TYR 10 Ca 1.15 1.23 0.00 0.00 -0.37 0.00 0.00 57.07 59.08 1kx6 s TYR 10 Cb -1.41 0.40 0.00 0.00 -0.40 0.00 0.00 41.96 40.54 1kx6 s TYR 10 CO 0.67 -0.75 0.00 0.43 -1.57 0.00 0.00 175.55 174.33 1kx6 n SER 11 N 5.41 0.00 -0.34 2.29 7.64 -1.26 -4.97 113.62 122.39 1kx6 n SER 11 Ca -0.00 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.83 1kx6 n SER 11 Cb 0.53 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.71 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 0.00 -0.27 -2.68 1.43 5.02 -1.26 -1.05 118.16 119.35 1kx6 n LYS 12 Ca 0.00 1.29 -0.27 0.00 -2.02 0.00 0.00 58.31 57.31 1kx6 n LYS 12 Cb 0.00 -1.91 -0.02 0.00 -0.02 0.00 0.00 35.03 33.09 1kx6 n LYS 12 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1kx6 n TYR 13 N -5.16 3.65 -2.18 2.13 4.11 -1.26 -5.06 117.16 113.38 1kx6 n TYR 13 Ca 0.06 -3.48 -0.41 0.00 -0.00 0.00 0.00 57.90 54.06 1kx6 n TYR 13 Cb 0.29 -0.25 -0.03 0.00 -0.00 0.00 0.00 39.34 39.35 1kx6 n TYR 13 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.86 175.69 1kx6 s LEU 14 N -3.50 4.41 0.96 -3.48 2.96 -0.22 -4.97 118.68 114.84 1kx6 s LEU 14 Ca 0.48 2.43 -0.13 0.00 -0.22 0.00 0.00 54.13 56.69 1kx6 s LEU 14 Cb 0.35 -3.61 0.06 0.00 0.50 0.00 0.00 46.19 43.49 1kx6 s LEU 14 CO -0.17 -0.56 0.50 0.47 -1.32 0.00 0.00 176.35 175.27 1kx6 n ASP 15 N 2.74 -1.73 -1.93 3.68 9.92 -1.26 -4.62 116.55 123.34 1kx6 n ASP 15 Ca 0.07 0.31 0.00 0.00 -0.53 0.00 0.00 54.79 54.63 1kx6 n ASP 15 Cb 0.42 -1.23 0.00 0.00 -0.64 0.00 0.00 41.12 39.67 1kx6 n ASP 15 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 1kx6 n SER 16 N -1.85 -8.30 0.11 -2.24 7.64 -1.26 -5.05 113.62 102.66 1kx6 n SER 16 Ca 0.07 1.26 0.00 0.00 1.01 0.00 0.00 58.87 61.21 1kx6 n SER 16 Cb 0.54 -4.67 0.00 0.00 -1.01 0.00 0.00 64.21 59.06 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 1.72 0.00 -0.23 1.43 0.63 -1.26 -4.93 116.66 114.01 1kx6 n ARG 17 Ca 0.00 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 56.83 1kx6 n ARG 17 Cb 0.00 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 32.85 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 0.00 -0.22 0.00 -0.14 2.43 -1.98 -3.39 114.38 111.08 1kx6 h ARG 18 Ca 0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1kx6 h ARG 18 Cb 0.00 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1kx6 h ARG 18 CO 0.00 -0.15 0.00 0.00 -1.51 0.00 0.00 179.97 178.31 1kx6 n ALA 19 N -3.17 0.00 -0.47 2.80 0.00 -1.26 -4.26 120.51 114.16 1kx6 n ALA 19 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1kx6 n ALA 19 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.78 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 0.00 0.33 0.00 7.27 -1.26 -2.32 117.38 121.40 1kx6 n GLN 20 Ca 0.00 0.00 0.14 0.00 0.07 0.00 0.00 57.00 57.21 1kx6 n GLN 20 Cb 0.00 0.00 0.74 0.00 2.41 0.00 0.00 30.24 33.39 1kx6 n GLN 20 CO 0.00 0.00 0.00 0.22 0.07 0.00 0.00 177.06 177.35 1kx6 h ASP 21 N 3.70 0.00 1.48 1.69 1.82 -1.88 1.53 116.42 124.76 1kx6 h ASP 21 Ca 0.00 0.00 -0.08 0.00 -0.39 0.00 0.00 57.03 56.56 1kx6 h ASP 21 Cb 0.00 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.00 1kx6 h ASP 21 CO 0.00 0.00 -0.37 0.15 -1.61 0.00 0.00 179.24 177.41 1kx6 h PHE 22 N 0.00 0.00 0.00 0.28 3.57 -1.64 -3.10 116.94 116.05 1kx6 h PHE 22 Ca 0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1kx6 h PHE 22 Cb 0.81 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.55 1kx6 h PHE 22 CO 0.00 0.37 0.20 0.28 -2.23 0.00 0.00 178.31 176.92 1kx6 h VAL 23 N 0.00 0.00 0.00 1.41 2.07 0.20 0.62 116.25 120.56 1kx6 h VAL 23 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1kx6 h VAL 23 Cb 1.21 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1kx6 h VAL 23 CO 0.05 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.64 1kx6 n GLN 24 N -2.78 0.99 0.00 1.57 6.02 -1.17 -1.39 117.38 120.61 1kx6 n GLN 24 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.97 1kx6 n GLN 24 Cb 0.25 -1.08 0.00 0.00 1.02 0.00 0.00 30.24 30.43 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 -0.42 0.00 0.32 1.08 -0.00 0.21 -3.88 117.44 114.75 1kx6 n TRP 25 Ca 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 57.50 57.66 1kx6 n TRP 25 Cb 0.04 0.19 0.64 0.00 -0.00 0.00 0.00 31.31 32.18 1kx6 n TRP 25 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1kx6 h LEU 26 N 0.00 0.00 -5.00 5.87 -0.00 -1.51 -3.35 115.31 111.33 1kx6 h LEU 26 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.71 1kx6 h LEU 26 Cb 0.59 0.00 -0.13 0.00 -0.00 0.00 0.00 40.66 41.12 1kx6 h LEU 26 CO 0.00 0.00 -0.18 0.23 -0.00 0.00 0.00 178.44 178.49 1kx6 n MET 27 N -2.77 0.64 -1.05 1.13 2.81 -0.49 -5.08 117.12 112.31 1kx6 n MET 27 Ca 0.01 -1.36 -0.37 0.00 -1.81 0.00 0.00 57.70 54.18 1kx6 n MET 27 Cb 0.26 -0.53 0.04 0.00 -0.71 0.00 0.00 33.22 32.28 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 0.26 -5.25 0.00 7.83 2.85 -1.15 -4.62 115.26 115.18 1kx6 n ASN 28 Ca -0.02 0.30 0.00 0.00 -0.11 0.00 0.00 54.58 54.75 1kx6 n ASN 28 Cb 0.73 -0.81 0.00 0.00 1.24 0.00 0.00 39.78 40.94 1kx6 n ASN 28 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56