#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kj0 n GLN 2 N 0.00 -2.29 -3.09 3.49 7.27 -1.26 -2.79 117.38 118.71 1kj0 n GLN 2 Ca 0.00 0.82 -0.20 0.00 0.07 0.00 0.00 57.00 57.70 1kj0 n GLN 2 Cb 0.00 -5.32 -0.04 0.00 2.41 0.00 0.00 30.24 27.29 1kj0 n GLN 2 CO 0.00 0.00 0.00 -0.85 0.07 0.00 0.00 177.06 176.28 1kj0 n GLU 3 N -2.95 -1.46 0.00 3.69 0.28 -1.26 -2.60 120.64 116.35 1kj0 n GLU 3 Ca -0.17 0.06 0.00 0.00 -0.16 0.00 0.00 57.16 56.89 1kj0 n GLU 3 Cb 0.64 -3.49 0.00 0.00 1.43 0.00 0.00 31.44 30.02 1kj0 n GLU 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1kj0 n THR 5 N 0.02 0.00 0.16 0.00 -1.04 -1.25 0.11 114.28 112.27 1kj0 n THR 5 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1kj0 n THR 5 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1kj0 n THR 5 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1kj0 n PRO 6 N -2.81 0.69 -3.09 -2.82 -0.04 -1.26 -4.05 135.00 121.62 1kj0 n PRO 6 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 1kj0 n PRO 6 Cb 0.00 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 1kj0 n PRO 6 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1kj0 n GLY 7 N 1.17 -1.24 2.62 0.55 0.00 -1.26 -4.88 105.19 102.16 1kj0 n GLY 7 Ca 0.00 0.60 -0.34 0.00 0.00 0.00 0.00 46.02 46.29 1kj0 n GLY 7 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1kj0 n GLN 8 N -1.60 2.57 -1.56 1.61 6.02 -1.26 -4.87 117.38 118.29 1kj0 n GLN 8 Ca -0.01 -3.00 -0.60 0.00 -0.01 0.00 0.00 57.00 53.39 1kj0 n GLN 8 Cb 0.51 -2.19 -0.08 0.00 1.02 0.00 0.00 30.24 29.50 1kj0 n GLN 8 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1kj0 n THR 9 N -0.13 0.01 -3.69 5.09 -1.04 -1.26 -4.75 114.28 108.51 1kj0 n THR 9 Ca 0.52 -0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 62.25 1kj0 n THR 9 Cb 0.42 -0.21 -0.11 0.00 -1.82 0.00 0.00 70.33 68.62 1kj0 n THR 9 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 1kj0 n LYS 10 N 2.13 1.63 -1.50 -2.82 0.00 -1.15 -5.03 118.16 111.43 1kj0 n LYS 10 Ca 0.22 -4.24 -0.14 0.00 -0.00 0.00 0.00 58.31 54.15 1kj0 n LYS 10 Cb 0.07 -2.12 -0.10 0.00 -0.00 0.00 0.00 35.03 32.87 1kj0 n LYS 10 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 1kj0 n LYS 11 N 1.86 0.29 0.00 -1.58 2.85 -1.26 -4.40 118.16 115.92 1kj0 n LYS 11 Ca 0.24 -0.84 -0.00 0.00 -1.05 0.00 0.00 58.31 56.65 1kj0 n LYS 11 Cb 0.39 -3.03 -0.00 0.00 -0.65 0.00 0.00 35.03 31.74 1kj0 n LYS 11 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 177.40 179.31 1kj0 h GLN 12 N 11.78 -0.02 0.00 -1.58 4.20 -1.96 -3.50 115.11 124.03 1kj0 h GLN 12 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1kj0 h GLN 12 Cb 1.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.81 1kj0 h GLN 12 CO 1.11 -0.01 0.00 -0.40 -0.67 0.00 0.00 178.83 178.86 1kj0 n ASP 13 N -2.24 0.00 0.25 1.46 5.68 -1.26 -4.97 116.55 115.47 1kj0 n ASP 13 Ca -0.00 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.39 1kj0 n ASP 13 Cb 0.01 0.00 0.67 0.00 -1.14 0.00 0.00 41.12 40.66 1kj0 n ASP 13 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1kj0 s ASN 15 N -6.38 5.31 -1.03 0.00 -0.87 -1.24 -4.65 114.94 106.09 1kj0 s ASN 15 Ca -0.03 -0.09 -0.06 0.00 -1.57 0.00 0.00 52.86 51.11 1kj0 s ASN 15 Cb 0.14 -1.93 0.26 0.00 -0.02 0.00 0.00 41.25 39.69 1kj0 s ASN 15 CO 0.61 0.06 0.99 0.41 -2.57 0.00 0.00 177.10 176.61 1kj0 n THR 16 N 4.30 3.96 -1.66 1.60 -1.04 -1.26 -3.77 114.28 116.41 1kj0 n THR 16 Ca -0.16 -5.29 -0.46 0.00 -2.04 0.00 0.00 64.05 56.10 1kj0 n THR 16 Cb 0.52 -2.49 -0.04 0.00 -1.82 0.00 0.00 70.33 66.50 1kj0 n THR 16 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1kj0 s ASN 18 N 0.54 4.00 0.71 0.00 3.84 -1.26 -2.93 114.94 119.83 1kj0 s ASN 18 Ca 0.74 -0.29 -0.10 0.00 0.21 0.00 0.00 52.86 53.42 1kj0 s ASN 18 Cb -0.69 -1.36 0.03 0.00 -0.55 0.00 0.00 41.25 38.67 1kj0 s ASN 18 CO 0.45 0.22 1.08 0.00 -2.79 0.00 0.00 177.10 176.06 1kj0 s THR 20 N -3.33 0.57 -0.41 0.00 -4.23 -1.09 -4.61 115.64 102.53 1kj0 s THR 20 Ca 0.58 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.04 1kj0 s THR 20 Cb -0.11 -2.40 -0.13 0.00 1.34 0.00 0.00 72.50 71.20 1kj0 s THR 20 CO 0.50 0.00 2.44 -0.81 -0.54 0.00 0.00 174.62 176.21 1kj0 n PRO 21 N -0.84 1.73 0.00 3.99 -0.04 -1.26 -3.02 135.00 135.56 1kj0 n PRO 21 Ca -0.04 -1.02 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 1kj0 n PRO 21 Cb 0.65 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 1kj0 n PRO 21 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1kj0 n THR 22 N 3.22 0.00 -4.82 0.52 5.66 -1.26 -5.05 114.28 112.55 1kj0 n THR 22 Ca 0.37 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.37 1kj0 n THR 22 Cb 0.43 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.21 1kj0 n THR 22 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1kj0 n GLY 23 N 0.00 2.07 1.04 1.09 0.00 0.30 -4.91 105.19 104.78 1kj0 n GLY 23 Ca 0.00 -0.53 0.10 0.00 0.00 0.00 0.00 46.02 45.60 1kj0 n GLY 23 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1kj0 n VAL 24 N 0.00 -0.02 -3.66 1.61 0.31 -0.56 -2.67 118.33 113.35 1kj0 n VAL 24 Ca 0.00 0.28 -0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1kj0 n VAL 24 Cb 0.00 -0.56 -0.00 0.00 -0.91 0.00 0.00 33.84 32.37 1kj0 n VAL 24 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 1kj0 n TRP 25 N -3.32 -0.34 0.04 3.52 7.02 -1.26 -3.52 117.44 119.58 1kj0 n TRP 25 Ca -0.02 -0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.46 1kj0 n TRP 25 Cb 0.60 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.49 1kj0 n TRP 25 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1kj0 n ALA 26 N -3.00 3.00 -0.93 6.99 0.00 -0.80 -4.85 120.51 120.92 1kj0 n ALA 26 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 1kj0 n ALA 26 Cb 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 19.45 19.47 1kj0 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kj0 s THR 28 N -3.95 0.01 0.00 0.00 -1.32 -1.26 -4.89 115.64 104.23 1kj0 s THR 28 Ca 0.00 -0.08 0.00 0.00 -1.21 0.00 0.00 61.69 60.40 1kj0 s THR 28 Cb 0.00 -0.65 0.00 0.00 -1.51 0.00 0.00 72.50 70.34 1kj0 s THR 28 CO 0.00 -0.04 0.00 -1.14 -2.21 0.00 0.00 174.62 171.23 1kj0 n ARG 29 N 2.47 3.19 -2.06 7.08 0.63 -1.26 -3.59 116.66 123.12 1kj0 n ARG 29 Ca -0.15 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.74 1kj0 n ARG 29 Cb 0.57 0.00 0.02 0.00 0.45 0.00 0.00 32.46 33.50 1kj0 n ARG 29 CO 0.00 0.00 0.00 1.17 -2.51 0.00 0.00 177.63 176.29 1kj0 n LYS 30 N 0.00 -0.67 -0.41 -0.14 4.81 -1.26 -4.87 118.16 115.61 1kj0 n LYS 30 Ca 0.00 0.39 0.05 0.00 -0.87 0.00 0.00 58.31 57.88 1kj0 n LYS 30 Cb 0.00 -2.91 -0.02 0.00 0.02 0.00 0.00 35.03 32.12 1kj0 n LYS 30 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1kj0 n GLY 31 N -1.38 -2.36 3.17 3.14 0.00 -1.26 -4.77 105.19 101.74 1kj0 n GLY 31 Ca -0.02 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.25 1kj0 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kj0 s PRO 33 N 1.26 3.88 0.00 0.00 0.04 -1.26 -4.96 135.00 133.96 1kj0 s PRO 33 Ca 0.06 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.49 1kj0 s PRO 33 Cb -0.24 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.37 1kj0 s PRO 33 CO -0.02 -1.18 0.11 -0.35 0.04 0.00 0.00 177.00 175.61 1kj0 n PRO 34 N 7.43 0.00 0.00 0.56 -0.04 -1.26 -5.07 135.00 136.62 1kj0 n PRO 34 Ca 0.16 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1kj0 n PRO 34 Cb 0.46 -0.49 0.00 0.00 -0.04 0.00 0.00 33.50 33.43 1kj0 n PRO 34 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04