#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kj0 s GLN 2 N 0.00 0.41 0.00 5.31 0.74 -1.26 -4.81 119.66 120.05 1kj0 s GLN 2 Ca 0.00 0.97 0.00 0.00 0.05 0.00 0.00 55.36 56.38 1kj0 s GLN 2 Cb 0.00 0.18 0.00 0.00 1.10 0.00 0.00 33.01 34.29 1kj0 s GLN 2 CO 0.00 -0.20 0.00 -0.85 -0.55 0.00 0.00 175.29 173.69 1kj0 n GLU 3 N 4.77 0.00 -4.02 1.67 0.28 -1.26 -4.99 120.64 117.09 1kj0 n GLU 3 Ca -0.17 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.74 1kj0 n GLU 3 Cb 0.53 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.34 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 -0.38 0.00 0.91 0.00 -1.04 -1.21 0.24 114.28 112.80 1kj0 n THR 5 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1kj0 n THR 5 Cb 0.62 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 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 -3.12 0.91 -2.42 -2.82 -0.04 -1.26 -2.92 135.00 123.32 1kj0 n PRO 6 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.42 1kj0 n PRO 6 Cb 0.00 -1.13 -0.03 0.00 -0.04 0.00 0.00 33.50 32.30 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 0.45 -4.69 0.18 0.55 0.00 -1.25 -4.90 105.19 95.53 1kj0 n GLY 7 Ca 0.00 1.16 0.12 0.00 0.00 0.00 0.00 46.02 47.30 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 1.19 0.57 -2.37 1.61 6.02 -1.26 -4.94 117.38 118.20 1kj0 n GLN 8 Ca -0.26 -0.37 -0.01 0.00 -0.01 0.00 0.00 57.00 56.35 1kj0 n GLN 8 Cb 0.41 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.17 1kj0 n GLN 8 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1kj0 n THR 9 N -0.90 -7.05 -2.25 5.09 -2.24 -1.26 -5.00 114.28 100.68 1kj0 n THR 9 Ca 0.09 1.60 -0.11 0.00 -2.27 0.00 0.00 64.05 63.36 1kj0 n THR 9 Cb 0.36 -4.09 0.06 0.00 -2.10 0.00 0.00 70.33 64.56 1kj0 n THR 9 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1kj0 n LYS 10 N 1.98 0.13 -0.02 -0.78 4.76 -1.20 -5.03 118.16 118.01 1kj0 n LYS 10 Ca -0.06 -1.20 -0.02 0.00 -2.87 0.00 0.00 58.31 54.16 1kj0 n LYS 10 Cb 0.10 -0.36 -0.02 0.00 -1.84 0.00 0.00 35.03 32.91 1kj0 n LYS 10 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1kj0 n LYS 11 N -1.92 1.09 0.00 1.97 2.85 -1.26 -4.62 118.16 116.27 1kj0 n LYS 11 Ca 0.08 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.35 1kj0 n LYS 11 Cb 0.27 -1.07 0.00 0.00 -0.65 0.00 0.00 35.03 33.58 1kj0 n LYS 11 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 177.40 178.29 1kj0 n GLN 12 N -2.46 0.00 0.00 -1.58 -0.06 -1.26 -4.75 117.38 107.27 1kj0 n GLN 12 Ca -0.06 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.94 1kj0 n GLN 12 Cb 0.57 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.75 1kj0 n GLN 12 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 1kj0 n ASP 13 N -2.15 0.00 -0.05 1.69 5.68 -1.26 -4.91 116.55 115.54 1kj0 n ASP 13 Ca 0.00 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.44 1kj0 n ASP 13 Cb 0.00 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 40.75 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 -2.33 2.09 0.21 0.00 0.01 -1.26 -4.92 114.94 108.74 1kj0 s ASN 15 Ca 0.35 -0.27 -0.24 0.00 -0.71 0.00 0.00 52.86 52.00 1kj0 s ASN 15 Cb 0.21 -0.77 -0.08 0.00 0.41 0.00 0.00 41.25 41.01 1kj0 s ASN 15 CO 0.43 -0.13 0.80 -0.89 -1.51 0.00 0.00 177.10 175.79 1kj0 s THR 16 N 1.76 4.39 -0.29 1.60 2.01 -1.26 -4.56 115.64 119.28 1kj0 s THR 16 Ca 0.05 1.61 -0.12 0.00 0.31 0.00 0.00 61.69 63.54 1kj0 s THR 16 Cb -0.13 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.30 1kj0 s THR 16 CO -0.08 0.36 0.23 0.00 -0.69 0.00 0.00 174.62 174.45 1kj0 s ASN 18 N 1.74 6.56 -0.08 0.00 -0.87 -1.26 -3.25 114.94 117.78 1kj0 s ASN 18 Ca 0.08 0.67 -0.11 0.00 -1.57 0.00 0.00 52.86 51.92 1kj0 s ASN 18 Cb -0.16 -2.25 -0.05 0.00 -0.02 0.00 0.00 41.25 38.77 1kj0 s ASN 18 CO 0.11 0.00 0.28 0.00 -2.57 0.00 0.00 177.10 174.92 1kj0 n THR 20 N 2.25 0.00 -0.62 0.00 -1.04 -1.26 -3.77 114.28 109.84 1kj0 n THR 20 Ca -0.16 -0.42 -0.06 0.00 -2.04 0.00 0.00 64.05 61.37 1kj0 n THR 20 Cb 0.53 -0.72 -0.08 0.00 -1.82 0.00 0.00 70.33 68.24 1kj0 n THR 20 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1kj0 n PRO 21 N -1.08 1.23 0.00 -2.82 -0.04 -1.15 -2.85 135.00 128.29 1kj0 n PRO 21 Ca 0.02 -0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.01 1kj0 n PRO 21 Cb 0.13 -1.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 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 2.23 0.00 -3.35 0.52 5.66 -1.22 -4.91 114.28 113.21 1kj0 n THR 22 Ca 0.20 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.20 1kj0 n THR 22 Cb 0.58 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 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 1.12 3.93 1.09 0.00 0.67 -4.58 105.19 107.43 1kj0 n GLY 23 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 0.00 -1.44 1.61 0.31 -1.26 -4.03 118.33 113.52 1kj0 n VAL 24 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.34 1kj0 n VAL 24 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 0.00 -1.56 0.14 3.52 7.02 -1.26 -4.95 117.44 120.35 1kj0 n TRP 25 Ca 0.00 0.11 0.00 0.00 -1.02 0.00 0.00 57.50 56.59 1kj0 n TRP 25 Cb 0.00 -0.13 0.00 0.00 -2.42 0.00 0.00 31.31 28.76 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 -0.21 0.58 -1.82 6.99 0.00 -1.21 -4.94 120.51 119.89 1kj0 n ALA 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1kj0 n ALA 26 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 1kj0 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1kj0 n THR 28 N 1.44 0.00 -3.23 0.00 -2.24 -1.25 -5.02 114.28 103.97 1kj0 n THR 28 Ca 0.00 -0.58 -0.03 0.00 -2.27 0.00 0.00 64.05 61.17 1kj0 n THR 28 Cb 0.00 -1.66 -0.03 0.00 -2.10 0.00 0.00 70.33 66.54 1kj0 n THR 28 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kj0 s ARG 29 N -4.77 0.48 0.00 -0.78 1.70 -1.26 -4.83 118.95 109.49 1kj0 s ARG 29 Ca 0.46 0.42 0.00 0.00 -0.47 0.00 0.00 55.73 56.14 1kj0 s ARG 29 Cb -0.01 -0.01 0.00 0.00 -0.57 0.00 0.00 34.95 34.35 1kj0 s ARG 29 CO 0.33 -0.96 0.00 1.63 -1.08 0.00 0.00 175.30 175.21 1kj0 n LYS 30 N 5.39 3.21 0.00 3.89 5.02 -1.26 -5.11 118.16 129.30 1kj0 n LYS 30 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1kj0 n LYS 30 Cb 0.51 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 34.86 1kj0 n LYS 30 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1kj0 n GLY 31 N 1.41 4.26 2.80 0.72 0.00 -1.26 -5.13 105.19 107.98 1kj0 n GLY 31 Ca 0.00 -0.91 -0.16 0.00 0.00 0.00 0.00 46.02 44.96 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 2.39 1.51 -1.03 0.00 0.04 -1.26 -4.88 135.00 131.77 1kj0 s PRO 33 Ca 0.09 0.58 -0.16 0.00 0.04 0.00 0.00 61.00 61.56 1kj0 s PRO 33 Cb -0.15 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 1kj0 s PRO 33 CO -0.18 -2.01 2.12 -0.35 0.04 0.00 0.00 177.00 176.62 1kj0 n PRO 34 N -3.69 2.11 -0.48 0.56 -0.04 -1.26 -4.99 135.00 127.21 1kj0 n PRO 34 Ca 0.07 -1.96 0.00 0.00 -0.04 0.00 0.00 63.50 61.57 1kj0 n PRO 34 Cb 0.57 -2.89 0.00 0.00 -0.04 0.00 0.00 33.50 31.14 1kj0 n PRO 34 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18