#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kj6 s ILE 2 N 0.00 0.84 0.01 -0.61 -4.36 -1.26 -5.16 121.20 110.65 1kj6 s ILE 2 Ca 0.00 -1.99 0.06 0.00 -0.26 0.00 0.00 60.65 58.46 1kj6 s ILE 2 Cb 0.00 -1.97 -0.03 0.00 1.25 0.00 0.00 42.46 41.71 1kj6 s ILE 2 CO 0.00 -0.62 -0.17 0.27 0.24 0.00 0.00 174.94 174.65 1kj6 s ILE 3 N -3.55 2.82 0.08 8.37 -0.00 -1.26 -5.03 121.20 122.65 1kj6 s ILE 3 Ca 0.20 -1.03 0.00 0.00 -0.00 0.00 0.00 60.65 59.82 1kj6 s ILE 3 Cb 0.05 -2.15 -0.26 0.00 -0.00 0.00 0.00 42.46 40.11 1kj6 s ILE 3 CO 0.01 0.44 1.16 0.78 -0.00 0.00 0.00 174.94 177.33 1kj6 h ASN 4 N 4.86 0.26 -3.69 4.36 2.35 -2.09 -3.46 115.58 118.18 1kj6 h ASN 4 Ca -0.47 -0.29 -0.54 0.00 -0.55 0.00 0.00 56.30 54.45 1kj6 h ASN 4 Cb 1.15 -0.08 0.10 0.00 0.05 0.00 0.00 38.32 39.54 1kj6 h ASN 4 CO 0.49 1.23 0.78 0.35 -1.65 0.00 0.00 177.43 178.62 1kj6 n THR 5 N -3.45 1.73 -1.49 2.81 -2.24 -1.26 -4.91 114.28 105.47 1kj6 n THR 5 Ca -0.06 -0.43 -0.34 0.00 -2.27 0.00 0.00 64.05 60.95 1kj6 n THR 5 Cb 1.00 -1.94 0.07 0.00 -2.10 0.00 0.00 70.33 67.36 1kj6 n THR 5 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1kj6 n LEU 6 N 0.94 7.30 0.00 3.22 -0.00 -1.26 -4.64 117.00 122.56 1kj6 n LEU 6 Ca 0.03 -4.42 0.03 0.00 -0.00 0.00 0.00 56.01 51.66 1kj6 n LEU 6 Cb 0.38 -0.90 0.18 0.00 -0.00 0.00 0.00 43.42 43.08 1kj6 n LEU 6 CO 0.64 1.59 0.52 0.00 -0.00 0.00 0.00 177.39 180.14 1kj6 n GLN 7 N -0.85 0.12 0.06 1.47 6.02 -1.26 -1.12 117.38 121.82 1kj6 n GLN 7 Ca 0.59 0.18 0.13 0.00 -0.01 0.00 0.00 57.00 57.89 1kj6 n GLN 7 Cb 0.66 -1.50 0.34 0.00 1.02 0.00 0.00 30.24 30.76 1kj6 n GLN 7 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1kj6 n LYS 8 N -1.24 0.20 -1.11 -1.09 4.76 -1.26 -2.13 118.16 116.29 1kj6 n LYS 8 Ca 0.04 0.11 -0.04 0.00 -2.87 0.00 0.00 58.31 55.54 1kj6 n LYS 8 Cb 0.05 -1.67 -0.05 0.00 -1.84 0.00 0.00 35.03 31.52 1kj6 n LYS 8 CO 0.00 0.00 0.00 2.48 -1.37 0.00 0.00 177.40 178.51 1kj6 n TYR 9 N -1.99 0.00 0.03 2.13 4.11 -0.49 -4.86 117.16 116.10 1kj6 n TYR 9 Ca 0.05 -0.49 -0.08 0.00 -0.00 0.00 0.00 57.90 57.38 1kj6 n TYR 9 Cb 0.41 0.34 0.08 0.00 -0.00 0.00 0.00 39.34 40.17 1kj6 n TYR 9 CO 0.00 0.00 0.00 -0.92 -0.00 0.00 0.00 176.86 175.94 1kj6 h TYR 10 N 0.24 0.56 -0.04 -3.48 5.03 -1.29 -2.46 116.97 115.52 1kj6 h TYR 10 Ca -0.48 -0.20 0.00 0.00 2.58 0.00 0.00 58.73 60.63 1kj6 h TYR 10 Cb 1.52 -0.10 0.00 0.00 1.55 0.00 0.00 36.73 39.70 1kj6 h TYR 10 CO -0.10 0.90 0.00 0.00 -1.32 0.00 0.00 178.16 177.64 1kj6 n ARG 12 N -0.46 1.06 -0.02 0.00 3.00 -0.94 -3.60 116.66 115.71 1kj6 n ARG 12 Ca 0.08 -0.07 -0.14 0.00 -0.00 0.00 0.00 57.85 57.72 1kj6 n ARG 12 Cb 0.08 -1.32 -0.14 0.00 0.00 0.00 0.00 32.46 31.07 1kj6 n ARG 12 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1kj6 n VAL 13 N -2.18 1.65 -2.07 5.15 0.24 -1.12 -4.77 118.33 115.23 1kj6 n VAL 13 Ca -0.10 -0.74 -0.03 0.00 -2.04 0.00 0.00 64.34 61.43 1kj6 n VAL 13 Cb 0.59 -1.26 0.00 0.00 -1.47 0.00 0.00 33.84 31.70 1kj6 n VAL 13 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1kj6 n ARG 14 N -3.19 0.27 -2.39 7.34 1.85 -1.15 -5.14 116.66 114.25 1kj6 n ARG 14 Ca -0.24 -0.57 -0.40 0.00 -1.00 0.00 0.00 57.85 55.63 1kj6 n ARG 14 Cb 1.06 0.40 -0.04 0.00 -1.05 0.00 0.00 32.46 32.83 1kj6 n ARG 14 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1kj6 s GLY 15 N -0.55 3.04 0.00 2.89 0.00 -1.14 -4.93 107.32 106.62 1kj6 s GLY 15 Ca 0.02 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.72 1kj6 s GLY 15 CO -0.03 1.61 0.00 0.61 0.00 0.00 0.00 173.10 175.29 1kj6 n GLY 16 N 1.14 0.31 3.92 0.20 0.00 -1.26 -4.91 105.19 104.59 1kj6 n GLY 16 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1kj6 n GLY 16 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1kj6 s ARG 17 N 0.00 2.52 -0.02 1.61 1.70 -0.18 -4.96 118.95 119.62 1kj6 s ARG 17 Ca 0.00 -1.57 0.02 0.00 -0.47 0.00 0.00 55.73 53.71 1kj6 s ARG 17 Cb 0.00 -2.43 0.00 0.00 -0.57 0.00 0.00 34.95 31.96 1kj6 s ARG 17 CO 0.00 -0.33 -0.08 0.00 -1.08 0.00 0.00 175.30 173.81 1kj6 s ALA 19 N 0.15 4.13 -0.07 0.00 0.00 -1.04 -4.99 121.76 119.94 1kj6 s ALA 19 Ca -0.02 -1.65 -0.16 0.00 0.00 0.00 0.00 51.96 50.13 1kj6 s ALA 19 Cb -0.07 -1.36 -0.30 0.00 0.00 0.00 0.00 23.12 21.39 1kj6 s ALA 19 CO 0.00 -0.11 0.69 0.28 0.00 0.00 0.00 175.76 176.62 1kj6 h VAL 20 N 0.99 1.13 0.00 0.00 2.07 -1.93 -3.37 116.25 115.14 1kj6 h VAL 20 Ca -0.43 -2.48 0.00 0.00 0.82 0.00 0.00 66.70 64.61 1kj6 h VAL 20 Cb 1.26 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 33.89 1kj6 h VAL 20 CO 0.54 0.75 0.00 -0.11 0.02 0.00 0.00 177.57 178.77 1kj6 n LEU 21 N -3.88 0.00 -4.80 2.57 -0.00 -1.26 -4.50 117.00 105.13 1kj6 n LEU 21 Ca -0.22 0.00 -0.30 0.00 -0.00 0.00 0.00 56.01 55.49 1kj6 n LEU 21 Cb 0.94 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 44.30 1kj6 n LEU 21 CO 0.47 0.00 -0.24 -0.55 -0.00 0.00 0.00 177.39 177.07 1kj6 s SER 22 N 1.00 5.67 1.33 1.96 0.15 -1.26 -4.45 113.70 118.10 1kj6 s SER 22 Ca 0.00 0.02 -0.19 0.00 0.70 0.00 0.00 55.95 56.48 1kj6 s SER 22 Cb 0.00 -1.56 0.33 0.00 -1.71 0.00 0.00 66.02 63.08 1kj6 s SER 22 CO 0.00 0.15 0.97 0.00 1.20 0.00 0.00 173.24 175.57 1kj6 s LEU 24 N -7.58 4.27 0.31 0.00 2.01 -1.26 -4.98 118.68 111.45 1kj6 s LEU 24 Ca 0.69 0.75 0.25 0.00 0.01 0.00 0.00 54.13 55.83 1kj6 s LEU 24 Cb -0.17 -3.30 1.08 0.00 0.01 0.00 0.00 46.19 43.82 1kj6 s LEU 24 CO 0.60 0.06 1.75 1.55 1.01 0.00 0.00 176.35 181.32 1kj6 h PRO 25 N 3.06 0.00 -0.09 1.29 0.13 -2.02 -2.31 132.00 132.07 1kj6 h PRO 25 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1kj6 h PRO 25 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1kj6 h PRO 25 CO 0.70 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.10 1kj6 n LYS 26 N -2.36 2.01 -3.90 0.86 5.02 -1.26 -4.91 118.16 113.62 1kj6 n LYS 26 Ca 0.01 -1.48 -0.11 0.00 -2.02 0.00 0.00 58.31 54.72 1kj6 n LYS 26 Cb 0.21 -1.46 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 1kj6 n LYS 26 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1kj6 s GLU 27 N -1.91 0.31 0.43 1.97 -1.05 -0.87 -2.52 118.70 115.06 1kj6 s GLU 27 Ca 0.34 -0.31 -0.01 0.00 -0.15 0.00 0.00 54.97 54.84 1kj6 s GLU 27 Cb 0.20 0.12 -0.02 0.00 -0.44 0.00 0.00 34.13 34.00 1kj6 s GLU 27 CO 0.31 -0.06 0.66 -1.83 0.95 0.00 0.00 175.26 175.29 1kj6 s GLU 28 N -0.96 3.29 -0.02 -4.83 -1.05 -1.00 -4.35 118.70 109.77 1kj6 s GLU 28 Ca -0.11 -0.28 -0.17 0.00 -0.15 0.00 0.00 54.97 54.26 1kj6 s GLU 28 Cb -0.06 -2.54 -0.05 0.00 -0.44 0.00 0.00 34.13 31.03 1kj6 s GLU 28 CO 0.00 -0.14 0.49 -1.14 0.95 0.00 0.00 175.26 175.42 1kj6 s GLN 29 N -4.54 4.17 -0.00 -4.83 0.74 -1.25 -0.29 119.66 113.66 1kj6 s GLN 29 Ca 0.46 0.53 0.00 0.00 0.05 0.00 0.00 55.36 56.40 1kj6 s GLN 29 Cb -0.10 -3.31 -0.00 0.00 1.10 0.00 0.00 33.01 30.70 1kj6 s GLN 29 CO 0.39 0.46 0.01 0.44 -0.55 0.00 0.00 175.29 176.04 1kj6 n ILE 30 N 2.52 0.00 -2.59 -2.34 -5.35 -0.69 -4.98 119.36 105.93 1kj6 n ILE 30 Ca -0.10 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.14 1kj6 n ILE 30 Cb 0.52 0.74 0.00 0.00 -1.74 0.00 0.00 39.64 39.15 1kj6 n ILE 30 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1kj6 n GLY 31 N 1.78 0.83 2.92 3.28 0.00 -1.26 -4.77 105.19 107.97 1kj6 n GLY 31 Ca -0.00 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1kj6 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kj6 s LYS 32 N 1.39 1.36 0.06 1.61 1.02 -0.90 -1.03 119.74 123.26 1kj6 s LYS 32 Ca 0.00 -1.30 -0.24 0.00 0.02 0.00 0.00 55.97 54.46 1kj6 s LYS 32 Cb 0.00 -2.64 -0.11 0.00 -0.52 0.00 0.00 37.83 34.57 1kj6 s LYS 32 CO 0.00 -0.80 1.38 0.00 -0.92 0.00 0.00 175.35 175.00 1kj6 s SER 34 N -3.82 5.83 0.00 0.00 0.15 -1.26 -4.95 113.70 109.65 1kj6 s SER 34 Ca -0.12 -0.20 0.25 0.00 0.70 0.00 0.00 55.95 56.58 1kj6 s SER 34 Cb 0.04 -1.36 0.37 0.00 -1.71 0.00 0.00 66.02 63.36 1kj6 s SER 34 CO 0.41 -0.26 1.36 0.35 1.20 0.00 0.00 173.24 176.30 1kj6 n THR 35 N -1.44 0.00 0.06 6.45 -2.24 -1.26 -4.00 114.28 111.84 1kj6 n THR 35 Ca -0.04 -0.42 -0.21 0.00 -2.27 0.00 0.00 64.05 61.11 1kj6 n THR 35 Cb 0.58 1.25 -0.13 0.00 -2.10 0.00 0.00 70.33 69.93 1kj6 n THR 35 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1kj6 h ARG 36 N 3.99 0.52 0.00 -0.78 2.47 -1.98 -3.46 114.38 115.14 1kj6 h ARG 36 Ca 0.00 -0.68 0.00 0.00 -1.26 0.00 0.00 59.98 58.04 1kj6 h ARG 36 Cb 0.87 0.22 0.00 0.00 -1.65 0.00 0.00 29.97 29.41 1kj6 h ARG 36 CO 0.00 1.29 0.00 0.41 0.56 0.00 0.00 179.97 182.23 1kj6 n GLY 37 N 1.34 0.00 1.65 0.04 0.00 -1.26 -5.18 105.19 101.77 1kj6 n GLY 37 Ca -0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 1kj6 n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kj6 n ARG 38 N 0.00 1.14 -3.91 1.61 1.74 -1.26 -4.61 116.66 111.37 1kj6 n ARG 38 Ca 0.00 -1.69 -0.09 0.00 -0.77 0.00 0.00 57.85 55.30 1kj6 n ARG 38 Cb 0.00 0.65 -0.06 0.00 -1.02 0.00 0.00 32.46 32.03 1kj6 n ARG 38 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1kj6 s LYS 39 N -2.80 1.20 -0.14 5.56 3.01 -1.26 -4.41 119.74 120.90 1kj6 s LYS 39 Ca 0.04 -1.10 -0.03 0.00 -1.01 0.00 0.00 55.97 53.87 1kj6 s LYS 39 Cb 0.00 0.41 -0.03 0.00 -1.01 0.00 0.00 37.83 37.20 1kj6 s LYS 39 CO 0.03 -0.45 -0.04 0.00 0.51 0.00 0.00 175.35 175.39 1kj6 s ARG 42 N -1.38 1.28 0.27 0.00 3.00 0.61 -1.01 118.95 121.71 1kj6 s ARG 42 Ca 0.13 -0.90 -0.30 0.00 -1.00 0.00 0.00 55.73 53.66 1kj6 s ARG 42 Cb -0.10 -2.44 -0.14 0.00 0.00 0.00 0.00 34.95 32.28 1kj6 s ARG 42 CO 0.03 -0.67 1.24 0.54 0.00 0.00 0.00 175.30 176.45 1kj6 n ARG 43 N 4.76 1.77 -3.25 5.12 5.12 -1.26 -2.38 116.66 126.54 1kj6 n ARG 43 Ca -0.09 0.63 -0.27 0.00 -1.93 0.00 0.00 57.85 56.18 1kj6 n ARG 43 Cb 0.44 -2.17 -0.07 0.00 -1.16 0.00 0.00 32.46 29.51 1kj6 n ARG 43 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 1kj6 n LYS 44 N 1.27 2.81 0.00 5.56 0.00 -1.05 -4.94 118.16 121.82 1kj6 n LYS 44 Ca 0.10 -4.74 0.00 0.00 -0.00 0.00 0.00 58.31 53.67 1kj6 n LYS 44 Cb 0.32 -2.26 0.00 0.00 -0.00 0.00 0.00 35.03 33.09 1kj6 n LYS 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03