#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 0.16 0.01 -0.61 1.10 -1.26 -5.14 121.20 115.46 1kj6 s ILE 2 Ca 0.00 -1.31 -0.29 0.00 -0.51 0.00 0.00 60.65 58.54 1kj6 s ILE 2 Cb 0.00 -1.19 -0.04 0.00 0.15 0.00 0.00 42.46 41.39 1kj6 s ILE 2 CO 0.00 -0.73 0.91 -0.63 -2.11 0.00 0.00 174.94 172.39 1kj6 s ILE 3 N -3.31 4.82 -0.22 2.00 1.09 -1.26 -4.95 121.20 119.37 1kj6 s ILE 3 Ca 0.01 1.93 -0.03 0.00 -1.10 0.00 0.00 60.65 61.45 1kj6 s ILE 3 Cb 0.03 -4.26 -0.12 0.00 -1.06 0.00 0.00 42.46 37.05 1kj6 s ILE 3 CO -0.08 0.22 -0.23 -3.20 -0.10 0.00 0.00 174.94 171.55 1kj6 n ASN 4 N 3.59 2.06 -4.10 3.58 5.15 -1.26 -5.00 115.26 119.27 1kj6 n ASN 4 Ca 0.03 0.04 -0.22 0.00 -0.60 0.00 0.00 54.58 53.83 1kj6 n ASN 4 Cb 0.51 -0.47 -0.15 0.00 -0.53 0.00 0.00 39.78 39.14 1kj6 n ASN 4 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1kj6 s THR 5 N -2.42 1.10 -0.53 -0.44 2.01 -1.26 -5.04 115.64 109.05 1kj6 s THR 5 Ca -0.30 -0.59 -0.03 0.00 0.31 0.00 0.00 61.69 61.08 1kj6 s THR 5 Cb 0.09 -0.92 0.14 0.00 0.01 0.00 0.00 72.50 71.82 1kj6 s THR 5 CO 0.46 0.31 2.56 0.00 -0.69 0.00 0.00 174.62 177.26 1kj6 n LEU 6 N 2.79 6.72 0.00 4.42 -0.00 -1.26 -4.59 117.00 125.08 1kj6 n LEU 6 Ca -0.15 -4.19 0.05 0.00 -0.00 0.00 0.00 56.01 51.73 1kj6 n LEU 6 Cb 0.55 -1.18 0.27 0.00 -0.00 0.00 0.00 43.42 43.05 1kj6 n LEU 6 CO 0.24 1.70 0.60 0.00 -0.00 0.00 0.00 177.39 179.93 1kj6 n GLN 7 N 0.51 0.18 0.14 1.47 6.02 -1.26 -0.33 117.38 124.10 1kj6 n GLN 7 Ca 0.49 0.16 0.12 0.00 -0.01 0.00 0.00 57.00 57.76 1kj6 n GLN 7 Cb 0.49 -1.50 0.19 0.00 1.02 0.00 0.00 30.24 30.44 1kj6 n GLN 7 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1kj6 h LYS 8 N 0.00 0.00 -0.00 -1.09 1.79 -1.95 -3.26 116.57 112.06 1kj6 h LYS 8 Ca 0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 1kj6 h LYS 8 Cb 0.08 0.00 -0.19 0.00 -1.58 0.00 0.00 32.23 30.54 1kj6 h LYS 8 CO 0.00 0.00 -0.45 2.48 -1.08 0.00 0.00 179.45 180.40 1kj6 n TYR 9 N -2.61 -0.04 0.48 -1.35 4.11 -0.61 -4.91 117.16 112.24 1kj6 n TYR 9 Ca 0.03 -0.53 0.12 0.00 -0.00 0.00 0.00 57.90 57.52 1kj6 n TYR 9 Cb 0.49 0.38 0.46 0.00 -0.00 0.00 0.00 39.34 40.67 1kj6 n TYR 9 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.86 177.84 1kj6 n TYR 10 N 0.07 0.72 0.71 -3.48 4.19 0.55 -2.26 117.16 117.65 1kj6 n TYR 10 Ca -0.20 0.26 0.07 0.00 3.31 0.00 0.00 57.90 61.34 1kj6 n TYR 10 Cb 0.80 -0.92 -0.09 0.00 0.49 0.00 0.00 39.34 39.62 1kj6 n TYR 10 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1kj6 n ARG 12 N -1.36 0.63 -0.09 0.00 5.12 -0.96 -1.22 116.66 118.78 1kj6 n ARG 12 Ca 0.03 -0.40 -0.09 0.00 -1.93 0.00 0.00 57.85 55.46 1kj6 n ARG 12 Cb 0.24 -1.49 -0.13 0.00 -1.16 0.00 0.00 32.46 29.91 1kj6 n ARG 12 CO 0.00 0.00 0.00 1.33 -1.93 0.00 0.00 177.63 177.03 1kj6 n VAL 13 N -0.84 1.18 -1.71 1.55 0.24 -1.16 -4.82 118.33 112.77 1kj6 n VAL 13 Ca 0.10 -0.72 -0.02 0.00 -2.04 0.00 0.00 64.34 61.66 1kj6 n VAL 13 Cb 0.36 -0.57 -0.02 0.00 -1.47 0.00 0.00 33.84 32.13 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 -2.66 0.00 -1.58 7.34 1.85 -1.26 -5.15 116.66 115.21 1kj6 n ARG 14 Ca -0.28 -0.34 -0.36 0.00 -1.00 0.00 0.00 57.85 55.87 1kj6 n ARG 14 Cb 1.05 0.28 0.08 0.00 -1.05 0.00 0.00 32.46 32.82 1kj6 n ARG 14 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1kj6 n GLY 15 N 0.00 0.18 0.00 2.89 0.00 -0.36 -4.96 105.19 102.94 1kj6 n GLY 15 Ca -0.09 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1kj6 n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kj6 n GLY 16 N 0.97 1.05 3.91 -0.02 0.00 -1.24 -4.97 105.19 104.91 1kj6 n GLY 16 Ca 0.15 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 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 0.47 2.24 -0.02 1.61 1.70 -0.63 -4.95 118.95 119.37 1kj6 s ARG 17 Ca 0.00 -2.06 0.05 0.00 -0.47 0.00 0.00 55.73 53.25 1kj6 s ARG 17 Cb 0.00 -2.09 -0.01 0.00 -0.57 0.00 0.00 34.95 32.28 1kj6 s ARG 17 CO 0.00 -0.68 -0.15 0.00 -1.08 0.00 0.00 175.30 173.39 1kj6 s ALA 19 N -0.28 3.86 -0.01 0.00 0.00 -1.06 -4.99 121.76 119.28 1kj6 s ALA 19 Ca 0.04 -1.35 -0.16 0.00 0.00 0.00 0.00 51.96 50.49 1kj6 s ALA 19 Cb -0.07 -1.55 -0.33 0.00 0.00 0.00 0.00 23.12 21.17 1kj6 s ALA 19 CO -0.00 0.19 0.88 0.28 0.00 0.00 0.00 175.76 177.11 1kj6 h VAL 20 N 1.24 1.23 0.00 0.00 2.07 -1.95 -3.38 116.25 115.46 1kj6 h VAL 20 Ca -0.50 -2.61 0.00 0.00 0.82 0.00 0.00 66.70 64.42 1kj6 h VAL 20 Cb 1.24 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 34.00 1kj6 h VAL 20 CO 0.60 0.80 0.00 0.18 0.02 0.00 0.00 177.57 179.16 1kj6 n LEU 21 N -3.78 0.26 -4.41 2.57 4.77 -1.26 -4.68 117.00 110.47 1kj6 n LEU 21 Ca -0.19 0.34 -0.31 0.00 -0.03 0.00 0.00 56.01 55.83 1kj6 n LEU 21 Cb 1.04 0.14 -0.13 0.00 -2.33 0.00 0.00 43.42 42.13 1kj6 n LEU 21 CO 0.55 -0.76 -0.52 -0.55 -1.33 0.00 0.00 177.39 174.78 1kj6 s SER 22 N -5.27 3.56 1.25 -1.43 0.15 -1.26 -4.68 113.70 106.01 1kj6 s SER 22 Ca 0.00 -0.48 -0.17 0.00 0.70 0.00 0.00 55.95 55.99 1kj6 s SER 22 Cb 0.00 -0.49 0.28 0.00 -1.71 0.00 0.00 66.02 64.10 1kj6 s SER 22 CO 0.00 0.26 0.73 0.00 1.20 0.00 0.00 173.24 175.43 1kj6 s LEU 24 N -5.80 4.28 0.62 0.00 2.01 -1.26 -4.98 118.68 113.56 1kj6 s LEU 24 Ca 0.63 0.98 0.40 0.00 0.01 0.00 0.00 54.13 56.16 1kj6 s LEU 24 Cb -0.18 -3.37 2.03 0.00 0.01 0.00 0.00 46.19 44.69 1kj6 s LEU 24 CO 0.61 0.05 2.23 -0.65 1.01 0.00 0.00 176.35 179.60 1kj6 h PRO 25 N 3.24 0.00 -0.15 1.29 0.11 -2.01 -1.70 132.00 132.78 1kj6 h PRO 25 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1kj6 h PRO 25 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1kj6 h PRO 25 CO 0.67 0.01 0.00 1.63 -0.21 0.00 0.00 178.00 180.10 1kj6 n LYS 26 N -3.12 1.94 -3.80 1.05 4.01 -1.26 -4.88 118.16 112.10 1kj6 n LYS 26 Ca -0.02 -1.40 -0.13 0.00 -0.51 0.00 0.00 58.31 56.26 1kj6 n LYS 26 Cb 0.16 -1.45 -0.12 0.00 -0.51 0.00 0.00 35.03 33.11 1kj6 n LYS 26 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1kj6 s GLU 27 N -1.81 0.21 0.59 1.97 -1.05 -0.64 -2.58 118.70 115.39 1kj6 s GLU 27 Ca 0.34 0.27 -0.05 0.00 -0.15 0.00 0.00 54.97 55.38 1kj6 s GLU 27 Cb 0.20 0.09 0.02 0.00 -0.44 0.00 0.00 34.13 33.99 1kj6 s GLU 27 CO 0.30 -0.03 0.90 -1.83 0.95 0.00 0.00 175.26 175.54 1kj6 s GLU 28 N 0.17 2.82 -0.01 -4.83 -1.05 -0.94 -4.17 118.70 110.68 1kj6 s GLU 28 Ca -0.01 -0.10 -0.18 0.00 -0.15 0.00 0.00 54.97 54.53 1kj6 s GLU 28 Cb -0.02 -2.29 -0.06 0.00 -0.44 0.00 0.00 34.13 31.33 1kj6 s GLU 28 CO -0.00 -0.75 0.52 -1.14 0.95 0.00 0.00 175.26 174.84 1kj6 s GLN 29 N -4.99 4.19 -0.02 -4.83 -0.44 -1.26 0.17 119.66 112.49 1kj6 s GLN 29 Ca 0.54 0.60 0.05 0.00 -2.50 0.00 0.00 55.36 54.05 1kj6 s GLN 29 Cb -0.11 -3.30 -0.07 0.00 -1.64 0.00 0.00 33.01 27.89 1kj6 s GLN 29 CO 0.44 0.48 0.08 0.44 0.50 0.00 0.00 175.29 177.24 1kj6 n ILE 30 N 2.42 0.09 0.00 -2.34 -5.35 -0.45 -4.94 119.36 108.79 1kj6 n ILE 30 Ca -0.10 -0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.24 1kj6 n ILE 30 Cb 0.51 0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 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 2.36 -0.82 3.17 3.28 0.00 -1.25 -4.69 105.19 107.23 1kj6 n GLY 31 Ca -0.03 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.11 2.31 0.00 1.61 1.02 -1.23 -1.06 119.74 122.27 1kj6 s LYS 32 Ca 0.00 -1.84 0.00 0.00 0.02 0.00 0.00 55.97 54.15 1kj6 s LYS 32 Cb 0.00 -3.79 0.00 0.00 -0.52 0.00 0.00 37.83 33.52 1kj6 s LYS 32 CO 0.00 -1.15 0.35 0.00 -0.92 0.00 0.00 175.35 173.63 1kj6 n SER 34 N -0.50 0.00 -4.36 0.00 2.88 -1.26 -4.96 113.62 105.43 1kj6 n SER 34 Ca 0.00 -0.33 -0.28 0.00 -1.33 0.00 0.00 58.87 56.93 1kj6 n SER 34 Cb 0.00 0.00 0.27 0.00 -0.75 0.00 0.00 64.21 63.73 1kj6 n SER 34 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1kj6 s THR 35 N 0.02 1.92 -0.40 2.46 -1.32 -1.26 -4.67 115.64 112.39 1kj6 s THR 35 Ca 0.00 0.00 -0.37 0.00 -1.21 0.00 0.00 61.69 60.11 1kj6 s THR 35 Cb 0.00 -2.02 -0.13 0.00 -1.51 0.00 0.00 72.50 68.84 1kj6 s THR 35 CO 0.00 0.00 2.20 0.54 -2.21 0.00 0.00 174.62 175.15 1kj6 n ARG 36 N -5.13 0.84 0.00 7.08 3.00 -1.26 -2.63 116.66 118.56 1kj6 n ARG 36 Ca 0.03 0.22 0.00 0.00 -0.01 0.00 0.00 57.85 58.09 1kj6 n ARG 36 Cb 0.55 -2.27 0.00 0.00 0.00 0.00 0.00 32.46 30.74 1kj6 n ARG 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1kj6 n GLY 37 N 6.73 0.91 2.00 -0.13 0.00 -1.26 -5.14 105.19 108.29 1kj6 n GLY 37 Ca 0.45 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.30 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 1.22 -3.93 1.61 1.74 -1.08 -4.73 116.66 111.49 1kj6 n ARG 38 Ca 0.00 -1.94 -0.09 0.00 -0.77 0.00 0.00 57.85 55.04 1kj6 n ARG 38 Cb 0.00 0.40 -0.07 0.00 -1.02 0.00 0.00 32.46 31.77 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 -3.08 1.14 -0.15 5.56 3.01 -1.26 -4.40 119.74 120.56 1kj6 s LYS 39 Ca 0.07 -1.12 -0.04 0.00 -1.01 0.00 0.00 55.97 53.86 1kj6 s LYS 39 Cb -0.01 0.38 -0.03 0.00 -1.01 0.00 0.00 37.83 37.17 1kj6 s LYS 39 CO 0.04 -0.42 -0.01 0.00 0.51 0.00 0.00 175.35 175.48 1kj6 s ARG 42 N -1.42 2.08 0.24 0.00 6.06 0.13 -1.60 118.95 124.44 1kj6 s ARG 42 Ca 0.16 -1.21 -0.31 0.00 -2.50 0.00 0.00 55.73 51.87 1kj6 s ARG 42 Cb -0.11 -2.77 -0.12 0.00 0.06 0.00 0.00 34.95 32.01 1kj6 s ARG 42 CO 0.06 -0.56 1.66 -2.13 -2.50 0.00 0.00 175.30 171.83 1kj6 n ARG 43 N 4.52 2.70 -4.12 5.12 0.63 -1.26 -2.23 116.66 122.02 1kj6 n ARG 43 Ca -0.14 0.97 -0.13 0.00 -0.92 0.00 0.00 57.85 57.63 1kj6 n ARG 43 Cb 0.43 -2.78 -0.11 0.00 0.45 0.00 0.00 32.46 30.45 1kj6 n ARG 43 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 1kj6 s LYS 44 N 0.41 0.68 0.00 -0.14 0.00 -1.07 -4.97 119.74 114.66 1kj6 s LYS 44 Ca 0.70 -0.99 0.00 0.00 0.00 0.00 0.00 55.97 55.68 1kj6 s LYS 44 Cb -0.51 -0.34 0.00 0.00 0.00 0.00 0.00 37.83 36.97 1kj6 s LYS 44 CO 0.40 0.05 0.21 1.63 0.00 0.00 0.00 175.35 177.64