#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1h s ARG 3 N -0.83 2.82 1.27 0.00 1.81 -1.15 -4.33 118.95 118.53 1d1h s ARG 3 Ca -0.22 0.18 -0.19 0.00 -1.72 0.00 0.00 55.73 53.78 1d1h s ARG 3 Cb 0.01 -4.47 0.31 0.00 -0.45 0.00 0.00 34.95 30.35 1d1h s ARG 3 CO 0.70 -2.64 1.03 -0.47 -0.68 0.00 0.00 175.30 173.25 1d1h s TYR 4 N 8.12 0.26 -0.49 -0.53 6.14 -1.26 -3.01 117.35 126.58 1d1h s TYR 4 Ca 0.58 0.62 -0.44 0.00 0.64 0.00 0.00 57.07 58.47 1d1h s TYR 4 Cb -0.10 -3.21 -0.18 0.00 0.42 0.00 0.00 41.96 38.89 1d1h s TYR 4 CO 0.15 -4.23 2.08 1.28 0.64 0.00 0.00 175.55 175.47 1d1h n LEU 5 N -5.07 0.92 -0.28 6.97 4.77 -1.26 -0.38 117.00 122.67 1d1h n LEU 5 Ca 0.11 0.72 0.00 0.00 -0.03 0.00 0.00 56.01 56.81 1d1h n LEU 5 Cb 0.59 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1d1h n LEU 5 CO 0.46 -0.77 0.00 0.49 -1.33 0.00 0.00 177.39 176.24 1d1h n PHE 6 N 7.29 0.00 -4.72 -1.77 3.72 -0.85 -4.97 117.46 116.16 1d1h n PHE 6 Ca 0.51 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.58 1d1h n PHE 6 Cb -0.02 -0.66 -0.14 0.00 -0.94 0.00 0.00 39.48 37.72 1d1h n PHE 6 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1d1h s GLY 7 N -2.66 1.57 -0.22 1.37 0.00 0.49 -4.82 107.32 103.05 1d1h s GLY 7 Ca 0.00 -0.88 -0.33 0.00 0.00 0.00 0.00 44.72 43.51 1d1h s GLY 7 CO 0.00 -0.21 2.09 0.61 0.00 0.00 0.00 173.10 175.59 1d1h n GLY 8 N 3.42 0.98 3.07 0.20 0.00 -1.26 -2.48 105.19 109.12 1d1h n GLY 8 Ca -0.18 0.87 -0.19 0.00 0.00 0.00 0.00 46.02 46.52 1d1h n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d1h n LYS 10 N 2.55 0.55 -3.99 0.00 5.02 -1.26 -4.65 118.16 116.37 1d1h n LYS 10 Ca -0.15 -0.12 -0.09 0.00 -2.02 0.00 0.00 58.31 55.93 1d1h n LYS 10 Cb 0.56 -1.56 -0.08 0.00 -0.02 0.00 0.00 35.03 33.93 1d1h n LYS 10 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1d1h s THR 11 N -3.41 0.12 0.40 -0.18 -4.23 -1.26 -4.98 115.64 102.10 1d1h s THR 11 Ca -0.04 -1.51 0.10 0.00 -1.18 0.00 0.00 61.69 59.06 1d1h s THR 11 Cb 0.14 -1.68 0.18 0.00 1.34 0.00 0.00 72.50 72.47 1d1h s THR 11 CO 0.88 -0.56 1.95 0.74 -0.54 0.00 0.00 174.62 177.10 1d1h h THR 12 N 2.78 1.16 -0.01 3.99 2.02 -1.94 0.06 112.91 120.96 1d1h h THR 12 Ca -0.33 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.17 1d1h h THR 12 Cb 1.20 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.78 1d1h h THR 12 CO 0.56 0.21 0.00 -1.54 0.37 0.00 0.00 175.52 175.12 1d1h n SER 13 N -4.31 0.10 -1.08 4.18 3.41 -1.26 -3.12 113.62 111.55 1d1h n SER 13 Ca -0.01 -1.31 0.11 0.00 -0.26 0.00 0.00 58.87 57.40 1d1h n SER 13 Cb 0.24 -0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.45 1d1h n SER 13 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1d1h n ASP 14 N -0.78 3.17 -4.59 4.04 9.92 0.01 -4.94 116.55 123.37 1d1h n ASP 14 Ca 0.17 -1.96 -0.27 0.00 -0.53 0.00 0.00 54.79 52.20 1d1h n ASP 14 Cb 0.10 -0.32 -0.11 0.00 -0.64 0.00 0.00 41.12 40.14 1d1h n ASP 14 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1d1h n LYS 17 N 0.00 0.00 0.00 0.00 5.02 -1.26 -4.43 118.16 117.49 1d1h n LYS 17 Ca 0.00 0.16 0.02 0.00 -2.02 0.00 0.00 58.31 56.47 1d1h n LYS 17 Cb 0.00 -0.60 0.09 0.00 -0.02 0.00 0.00 35.03 34.49 1d1h n LYS 17 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1d1h n HIS 18 N -2.10 0.01 -2.76 2.13 8.25 -1.26 -4.71 115.22 114.79 1d1h n HIS 18 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.23 1d1h n HIS 18 Cb 0.00 -0.51 0.02 0.00 1.12 0.00 0.00 29.99 30.63 1d1h n HIS 18 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1d1h s LEU 19 N -3.02 3.43 -0.20 2.41 1.43 -1.26 -0.83 118.68 120.64 1d1h s LEU 19 Ca 0.02 0.26 -0.09 0.00 -1.03 0.00 0.00 54.13 53.29 1d1h s LEU 19 Cb 0.02 -3.12 0.08 0.00 0.03 0.00 0.00 46.19 43.21 1d1h s LEU 19 CO 0.07 -0.93 0.46 -0.83 0.23 0.00 0.00 176.35 175.34 1d1h s GLY 20 N -4.31 -0.40 0.30 -3.19 0.00 0.34 -4.66 107.32 95.39 1d1h s GLY 20 Ca 0.52 1.65 -0.29 0.00 0.00 0.00 0.00 44.72 46.61 1d1h s GLY 20 CO 0.39 2.21 1.24 0.00 0.00 0.00 0.00 173.10 176.95 1d1h s LYS 22 N -1.47 2.46 -0.21 0.00 3.01 -1.24 -4.47 119.74 117.81 1d1h s LYS 22 Ca 0.48 -1.01 -0.30 0.00 -1.01 0.00 0.00 55.97 54.14 1d1h s LYS 22 Cb -0.37 -2.63 -0.35 0.00 -1.01 0.00 0.00 37.83 33.48 1d1h s LYS 22 CO 0.47 -0.39 1.69 1.97 0.51 0.00 0.00 175.35 179.60 1d1h n PHE 23 N 4.58 0.20 0.00 3.18 1.16 -1.26 -1.70 117.46 123.62 1d1h n PHE 23 Ca -0.17 -0.46 0.00 0.00 -1.87 0.00 0.00 57.45 54.95 1d1h n PHE 23 Cb 0.46 -1.11 0.00 0.00 -1.61 0.00 0.00 39.48 37.22 1d1h n PHE 23 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1d1h n ARG 24 N 8.01 0.00 0.04 3.97 5.12 -1.26 -4.97 116.66 127.57 1d1h n ARG 24 Ca 0.46 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 56.35 1d1h n ARG 24 Cb 0.43 0.00 0.22 0.00 -1.16 0.00 0.00 32.46 31.95 1d1h n ARG 24 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1d1h h ASP 25 N 0.00 0.42 0.00 0.55 5.19 -1.76 -3.46 116.42 117.36 1d1h h ASP 25 Ca 0.00 -0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.27 1d1h h ASP 25 Cb 0.00 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.39 1d1h h ASP 25 CO 0.00 0.68 0.00 1.17 -3.12 0.00 0.00 179.24 177.97 1d1h n LYS 26 N -4.12 0.00 -2.36 3.56 4.81 -1.21 -4.97 118.16 113.86 1d1h n LYS 26 Ca -0.01 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.36 1d1h n LYS 26 Cb 0.40 -0.49 -0.01 0.00 0.02 0.00 0.00 35.03 34.96 1d1h n LYS 26 CO 0.00 0.00 0.00 2.48 1.17 0.00 0.00 177.40 181.05 1d1h n TYR 27 N -1.52 -0.64 -4.20 5.64 0.18 -1.26 -2.20 117.16 113.14 1d1h n TYR 27 Ca 0.00 -0.65 -0.34 0.00 1.88 0.00 0.00 57.90 58.79 1d1h n TYR 27 Cb 0.00 -0.11 -0.11 0.00 -0.38 0.00 0.00 39.34 38.74 1d1h n TYR 27 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1d1h s ALA 29 N 0.46 1.77 0.49 0.00 0.00 -0.96 -2.00 121.76 121.52 1d1h s ALA 29 Ca -0.01 -1.05 -0.19 0.00 0.00 0.00 0.00 51.96 50.72 1d1h s ALA 29 Cb -0.14 -0.35 -0.13 0.00 0.00 0.00 0.00 23.12 22.50 1d1h s ALA 29 CO 0.02 0.40 0.19 0.91 0.00 0.00 0.00 175.76 177.28 1d1h n TRP 30 N 1.92 -1.81 0.00 0.00 5.03 -1.26 -0.51 117.44 120.81 1d1h n TRP 30 Ca -0.17 0.50 0.00 0.00 3.03 0.00 0.00 57.50 60.86 1d1h n TRP 30 Cb 0.53 -1.82 0.00 0.00 -1.03 0.00 0.00 31.31 28.99 1d1h n TRP 30 CO 0.00 0.00 0.00 -3.47 -0.03 0.00 0.00 177.69 174.19 1d1h n ASP 31 N 1.73 0.00 0.00 -0.99 2.03 -0.01 -4.63 116.55 114.68 1d1h n ASP 31 Ca 0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.41 1d1h n ASP 31 Cb 0.45 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.85 1d1h n ASP 31 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1d1h n PHE 32 N 0.00 0.00 0.00 -0.67 7.35 -1.26 -4.73 117.46 118.15 1d1h n PHE 32 Ca 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 1d1h n PHE 32 Cb 0.00 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.83 1d1h n PHE 32 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1d1h n THR 33 N -0.08 0.00 -0.38 -2.13 -2.24 -1.26 -3.20 114.28 104.98 1d1h n THR 33 Ca 0.00 0.00 0.32 0.00 -2.27 0.00 0.00 64.05 62.10 1d1h n THR 33 Cb 0.00 0.00 0.53 0.00 -2.10 0.00 0.00 70.33 68.76 1d1h n THR 33 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1d1h n PHE 34 N 0.00 0.46 -0.62 4.78 -0.00 -1.26 -5.29 117.46 115.54 1d1h n PHE 34 Ca 0.00 0.47 0.00 0.00 -0.00 0.00 0.00 57.45 57.92 1d1h n PHE 34 Cb 0.00 -0.87 0.00 0.00 -0.00 0.00 0.00 39.48 38.61 1d1h n PHE 34 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21