#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 2.94 3.25 0.00 0.00 3.00 -1.22 -4.43 118.95 122.49 1d1h s ARG 3 Ca 0.32 -0.59 0.00 0.00 0.00 0.00 0.00 55.73 55.46 1d1h s ARG 3 Cb 0.01 -4.39 0.00 0.00 0.00 0.00 0.00 34.95 30.57 1d1h s ARG 3 CO -0.22 -2.06 0.00 0.98 0.00 0.00 0.00 175.30 174.01 1d1h n TYR 4 N 8.75 -1.05 -1.70 -0.53 9.36 -1.26 -3.37 117.16 127.35 1d1h n TYR 4 Ca 0.06 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.85 1d1h n TYR 4 Cb 0.48 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.17 1d1h n TYR 4 CO 0.00 0.00 0.00 -0.11 0.22 0.00 0.00 176.86 176.97 1d1h n LEU 5 N 0.00 3.69 -0.30 2.98 7.94 -1.26 -0.94 117.00 129.11 1d1h n LEU 5 Ca 0.00 1.12 -0.04 0.00 -1.11 0.00 0.00 56.01 55.99 1d1h n LEU 5 Cb 0.00 -1.51 -0.02 0.00 0.53 0.00 0.00 43.42 42.42 1d1h n LEU 5 CO 0.00 -0.13 -0.04 0.49 -1.11 0.00 0.00 177.39 176.60 1d1h n PHE 6 N 2.49 0.00 -3.16 1.96 3.72 -0.71 -4.92 117.46 116.85 1d1h n PHE 6 Ca 0.12 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.13 1d1h n PHE 6 Cb 0.33 -1.18 -0.05 0.00 -0.94 0.00 0.00 39.48 37.64 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 -2.45 2.51 0.12 1.37 0.00 -0.12 -4.66 107.32 104.10 1d1h s GLY 7 Ca 0.00 -0.01 -0.33 0.00 0.00 0.00 0.00 44.72 44.38 1d1h s GLY 7 CO 0.00 1.02 1.73 0.61 0.00 0.00 0.00 173.10 176.45 1d1h n GLY 8 N 3.19 1.41 2.88 0.20 0.00 -1.26 -0.70 105.19 110.92 1d1h n GLY 8 Ca -0.04 0.70 -0.15 0.00 0.00 0.00 0.00 46.02 46.53 1d1h n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d1h h LYS 10 N 6.44 0.00 0.00 0.00 1.79 -1.87 -3.42 116.57 119.51 1d1h h LYS 10 Ca -0.31 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.09 1d1h h LYS 10 Cb 1.18 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.82 1d1h h LYS 10 CO 0.50 0.24 0.15 -2.37 -1.08 0.00 0.00 179.45 176.88 1d1h n THR 11 N -3.11 0.00 0.08 -0.16 5.66 -1.26 -4.79 114.28 110.70 1d1h n THR 11 Ca 0.02 -0.93 0.01 0.00 -3.05 0.00 0.00 64.05 60.10 1d1h n THR 11 Cb 0.64 0.81 0.33 0.00 -1.55 0.00 0.00 70.33 70.56 1d1h n THR 11 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 1d1h h THR 12 N 1.80 1.21 -0.33 1.09 2.02 -1.89 -2.68 112.91 114.13 1d1h h THR 12 Ca -0.26 -0.96 -0.22 0.00 0.77 0.00 0.00 66.41 65.74 1d1h h THR 12 Cb 0.98 1.26 -0.09 0.00 -1.74 0.00 0.00 68.15 68.56 1d1h h THR 12 CO 0.33 0.30 0.27 -1.54 0.37 0.00 0.00 175.52 175.25 1d1h n SER 13 N -4.22 6.08 -0.10 4.18 3.41 -1.26 -3.46 113.62 118.26 1d1h n SER 13 Ca -0.00 -2.84 0.00 0.00 -0.26 0.00 0.00 58.87 55.77 1d1h n SER 13 Cb 0.31 -1.09 0.00 0.00 -0.26 0.00 0.00 64.21 63.17 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 0.28 -4.42 4.04 9.92 -1.01 -5.03 116.55 121.11 1d1h n ASP 14 Ca 0.21 -1.36 -0.22 0.00 -0.53 0.00 0.00 54.79 52.89 1d1h n ASP 14 Cb 0.56 -0.05 -0.10 0.00 -0.64 0.00 0.00 41.12 40.88 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 3.00 -1.26 -4.41 118.16 115.49 1d1h n LYS 17 Ca 0.00 0.19 0.01 0.00 -0.00 0.00 0.00 58.31 58.51 1d1h n LYS 17 Cb 0.00 -0.66 0.06 0.00 0.00 0.00 0.00 35.03 34.43 1d1h n LYS 17 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1d1h n HIS 18 N -2.17 0.00 -3.73 5.64 8.25 -1.26 -4.68 115.22 117.28 1d1h n HIS 18 Ca 0.00 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.19 1d1h n HIS 18 Cb 0.00 -0.50 -0.03 0.00 1.12 0.00 0.00 29.99 30.58 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 -3.00 4.24 -0.07 2.41 1.43 -1.26 0.25 118.68 122.67 1d1h s LEU 19 Ca 0.01 0.35 -0.03 0.00 -1.03 0.00 0.00 54.13 53.44 1d1h s LEU 19 Cb 0.02 -3.12 0.04 0.00 0.03 0.00 0.00 46.19 43.16 1d1h s LEU 19 CO 0.05 -0.04 0.15 -0.83 0.23 0.00 0.00 176.35 175.91 1d1h s GLY 20 N -3.24 -0.02 0.12 -3.19 0.00 0.19 -4.63 107.32 96.55 1d1h s GLY 20 Ca 0.38 0.66 -0.30 0.00 0.00 0.00 0.00 44.72 45.46 1d1h s GLY 20 CO 0.29 1.07 1.21 0.00 0.00 0.00 0.00 173.10 175.67 1d1h s LYS 22 N 0.51 1.88 -0.73 0.00 3.01 -1.26 -4.29 119.74 118.87 1d1h s LYS 22 Ca 0.57 -0.39 -0.16 0.00 -1.01 0.00 0.00 55.97 54.98 1d1h s LYS 22 Cb -0.31 -2.14 -0.18 0.00 -1.01 0.00 0.00 37.83 34.18 1d1h s LYS 22 CO 0.32 -1.45 1.94 1.19 0.51 0.00 0.00 175.35 177.86 1d1h n PHE 23 N -3.04 0.53 -1.79 3.18 3.72 -1.26 -2.45 117.46 116.35 1d1h n PHE 23 Ca 0.10 -0.04 -0.08 0.00 -0.05 0.00 0.00 57.45 57.37 1d1h n PHE 23 Cb 0.60 -1.59 -0.02 0.00 -0.94 0.00 0.00 39.48 37.54 1d1h n PHE 23 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 1d1h n ARG 24 N 6.79 -1.78 -0.00 -1.08 0.63 -1.26 -4.83 116.66 115.13 1d1h n ARG 24 Ca 0.40 0.44 -0.02 0.00 -0.92 0.00 0.00 57.85 57.75 1d1h n ARG 24 Cb 0.38 -4.78 -0.01 0.00 0.45 0.00 0.00 32.46 28.50 1d1h n ARG 24 CO 0.00 0.00 0.00 0.22 -2.51 0.00 0.00 177.63 175.34 1d1h h ASP 25 N 0.00 -0.20 0.00 6.15 3.58 -1.82 -3.47 116.42 120.66 1d1h h ASP 25 Ca -0.18 0.02 0.00 0.00 0.42 0.00 0.00 57.03 57.30 1d1h h ASP 25 Cb 0.81 0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.94 1d1h h ASP 25 CO 0.24 -0.05 0.00 1.17 -2.88 0.00 0.00 179.24 177.71 1d1h n LYS 26 N -2.93 0.00 -2.04 0.28 4.81 -1.26 -5.09 118.16 111.93 1d1h n LYS 26 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.43 1d1h n LYS 26 Cb 0.04 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.09 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 0.00 0.02 -4.41 5.64 4.11 -1.26 -1.76 117.16 119.50 1d1h n TYR 27 Ca 0.00 -0.04 -0.35 0.00 -0.00 0.00 0.00 57.90 57.51 1d1h n TYR 27 Cb 0.00 -0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.24 1d1h n TYR 27 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1d1h s ALA 29 N -0.86 1.48 0.86 0.00 0.00 -0.97 -1.73 121.76 120.54 1d1h s ALA 29 Ca 0.13 -0.93 -0.15 0.00 0.00 0.00 0.00 51.96 51.01 1d1h s ALA 29 Cb -0.11 -0.28 -0.13 0.00 0.00 0.00 0.00 23.12 22.60 1d1h s ALA 29 CO 0.02 0.32 -0.73 0.91 0.00 0.00 0.00 175.76 176.28 1d1h n TRP 30 N 1.96 -4.38 -0.65 0.00 5.03 -1.26 0.53 117.44 118.66 1d1h n TRP 30 Ca -0.17 -0.01 -0.07 0.00 3.03 0.00 0.00 57.50 60.28 1d1h n TRP 30 Cb 0.54 -1.23 -0.11 0.00 -1.03 0.00 0.00 31.31 29.48 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 3.02 3.53 -4.71 -0.99 -0.08 0.68 -4.19 116.55 113.81 1d1h n ASP 31 Ca -0.02 -2.14 -0.62 0.00 -1.51 0.00 0.00 54.79 50.50 1d1h n ASP 31 Cb 0.49 -0.94 -0.08 0.00 2.34 0.00 0.00 41.12 42.93 1d1h n ASP 31 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 1d1h n PHE 32 N 2.59 1.82 -0.08 -0.67 7.35 -1.26 -4.86 117.46 122.34 1d1h n PHE 32 Ca 0.27 0.85 -0.23 0.00 -0.76 0.00 0.00 57.45 57.58 1d1h n PHE 32 Cb 0.60 -2.33 -0.12 0.00 0.35 0.00 0.00 39.48 37.98 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 4.06 1.60 0.00 -2.13 -2.24 -1.26 -5.05 114.28 109.25 1d1h n THR 33 Ca 0.28 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1d1h n THR 33 Cb 0.04 -1.84 0.00 0.00 -2.10 0.00 0.00 70.33 66.43 1d1h n THR 33 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 1d1h n PHE 34 N -3.98 -0.37 -0.83 4.78 1.16 -1.26 -5.33 117.46 111.63 1d1h n PHE 34 Ca -0.39 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.19 1d1h n PHE 34 Cb 0.87 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.74 1d1h n PHE 34 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34