#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 5.59 3.31 0.00 0.00 3.00 -1.20 -4.43 118.95 125.22 1d1h s ARG 3 Ca 0.96 -0.13 0.00 0.00 0.00 0.00 0.00 55.73 56.57 1d1h s ARG 3 Cb -1.05 -4.11 0.00 0.00 0.00 0.00 0.00 34.95 29.79 1d1h s ARG 3 CO 0.44 -1.89 0.00 0.98 0.00 0.00 0.00 175.30 174.83 1d1h n TYR 4 N 8.70 -0.84 -1.69 -0.53 9.36 -1.26 -3.00 117.16 127.90 1d1h n TYR 4 Ca 0.04 0.00 -0.44 0.00 3.32 0.00 0.00 57.90 60.82 1d1h n TYR 4 Cb 0.49 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.16 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 3.78 -1.22 2.98 0.00 -1.26 -1.44 117.00 119.83 1d1h n LEU 5 Ca 0.00 1.02 -0.11 0.00 0.00 0.00 0.00 56.01 56.92 1d1h n LEU 5 Cb 0.00 -1.51 -0.01 0.00 0.00 0.00 0.00 43.42 41.90 1d1h n LEU 5 CO 0.00 0.06 -0.14 0.49 0.00 0.00 0.00 177.39 177.80 1d1h n PHE 6 N 5.02 -0.48 -3.53 1.96 3.72 -0.83 -4.93 117.46 118.39 1d1h n PHE 6 Ca 0.18 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.21 1d1h n PHE 6 Cb 0.34 -2.53 -0.06 0.00 -0.94 0.00 0.00 39.48 36.29 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 -2.54 2.34 -0.04 1.37 0.00 -0.52 -4.70 107.32 103.24 1d1h s GLY 7 Ca 0.00 -0.34 -0.29 0.00 0.00 0.00 0.00 44.72 44.09 1d1h s GLY 7 CO 0.00 0.27 2.03 -0.32 0.00 0.00 0.00 173.10 175.08 1d1h s GLY 8 N -0.33 1.19 -0.02 0.20 0.00 -1.25 -1.69 107.32 105.41 1d1h s GLY 8 Ca 0.21 1.16 0.04 0.00 0.00 0.00 0.00 44.72 46.13 1d1h s GLY 8 CO 0.09 3.56 -0.14 0.00 0.00 0.00 0.00 173.10 176.60 1d1h h LYS 10 N 5.98 0.00 0.00 0.00 1.79 -1.86 -3.40 116.57 119.08 1d1h h LYS 10 Ca -0.34 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 57.95 1d1h h LYS 10 Cb 1.16 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.78 1d1h h LYS 10 CO 0.48 0.26 -0.01 -2.37 -1.08 0.00 0.00 179.45 176.74 1d1h n THR 11 N -3.00 0.00 0.10 -0.16 5.66 -1.26 -4.49 114.28 111.13 1d1h n THR 11 Ca -0.02 -1.33 -0.02 0.00 -3.05 0.00 0.00 64.05 59.63 1d1h n THR 11 Cb 0.70 0.93 0.23 0.00 -1.55 0.00 0.00 70.33 70.64 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 1.88 1.31 -0.09 1.09 2.02 -1.93 -2.23 112.91 114.96 1d1h h THR 12 Ca -0.26 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 65.43 1d1h h THR 12 Cb 1.05 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 1d1h h THR 12 CO 0.34 0.45 0.00 -0.24 0.37 0.00 0.00 175.52 176.44 1d1h n SER 13 N -4.03 0.53 -1.30 4.18 2.88 -1.26 -3.27 113.62 111.35 1d1h n SER 13 Ca -0.01 -1.89 0.12 0.00 -1.33 0.00 0.00 58.87 55.76 1d1h n SER 13 Cb 0.47 -0.06 0.29 0.00 -0.75 0.00 0.00 64.21 64.16 1d1h n SER 13 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1d1h n ASP 14 N -0.26 3.83 -4.59 -3.46 9.92 -0.84 -4.96 116.55 116.19 1d1h n ASP 14 Ca 0.06 -2.00 -0.29 0.00 -0.53 0.00 0.00 54.79 52.03 1d1h n ASP 14 Cb 0.10 -0.43 -0.09 0.00 -0.64 0.00 0.00 41.12 40.06 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 0.11 0.00 4.01 -1.26 -4.38 118.16 116.64 1d1h n LYS 17 Ca 0.00 0.20 0.07 0.00 -0.51 0.00 0.00 58.31 58.07 1d1h n LYS 17 Cb 0.00 -0.68 0.39 0.00 -0.51 0.00 0.00 35.03 34.23 1d1h n LYS 17 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1d1h n HIS 18 N -2.24 0.49 -3.57 2.13 8.25 -1.26 -4.65 115.22 114.36 1d1h n HIS 18 Ca 0.00 0.26 -0.26 0.00 -0.26 0.00 0.00 57.72 57.46 1d1h n HIS 18 Cb 0.00 -0.89 -0.02 0.00 1.12 0.00 0.00 29.99 30.20 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 -4.01 4.14 -0.12 2.41 1.43 -1.26 -1.10 118.68 120.17 1d1h s LEU 19 Ca -0.02 0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 53.45 1d1h s LEU 19 Cb 0.04 -3.23 0.06 0.00 0.03 0.00 0.00 46.19 43.09 1d1h s LEU 19 CO 0.13 -0.15 0.25 -0.83 0.23 0.00 0.00 176.35 175.98 1d1h s GLY 20 N -3.57 -0.12 0.06 -3.19 0.00 0.53 -4.54 107.32 96.49 1d1h s GLY 20 Ca 0.39 0.95 -0.31 0.00 0.00 0.00 0.00 44.72 45.75 1d1h s GLY 20 CO 0.32 1.67 1.64 0.00 0.00 0.00 0.00 173.10 176.72 1d1h s LYS 22 N 2.71 3.38 -1.38 0.00 1.02 -1.25 -4.29 119.74 119.93 1d1h s LYS 22 Ca 0.73 -0.70 -0.14 0.00 0.02 0.00 0.00 55.97 55.88 1d1h s LYS 22 Cb -0.39 -4.73 0.02 0.00 -0.52 0.00 0.00 37.83 32.21 1d1h s LYS 22 CO 0.32 -2.15 0.36 0.34 -0.92 0.00 0.00 175.35 173.30 1d1h n PHE 23 N 9.00 -1.41 -2.60 3.18 -0.00 -1.26 0.11 117.46 124.49 1d1h n PHE 23 Ca 0.17 0.43 -0.04 0.00 -0.00 0.00 0.00 57.45 58.00 1d1h n PHE 23 Cb 0.50 -2.99 -0.00 0.00 -0.00 0.00 0.00 39.48 36.98 1d1h n PHE 23 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1d1h n ARG 24 N -4.70 -2.79 0.00 -4.13 1.74 -1.26 -4.82 116.66 100.71 1d1h n ARG 24 Ca -0.23 0.11 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 1d1h n ARG 24 Cb 0.64 -4.63 0.00 0.00 -1.02 0.00 0.00 32.46 27.45 1d1h n ARG 24 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1d1h n ASP 25 N -1.61 0.00 0.04 0.55 2.03 0.31 -4.92 116.55 112.95 1d1h n ASP 25 Ca -0.02 0.94 0.00 0.00 0.52 0.00 0.00 54.79 56.23 1d1h n ASP 25 Cb 0.52 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 1d1h n ASP 25 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1d1h n LYS 26 N -2.16 0.00 -2.11 -0.67 0.00 -1.26 -5.05 118.16 106.92 1d1h n LYS 26 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 58.31 58.26 1d1h n LYS 26 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.03 1d1h n LYS 26 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.40 179.88 1d1h n TYR 27 N -2.54 -0.88 -4.84 5.64 0.18 -1.26 -0.87 117.16 112.59 1d1h n TYR 27 Ca 0.00 -0.45 -0.33 0.00 1.88 0.00 0.00 57.90 59.00 1d1h n TYR 27 Cb 0.00 -0.08 -0.14 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 -0.13 1.75 -0.38 0.00 0.00 -0.96 -1.96 121.76 120.07 1d1h s ALA 29 Ca -0.01 -1.04 -0.42 0.00 0.00 0.00 0.00 51.96 50.48 1d1h s ALA 29 Cb -0.14 -0.35 -0.17 0.00 0.00 0.00 0.00 23.12 22.47 1d1h s ALA 29 CO 0.03 0.39 1.76 0.91 0.00 0.00 0.00 175.76 178.86 1d1h n TRP 30 N 1.91 1.86 -2.21 0.00 5.03 -1.26 -0.35 117.44 122.43 1d1h n TRP 30 Ca -0.17 0.74 0.00 0.00 3.03 0.00 0.00 57.50 61.10 1d1h n TRP 30 Cb 0.53 -2.38 0.00 0.00 -1.03 0.00 0.00 31.31 28.44 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 5.41 0.00 -4.32 -0.99 2.03 -0.26 -4.75 116.55 113.67 1d1h n ASP 31 Ca 0.31 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.30 1d1h n ASP 31 Cb 0.06 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.31 1d1h n ASP 31 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1d1h s PHE 32 N -2.65 2.74 -0.13 -0.67 5.36 -0.98 -4.94 117.98 116.70 1d1h s PHE 32 Ca 0.00 -0.81 -0.06 0.00 -0.96 0.00 0.00 56.93 55.10 1d1h s PHE 32 Cb 0.00 -1.82 0.06 0.00 -0.34 0.00 0.00 43.02 40.92 1d1h s PHE 32 CO 0.00 -0.31 0.30 0.95 -1.46 0.00 0.00 175.22 174.70 1d1h s THR 33 N 0.43 -0.18 0.00 0.12 -4.23 -1.26 -3.99 115.64 106.54 1d1h s THR 33 Ca -0.12 0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.56 1d1h s THR 33 Cb -0.16 -0.47 0.00 0.00 1.34 0.00 0.00 72.50 73.21 1d1h s THR 33 CO 0.06 0.07 0.00 0.33 -0.54 0.00 0.00 174.62 174.54 1d1h n PHE 34 N 4.60 0.00 -1.41 3.99 7.35 -1.26 -5.03 117.46 125.70 1d1h n PHE 34 Ca -0.19 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.50 1d1h n PHE 34 Cb 0.52 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.35 1d1h n PHE 34 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45