#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 0.00 3.28 0.00 0.00 3.00 -1.20 -4.40 118.95 119.63 1d1h s ARG 3 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 55.73 55.61 1d1h s ARG 3 Cb 0.00 -4.13 0.00 0.00 0.00 0.00 0.00 34.95 30.82 1d1h s ARG 3 CO 0.00 -2.00 0.00 0.98 0.00 0.00 0.00 175.30 174.28 1d1h n TYR 4 N 9.05 -0.49 -1.88 -0.53 9.36 -1.26 -3.11 117.16 128.30 1d1h n TYR 4 Ca 0.04 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.84 1d1h n TYR 4 Cb 0.49 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 -1.17 0.22 0.00 0.00 176.86 175.91 1d1h s LEU 5 N 0.00 4.37 -1.12 2.98 0.20 -1.26 -2.06 118.68 121.79 1d1h s LEU 5 Ca 0.00 2.66 0.00 0.00 0.69 0.00 0.00 54.13 57.48 1d1h s LEU 5 Cb 0.00 -3.59 0.00 0.00 -0.43 0.00 0.00 46.19 42.17 1d1h s LEU 5 CO 0.00 -0.88 0.00 0.49 -0.29 0.00 0.00 176.35 175.67 1d1h n PHE 6 N 4.28 -0.10 -3.32 5.38 3.72 -0.76 -4.94 117.46 121.73 1d1h n PHE 6 Ca 0.15 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.16 1d1h n PHE 6 Cb 0.38 -2.15 -0.06 0.00 -0.94 0.00 0.00 39.48 36.71 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 -2.81 2.57 0.06 1.37 0.00 -0.88 -4.75 107.32 102.88 1d1h s GLY 7 Ca 0.00 -0.06 -0.32 0.00 0.00 0.00 0.00 44.72 44.33 1d1h s GLY 7 CO 0.00 0.48 1.82 0.61 0.00 0.00 0.00 173.10 176.01 1d1h n GLY 8 N 2.10 1.53 2.91 0.20 0.00 -1.26 -2.62 105.19 108.05 1d1h n GLY 8 Ca -0.10 0.76 -0.13 0.00 0.00 0.00 0.00 46.02 46.55 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 3.82 0.33 -3.92 0.00 4.76 -1.26 -4.50 118.16 117.39 1d1h n LYS 10 Ca -0.22 0.05 -0.09 0.00 -2.87 0.00 0.00 58.31 55.18 1d1h n LYS 10 Cb 0.54 -1.66 -0.07 0.00 -1.84 0.00 0.00 35.03 32.00 1d1h n LYS 10 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1d1h s THR 11 N -3.21 0.09 0.36 -0.18 -4.23 -1.26 -5.03 115.64 102.18 1d1h s THR 11 Ca 0.04 -1.30 0.08 0.00 -1.18 0.00 0.00 61.69 59.33 1d1h s THR 11 Cb 0.13 -1.69 0.13 0.00 1.34 0.00 0.00 72.50 72.41 1d1h s THR 11 CO 0.76 -0.39 1.86 0.74 -0.54 0.00 0.00 174.62 177.05 1d1h h THR 12 N 2.59 1.21 -0.07 3.99 2.02 -1.93 -0.92 112.91 119.81 1d1h h THR 12 Ca -0.32 -0.98 0.00 0.00 0.77 0.00 0.00 66.41 65.87 1d1h h THR 12 Cb 1.22 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.96 1d1h h THR 12 CO 0.50 0.30 0.00 -1.54 0.37 0.00 0.00 175.52 175.15 1d1h n SER 13 N -4.21 0.39 -0.95 4.18 3.41 -1.26 -3.23 113.62 111.95 1d1h n SER 13 Ca -0.01 -1.86 0.11 0.00 -0.26 0.00 0.00 58.87 56.85 1d1h n SER 13 Cb 0.32 -0.04 0.13 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.35 3.01 -4.72 4.04 9.92 -0.35 -4.97 116.55 123.13 1d1h n ASP 14 Ca 0.06 -1.93 -0.27 0.00 -0.53 0.00 0.00 54.79 52.12 1d1h n ASP 14 Cb 0.08 -0.08 -0.08 0.00 -0.64 0.00 0.00 41.12 40.40 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 0.07 0.00 5.02 -1.26 -4.41 118.16 117.57 1d1h n LYS 17 Ca 0.00 0.17 0.05 0.00 -2.02 0.00 0.00 58.31 56.51 1d1h n LYS 17 Cb 0.00 -0.62 0.26 0.00 -0.02 0.00 0.00 35.03 34.64 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 -2.12 0.31 -3.46 2.13 8.25 -1.26 -4.61 115.22 114.46 1d1h n HIS 18 Ca 0.00 0.16 -0.25 0.00 -0.26 0.00 0.00 57.72 57.37 1d1h n HIS 18 Cb 0.00 -0.75 -0.02 0.00 1.12 0.00 0.00 29.99 30.34 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 -3.63 4.07 -0.11 2.41 1.43 -1.26 0.14 118.68 121.74 1d1h s LEU 19 Ca -0.00 0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 53.50 1d1h s LEU 19 Cb 0.03 -3.29 0.05 0.00 0.03 0.00 0.00 46.19 43.02 1d1h s LEU 19 CO 0.10 -0.23 0.23 -0.83 0.23 0.00 0.00 176.35 175.86 1d1h s GLY 20 N -3.77 -0.10 -0.70 -3.19 0.00 0.16 -4.11 107.32 95.60 1d1h s GLY 20 Ca 0.40 0.89 -0.26 0.00 0.00 0.00 0.00 44.72 45.75 1d1h s GLY 20 CO 0.34 1.56 1.97 0.00 0.00 0.00 0.00 173.10 176.97 1d1h s LYS 22 N 7.26 2.30 -0.37 0.00 1.02 -1.23 -4.21 119.74 124.52 1d1h s LYS 22 Ca 0.73 -0.39 -0.03 0.00 0.02 0.00 0.00 55.97 56.30 1d1h s LYS 22 Cb -0.11 -2.25 0.11 0.00 -0.52 0.00 0.00 37.83 35.05 1d1h s LYS 22 CO 0.14 -1.09 2.50 1.19 -0.92 0.00 0.00 175.35 177.17 1d1h n PHE 23 N -2.76 1.48 0.00 3.18 3.01 -1.26 -4.34 117.46 116.77 1d1h n PHE 23 Ca 0.08 -1.93 0.00 0.00 1.01 0.00 0.00 57.45 56.61 1d1h n PHE 23 Cb 0.60 -1.21 0.00 0.00 -0.01 0.00 0.00 39.48 38.86 1d1h n PHE 23 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1d1h n ARG 24 N 0.74 0.00 -2.09 -1.08 3.00 -1.26 -4.89 116.66 111.08 1d1h n ARG 24 Ca 0.40 0.00 -0.33 0.00 -0.01 0.00 0.00 57.85 57.92 1d1h n ARG 24 Cb 0.58 0.00 0.03 0.00 0.00 0.00 0.00 32.46 33.07 1d1h n ARG 24 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1d1h n ASP 25 N 0.00 6.15 -2.64 0.55 8.00 -1.26 -4.89 116.55 122.46 1d1h n ASP 25 Ca 0.00 -3.78 -0.07 0.00 0.71 0.00 0.00 54.79 51.65 1d1h n ASP 25 Cb 0.00 -0.74 -0.01 0.00 -0.02 0.00 0.00 41.12 40.35 1d1h n ASP 25 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1d1h n LYS 26 N -0.57 -2.41 -1.90 -1.24 2.85 -1.26 -4.85 118.16 108.77 1d1h n LYS 26 Ca 0.48 0.02 -0.03 0.00 -1.05 0.00 0.00 58.31 57.73 1d1h n LYS 26 Cb 0.52 -4.05 -0.00 0.00 -0.65 0.00 0.00 35.03 30.85 1d1h n LYS 26 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 177.40 179.83 1d1h n TYR 27 N -2.50 -0.91 -4.56 5.58 0.18 -1.26 -1.56 117.16 112.14 1d1h n TYR 27 Ca 0.02 -0.23 -0.33 0.00 1.88 0.00 0.00 57.90 59.24 1d1h n TYR 27 Cb 0.44 -0.04 -0.15 0.00 -0.38 0.00 0.00 39.34 39.21 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 0.74 1.63 0.43 0.00 0.00 -0.96 -1.82 121.76 121.78 1d1h s ALA 29 Ca -0.06 -0.99 -0.21 0.00 0.00 0.00 0.00 51.96 50.70 1d1h s ALA 29 Cb -0.15 -0.32 -0.14 0.00 0.00 0.00 0.00 23.12 22.51 1d1h s ALA 29 CO 0.01 0.36 0.26 0.91 0.00 0.00 0.00 175.76 177.30 1d1h n TRP 30 N 1.93 -1.52 -1.32 0.00 5.03 -1.26 0.36 117.44 120.66 1d1h n TRP 30 Ca -0.17 0.59 0.00 0.00 3.03 0.00 0.00 57.50 60.95 1d1h n TRP 30 Cb 0.54 -1.85 0.00 0.00 -1.03 0.00 0.00 31.31 28.96 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 1.84 -1.77 -2.48 -0.99 -0.08 0.37 -4.61 116.55 108.84 1d1h n ASP 31 Ca 0.11 0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 53.15 1d1h n ASP 31 Cb 0.41 -0.88 -0.09 0.00 2.34 0.00 0.00 41.12 42.90 1d1h n ASP 31 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 1d1h n PHE 32 N 0.08 1.19 -0.01 -0.67 -1.74 -1.26 -3.98 117.46 111.06 1d1h n PHE 32 Ca 0.00 -1.96 0.02 0.00 -0.56 0.00 0.00 57.45 54.96 1d1h n PHE 32 Cb 0.00 -1.59 -0.07 0.00 1.52 0.00 0.00 39.48 39.34 1d1h n PHE 32 CO 0.00 0.00 0.00 2.41 -0.56 0.00 0.00 176.76 178.61 1d1h n THR 33 N 1.74 0.15 -0.47 1.97 -1.04 -1.26 -4.96 114.28 110.41 1d1h n THR 33 Ca 0.50 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 62.27 1d1h n THR 33 Cb 0.63 0.02 -0.00 0.00 -1.82 0.00 0.00 70.33 69.16 1d1h n THR 33 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1d1h n PHE 34 N -1.95 -1.21 -1.34 -1.42 1.16 -1.26 -5.17 117.46 106.28 1d1h n PHE 34 Ca -0.05 0.02 0.00 0.00 -1.87 0.00 0.00 57.45 55.55 1d1h n PHE 34 Cb 0.38 -0.01 0.00 0.00 -1.61 0.00 0.00 39.48 38.24 1d1h n PHE 34 CO 0.00 0.00 0.00 -1.13 -1.87 0.00 0.00 176.76 173.76