#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 3.16 0.00 0.00 3.00 -1.15 -4.40 118.95 119.56 1d1h s ARG 3 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 55.73 55.01 1d1h s ARG 3 Cb 0.00 -4.26 0.00 0.00 0.00 0.00 0.00 34.95 30.69 1d1h s ARG 3 CO 0.00 -1.91 0.00 0.98 0.00 0.00 0.00 175.30 174.37 1d1h n TYR 4 N 8.12 -0.77 -1.68 -0.53 9.36 -1.26 -3.44 117.16 126.95 1d1h n TYR 4 Ca -0.00 0.00 -0.44 0.00 3.32 0.00 0.00 57.90 60.77 1d1h n TYR 4 Cb 0.47 0.00 -0.02 0.00 -0.63 0.00 0.00 39.34 39.15 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 3.27 -0.66 2.98 0.00 -1.26 -0.81 117.00 120.52 1d1h n LEU 5 Ca 0.00 1.15 -0.09 0.00 0.00 0.00 0.00 56.01 57.07 1d1h n LEU 5 Cb 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 43.42 41.93 1d1h n LEU 5 CO 0.00 -0.42 -0.08 0.49 0.00 0.00 0.00 177.39 177.38 1d1h n PHE 6 N 1.81 0.00 -2.82 1.96 3.72 -0.79 -4.90 117.46 116.44 1d1h n PHE 6 Ca 0.11 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.09 1d1h n PHE 6 Cb 0.32 -2.07 -0.03 0.00 -0.94 0.00 0.00 39.48 36.76 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 -2.51 2.51 -0.20 1.37 0.00 0.01 -4.68 107.32 103.82 1d1h s GLY 7 Ca 0.00 0.29 -0.29 0.00 0.00 0.00 0.00 44.72 44.72 1d1h s GLY 7 CO 0.00 1.63 2.02 -0.32 0.00 0.00 0.00 173.10 176.44 1d1h s GLY 8 N 1.02 0.81 -0.01 0.20 0.00 -1.26 -2.06 107.32 106.02 1d1h s GLY 8 Ca 0.45 0.74 0.07 0.00 0.00 0.00 0.00 44.72 45.97 1d1h s GLY 8 CO 0.20 3.55 -0.23 0.00 0.00 0.00 0.00 173.10 176.62 1d1h h LYS 10 N 5.25 0.00 0.00 0.00 1.63 -1.87 -3.43 116.57 118.14 1d1h h LYS 10 Ca -0.45 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.32 1d1h h LYS 10 Cb 1.13 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.77 1d1h h LYS 10 CO 0.47 0.11 0.21 -2.37 -3.45 0.00 0.00 179.45 174.42 1d1h n THR 11 N -3.05 0.00 0.14 1.00 5.66 -1.26 -5.03 114.28 111.75 1d1h n THR 11 Ca 0.02 -0.82 0.02 0.00 -3.05 0.00 0.00 64.05 60.22 1d1h n THR 11 Cb 0.58 0.80 0.38 0.00 -1.55 0.00 0.00 70.33 70.55 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 -0.30 1.09 2.02 -1.93 -2.09 112.91 114.71 1d1h h THR 12 Ca -0.27 -0.96 -0.10 0.00 0.77 0.00 0.00 66.41 65.85 1d1h h THR 12 Cb 1.00 1.38 -0.06 0.00 -1.74 0.00 0.00 68.15 68.73 1d1h h THR 12 CO 0.34 0.29 0.13 -0.24 0.37 0.00 0.00 175.52 176.41 1d1h n SER 13 N -4.21 3.04 -0.21 4.18 2.88 -1.26 -3.54 113.62 114.50 1d1h n SER 13 Ca -0.01 -2.48 0.02 0.00 -1.33 0.00 0.00 58.87 55.07 1d1h n SER 13 Cb 0.32 -0.60 0.03 0.00 -0.75 0.00 0.00 64.21 63.21 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 0.05 1.66 -4.69 -3.46 9.92 -0.79 -5.03 116.55 114.21 1d1h n ASP 14 Ca 0.17 -1.42 -0.25 0.00 -0.53 0.00 0.00 54.79 52.77 1d1h n ASP 14 Cb 0.78 -0.03 -0.08 0.00 -0.64 0.00 0.00 41.12 41.16 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 4.81 -1.26 -4.42 118.16 117.29 1d1h n LYS 17 Ca 0.00 0.16 0.01 0.00 -0.87 0.00 0.00 58.31 57.62 1d1h n LYS 17 Cb 0.00 -0.63 0.05 0.00 0.02 0.00 0.00 35.03 34.47 1d1h n LYS 17 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1d1h n HIS 18 N -2.16 0.00 -3.64 5.64 8.25 -1.26 -4.68 115.22 117.37 1d1h n HIS 18 Ca 0.00 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.26 1d1h n HIS 18 Cb 0.00 -0.49 -0.01 0.00 1.12 0.00 0.00 29.99 30.61 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 -2.98 4.08 -0.17 2.41 1.02 -1.26 0.07 118.68 121.84 1d1h s LEU 19 Ca 0.01 -0.11 -0.13 0.00 0.02 0.00 0.00 54.13 53.92 1d1h s LEU 19 Cb 0.01 -2.78 0.05 0.00 0.02 0.00 0.00 46.19 43.49 1d1h s LEU 19 CO 0.04 -0.31 0.44 -0.83 0.02 0.00 0.00 176.35 175.71 1d1h s GLY 20 N -4.11 -0.34 -0.21 -3.19 0.00 0.09 -4.64 107.32 94.92 1d1h s GLY 20 Ca 0.41 1.41 -0.29 0.00 0.00 0.00 0.00 44.72 46.25 1d1h s GLY 20 CO 0.30 1.37 1.35 0.00 0.00 0.00 0.00 173.10 176.12 1d1h s LYS 22 N 3.90 3.00 0.90 0.00 1.02 -1.22 -4.36 119.74 122.98 1d1h s LYS 22 Ca 0.59 -0.83 -0.17 0.00 0.02 0.00 0.00 55.97 55.57 1d1h s LYS 22 Cb -0.21 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.36 1d1h s LYS 22 CO 0.20 -0.24 -0.63 1.19 -0.92 0.00 0.00 175.35 174.95 1d1h n PHE 23 N 4.64 -1.47 0.00 3.18 3.72 -1.26 -3.33 117.46 122.94 1d1h n PHE 23 Ca -0.20 0.48 0.00 0.00 -0.05 0.00 0.00 57.45 57.68 1d1h n PHE 23 Cb 0.49 -1.41 0.00 0.00 -0.94 0.00 0.00 39.48 37.63 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 0.95 0.00 -0.04 -1.08 0.63 -1.26 -4.42 116.66 111.43 1d1h n ARG 24 Ca 0.00 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.89 1d1h n ARG 24 Cb 0.49 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.34 1d1h n ARG 24 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1d1h n ASP 25 N 2.15 3.16 0.00 6.15 8.00 -1.23 -5.01 116.55 129.77 1d1h n ASP 25 Ca 0.00 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.49 1d1h n ASP 25 Cb 0.00 0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.61 1d1h n ASP 25 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1d1h n LYS 26 N -2.38 0.00 -0.09 -1.24 4.81 -1.21 -5.01 118.16 113.04 1d1h n LYS 26 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.31 1d1h n LYS 26 Cb 0.73 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.78 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 -2.00 -2.91 -4.88 5.64 4.11 -1.26 -1.64 117.16 114.22 1d1h n TYR 27 Ca 0.00 0.00 -0.32 0.00 -0.00 0.00 0.00 57.90 57.58 1d1h n TYR 27 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 39.34 39.21 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 -0.78 0.13 0.41 0.00 0.00 -0.91 -1.88 121.76 118.73 1d1h s ALA 29 Ca 0.12 -0.43 -0.22 0.00 0.00 0.00 0.00 51.96 51.43 1d1h s ALA 29 Cb -0.10 0.09 -0.13 0.00 0.00 0.00 0.00 23.12 22.98 1d1h s ALA 29 CO 0.02 -0.10 0.47 0.91 0.00 0.00 0.00 175.76 177.06 1d1h n TRP 30 N 2.03 -0.77 0.00 0.00 5.03 -1.26 -0.73 117.44 121.73 1d1h n TRP 30 Ca -0.20 0.62 0.00 0.00 3.03 0.00 0.00 57.50 60.95 1d1h n TRP 30 Cb 0.56 -1.95 0.00 0.00 -1.03 0.00 0.00 31.31 28.89 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 1.49 0.00 0.00 -0.99 -0.08 0.11 -4.70 116.55 112.38 1d1h n ASP 31 Ca 0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.40 1d1h n ASP 31 Cb 0.39 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.85 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 0.00 0.00 -4.27 -0.67 7.35 -1.26 -4.73 117.46 113.89 1d1h n PHE 32 Ca 0.00 0.00 -0.19 0.00 -0.76 0.00 0.00 57.45 56.50 1d1h n PHE 32 Cb 0.00 0.00 -0.13 0.00 0.35 0.00 0.00 39.48 39.70 1d1h n PHE 32 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1d1h s THR 33 N 0.00 1.14 0.00 -2.13 -4.23 -1.26 -4.84 115.64 104.32 1d1h s THR 33 Ca 0.00 -1.17 0.00 0.00 -1.18 0.00 0.00 61.69 59.34 1d1h s THR 33 Cb 0.00 -1.07 0.00 0.00 1.34 0.00 0.00 72.50 72.77 1d1h s THR 33 CO 0.00 -0.10 0.00 0.49 -0.54 0.00 0.00 174.62 174.47 1d1h n PHE 34 N 1.57 -0.76 1.68 3.99 3.72 -1.26 -5.28 117.46 121.12 1d1h n PHE 34 Ca -0.20 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.34 1d1h n PHE 34 Cb 0.54 0.14 0.80 0.00 -0.94 0.00 0.00 39.48 40.02 1d1h n PHE 34 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16