#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 -0.97 3.30 1.19 0.00 3.00 -1.23 -4.44 118.95 119.81 1d1h s ARG 3 Ca -0.11 -0.12 -0.17 0.00 0.00 0.00 0.00 55.73 55.33 1d1h s ARG 3 Cb 0.01 -4.12 0.28 0.00 0.00 0.00 0.00 34.95 31.11 1d1h s ARG 3 CO 0.29 -1.95 1.05 -0.47 0.00 0.00 0.00 175.30 174.22 1d1h s TYR 4 N 5.30 0.85 -0.22 -0.53 6.14 -1.26 -3.22 117.35 124.41 1d1h s TYR 4 Ca 0.37 0.75 -0.28 0.00 0.64 0.00 0.00 57.07 58.55 1d1h s TYR 4 Cb -0.09 -3.23 -0.12 0.00 0.42 0.00 0.00 41.96 38.94 1d1h s TYR 4 CO 0.18 -3.86 0.90 -0.11 0.64 0.00 0.00 175.55 173.30 1d1h n LEU 5 N -4.82 0.54 -0.45 6.97 0.00 -1.26 -0.07 117.00 117.90 1d1h n LEU 5 Ca 0.09 0.73 -0.04 0.00 0.00 0.00 0.00 56.01 56.79 1d1h n LEU 5 Cb 0.58 -0.55 -0.01 0.00 0.00 0.00 0.00 43.42 43.44 1d1h n LEU 5 CO 0.50 -0.70 -0.05 0.49 0.00 0.00 0.00 177.39 177.63 1d1h n PHE 6 N 2.04 -0.15 -3.58 1.96 3.72 -0.91 -4.97 117.46 115.57 1d1h n PHE 6 Ca 0.17 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.18 1d1h n PHE 6 Cb -0.01 -1.48 -0.11 0.00 -0.94 0.00 0.00 39.48 36.94 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 -2.85 1.93 0.08 1.37 0.00 0.90 -4.77 107.32 103.98 1d1h s GLY 7 Ca 0.00 -1.22 -0.37 0.00 0.00 0.00 0.00 44.72 43.13 1d1h s GLY 7 CO 0.00 0.70 1.26 0.61 0.00 0.00 0.00 173.10 175.66 1d1h n GLY 8 N 5.07 0.24 3.03 0.20 0.00 -1.26 -2.00 105.19 110.47 1d1h n GLY 8 Ca -0.14 0.70 -0.13 0.00 0.00 0.00 0.00 46.02 46.46 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 6.21 0.00 -3.70 0.00 1.57 -1.88 -3.43 116.57 115.33 1d1h h LYS 10 Ca -0.29 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.41 1d1h h LYS 10 Cb 1.19 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.37 1d1h h LYS 10 CO 0.40 0.00 -0.23 0.95 -0.57 0.00 0.00 179.45 180.01 1d1h s THR 11 N -3.25 0.07 0.39 -0.16 -4.23 -1.26 -5.02 115.64 102.18 1d1h s THR 11 Ca 0.03 -1.14 0.10 0.00 -1.18 0.00 0.00 61.69 59.50 1d1h s THR 11 Cb 0.12 -1.63 0.16 0.00 1.34 0.00 0.00 72.50 72.49 1d1h s THR 11 CO 0.76 -0.32 1.92 0.74 -0.54 0.00 0.00 174.62 177.17 1d1h h THR 12 N 2.49 1.18 0.00 3.99 2.02 -1.93 -0.09 112.91 120.56 1d1h h THR 12 Ca -0.32 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.08 1d1h h THR 12 Cb 1.23 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 1d1h h THR 12 CO 0.47 0.24 0.00 -0.24 0.37 0.00 0.00 175.52 176.36 1d1h n SER 13 N -4.27 0.00 -1.59 4.18 2.88 -1.26 -3.07 113.62 110.49 1d1h n SER 13 Ca -0.01 -1.12 0.08 0.00 -1.33 0.00 0.00 58.87 56.49 1d1h n SER 13 Cb 0.27 0.00 0.35 0.00 -0.75 0.00 0.00 64.21 64.08 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 -0.89 4.72 -4.31 -3.46 9.92 -0.05 -4.95 116.55 117.53 1d1h n ASP 14 Ca 0.18 -2.53 -0.23 0.00 -0.53 0.00 0.00 54.79 51.68 1d1h n ASP 14 Cb 0.08 -0.59 -0.10 0.00 -0.64 0.00 0.00 41.12 39.87 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 -4.44 118.16 117.27 1d1h n LYS 17 Ca 0.00 0.13 0.02 0.00 -0.87 0.00 0.00 58.31 57.59 1d1h n LYS 17 Cb 0.00 -0.53 0.08 0.00 0.02 0.00 0.00 35.03 34.59 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 -1.94 0.00 -3.61 5.64 8.25 -1.26 -4.66 115.22 117.64 1d1h n HIS 18 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 1d1h n HIS 18 Cb 0.00 -0.49 -0.06 0.00 1.12 0.00 0.00 29.99 30.56 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 -2.99 4.39 -0.06 2.41 1.43 -1.26 0.26 118.68 122.87 1d1h s LEU 19 Ca 0.02 0.77 0.00 0.00 -1.03 0.00 0.00 54.13 53.89 1d1h s LEU 19 Cb 0.02 -2.74 0.02 0.00 0.03 0.00 0.00 46.19 43.53 1d1h s LEU 19 CO 0.07 0.25 -0.03 -0.83 0.23 0.00 0.00 176.35 176.03 1d1h s GLY 20 N -1.49 0.48 0.10 -3.19 0.00 0.20 -4.53 107.32 98.89 1d1h s GLY 20 Ca 0.28 -0.11 -0.31 0.00 0.00 0.00 0.00 44.72 44.58 1d1h s GLY 20 CO 0.15 0.68 1.40 0.00 0.00 0.00 0.00 173.10 175.33 1d1h s LYS 22 N 1.25 1.78 -1.44 0.00 1.02 -1.25 -4.44 119.74 116.67 1d1h s LYS 22 Ca 0.65 -0.94 -0.09 0.00 0.02 0.00 0.00 55.97 55.61 1d1h s LYS 22 Cb -0.36 -1.82 -0.08 0.00 -0.52 0.00 0.00 37.83 35.04 1d1h s LYS 22 CO 0.30 0.49 2.74 0.34 -0.92 0.00 0.00 175.35 178.30 1d1h n PHE 23 N 2.16 2.14 0.00 3.18 7.35 -1.26 -3.53 117.46 127.50 1d1h n PHE 23 Ca -0.16 -2.80 0.00 0.00 -0.76 0.00 0.00 57.45 53.73 1d1h n PHE 23 Cb 0.52 -2.28 0.00 0.00 0.35 0.00 0.00 39.48 38.07 1d1h n PHE 23 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1d1h n ARG 24 N 3.74 0.00 0.16 -4.13 1.74 -1.26 -4.93 116.66 111.99 1d1h n ARG 24 Ca 0.70 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.81 1d1h n ARG 24 Cb 0.20 0.00 0.22 0.00 -1.02 0.00 0.00 32.46 31.87 1d1h n ARG 24 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 1d1h h ASP 25 N 0.00 0.00 0.00 0.55 3.32 -2.03 -3.47 116.42 114.79 1d1h h ASP 25 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d1h h ASP 25 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1d1h h ASP 25 CO 0.00 0.49 0.00 0.29 -1.72 0.00 0.00 179.24 178.30 1d1h n LYS 26 N -3.51 0.00 -1.48 3.56 5.02 -1.23 -5.02 118.16 115.50 1d1h n LYS 26 Ca -0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.26 1d1h n LYS 26 Cb 0.60 -0.76 0.01 0.00 -0.02 0.00 0.00 35.03 34.86 1d1h n LYS 26 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1d1h n TYR 27 N -2.00 -2.46 -3.52 2.13 0.18 -1.26 -2.30 117.16 107.92 1d1h n TYR 27 Ca 0.00 -0.36 -0.38 0.00 1.88 0.00 0.00 57.90 59.04 1d1h n TYR 27 Cb 0.00 -0.09 -0.10 0.00 -0.38 0.00 0.00 39.34 38.77 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 1.77 2.43 0.59 0.00 0.00 -0.94 -2.14 121.76 123.46 1d1h s ALA 29 Ca 0.10 -1.07 -0.13 0.00 0.00 0.00 0.00 51.96 50.86 1d1h s ALA 29 Cb -0.16 -0.75 -0.11 0.00 0.00 0.00 0.00 23.12 22.10 1d1h s ALA 29 CO 0.10 0.55 -0.38 0.91 0.00 0.00 0.00 175.76 176.93 1d1h n TRP 30 N 2.27 -3.17 -0.68 0.00 5.03 -1.26 0.59 117.44 120.22 1d1h n TRP 30 Ca -0.17 0.13 -0.10 0.00 3.03 0.00 0.00 57.50 60.40 1d1h n TRP 30 Cb 0.52 -1.16 -0.10 0.00 -1.03 0.00 0.00 31.31 29.53 1d1h n TRP 30 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 177.69 177.41 1d1h n ASP 31 N 2.30 3.72 -2.86 -0.99 8.00 0.74 -4.23 116.55 123.24 1d1h n ASP 31 Ca 0.02 -2.17 -0.16 0.00 0.71 0.00 0.00 54.79 53.19 1d1h n ASP 31 Cb 0.39 -0.97 -0.14 0.00 -0.02 0.00 0.00 41.12 40.39 1d1h n ASP 31 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 1d1h n PHE 32 N 2.82 0.06 -0.22 1.24 7.35 -1.26 -4.83 117.46 122.63 1d1h n PHE 32 Ca 0.31 0.04 -0.27 0.00 -0.76 0.00 0.00 57.45 56.77 1d1h n PHE 32 Cb 0.56 -0.51 0.26 0.00 0.35 0.00 0.00 39.48 40.14 1d1h n PHE 32 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 1d1h n THR 33 N 3.70 0.00 -2.69 -2.13 5.66 -1.26 -4.70 114.28 112.86 1d1h n THR 33 Ca 0.43 0.00 -0.04 0.00 -3.05 0.00 0.00 64.05 61.39 1d1h n THR 33 Cb 0.08 -0.87 -0.03 0.00 -1.55 0.00 0.00 70.33 67.95 1d1h n THR 33 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 1d1h n PHE 34 N -5.53 -3.81 0.54 1.09 -0.00 -1.26 -5.27 117.46 103.23 1d1h n PHE 34 Ca 0.12 2.14 0.07 0.00 -0.00 0.00 0.00 57.45 59.77 1d1h n PHE 34 Cb 0.53 -3.53 0.05 0.00 -0.00 0.00 0.00 39.48 36.53 1d1h n PHE 34 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63