#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1la4 s ARG 3 N -3.21 3.97 0.00 0.00 3.00 -1.01 -4.73 118.95 116.96 1la4 s ARG 3 Ca 0.28 -0.34 0.00 0.00 0.00 0.00 0.00 55.73 55.67 1la4 s ARG 3 Cb -0.05 -3.24 0.00 0.00 0.00 0.00 0.00 34.95 31.66 1la4 s ARG 3 CO 0.23 0.24 0.00 0.66 0.00 0.00 0.00 175.30 176.43 1la4 n TYR 4 N 3.65 -0.21 -1.46 -0.53 4.01 -1.26 -2.24 117.16 119.11 1la4 n TYR 4 Ca -0.16 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.15 1la4 n TYR 4 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.55 1la4 n TYR 4 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1la4 n LEU 5 N 0.00 0.01 -2.67 7.72 4.77 -1.24 -0.87 117.00 124.72 1la4 n LEU 5 Ca 0.00 0.95 -0.08 0.00 -0.03 0.00 0.00 56.01 56.85 1la4 n LEU 5 Cb 0.00 -1.12 -0.01 0.00 -2.33 0.00 0.00 43.42 39.97 1la4 n LEU 5 CO 0.00 -2.77 -0.06 0.49 -1.33 0.00 0.00 177.39 173.72 1la4 n PHE 6 N -0.70 -1.76 -2.48 -1.77 3.72 0.73 -4.78 117.46 110.43 1la4 n PHE 6 Ca 0.12 0.08 -0.42 0.00 -0.05 0.00 0.00 57.45 57.17 1la4 n PHE 6 Cb 0.38 -1.74 -0.03 0.00 -0.94 0.00 0.00 39.48 37.15 1la4 n PHE 6 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1la4 s GLY 7 N -2.14 2.10 -0.74 1.37 0.00 -0.05 -4.57 107.32 103.29 1la4 s GLY 7 Ca 0.08 0.59 -0.29 0.00 0.00 0.00 0.00 44.72 45.10 1la4 s GLY 7 CO 0.10 2.20 2.54 0.61 0.00 0.00 0.00 173.10 178.56 1la4 n GLY 8 N 3.36 -0.14 3.26 0.20 0.00 -1.26 -2.06 105.19 108.54 1la4 n GLY 8 Ca 0.11 0.93 -0.16 0.00 0.00 0.00 0.00 46.02 46.90 1la4 n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1la4 n LYS 10 N 0.03 3.26 -3.76 0.00 4.81 -1.26 -4.17 118.16 117.08 1la4 n LYS 10 Ca -0.12 -0.31 -0.10 0.00 -0.87 0.00 0.00 58.31 56.92 1la4 n LYS 10 Cb 0.59 -0.86 -0.04 0.00 0.02 0.00 0.00 35.03 34.74 1la4 n LYS 10 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1la4 s THR 11 N -1.01 0.04 0.29 3.15 -4.23 -1.26 -5.04 115.64 107.57 1la4 s THR 11 Ca 0.03 -0.84 0.11 0.00 -1.18 0.00 0.00 61.69 59.81 1la4 s THR 11 Cb 0.04 -1.57 -0.00 0.00 1.34 0.00 0.00 72.50 72.30 1la4 s THR 11 CO 0.13 -0.16 1.66 0.74 -0.54 0.00 0.00 174.62 176.45 1la4 h THR 12 N 2.26 1.40 0.00 3.99 2.02 -1.94 -2.63 112.91 118.01 1la4 h THR 12 Ca -0.30 -1.92 0.00 0.00 0.77 0.00 0.00 66.41 64.96 1la4 h THR 12 Cb 1.26 2.04 0.00 0.00 -1.74 0.00 0.00 68.15 69.70 1la4 h THR 12 CO 0.40 0.55 0.00 0.00 0.37 0.00 0.00 175.52 176.84 1la4 n ALA 13 N -2.43 2.29 1.22 6.16 0.00 -1.26 -2.54 120.51 123.95 1la4 n ALA 13 Ca -0.01 -0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.43 1la4 n ALA 13 Cb 0.57 -1.31 0.29 0.00 0.00 0.00 0.00 19.45 18.99 1la4 n ALA 13 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1la4 n ASP 14 N -0.95 1.91 -3.98 0.00 9.92 -0.99 -4.94 116.55 117.52 1la4 n ASP 14 Ca 0.14 -1.52 -0.16 0.00 -0.53 0.00 0.00 54.79 52.73 1la4 n ASP 14 Cb 0.07 0.11 0.02 0.00 -0.64 0.00 0.00 41.12 40.68 1la4 n ASP 14 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1la4 n LYS 17 N -2.17 1.74 0.00 0.00 2.85 -1.26 -3.73 118.16 115.59 1la4 n LYS 17 Ca 0.04 -1.17 0.00 0.00 -1.05 0.00 0.00 58.31 56.13 1la4 n LYS 17 Cb 0.15 -1.63 0.00 0.00 -0.65 0.00 0.00 35.03 32.90 1la4 n LYS 17 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1la4 n HIS 18 N 1.23 0.00 -2.97 5.58 8.25 -1.26 -5.12 115.22 120.93 1la4 n HIS 18 Ca 0.28 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.40 1la4 n HIS 18 Cb 0.63 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.67 1la4 n HIS 18 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1la4 s LEU 19 N -2.28 4.17 -0.25 2.41 1.02 -1.24 -3.81 118.68 118.69 1la4 s LEU 19 Ca 0.00 1.54 0.01 0.00 0.02 0.00 0.00 54.13 55.70 1la4 s LEU 19 Cb 0.00 -4.05 0.05 0.00 0.02 0.00 0.00 46.19 42.21 1la4 s LEU 19 CO 0.00 -0.15 -0.10 0.00 0.02 0.00 0.00 176.35 176.12 1la4 s ALA 20 N -1.83 2.58 -0.79 4.21 0.00 0.55 -4.53 121.76 121.95 1la4 s ALA 20 Ca 0.52 -1.65 -0.23 0.00 0.00 0.00 0.00 51.96 50.61 1la4 s ALA 20 Cb -0.13 -1.59 -0.18 0.00 0.00 0.00 0.00 23.12 21.22 1la4 s ALA 20 CO 0.19 -1.03 2.39 0.00 0.00 0.00 0.00 175.76 177.30 1la4 s ARG 22 N 8.39 4.44 0.00 0.00 1.81 0.94 -4.44 118.95 130.09 1la4 s ARG 22 Ca 1.07 1.96 0.09 0.00 -1.72 0.00 0.00 55.73 57.13 1la4 s ARG 22 Cb -0.40 -3.22 0.44 0.00 -0.45 0.00 0.00 34.95 31.32 1la4 s ARG 22 CO 0.26 -0.18 1.20 0.45 -0.68 0.00 0.00 175.30 176.35 1la4 n SER 23 N 2.61 0.00 -3.69 0.23 2.88 -1.26 -2.34 113.62 112.05 1la4 n SER 23 Ca 0.05 0.24 -0.42 0.00 -1.33 0.00 0.00 58.87 57.42 1la4 n SER 23 Cb 0.44 -0.34 -0.01 0.00 -0.75 0.00 0.00 64.21 63.55 1la4 n SER 23 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1la4 n ASP 24 N -1.34 4.16 0.00 -3.46 9.92 -1.26 -3.58 116.55 120.98 1la4 n ASP 24 Ca 0.04 -2.81 0.00 0.00 -0.53 0.00 0.00 54.79 51.49 1la4 n ASP 24 Cb 0.08 -1.62 0.00 0.00 -0.64 0.00 0.00 41.12 38.94 1la4 n ASP 24 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1la4 n GLY 25 N 4.09 0.91 3.34 0.44 0.00 -1.26 -4.65 105.19 108.05 1la4 n GLY 25 Ca 0.54 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.44 1la4 n GLY 25 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1la4 n LYS 26 N -1.40 -1.47 -4.02 1.61 5.02 -0.99 -4.87 118.16 112.05 1la4 n LYS 26 Ca 0.00 1.10 -0.14 0.00 -2.02 0.00 0.00 58.31 57.25 1la4 n LYS 26 Cb 0.00 -4.79 -0.14 0.00 -0.02 0.00 0.00 35.03 30.08 1la4 n LYS 26 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 1la4 s TYR 27 N -3.12 0.25 -0.12 2.13 -0.85 -1.03 -1.98 117.35 112.63 1la4 s TYR 27 Ca 0.14 -0.07 -0.24 0.00 -0.52 0.00 0.00 57.07 56.38 1la4 s TYR 27 Cb -0.04 -0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.12 1la4 s TYR 27 CO 0.80 -0.01 0.74 0.00 -1.52 0.00 0.00 175.55 175.55 1la4 s ALA 29 N 1.46 -0.59 0.76 0.00 0.00 -1.05 0.26 121.76 122.60 1la4 s ALA 29 Ca 0.36 1.02 -0.12 0.00 0.00 0.00 0.00 51.96 53.22 1la4 s ALA 29 Cb -0.17 -0.78 0.05 0.00 0.00 0.00 0.00 23.12 22.21 1la4 s ALA 29 CO 0.15 -0.35 1.12 1.67 0.00 0.00 0.00 175.76 178.34 1la4 s TRP 30 N 1.66 3.10 -0.14 0.00 -2.14 -1.25 -0.33 118.94 119.85 1la4 s TRP 30 Ca -0.06 0.99 0.22 0.00 2.66 0.00 0.00 56.10 59.91 1la4 s TRP 30 Cb -0.11 -3.19 -0.16 0.00 -3.10 0.00 0.00 33.47 26.91 1la4 s TRP 30 CO -0.09 -1.49 0.76 -3.47 -2.66 0.00 0.00 176.95 170.00 1la4 n ASP 31 N -3.20 0.45 -2.11 -2.66 2.03 -1.25 -4.84 116.55 104.97 1la4 n ASP 31 Ca 0.07 0.18 -0.05 0.00 0.52 0.00 0.00 54.79 55.51 1la4 n ASP 31 Cb 0.58 1.14 0.02 0.00 -0.72 0.00 0.00 41.12 42.14 1la4 n ASP 31 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1la4 n GLY 32 N 1.24 0.17 0.00 0.27 0.00 -1.26 -5.05 105.19 100.56 1la4 n GLY 32 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1la4 n GLY 32 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1la4 n THR 33 N -2.07 0.00 -0.39 2.61 5.66 -1.26 -5.29 114.28 113.54 1la4 n THR 33 Ca -0.02 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.98 1la4 n THR 33 Cb 0.54 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.32 1la4 n THR 33 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35