#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 -2.02 1.79 0.00 0.00 3.52 -1.20 -4.78 118.95 116.26 1la4 s ARG 3 Ca 0.18 -1.43 0.00 0.00 -0.13 0.00 0.00 55.73 54.35 1la4 s ARG 3 Cb -0.01 -1.98 0.00 0.00 -1.56 0.00 0.00 34.95 31.39 1la4 s ARG 3 CO 0.01 0.41 0.00 0.66 -0.81 0.00 0.00 175.30 175.57 1la4 n TYR 4 N 0.06 -0.50 -1.20 5.12 4.01 -1.26 -2.09 117.16 121.30 1la4 n TYR 4 Ca -0.11 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.25 1la4 n TYR 4 Cb 0.56 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.61 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 -3.94 -2.82 7.72 4.32 -1.24 -0.88 117.00 120.15 1la4 n LEU 5 Ca 0.00 0.55 -0.13 0.00 -0.02 0.00 0.00 56.01 56.40 1la4 n LEU 5 Cb 0.00 -0.85 -0.02 0.00 -1.62 0.00 0.00 43.42 40.92 1la4 n LEU 5 CO 0.00 -4.98 -0.05 0.49 -1.22 0.00 0.00 177.39 171.63 1la4 n PHE 6 N -1.77 -1.36 -2.57 -1.77 3.72 0.80 -4.74 117.46 109.76 1la4 n PHE 6 Ca 0.06 0.21 -0.43 0.00 -0.05 0.00 0.00 57.45 57.25 1la4 n PHE 6 Cb 0.49 -1.07 -0.02 0.00 -0.94 0.00 0.00 39.48 37.93 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 -2.08 2.04 -0.86 1.37 0.00 -0.06 -4.60 107.32 103.13 1la4 s GLY 7 Ca 0.26 0.42 -0.31 0.00 0.00 0.00 0.00 44.72 45.09 1la4 s GLY 7 CO 0.32 2.15 2.60 0.61 0.00 0.00 0.00 173.10 178.78 1la4 n GLY 8 N 3.30 -0.32 3.23 0.20 0.00 -1.26 -2.34 105.19 107.99 1la4 n GLY 8 Ca 0.11 1.06 -0.15 0.00 0.00 0.00 0.00 46.02 47.05 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 0.08 1.76 -3.85 0.00 4.01 -1.26 -4.05 118.16 114.85 1la4 n LYS 10 Ca -0.12 -0.23 -0.09 0.00 -0.51 0.00 0.00 58.31 57.35 1la4 n LYS 10 Cb 0.59 -0.69 -0.07 0.00 -0.51 0.00 0.00 35.03 34.36 1la4 n LYS 10 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1la4 s THR 11 N -0.32 0.11 0.17 -0.18 -4.23 -1.26 -5.03 115.64 104.91 1la4 s THR 11 Ca 0.00 -1.14 -0.10 0.00 -1.18 0.00 0.00 61.69 59.27 1la4 s THR 11 Cb 0.00 -1.43 0.03 0.00 1.34 0.00 0.00 72.50 72.43 1la4 s THR 11 CO 0.00 -0.52 1.58 0.74 -0.54 0.00 0.00 174.62 175.88 1la4 h THR 12 N 2.64 1.27 0.00 3.99 2.02 -1.95 -2.35 112.91 118.53 1la4 h THR 12 Ca -0.33 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 65.55 1la4 h THR 12 Cb 1.21 1.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.63 1la4 h THR 12 CO 0.53 0.45 0.00 0.00 0.37 0.00 0.00 175.52 176.87 1la4 n ALA 13 N -2.50 2.06 0.96 6.16 0.00 -1.26 -2.52 120.51 123.41 1la4 n ALA 13 Ca 0.01 -0.10 0.14 0.00 0.00 0.00 0.00 53.44 53.49 1la4 n ALA 13 Cb 0.42 -1.28 0.58 0.00 0.00 0.00 0.00 19.45 19.17 1la4 n ALA 13 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1la4 n ASP 14 N -1.10 0.11 -4.16 0.00 2.03 -0.88 -4.85 116.55 107.70 1la4 n ASP 14 Ca 0.11 0.48 -0.14 0.00 0.52 0.00 0.00 54.79 55.75 1la4 n ASP 14 Cb 0.09 -0.50 0.05 0.00 -0.72 0.00 0.00 41.12 40.03 1la4 n ASP 14 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1la4 n LYS 17 N -1.42 1.54 0.00 0.00 5.02 -1.26 -3.69 118.16 118.35 1la4 n LYS 17 Ca 0.01 -0.75 0.00 0.00 -2.02 0.00 0.00 58.31 55.54 1la4 n LYS 17 Cb 0.02 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.55 1la4 n LYS 17 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1la4 n HIS 18 N 1.52 0.00 -2.83 2.13 8.25 -1.26 -5.12 115.22 117.91 1la4 n HIS 18 Ca 0.21 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.29 1la4 n HIS 18 Cb 0.63 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.68 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 -2.20 4.48 -0.29 2.41 1.43 -1.24 -3.83 118.68 119.44 1la4 s LEU 19 Ca 0.00 1.81 -0.01 0.00 -1.03 0.00 0.00 54.13 54.89 1la4 s LEU 19 Cb 0.00 -3.74 0.05 0.00 0.03 0.00 0.00 46.19 42.53 1la4 s LEU 19 CO 0.00 0.06 -0.02 0.00 0.23 0.00 0.00 176.35 176.61 1la4 s ALA 20 N -1.40 2.77 -0.27 4.21 0.00 0.46 -4.50 121.76 123.02 1la4 s ALA 20 Ca 0.44 -1.69 -0.31 0.00 0.00 0.00 0.00 51.96 50.40 1la4 s ALA 20 Cb -0.21 -1.85 -0.08 0.00 0.00 0.00 0.00 23.12 20.98 1la4 s ALA 20 CO 0.27 -1.16 2.21 0.00 0.00 0.00 0.00 175.76 177.08 1la4 s ARG 22 N 6.33 4.42 0.54 0.00 1.81 0.61 -4.46 118.95 128.19 1la4 s ARG 22 Ca 1.04 1.08 0.28 0.00 -1.72 0.00 0.00 55.73 56.41 1la4 s ARG 22 Cb -0.54 -3.50 1.53 0.00 -0.45 0.00 0.00 34.95 31.99 1la4 s ARG 22 CO 0.41 -0.12 2.11 1.03 -0.68 0.00 0.00 175.30 178.05 1la4 h SER 23 N 6.98 0.00 0.00 0.23 0.87 -1.91 -0.48 113.55 119.25 1la4 h SER 23 Ca -0.36 0.00 -0.70 0.00 -1.23 0.00 0.00 61.79 59.49 1la4 h SER 23 Cb 1.18 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.11 1la4 h SER 23 CO 0.79 0.09 3.09 -0.67 -0.53 0.00 0.00 176.83 179.60 1la4 n ASP 24 N -3.68 3.87 0.00 6.23 -0.08 -1.26 -3.06 116.55 118.57 1la4 n ASP 24 Ca -0.02 -2.82 0.00 0.00 -1.51 0.00 0.00 54.79 50.44 1la4 n ASP 24 Cb 0.20 -1.61 0.00 0.00 2.34 0.00 0.00 41.12 42.05 1la4 n ASP 24 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1la4 n GLY 25 N 4.12 0.63 3.82 0.27 0.00 -1.25 -4.82 105.19 107.96 1la4 n GLY 25 Ca 0.52 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.20 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 0.00 -0.91 -3.85 1.61 5.02 -0.21 -4.89 118.16 114.92 1la4 n LYS 26 Ca 0.00 0.44 -0.13 0.00 -2.02 0.00 0.00 58.31 56.60 1la4 n LYS 26 Cb 0.00 -3.18 -0.15 0.00 -0.02 0.00 0.00 35.03 31.68 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 -3.35 0.02 -0.11 2.13 1.13 -1.04 -2.25 117.35 113.88 1la4 s TYR 27 Ca 0.35 0.03 -0.27 0.00 -1.41 0.00 0.00 57.07 55.77 1la4 s TYR 27 Cb -0.16 -0.07 -0.02 0.00 -1.10 0.00 0.00 41.96 40.61 1la4 s TYR 27 CO 0.91 -0.03 0.88 0.00 -2.51 0.00 0.00 175.55 174.80 1la4 s ALA 29 N 1.74 -0.64 0.80 0.00 0.00 -1.05 0.28 121.76 122.89 1la4 s ALA 29 Ca 0.43 1.05 -0.12 0.00 0.00 0.00 0.00 51.96 53.32 1la4 s ALA 29 Cb -0.18 -0.89 0.07 0.00 0.00 0.00 0.00 23.12 22.13 1la4 s ALA 29 CO 0.17 -0.45 1.15 1.67 0.00 0.00 0.00 175.76 178.29 1la4 s TRP 30 N 1.92 2.95 -2.01 0.00 -2.14 -1.25 -0.40 118.94 118.01 1la4 s TRP 30 Ca -0.04 0.88 0.17 0.00 2.66 0.00 0.00 56.10 59.77 1la4 s TRP 30 Cb -0.11 -3.34 0.21 0.00 -3.10 0.00 0.00 33.47 27.13 1la4 s TRP 30 CO -0.09 -1.74 1.12 -0.25 -2.66 0.00 0.00 176.95 173.33 1la4 n ASP 31 N -3.34 2.66 0.00 -2.66 8.00 -1.25 -4.82 116.55 115.14 1la4 n ASP 31 Ca 0.07 -1.78 0.00 0.00 0.71 0.00 0.00 54.79 53.79 1la4 n ASP 31 Cb 0.59 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 1la4 n ASP 31 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1la4 n GLY 32 N 1.00 1.35 0.00 0.44 0.00 -1.26 -4.54 105.19 102.18 1la4 n GLY 32 Ca 0.12 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1la4 n GLY 32 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1la4 n THR 33 N 0.00 0.00 -0.15 2.61 -2.24 -1.26 -5.19 114.28 108.05 1la4 n THR 33 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1la4 n THR 33 Cb 0.00 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 1la4 n THR 33 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83