#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1smz n TRP 2 N 0.00 -0.87 -0.25 1.61 8.01 -1.26 -5.06 117.44 119.62 1smz n TRP 2 Ca 0.00 0.34 0.00 0.00 -1.31 0.00 0.00 57.50 56.53 1smz n TRP 2 Cb 0.00 -3.15 0.00 0.00 -2.01 0.00 0.00 31.31 26.15 1smz n TRP 2 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.69 174.31 1smz n THR 3 N -2.17 0.00 0.28 -0.99 5.66 -1.26 -4.76 114.28 111.03 1smz n THR 3 Ca -0.07 0.00 0.15 0.00 -3.05 0.00 0.00 64.05 61.08 1smz n THR 3 Cb 0.56 0.00 0.78 0.00 -1.55 0.00 0.00 70.33 70.11 1smz n THR 3 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1smz h LEU 4 N 0.00 0.00 -1.61 1.09 7.12 -2.00 -1.47 115.31 118.44 1smz h LEU 4 Ca 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.99 1smz h LEU 4 Cb 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.12 1smz h LEU 4 CO 0.00 0.08 0.02 0.78 -0.13 0.00 0.00 178.44 179.20 1smz h ASN 5 N 0.00 0.24 0.26 1.25 2.35 -1.99 0.31 115.58 117.99 1smz h ASN 5 Ca -0.00 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.71 1smz h ASN 5 Cb 0.36 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.67 1smz h ASN 5 CO 0.01 0.27 -0.12 0.28 -1.65 0.00 0.00 177.43 176.22 1smz h SER 6 N 0.27 -0.29 -0.18 5.81 0.02 -1.56 -3.03 113.55 114.59 1smz h SER 6 Ca 0.07 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.08 1smz h SER 6 Cb 0.15 0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1smz h SER 6 CO 0.00 -0.11 0.43 0.00 -1.14 0.00 0.00 176.83 176.01 1smz h ALA 7 N -1.64 1.70 -0.76 3.77 0.00 -1.56 0.15 119.26 120.93 1smz h ALA 7 Ca -0.04 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.94 1smz h ALA 7 Cb 0.27 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.98 1smz h ALA 7 CO 0.06 -0.53 -0.45 0.78 0.00 0.00 0.00 179.25 179.11 1smz h GLY 8 N 0.00 -1.29 -2.82 0.00 0.00 -0.79 -3.37 103.07 94.79 1smz h GLY 8 Ca 0.08 0.89 -0.15 0.00 0.00 0.00 0.00 47.33 48.15 1smz h GLY 8 CO -0.00 -0.21 -0.41 1.58 0.00 0.00 0.00 176.54 177.49 1smz n TYR 9 N -4.72 -0.34 -1.48 5.60 4.11 -0.95 -4.89 117.16 114.48 1smz n TYR 9 Ca 0.01 -0.79 0.06 0.00 -0.00 0.00 0.00 57.90 57.19 1smz n TYR 9 Cb 0.20 0.59 0.10 0.00 -0.00 0.00 0.00 39.34 40.23 1smz n TYR 9 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 1smz n LEU 10 N -0.25 1.61 -0.51 -3.48 4.32 0.49 -4.07 117.00 115.12 1smz n LEU 10 Ca -0.20 -2.49 0.10 0.00 -0.02 0.00 0.00 56.01 53.40 1smz n LEU 10 Cb 0.80 -0.29 0.01 0.00 -1.62 0.00 0.00 43.42 42.32 1smz n LEU 10 CO -0.12 0.63 0.33 0.00 -1.22 0.00 0.00 177.39 177.01 1smz n LEU 11 N -0.87 2.01 0.00 2.23 -0.00 -1.25 -4.44 117.00 114.69 1smz n LEU 11 Ca 0.11 -0.80 0.00 0.00 -0.00 0.00 0.00 56.01 55.32 1smz n LEU 11 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.11 1smz n LEU 11 CO -0.00 0.37 0.00 0.61 -0.00 0.00 0.00 177.39 178.37 1smz n GLY 12 N 1.31 -0.08 0.65 1.47 0.00 -1.26 -4.36 105.19 102.91 1smz n GLY 12 Ca 0.09 -0.02 0.45 0.00 0.00 0.00 0.00 46.02 46.54 1smz n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1smz h LYS 13 N 0.00 0.00 0.00 1.61 1.79 -1.84 1.13 116.57 119.26 1smz h LYS 13 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1smz h LYS 13 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1smz h LYS 13 CO 0.00 0.00 -0.40 0.44 -1.08 0.00 0.00 179.45 178.41 1smz n ILE 14 N -3.80 0.66 -0.29 1.86 -5.35 -1.26 -4.44 119.36 106.73 1smz n ILE 14 Ca 0.37 0.22 0.18 0.00 -0.27 0.00 0.00 62.75 63.25 1smz n ILE 14 Cb 1.79 -1.48 0.46 0.00 -1.74 0.00 0.00 39.64 38.67 1smz n ILE 14 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 1smz h ASN 15 N 0.00 0.52 0.79 7.28 -0.00 -1.73 1.52 115.58 123.96 1smz h ASN 15 Ca 0.00 0.07 -0.07 0.00 -0.00 0.00 0.00 56.30 56.29 1smz h ASN 15 Cb 0.40 -0.03 -0.01 0.00 -0.00 0.00 0.00 38.32 38.69 1smz h ASN 15 CO 0.00 0.18 -0.36 0.25 -0.00 0.00 0.00 177.43 177.50 1smz h LEU 16 N 0.50 0.00 0.00 0.34 7.12 0.11 -1.50 115.31 121.89 1smz h LEU 16 Ca 0.53 0.00 -0.14 0.00 0.13 0.00 0.00 57.88 58.40 1smz h LEU 16 Cb 1.18 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 41.32 1smz h LEU 16 CO -0.26 0.36 -0.55 0.11 -0.13 0.00 0.00 178.44 177.98 1smz h LYS 17 N 0.00 0.37 -0.03 1.25 1.79 0.20 -3.10 116.57 117.05 1smz h LYS 17 Ca -0.00 -0.40 -0.04 0.00 -2.18 0.00 0.00 60.65 58.03 1smz h LYS 17 Cb 0.85 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.60 1smz h LYS 17 CO 0.05 1.08 -0.17 0.00 -1.08 0.00 0.00 179.45 179.32 1smz h ALA 18 N 0.31 1.66 0.25 3.86 0.00 -0.42 -2.60 119.26 122.32 1smz h ALA 18 Ca -0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1smz h ALA 18 Cb 1.27 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1smz h ALA 18 CO 0.11 0.26 -0.19 1.25 0.00 0.00 0.00 179.25 180.67 1smz h LEU 19 N 0.05 -0.49 -2.04 0.00 5.85 -1.24 1.20 115.31 118.64 1smz h LEU 19 Ca 0.01 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1smz h LEU 19 Cb 0.33 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1smz h LEU 19 CO 0.02 -0.29 0.05 0.00 -0.34 0.00 0.00 178.44 177.88 1smz h ALA 20 N 0.27 1.04 0.09 1.25 0.00 -1.40 1.50 119.26 122.02 1smz h ALA 20 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.54 1smz h ALA 20 Cb 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1smz h ALA 20 CO -0.01 -0.04 -2.01 0.00 0.00 0.00 0.00 179.25 177.19 1smz n ALA 21 N -1.89 1.03 0.09 0.00 0.00 0.25 -2.48 120.51 117.52 1smz n ALA 21 Ca -0.02 -0.67 -0.04 0.00 0.00 0.00 0.00 53.44 52.70 1smz n ALA 21 Cb 0.10 -0.64 0.01 0.00 0.00 0.00 0.00 19.45 18.91 1smz n ALA 21 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1smz h LEU 22 N 0.05 0.00 0.00 0.00 8.10 0.38 -1.93 115.31 121.92 1smz h LEU 22 Ca -0.42 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.57 1smz h LEU 22 Cb 2.02 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 42.24 1smz h LEU 22 CO 0.07 0.83 -0.29 0.00 -4.11 0.00 0.00 178.44 174.94 1smz h ALA 23 N 1.17 0.86 0.00 0.17 0.00 0.18 -1.83 119.26 119.81 1smz h ALA 23 Ca -0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1smz h ALA 23 Cb 1.48 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 1smz h ALA 23 CO 0.11 0.01 -0.90 0.87 0.00 0.00 0.00 179.25 179.34 1smz h LYS 24 N 0.00 0.00 0.00 0.00 1.79 -1.32 -2.29 116.57 114.75 1smz h LYS 24 Ca -0.00 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.38 1smz h LYS 24 Cb 1.01 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.65 1smz h LYS 24 CO 0.00 0.45 -0.46 1.57 -1.08 0.00 0.00 179.45 179.93 1smz h LYS 25 N 0.00 0.00 0.00 3.15 2.10 -1.32 -3.30 116.57 117.20 1smz h LYS 25 Ca -0.07 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.57 1smz h LYS 25 Cb 1.49 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.82 1smz h LYS 25 CO 0.06 1.00 -0.07 -0.84 -2.00 0.00 0.00 179.45 177.60 1smz h ILE 26 N -1.00 0.32 -0.01 0.07 -0.00 -1.46 -3.51 117.51 111.91 1smz h ILE 26 Ca -0.13 -0.44 0.00 0.00 -0.00 0.00 0.00 64.86 64.29 1smz h ILE 26 Cb 1.11 1.32 0.00 0.00 -0.00 0.00 0.00 36.82 39.26 1smz h ILE 26 CO -0.08 0.07 0.00 -0.11 -0.00 0.00 0.00 178.15 178.03