#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1smz s TRP 2 N 0.00 -0.35 0.22 1.61 -0.00 -1.26 -5.04 118.94 114.13 1smz s TRP 2 Ca 0.00 0.77 -0.12 0.00 -0.00 0.00 0.00 56.10 56.75 1smz s TRP 2 Cb 0.00 0.34 0.29 0.00 -0.00 0.00 0.00 33.47 34.10 1smz s TRP 2 CO 0.00 -0.17 1.37 0.25 -0.00 0.00 0.00 176.95 178.40 1smz n THR 3 N 2.59 -0.43 0.00 5.86 -2.24 -1.26 -4.67 114.28 114.14 1smz n THR 3 Ca -0.14 2.04 0.00 0.00 -2.27 0.00 0.00 64.05 63.68 1smz n THR 3 Cb 0.57 -2.75 0.00 0.00 -2.10 0.00 0.00 70.33 66.05 1smz n THR 3 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1smz n LEU 4 N -5.35 0.00 0.07 3.22 7.99 -1.26 -4.17 117.00 117.51 1smz n LEU 4 Ca 0.11 0.00 -0.03 0.00 -0.01 0.00 0.00 56.01 56.08 1smz n LEU 4 Cb 0.39 0.00 0.22 0.00 -0.11 0.00 0.00 43.42 43.91 1smz n LEU 4 CO -0.11 0.00 0.66 0.78 -1.51 0.00 0.00 177.39 177.21 1smz h ASN 5 N 0.00 0.32 -0.02 -1.43 4.21 -1.99 0.16 115.58 116.83 1smz h ASN 5 Ca 0.00 -0.13 -0.11 0.00 1.21 0.00 0.00 56.30 57.28 1smz h ASN 5 Cb 0.00 -0.09 0.01 0.00 -1.12 0.00 0.00 38.32 37.12 1smz h ASN 5 CO 0.00 0.67 -0.40 0.28 -1.29 0.00 0.00 177.43 176.69 1smz h SER 6 N 0.26 0.39 0.00 5.81 0.02 -1.95 -3.00 113.55 115.09 1smz h SER 6 Ca 0.03 -0.73 0.00 0.00 -0.84 0.00 0.00 61.79 60.25 1smz h SER 6 Cb 0.78 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.21 1smz h SER 6 CO 0.06 1.07 0.00 0.00 -1.14 0.00 0.00 176.83 176.82 1smz n ALA 7 N -2.55 2.54 -0.17 3.77 0.00 -1.16 -3.35 120.51 119.60 1smz n ALA 7 Ca -0.10 -0.17 -0.01 0.00 0.00 0.00 0.00 53.44 53.16 1smz n ALA 7 Cb 0.57 -1.45 0.23 0.00 0.00 0.00 0.00 19.45 18.80 1smz n ALA 7 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1smz h GLY 8 N 4.40 0.97 -3.21 0.00 0.00 -0.53 -1.75 103.07 102.95 1smz h GLY 8 Ca 0.00 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 46.79 1smz h GLY 8 CO 0.00 0.42 0.11 1.58 0.00 0.00 0.00 176.54 178.65 1smz n TYR 9 N -4.36 2.01 0.55 5.60 4.11 -1.21 -4.06 117.16 119.80 1smz n TYR 9 Ca 0.06 -0.99 0.06 0.00 -0.00 0.00 0.00 57.90 57.03 1smz n TYR 9 Cb 0.12 -0.55 -0.07 0.00 -0.00 0.00 0.00 39.34 38.83 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 0.03 0.55 -1.56 -3.48 4.32 -0.66 -4.34 117.00 111.86 1smz n LEU 10 Ca 0.32 -0.47 -0.05 0.00 -0.02 0.00 0.00 56.01 55.80 1smz n LEU 10 Cb 1.22 0.00 0.18 0.00 -1.62 0.00 0.00 43.42 43.20 1smz n LEU 10 CO 0.34 0.14 0.81 0.00 -1.22 0.00 0.00 177.39 177.46 1smz n LEU 11 N -1.34 4.62 0.00 2.23 -0.00 -1.20 -3.89 117.00 117.42 1smz n LEU 11 Ca 0.02 -2.40 0.00 0.00 -0.00 0.00 0.00 56.01 53.63 1smz n LEU 11 Cb 0.21 -0.66 0.00 0.00 -0.00 0.00 0.00 43.42 42.96 1smz n LEU 11 CO 0.26 0.66 -0.39 0.61 -0.00 0.00 0.00 177.39 178.53 1smz n GLY 12 N -0.07 0.00 0.68 1.47 0.00 -1.26 -3.88 105.19 102.14 1smz n GLY 12 Ca 0.27 0.00 0.49 0.00 0.00 0.00 0.00 46.02 46.78 1smz n GLY 12 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1smz h LYS 13 N 0.00 0.00 0.00 1.61 2.10 -1.79 1.55 116.57 120.04 1smz h LYS 13 Ca 0.00 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.58 1smz h LYS 13 Cb 0.77 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.09 1smz h LYS 13 CO 0.00 0.00 -0.89 0.44 -2.00 0.00 0.00 179.45 177.00 1smz n ILE 14 N -3.88 0.94 -0.28 0.07 -5.35 -1.26 -4.40 119.36 105.20 1smz n ILE 14 Ca 0.41 0.11 0.09 0.00 -0.27 0.00 0.00 62.75 63.09 1smz n ILE 14 Cb 1.91 -1.74 0.24 0.00 -1.74 0.00 0.00 39.64 38.31 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 -0.33 0.17 0.02 7.28 -0.00 -1.54 1.66 115.58 122.84 1smz h ASN 15 Ca -0.11 0.15 -0.00 0.00 -0.00 0.00 0.00 56.30 56.33 1smz h ASN 15 Cb 0.74 0.16 -0.00 0.00 -0.00 0.00 0.00 38.32 39.23 1smz h ASN 15 CO -0.07 -0.01 -0.01 0.25 -0.00 0.00 0.00 177.43 177.59 1smz h LEU 16 N 0.34 0.00 0.11 0.34 7.12 0.20 1.44 115.31 124.86 1smz h LEU 16 Ca 0.48 0.00 -0.17 0.00 0.13 0.00 0.00 57.88 58.32 1smz h LEU 16 Cb 0.85 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 41.00 1smz h LEU 16 CO -0.51 0.01 -0.76 0.11 -0.13 0.00 0.00 178.44 177.16 1smz h LYS 17 N 0.00 0.23 0.00 1.25 1.79 0.20 -3.19 116.57 116.86 1smz h LYS 17 Ca -0.00 -0.39 -0.05 0.00 -2.18 0.00 0.00 60.65 58.02 1smz h LYS 17 Cb 0.02 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1smz h LYS 17 CO 0.00 1.19 -0.26 0.00 -1.08 0.00 0.00 179.45 179.30 1smz h ALA 18 N 0.03 1.15 -0.70 3.86 0.00 0.10 -2.58 119.26 121.13 1smz h ALA 18 Ca -0.14 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 1smz h ALA 18 Cb 1.53 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.25 1smz h ALA 18 CO 0.10 0.32 0.29 1.25 0.00 0.00 0.00 179.25 181.21 1smz h LEU 19 N 0.00 0.96 -2.44 0.00 6.46 0.19 0.79 115.31 121.26 1smz h LEU 19 Ca -0.00 -0.17 0.02 0.00 -0.12 0.00 0.00 57.88 57.61 1smz h LEU 19 Cb 0.65 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 40.32 1smz h LEU 19 CO 0.03 0.86 0.08 0.00 -0.62 0.00 0.00 178.44 178.80 1smz h ALA 20 N 1.13 1.54 0.06 1.25 0.00 -1.44 1.54 119.26 123.34 1smz h ALA 20 Ca 0.23 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.84 1smz h ALA 20 Cb 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1smz h ALA 20 CO -0.02 -0.11 -1.65 0.00 0.00 0.00 0.00 179.25 177.47 1smz h ALA 21 N 1.90 0.52 0.00 0.00 0.00 -1.18 -2.60 119.26 117.91 1smz h ALA 21 Ca 0.03 -1.30 -0.15 0.00 0.00 0.00 0.00 54.91 53.49 1smz h ALA 21 Cb 0.19 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1smz h ALA 21 CO -0.00 1.37 -0.70 1.37 0.00 0.00 0.00 179.25 181.29 1smz h LEU 22 N 0.03 0.00 0.00 0.00 8.10 0.14 -1.87 115.31 121.72 1smz h LEU 22 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.71 1smz h LEU 22 Cb 2.00 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 42.22 1smz h LEU 22 CO 0.11 0.70 -0.42 0.00 -4.11 0.00 0.00 178.44 174.72 1smz h ALA 23 N 1.30 0.75 0.03 0.17 0.00 0.20 -2.19 119.26 119.51 1smz h ALA 23 Ca -0.01 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 1smz h ALA 23 Cb 1.42 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.17 1smz h ALA 23 CO 0.09 0.00 -1.51 0.87 0.00 0.00 0.00 179.25 178.70 1smz h LYS 24 N 0.00 0.05 0.00 0.00 1.79 -1.29 -2.83 116.57 114.30 1smz h LYS 24 Ca 0.00 -0.09 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1smz h LYS 24 Cb 0.84 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 1smz h LYS 24 CO 0.00 0.77 -0.00 1.57 -1.08 0.00 0.00 179.45 180.70 1smz h LYS 25 N 0.01 -0.01 0.00 3.15 2.10 -1.38 -3.22 116.57 117.23 1smz h LYS 25 Ca -0.21 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.43 1smz h LYS 25 Cb 1.95 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.28 1smz h LYS 25 CO 0.11 0.86 -0.03 -0.84 -2.00 0.00 0.00 179.45 177.55 1smz h ILE 26 N -0.95 0.36 0.00 0.07 -0.00 -1.55 -3.51 117.51 111.92 1smz h ILE 26 Ca -0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 64.86 64.69 1smz h ILE 26 Cb 0.87 1.12 0.00 0.00 -0.00 0.00 0.00 36.82 38.81 1smz h ILE 26 CO 0.00 0.03 0.00 -0.11 -0.00 0.00 0.00 178.15 178.07