#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 2.44 -0.87 1.61 -0.00 -1.26 -4.53 117.44 114.83 1smz n TRP 2 Ca 0.00 -3.93 0.00 0.00 -0.00 0.00 0.00 57.50 53.57 1smz n TRP 2 Cb 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 31.31 30.84 1smz n TRP 2 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 177.69 175.32 1smz n THR 3 N 0.32 0.00 0.30 5.87 5.66 -1.26 -4.97 114.28 120.20 1smz n THR 3 Ca 0.28 0.00 0.18 0.00 -3.05 0.00 0.00 64.05 61.46 1smz n THR 3 Cb 0.48 0.00 0.95 0.00 -1.55 0.00 0.00 70.33 70.21 1smz n THR 3 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1smz h LEU 4 N 0.00 0.00 -0.71 1.09 -0.00 -2.00 0.69 115.31 114.37 1smz h LEU 4 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.87 1smz h LEU 4 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.63 1smz h LEU 4 CO 0.00 0.00 0.41 0.78 -0.00 0.00 0.00 178.44 179.63 1smz h ASN 5 N 0.00 0.87 0.17 -0.43 4.21 -1.93 -1.40 115.58 117.08 1smz h ASN 5 Ca 0.00 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.43 1smz h ASN 5 Cb 0.25 -0.22 -0.03 0.00 -1.12 0.00 0.00 38.32 37.20 1smz h ASN 5 CO 0.00 0.70 -0.35 0.28 -1.29 0.00 0.00 177.43 176.78 1smz h SER 6 N 0.97 -1.01 -0.01 5.81 0.02 -1.09 0.19 113.55 118.44 1smz h SER 6 Ca 0.25 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 1smz h SER 6 Cb 0.01 0.36 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1smz h SER 6 CO -0.04 -0.40 0.24 0.00 -1.14 0.00 0.00 176.83 175.48 1smz h ALA 7 N -1.00 1.26 -0.89 3.77 0.00 -1.63 -2.40 119.26 118.36 1smz h ALA 7 Ca -0.02 -0.00 0.26 0.00 0.00 0.00 0.00 54.91 55.15 1smz h ALA 7 Cb 0.53 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.16 1smz h ALA 7 CO -0.14 -0.24 0.07 0.41 0.00 0.00 0.00 179.25 179.35 1smz n GLY 8 N -1.19 -1.16 1.13 0.00 0.00 0.66 -1.19 105.19 103.45 1smz n GLY 8 Ca -0.02 0.86 0.04 0.00 0.00 0.00 0.00 46.02 46.90 1smz n GLY 8 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1smz n TYR 9 N -5.28 0.00 -0.01 1.61 4.11 -0.92 -4.78 117.16 111.90 1smz n TYR 9 Ca 0.22 -0.75 -0.01 0.00 -0.00 0.00 0.00 57.90 57.36 1smz n TYR 9 Cb 0.74 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.34 39.91 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 -0.05 2.68 -0.32 -3.48 4.32 -0.33 -4.55 117.00 115.28 1smz n LEU 10 Ca 0.09 -0.00 0.14 0.00 -0.02 0.00 0.00 56.01 56.22 1smz n LEU 10 Cb 0.97 -0.04 0.30 0.00 -1.62 0.00 0.00 43.42 43.03 1smz n LEU 10 CO -0.04 0.47 0.86 0.17 -1.22 0.00 0.00 177.39 177.63 1smz h LEU 11 N -0.00 -0.29 0.28 2.23 8.10 -1.54 0.43 115.31 124.51 1smz h LEU 11 Ca -0.03 0.25 -0.01 0.00 0.11 0.00 0.00 57.88 58.20 1smz h LEU 11 Cb 1.04 0.40 0.00 0.00 -0.44 0.00 0.00 40.66 41.66 1smz h LEU 11 CO -0.01 -0.29 -0.14 1.23 -4.11 0.00 0.00 178.44 175.13 1smz h GLY 12 N 0.07 -0.40 0.09 0.17 0.00 -1.84 1.32 103.07 102.49 1smz h GLY 12 Ca 0.58 0.15 0.01 0.00 0.00 0.00 0.00 47.33 48.07 1smz h GLY 12 CO -0.82 -0.14 -0.38 0.50 0.00 0.00 0.00 176.54 175.70 1smz h LYS 13 N -0.43 -0.53 0.24 4.80 1.57 -0.53 0.73 116.57 122.42 1smz h LYS 13 Ca -0.04 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1smz h LYS 13 Cb 0.33 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1smz h LYS 13 CO 0.06 -0.35 -0.26 -0.84 -0.57 0.00 0.00 179.45 177.49 1smz h ILE 14 N -0.55 0.45 -0.48 1.86 3.07 -0.77 0.90 117.51 121.98 1smz h ILE 14 Ca -0.01 0.00 0.14 0.00 1.55 0.00 0.00 64.86 66.54 1smz h ILE 14 Cb 0.55 0.45 -0.02 0.00 -0.27 0.00 0.00 36.82 37.53 1smz h ILE 14 CO -0.20 0.00 0.63 -1.13 -1.05 0.00 0.00 178.15 176.40 1smz h ASN 15 N -0.54 0.00 -0.17 2.16 -0.00 0.21 1.57 115.58 118.81 1smz h ASN 15 Ca -0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 56.30 56.22 1smz h ASN 15 Cb 0.50 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 38.81 1smz h ASN 15 CO -0.06 0.00 -0.12 0.25 -0.00 0.00 0.00 177.43 177.50 1smz h LEU 16 N 0.00 0.51 0.05 0.34 7.12 0.31 1.45 115.31 125.08 1smz h LEU 16 Ca 0.23 -0.13 -0.17 0.00 0.13 0.00 0.00 57.88 57.94 1smz h LEU 16 Cb 1.49 -0.14 0.02 0.00 -0.53 0.00 0.00 40.66 41.50 1smz h LEU 16 CO -0.00 0.67 -0.68 0.11 -0.13 0.00 0.00 178.44 178.40 1smz h LYS 17 N 0.49 0.38 0.00 1.25 1.79 0.23 -3.09 116.57 117.63 1smz h LYS 17 Ca 0.09 -0.47 -0.06 0.00 -2.18 0.00 0.00 60.65 58.03 1smz h LYS 17 Cb 0.50 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 1smz h LYS 17 CO 0.03 1.15 -0.27 0.00 -1.08 0.00 0.00 179.45 179.29 1smz h ALA 18 N 0.24 1.04 -0.68 3.86 0.00 -1.14 -2.72 119.26 119.86 1smz h ALA 18 Ca -0.10 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1smz h ALA 18 Cb 1.43 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.15 1smz h ALA 18 CO 0.13 0.33 0.20 1.25 0.00 0.00 0.00 179.25 181.16 1smz h LEU 19 N 0.00 0.98 -2.58 0.00 6.46 0.20 0.11 115.31 120.48 1smz h LEU 19 Ca -0.00 -0.18 -0.00 0.00 -0.12 0.00 0.00 57.88 57.57 1smz h LEU 19 Cb 0.76 -0.26 -0.00 0.00 -0.73 0.00 0.00 40.66 40.44 1smz h LEU 19 CO 0.03 0.92 -0.01 0.00 -0.62 0.00 0.00 178.44 178.76 1smz h ALA 20 N 1.20 1.24 0.05 1.25 0.00 -1.39 1.50 119.26 123.11 1smz h ALA 20 Ca 0.22 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.81 1smz h ALA 20 Cb 0.30 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1smz h ALA 20 CO -0.01 0.02 -1.70 0.00 0.00 0.00 0.00 179.25 177.56 1smz h ALA 21 N 1.99 0.59 0.00 0.00 0.00 -1.19 -2.62 119.26 118.03 1smz h ALA 21 Ca -0.00 -1.36 -0.20 0.00 0.00 0.00 0.00 54.91 53.35 1smz h ALA 21 Cb 0.07 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1smz h ALA 21 CO 0.00 1.44 -0.93 1.37 0.00 0.00 0.00 179.25 181.13 1smz h LEU 22 N 0.03 0.00 0.00 0.00 8.10 0.79 -2.80 115.31 121.43 1smz h LEU 22 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.70 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 0.10 0.93 -0.29 0.00 -4.11 0.00 0.00 178.44 175.07 1smz h ALA 23 N 1.07 0.85 0.00 0.17 0.00 0.19 -2.80 119.26 118.73 1smz h ALA 23 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1smz h ALA 23 Cb 1.69 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1smz h ALA 23 CO 0.12 0.00 -0.62 0.87 0.00 0.00 0.00 179.25 179.62 1smz h LYS 24 N 0.00 0.00 0.12 0.00 1.79 -1.38 -3.01 116.57 114.09 1smz h LYS 24 Ca 0.00 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.30 1smz h LYS 24 Cb 0.94 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.61 1smz h LYS 24 CO 0.00 0.45 -0.78 1.57 -1.08 0.00 0.00 179.45 179.61 1smz h LYS 25 N 0.00 0.26 0.00 3.15 2.10 -1.45 -3.19 116.57 117.44 1smz h LYS 25 Ca -0.03 -0.45 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1smz h LYS 25 Cb 1.39 0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.89 1smz h LYS 25 CO 0.06 1.22 0.00 -0.84 -2.00 0.00 0.00 179.45 177.89 1smz h ILE 26 N -0.43 0.00 -0.01 0.07 -0.00 -1.58 -3.52 117.51 112.04 1smz h ILE 26 Ca -0.14 -0.09 0.00 0.00 -0.00 0.00 0.00 64.86 64.63 1smz h ILE 26 Cb 1.59 0.98 0.00 0.00 -0.00 0.00 0.00 36.82 39.38 1smz h ILE 26 CO 0.13 0.00 0.00 -0.11 -0.00 0.00 0.00 178.15 178.17