#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hth n VAL 2 N 0.00 0.00 -2.68 -3.33 3.14 -1.26 -4.72 118.33 109.48 1hth n VAL 2 Ca 0.00 0.00 -0.30 0.00 -2.96 0.00 0.00 64.34 61.08 1hth n VAL 2 Cb 0.00 -0.26 -0.02 0.00 -1.06 0.00 0.00 33.84 32.50 1hth n VAL 2 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1hth s SER 3 N -4.85 6.46 0.08 6.55 0.15 -1.26 -4.99 113.70 115.84 1hth s SER 3 Ca 0.00 1.17 -0.17 0.00 0.70 0.00 0.00 55.95 57.66 1hth s SER 3 Cb 0.00 -2.34 -0.11 0.00 -1.71 0.00 0.00 66.02 61.86 1hth s SER 3 CO 0.00 -0.49 1.38 -0.33 1.20 0.00 0.00 173.24 175.00 1hth h GLU 4 N 0.89 0.58 -1.07 5.44 5.08 -2.03 -3.04 114.58 120.43 1hth h GLU 4 Ca -0.47 -0.32 -0.37 0.00 -1.00 0.00 0.00 59.36 57.20 1hth h GLU 4 Cb 1.19 0.02 -0.21 0.00 0.50 0.00 0.00 28.75 30.25 1hth h GLU 4 CO 0.63 0.91 0.48 0.44 -1.00 0.00 0.00 179.01 180.47 1hth n ILE 5 N -4.35 2.62 0.00 3.13 -6.64 -1.26 -4.07 119.36 108.79 1hth n ILE 5 Ca -0.05 -1.48 0.00 0.00 -1.77 0.00 0.00 62.75 59.45 1hth n ILE 5 Cb 0.45 -0.79 0.00 0.00 -1.44 0.00 0.00 39.64 37.86 1hth n ILE 5 CO 0.00 0.00 0.00 1.67 -1.77 0.00 0.00 176.55 176.45 1hth n GLN 6 N -0.50 0.95 -0.85 6.28 -0.06 -1.15 -4.56 117.38 117.49 1hth n GLN 6 Ca 0.41 0.00 -0.09 0.00 -2.00 0.00 0.00 57.00 55.31 1hth n GLN 6 Cb 1.14 -0.96 -0.13 0.00 -4.06 0.00 0.00 30.24 26.23 1hth n GLN 6 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 1hth n LEU 7 N -2.28 4.87 0.00 1.69 -0.00 -1.22 -3.88 117.00 116.18 1hth n LEU 7 Ca 0.00 -2.86 0.00 0.00 -0.00 0.00 0.00 56.01 53.15 1hth n LEU 7 Cb 0.46 -1.27 0.00 0.00 -0.00 0.00 0.00 43.42 42.61 1hth n LEU 7 CO 0.00 1.44 0.00 1.57 -0.00 0.00 0.00 177.39 180.40 1hth n HIS 9 N 2.37 0.00 0.06 1.96 -0.00 -1.26 -4.12 115.22 114.23 1hth n HIS 9 Ca 0.33 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.85 1hth n HIS 9 Cb 0.79 -0.06 -0.13 0.00 -0.00 0.00 0.00 29.99 30.59 1hth n HIS 9 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.34 175.43 1hth h ASN 10 N 0.00 0.74 -3.58 0.26 2.35 -1.98 -3.40 115.58 109.97 1hth h ASN 10 Ca 0.00 -0.82 -0.62 0.00 -0.55 0.00 0.00 56.30 54.31 1hth h ASN 10 Cb 0.00 -0.23 -0.40 0.00 0.05 0.00 0.00 38.32 37.74 1hth h ASN 10 CO 0.00 1.48 -0.71 -0.22 -1.65 0.00 0.00 177.43 176.33 1hth s LEU 11 N -8.01 3.16 -0.17 1.61 2.96 -1.26 -5.09 118.68 111.89 1hth s LEU 11 Ca -0.11 -2.85 -0.18 0.00 -0.22 0.00 0.00 54.13 50.77 1hth s LEU 11 Cb 0.04 -1.19 -0.15 0.00 0.50 0.00 0.00 46.19 45.40 1hth s LEU 11 CO 0.89 -0.24 0.18 1.23 -1.32 0.00 0.00 176.35 177.09 1hth h GLY 12 N 6.49 0.00 0.00 7.98 0.00 -1.94 -3.53 103.07 112.07 1hth h GLY 12 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1hth h GLY 12 CO 0.54 0.00 0.00 1.57 0.00 0.00 0.00 176.54 178.65 1hth n HIS 14 N -4.53 0.00 0.55 5.60 -0.00 -1.26 -5.03 115.22 110.55 1hth n HIS 14 Ca -0.20 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.55 1hth n HIS 14 Cb 0.50 0.00 0.14 0.00 -0.00 0.00 0.00 29.99 30.63 1hth n HIS 14 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.34 177.81 1hth n LEU 15 N 0.00 2.38 0.10 0.27 -0.00 -1.26 -3.84 117.00 114.66 1hth n LEU 15 Ca 0.00 -1.20 0.12 0.00 -0.00 0.00 0.00 56.01 54.93 1hth n LEU 15 Cb 0.00 -0.45 0.45 0.00 -0.00 0.00 0.00 43.42 43.42 1hth n LEU 15 CO 0.00 0.39 0.87 -3.20 -0.00 0.00 0.00 177.39 175.45 1hth n ASN 16 N 0.26 0.65 -0.65 1.45 2.85 -1.26 -3.44 115.26 115.13 1hth n ASN 16 Ca 0.10 0.60 0.00 0.00 -0.11 0.00 0.00 54.58 55.17 1hth n ASN 16 Cb 0.49 -0.76 0.00 0.00 1.24 0.00 0.00 39.78 40.75 1hth n ASN 16 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1hth n GLU 17 N -2.15 0.30 0.00 1.20 4.07 -1.25 -4.00 120.64 118.81 1hth n GLU 17 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1hth n GLU 17 Cb 0.34 -1.21 0.00 0.00 -0.06 0.00 0.00 31.44 30.51 1hth n GLU 17 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1hth n GLU 19 N 0.50 0.00 -0.10 5.31 2.13 -1.22 -4.42 120.64 122.84 1hth n GLU 19 Ca 0.00 0.00 -0.20 0.00 0.66 0.00 0.00 57.16 57.62 1hth n GLU 19 Cb 0.10 -0.17 -0.11 0.00 0.27 0.00 0.00 31.44 31.52 1hth n GLU 19 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1hth h ARG 20 N 0.15 0.00 -1.06 5.31 3.08 -1.91 -2.91 114.38 117.04 1hth h ARG 20 Ca 0.00 0.00 0.31 0.00 0.07 0.00 0.00 59.98 60.36 1hth h ARG 20 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 1hth h ARG 20 CO 0.00 0.97 0.97 -0.39 -1.07 0.00 0.00 179.97 180.45 1hth h VAL 21 N -1.00 0.19 0.03 2.04 -1.51 -1.92 1.29 116.25 115.37 1hth h VAL 21 Ca -0.28 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.19 1hth h VAL 21 Cb 1.23 0.27 0.00 0.00 -2.13 0.00 0.00 31.29 30.65 1hth h VAL 21 CO -0.17 0.00 -0.01 -0.08 -1.23 0.00 0.00 177.57 176.08 1hth h GLU 22 N 0.00 -0.04 0.58 5.19 4.81 -1.92 -2.96 114.58 120.24 1hth h GLU 22 Ca 0.50 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.71 1hth h GLU 22 Cb 2.43 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 31.82 1hth h GLU 22 CO -0.01 -0.02 -0.34 0.11 -0.73 0.00 0.00 179.01 178.02 1hth h TRP 23 N -0.05 -0.91 -0.79 0.92 -0.00 -0.14 -1.19 115.95 113.79 1hth h TRP 23 Ca -0.00 -0.01 0.31 0.00 -0.00 0.00 0.00 58.89 59.18 1hth h TRP 23 Cb 0.03 0.32 -0.14 0.00 -0.00 0.00 0.00 29.16 29.37 1hth h TRP 23 CO 0.15 -0.53 0.34 1.28 -0.00 0.00 0.00 178.44 179.68 1hth n LEU 24 N -5.48 0.20 0.03 0.11 4.32 0.40 0.10 117.00 116.68 1hth n LEU 24 Ca -0.12 1.31 -0.13 0.00 -0.02 0.00 0.00 56.01 57.05 1hth n LEU 24 Cb 0.38 -0.61 -0.14 0.00 -1.62 0.00 0.00 43.42 41.43 1hth n LEU 24 CO 0.35 -1.44 -0.39 -0.09 -1.22 0.00 0.00 177.39 174.60 1hth h ARG 25 N 0.00 0.14 -1.05 3.23 2.43 -1.25 -3.34 114.38 114.53 1hth h ARG 25 Ca 0.63 -0.23 -0.58 0.00 -0.81 0.00 0.00 59.98 58.98 1hth h ARG 25 Cb 1.62 0.09 -0.27 0.00 -0.42 0.00 0.00 29.97 30.98 1hth h ARG 25 CO -0.63 0.91 0.75 1.63 -1.51 0.00 0.00 179.97 181.12 1hth n LYS 26 N -3.31 2.44 -0.08 0.20 5.02 0.29 -4.45 118.16 118.27 1hth n LYS 26 Ca -0.16 -2.96 -0.11 0.00 -2.02 0.00 0.00 58.31 53.06 1hth n LYS 26 Cb 1.03 -2.16 -0.04 0.00 -0.02 0.00 0.00 35.03 33.84 1hth n LYS 26 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1hth n LYS 27 N -0.82 0.46 -0.03 1.97 0.00 0.25 -4.19 118.16 115.80 1hth n LYS 27 Ca 0.57 0.19 0.05 0.00 0.00 0.00 0.00 58.31 59.12 1hth n LYS 27 Cb 0.92 -1.31 0.23 0.00 0.00 0.00 0.00 35.03 34.88 1hth n LYS 27 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1hth n LEU 28 N -4.28 0.44 -2.05 3.14 4.77 -1.26 -3.50 117.00 114.26 1hth n LEU 28 Ca -0.19 -0.21 -0.03 0.00 -0.03 0.00 0.00 56.01 55.56 1hth n LEU 28 Cb 0.52 -0.04 0.06 0.00 -2.33 0.00 0.00 43.42 41.62 1hth n LEU 28 CO 0.15 0.10 0.09 1.67 -1.33 0.00 0.00 177.39 178.08 1hth n GLN 29 N -0.36 1.63 0.02 3.23 0.00 -1.26 -4.86 117.38 115.77 1hth n GLN 29 Ca 0.08 -3.22 -0.02 0.00 -0.00 0.00 0.00 57.00 53.84 1hth n GLN 29 Cb 0.10 -1.32 -0.01 0.00 0.00 0.00 0.00 30.24 29.01 1hth n GLN 29 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 1hth n ASP 30 N -0.40 0.97 0.00 1.69 2.03 -1.23 -4.95 116.55 114.66 1hth n ASP 30 Ca 0.15 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.60 1hth n ASP 30 Cb 0.91 -0.32 0.00 0.00 -0.72 0.00 0.00 41.12 40.99 1hth n ASP 30 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1hth n VAL 31 N -3.51 0.00 -2.49 5.18 3.14 -1.26 -5.06 118.33 114.33 1hth n VAL 31 Ca -0.04 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.32 1hth n VAL 31 Cb 0.21 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 33.06 1hth n VAL 31 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1hth n HIS 32 N 0.00 -1.18 0.00 1.45 1.44 -1.26 -5.05 115.22 110.62 1hth n HIS 32 Ca 0.00 -1.03 0.00 0.00 -2.01 0.00 0.00 57.72 54.68 1hth n HIS 32 Cb 0.00 1.11 0.00 0.00 0.12 0.00 0.00 29.99 31.22 1hth n HIS 32 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 1hth n ASN 33 N -0.89 0.00 0.00 4.39 0.23 -1.26 -5.13 115.26 112.61 1hth n ASN 33 Ca -0.13 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.92 1hth n ASN 33 Cb 0.72 -0.10 0.00 0.00 -2.08 0.00 0.00 39.78 38.33 1hth n ASN 33 CO 0.00 0.00 0.00 2.22 -0.93 0.00 0.00 177.26 178.55