#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ha8 h GLU 2 N 0.00 0.23 -0.28 1.61 4.39 -1.95 0.29 114.58 118.87 1ha8 h GLU 2 Ca 0.00 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.68 1ha8 h GLU 2 Cb 0.00 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.58 1ha8 h GLU 2 CO 0.00 0.37 0.08 0.00 -1.16 0.00 0.00 179.01 178.29 1ha8 h GLU 4 N 0.19 1.19 -0.30 0.00 5.08 -1.61 -2.35 114.58 116.78 1ha8 h GLU 4 Ca 0.13 -0.19 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1ha8 h GLU 4 Cb 0.12 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1ha8 h GLU 4 CO -0.15 0.93 0.02 0.37 -1.00 0.00 0.00 179.01 179.18 1ha8 h GLN 5 N 1.18 0.45 0.10 2.33 5.75 0.08 0.11 115.11 125.10 1ha8 h GLN 5 Ca 0.28 -0.08 -0.00 0.00 -0.15 0.00 0.00 58.65 58.69 1ha8 h GLN 5 Cb 0.15 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 28.63 1ha8 h GLN 5 CO -0.03 0.46 -0.05 0.00 -2.65 0.00 0.00 178.83 176.56 1ha8 h PHE 7 N -0.42 0.60 -0.41 0.00 0.04 -0.86 -0.73 116.94 115.16 1ha8 h PHE 7 Ca -0.01 0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1ha8 h PHE 7 Cb 0.35 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 1ha8 h PHE 7 CO 0.02 0.35 0.27 0.77 -0.60 0.00 0.00 178.31 179.13 1ha8 h SER 8 N 0.63 0.43 -0.79 2.17 0.02 -0.78 -1.35 113.55 113.88 1ha8 h SER 8 Ca 0.21 -0.01 -0.49 0.00 -0.84 0.00 0.00 61.79 60.66 1ha8 h SER 8 Cb 0.08 -0.10 -0.23 0.00 0.14 0.00 0.00 62.40 62.28 1ha8 h SER 8 CO -0.06 0.31 0.64 -0.67 -1.14 0.00 0.00 176.83 175.91 1ha8 n ASP 9 N -4.48 6.00 -1.44 3.07 2.03 -0.34 -4.86 116.55 116.54 1ha8 n ASP 9 Ca 0.04 -3.42 -0.15 0.00 0.52 0.00 0.00 54.79 51.77 1ha8 n ASP 9 Cb 0.10 -0.93 -0.03 0.00 -0.72 0.00 0.00 41.12 39.54 1ha8 n ASP 9 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ha8 n GLY 10 N -0.54 0.56 3.74 0.27 0.00 -0.51 -5.01 105.19 103.70 1ha8 n GLY 10 Ca 0.49 -0.29 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1ha8 n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ha8 s GLY 11 N -2.57 1.70 0.00 -0.02 0.00 -0.87 -4.98 107.32 100.58 1ha8 s GLY 11 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 44.72 45.08 1ha8 s GLY 11 CO 0.00 0.73 0.00 2.09 0.00 0.00 0.00 173.10 175.92 1ha8 n ASP 12 N -3.67 0.00 0.00 1.64 5.68 -1.26 -4.58 116.55 114.36 1ha8 n ASP 12 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 1ha8 n ASP 12 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1ha8 n ASP 12 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ha8 h THR 14 N 0.00 0.73 0.00 0.00 2.02 -2.00 -2.76 112.91 110.90 1ha8 h THR 14 Ca 0.00 -0.73 0.00 0.00 0.77 0.00 0.00 66.41 66.45 1ha8 h THR 14 Cb 0.61 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.11 1ha8 h THR 14 CO 0.00 0.14 0.00 1.07 0.37 0.00 0.00 175.52 177.10 1ha8 n THR 15 N -5.08 1.40 -0.58 3.16 5.66 -1.26 -1.78 114.28 115.80 1ha8 n THR 15 Ca -0.09 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.68 1ha8 n THR 15 Cb 0.26 -1.22 0.00 0.00 -1.55 0.00 0.00 70.33 67.82 1ha8 n THR 15 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1ha8 n PHE 17 N 0.00 1.16 -3.67 0.00 7.35 -0.73 -2.19 117.46 119.37 1ha8 n PHE 17 Ca 0.00 0.28 -0.28 0.00 -0.76 0.00 0.00 57.45 56.69 1ha8 n PHE 17 Cb 0.00 -1.16 -0.01 0.00 0.35 0.00 0.00 39.48 38.66 1ha8 n PHE 17 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1ha8 n ASN 18 N -3.37 -3.77 -4.05 -2.13 5.15 -1.14 -0.89 115.26 105.05 1ha8 n ASN 18 Ca -0.29 -0.61 -0.45 0.00 -0.60 0.00 0.00 54.58 52.63 1ha8 n ASN 18 Cb 1.05 -3.09 0.02 0.00 -0.53 0.00 0.00 39.78 37.22 1ha8 n ASN 18 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1ha8 n ASN 19 N -2.46 -4.21 0.00 1.20 2.85 -1.26 -3.07 115.26 108.31 1ha8 n ASN 19 Ca 0.02 -1.27 0.00 0.00 -0.11 0.00 0.00 54.58 53.22 1ha8 n ASN 19 Cb 0.52 -1.63 0.00 0.00 1.24 0.00 0.00 39.78 39.92 1ha8 n ASN 19 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ha8 n GLY 20 N -2.05 0.53 0.00 8.20 0.00 -0.07 -4.92 105.19 106.88 1ha8 n GLY 20 Ca -0.14 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1ha8 n GLY 20 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ha8 n THR 21 N -2.76 0.00 -1.10 2.61 -1.04 -0.61 -4.96 114.28 106.42 1ha8 n THR 21 Ca 0.00 -0.19 -0.03 0.00 -2.04 0.00 0.00 64.05 61.80 1ha8 n THR 21 Cb 0.00 0.69 0.02 0.00 -1.82 0.00 0.00 70.33 69.22 1ha8 n THR 21 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ha8 n GLY 22 N 1.30 -1.14 0.35 3.41 0.00 -0.16 -4.94 105.19 104.01 1ha8 n GLY 22 Ca 0.00 -1.68 -0.14 0.00 0.00 0.00 0.00 46.02 44.20 1ha8 n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ha8 h PRO 23 N 0.00 -0.81 -4.99 1.61 0.13 -1.83 -3.32 132.00 122.78 1ha8 h PRO 23 Ca -0.04 0.06 -0.71 0.00 -0.87 0.00 0.00 66.00 64.44 1ha8 h PRO 23 Cb 0.11 0.19 -0.10 0.00 0.13 0.00 0.00 31.00 31.32 1ha8 h PRO 23 CO 0.03 -0.52 2.18 0.00 -0.23 0.00 0.00 178.00 179.46 1ha8 n ALA 25 N 6.83 2.19 1.23 0.00 0.00 -1.25 -4.06 120.51 125.46 1ha8 n ALA 25 Ca 0.46 -0.43 0.10 0.00 0.00 0.00 0.00 53.44 53.57 1ha8 n ALA 25 Cb 0.43 0.34 0.60 0.00 0.00 0.00 0.00 19.45 20.82 1ha8 n ALA 25 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ha8 n ASN 26 N -3.33 0.00 -0.65 0.00 0.23 -1.26 -1.77 115.26 108.48 1ha8 n ASN 26 Ca -0.21 -0.48 0.09 0.00 -0.53 0.00 0.00 54.58 53.46 1ha8 n ASN 26 Cb 0.66 -0.08 0.29 0.00 -2.08 0.00 0.00 39.78 38.57 1ha8 n ASN 26 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ha8 n LEU 28 N 0.51 1.87 0.04 0.00 7.99 -0.73 -4.55 117.00 122.13 1ha8 n LEU 28 Ca 0.15 0.31 0.10 0.00 -0.01 0.00 0.00 56.01 56.56 1ha8 n LEU 28 Cb 0.35 -0.71 0.40 0.00 -0.11 0.00 0.00 43.42 43.36 1ha8 n LEU 28 CO 0.12 -0.30 0.80 0.00 -1.51 0.00 0.00 177.39 176.50 1ha8 n ALA 29 N -4.38 1.79 -2.83 -1.18 0.00 -1.26 -3.85 120.51 108.81 1ha8 n ALA 29 Ca -0.13 -0.02 -0.03 0.00 0.00 0.00 0.00 53.44 53.26 1ha8 n ALA 29 Cb 0.48 -1.32 0.01 0.00 0.00 0.00 0.00 19.45 18.62 1ha8 n ALA 29 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1ha8 s GLY 30 N -3.17 -1.35 -0.41 0.00 0.00 -1.26 -5.08 107.32 96.04 1ha8 s GLY 30 Ca 0.07 -0.13 0.09 0.00 0.00 0.00 0.00 44.72 44.75 1ha8 s GLY 30 CO 0.35 3.76 1.04 1.58 0.00 0.00 0.00 173.10 179.84 1ha8 n TYR 31 N 3.19 2.73 0.08 1.90 4.11 -1.25 -4.84 117.16 123.07 1ha8 n TYR 31 Ca 0.16 -3.12 -0.06 0.00 -0.00 0.00 0.00 57.90 54.88 1ha8 n TYR 31 Cb 0.57 -0.20 -0.05 0.00 -0.00 0.00 0.00 39.34 39.66 1ha8 n TYR 31 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.86 175.86 1ha8 h PRO 32 N 2.74 0.03 -0.07 -3.48 0.13 -1.94 -2.45 132.00 126.97 1ha8 h PRO 32 Ca 0.17 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1ha8 h PRO 32 Cb 0.96 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1ha8 h PRO 32 CO 0.74 0.93 0.00 0.00 -0.23 0.00 0.00 178.00 179.43 1ha8 n ALA 33 N -2.38 2.49 0.26 -0.56 0.00 -1.26 -4.67 120.51 114.39 1ha8 n ALA 33 Ca -0.01 -0.64 0.10 0.00 0.00 0.00 0.00 53.44 52.90 1ha8 n ALA 33 Cb 0.86 -0.94 0.71 0.00 0.00 0.00 0.00 19.45 20.09 1ha8 n ALA 33 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ha8 h GLY 34 N 4.75 0.00 2.00 0.00 0.00 -1.78 -0.78 103.07 107.27 1ha8 h GLY 34 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 1ha8 h GLY 34 CO 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 176.54 176.40 1ha8 n SER 36 N -3.68 2.83 -4.51 0.00 7.64 -0.32 -4.56 113.62 111.01 1ha8 n SER 36 Ca -0.02 -1.91 -0.43 0.00 1.01 0.00 0.00 58.87 57.53 1ha8 n SER 36 Cb 0.26 -0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.44 1ha8 n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1ha8 s ASN 37 N -1.79 6.79 0.62 6.43 -0.87 -0.64 -4.89 114.94 120.58 1ha8 s ASN 37 Ca 0.26 -2.31 0.26 0.00 -1.57 0.00 0.00 52.86 49.50 1ha8 s ASN 37 Cb 0.18 -2.48 1.29 0.00 -0.02 0.00 0.00 41.25 40.23 1ha8 s ASN 37 CO 0.27 -1.09 1.72 0.28 -2.57 0.00 0.00 177.10 175.72 1ha8 h SER 38 N 8.22 0.00 -0.74 -1.22 0.02 -1.80 0.43 113.55 118.45 1ha8 h SER 38 Ca 0.29 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.21 1ha8 h SER 38 Cb 0.94 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.44 1ha8 h SER 38 CO 1.31 0.00 0.34 -0.78 -1.14 0.00 0.00 176.83 176.56 1ha8 h ASP 39 N 0.00 1.00 0.01 3.07 3.58 -1.91 -3.26 116.42 118.91 1ha8 h ASP 39 Ca 0.19 -0.13 0.00 0.00 0.42 0.00 0.00 57.03 57.51 1ha8 h ASP 39 Cb 1.42 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.21 1ha8 h ASP 39 CO -0.00 0.86 -1.52 0.00 -2.88 0.00 0.00 179.24 175.70 1ha8 h THR 41 N 0.00 0.97 -0.30 0.00 2.02 -1.14 0.91 112.91 115.36 1ha8 h THR 41 Ca 0.00 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.05 1ha8 h THR 41 Cb 0.76 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 1ha8 h THR 41 CO 0.00 0.05 0.06 0.00 0.37 0.00 0.00 175.52 176.00 1ha8 h ALA 42 N 1.16 0.40 -0.03 6.16 0.00 -1.82 0.80 119.26 125.93 1ha8 h ALA 42 Ca 0.13 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1ha8 h ALA 42 Cb 0.06 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1ha8 h ALA 42 CO -0.10 0.08 -0.31 0.35 0.00 0.00 0.00 179.25 179.28 1ha8 h PHE 43 N 0.33 -0.84 -0.09 0.00 3.04 -1.79 -2.28 116.94 115.31 1ha8 h PHE 43 Ca 0.09 0.03 -0.14 0.00 3.98 0.00 0.00 57.97 61.94 1ha8 h PHE 43 Cb 0.32 0.38 -0.01 0.00 2.56 0.00 0.00 35.95 39.20 1ha8 h PHE 43 CO 0.02 -0.40 -0.55 -0.07 -2.02 0.00 0.00 178.31 175.29 1ha8 h LEU 44 N -0.44 0.29 -0.58 0.59 3.38 -0.49 0.12 115.31 118.18 1ha8 h LEU 44 Ca 0.07 -0.16 0.10 0.00 0.09 0.00 0.00 57.88 57.99 1ha8 h LEU 44 Cb 0.54 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.13 1ha8 h LEU 44 CO -0.28 0.79 0.14 -1.28 0.09 0.00 0.00 178.44 177.90 1ha8 h SER 45 N 0.20 0.04 0.00 -0.43 0.87 -0.74 0.40 113.55 113.89 1ha8 h SER 45 Ca 0.00 0.10 -0.23 0.00 -1.23 0.00 0.00 61.79 60.43 1ha8 h SER 45 Cb 1.04 0.13 0.01 0.00 -0.44 0.00 0.00 62.40 63.14 1ha8 h SER 45 CO 0.09 0.03 -0.88 1.56 -0.53 0.00 0.00 176.83 177.10 1ha8 h GLN 46 N 0.28 0.68 0.00 2.24 4.20 -0.63 -1.44 115.11 120.43 1ha8 h GLN 46 Ca 0.30 -0.63 0.00 0.00 0.06 0.00 0.00 58.65 58.39 1ha8 h GLN 46 Cb 0.43 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.36 1ha8 h GLN 46 CO -0.37 1.23 -0.85 0.00 -0.67 0.00 0.00 178.83 178.17 1ha8 n TYR 48 N -1.84 0.00 0.00 0.00 4.01 0.08 -5.03 117.16 114.37 1ha8 n TYR 48 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1ha8 n TYR 48 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 1ha8 n TYR 48 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ha8 n GLY 49 N 2.25 2.01 1.81 2.72 0.00 -0.54 -4.92 105.19 108.52 1ha8 n GLY 49 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1ha8 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ha8 n GLY 50 N 0.00 -1.62 3.25 -0.02 0.00 -1.07 -4.59 105.19 101.14 1ha8 n GLY 50 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1ha8 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32