#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h20 n GLN 2 N 0.00 0.00 -2.68 5.31 0.00 -1.26 -4.47 117.38 114.28 1h20 n GLN 2 Ca 0.00 -0.52 -0.42 0.00 0.00 0.00 0.00 57.00 56.06 1h20 n GLN 2 Cb 0.00 0.32 -0.02 0.00 0.00 0.00 0.00 30.24 30.54 1h20 n GLN 2 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 1h20 s HIS 3 N 0.00 2.78 0.00 2.61 -3.43 -1.26 -4.50 115.29 111.49 1h20 s HIS 3 Ca 0.00 -1.17 0.00 0.00 -0.80 0.00 0.00 55.06 53.09 1h20 s HIS 3 Cb 0.00 -4.58 0.00 0.00 -1.43 0.00 0.00 32.58 26.57 1h20 s HIS 3 CO 0.00 -1.77 0.00 0.00 -2.00 0.00 0.00 174.74 170.97 1h20 n ALA 4 N 8.02 0.00 -2.69 -1.38 0.00 -1.26 -4.94 120.51 118.26 1h20 n ALA 4 Ca 0.33 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 1h20 n ALA 4 Cb 0.49 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 19.48 1h20 n ALA 4 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1h20 s ASP 5 N -2.13 7.31 0.53 0.00 2.15 -1.26 -4.97 116.67 118.31 1h20 s ASP 5 Ca 0.00 1.63 0.32 0.00 0.43 0.00 0.00 52.55 54.93 1h20 s ASP 5 Cb 0.00 -2.57 1.30 0.00 -0.30 0.00 0.00 42.92 41.35 1h20 s ASP 5 CO 0.00 -0.33 1.96 1.55 -0.17 0.00 0.00 175.17 178.18 1h20 h PRO 6 N 6.91 0.00 0.00 4.34 0.13 -1.92 -3.32 132.00 138.14 1h20 h PRO 6 Ca -0.38 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.73 1h20 h PRO 6 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h20 h PRO 6 CO 0.79 0.05 -2.00 -0.89 -0.23 0.00 0.00 178.00 175.71 1h20 n ILE 7 N -3.17 0.09 -1.53 -3.56 -0.00 -1.26 -4.99 119.36 104.94 1h20 n ILE 7 Ca 0.00 -0.51 -0.54 0.00 -0.00 0.00 0.00 62.75 61.71 1h20 n ILE 7 Cb 0.32 -0.02 -0.07 0.00 -0.00 0.00 0.00 39.64 39.87 1h20 n ILE 7 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1h20 n ASN 9 N 7.98 -2.73 -4.71 0.00 3.02 0.48 -4.87 115.26 114.43 1h20 n ASN 9 Ca 0.36 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.49 1h20 n ASN 9 Cb 0.18 -0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 38.86 1h20 n ASN 9 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1h20 s LYS 10 N -1.61 4.24 -0.07 3.52 2.47 0.41 -4.44 119.74 124.27 1h20 s LYS 10 Ca 0.00 2.26 -0.30 0.00 -1.56 0.00 0.00 55.97 56.37 1h20 s LYS 10 Cb 0.00 -3.28 -0.03 0.00 -1.46 0.00 0.00 37.83 33.06 1h20 s LYS 10 CO 0.00 -0.58 1.15 -2.14 0.16 0.00 0.00 175.35 173.94 1h20 s PRO 11 N 1.46 4.37 0.00 4.03 0.02 -1.26 -0.76 135.00 142.87 1h20 s PRO 11 Ca 0.69 1.60 0.00 0.00 0.02 0.00 0.00 61.00 63.31 1h20 s PRO 11 Cb -0.41 -3.55 0.00 0.00 0.02 0.00 0.00 34.50 30.57 1h20 s PRO 11 CO 0.31 -0.41 0.00 0.00 -0.33 0.00 0.00 177.00 176.57 1h20 n LYS 13 N 0.00 0.00 -2.69 0.00 3.00 -1.26 -4.15 118.16 113.05 1h20 n LYS 13 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.10 1h20 n LYS 13 Cb 0.00 -0.68 0.10 0.00 0.00 0.00 0.00 35.03 34.44 1h20 n LYS 13 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1h20 n THR 14 N -2.20 0.00 0.04 3.15 -2.24 -1.26 -4.72 114.28 107.03 1h20 n THR 14 Ca 0.00 -1.69 0.04 0.00 -2.27 0.00 0.00 64.05 60.13 1h20 n THR 14 Cb 0.28 -0.75 -0.08 0.00 -2.10 0.00 0.00 70.33 67.68 1h20 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1h20 n HIS 15 N -2.60 0.79 0.21 4.78 1.44 -1.26 -3.30 115.22 115.27 1h20 n HIS 15 Ca 0.16 0.25 0.09 0.00 -2.01 0.00 0.00 57.72 56.21 1h20 n HIS 15 Cb 0.58 -0.98 0.62 0.00 0.12 0.00 0.00 29.99 30.34 1h20 n HIS 15 CO 0.00 0.00 0.00 -0.44 -2.81 0.00 0.00 176.34 173.09 1h20 h ASP 16 N 0.00 0.05 0.51 4.39 5.19 -1.97 -1.70 116.42 122.90 1h20 h ASP 16 Ca -0.13 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1h20 h ASP 16 Cb 1.41 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.90 1h20 h ASP 16 CO 0.03 0.04 0.00 0.47 -3.12 0.00 0.00 179.24 176.65 1h20 n ASP 17 N -4.52 0.22 -0.30 6.45 8.00 -1.21 -1.02 116.55 124.18 1h20 n ASP 17 Ca -0.01 0.56 0.08 0.00 0.71 0.00 0.00 54.79 56.13 1h20 n ASP 17 Cb 0.14 -0.60 0.17 0.00 -0.02 0.00 0.00 41.12 40.80 1h20 n ASP 17 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h20 h SER 19 N 0.41 0.16 0.78 0.00 4.64 -1.11 -1.40 113.55 117.03 1h20 h SER 19 Ca 0.01 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1h20 h SER 19 Cb 1.04 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1h20 h SER 19 CO 0.02 0.04 -0.02 0.61 -0.87 0.00 0.00 176.83 176.61 1h20 n GLY 20 N -1.65 -1.38 3.67 -0.77 0.00 -1.26 -4.89 105.19 98.90 1h20 n GLY 20 Ca 0.22 -0.13 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1h20 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h20 s ALA 21 N -2.80 0.97 0.00 4.61 0.00 -0.53 -4.77 121.76 119.24 1h20 s ALA 21 Ca 0.21 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1h20 s ALA 21 Cb 0.20 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 20.37 1h20 s ALA 21 CO 0.50 -3.16 0.00 -2.67 0.00 0.00 0.00 175.76 170.43 1h20 n TRP 22 N -4.42 0.00 -0.05 0.00 4.27 -1.26 -4.82 117.44 111.16 1h20 n TRP 22 Ca 0.11 0.00 -0.07 0.00 -3.89 0.00 0.00 57.50 53.65 1h20 n TRP 22 Cb 0.59 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.52 1h20 n TRP 22 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 1h20 n PHE 23 N -1.23 0.00 -0.97 -2.67 7.35 -1.26 -4.60 117.46 114.08 1h20 n PHE 23 Ca 0.00 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.55 1h20 n PHE 23 Cb 0.00 -0.36 -0.05 0.00 0.35 0.00 0.00 39.48 39.42 1h20 n PHE 23 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1h20 n GLN 25 N 1.36 0.84 -3.82 0.00 1.13 -1.18 -3.80 117.38 111.91 1h20 n GLN 25 Ca 0.31 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 55.24 1h20 n GLN 25 Cb 0.65 -1.19 -0.13 0.00 0.11 0.00 0.00 30.24 29.68 1h20 n GLN 25 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1h20 s ALA 26 N -1.54 -0.26 -0.35 -1.58 0.00 -1.01 -4.72 121.76 112.29 1h20 s ALA 26 Ca 0.00 0.37 -0.11 0.00 0.00 0.00 0.00 51.96 52.22 1h20 s ALA 26 Cb 0.00 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1h20 s ALA 26 CO 0.00 -0.07 0.20 0.00 0.00 0.00 0.00 175.76 175.89 1h20 s TRP 28 N 1.61 2.80 0.00 0.00 0.52 -0.70 -4.55 118.94 118.63 1h20 s TRP 28 Ca 0.04 1.50 0.00 0.00 0.02 0.00 0.00 56.10 57.66 1h20 s TRP 28 Cb -0.18 -3.47 0.00 0.00 -1.15 0.00 0.00 33.47 28.66 1h20 s TRP 28 CO 0.07 -1.75 0.85 0.27 0.02 0.00 0.00 176.95 176.41 1h20 n ASN 29 N -0.44 0.00 0.09 2.95 0.23 -1.26 -0.79 115.26 116.04 1h20 n ASN 29 Ca 0.07 0.85 -0.02 0.00 -0.53 0.00 0.00 54.58 54.95 1h20 n ASN 29 Cb 0.47 -0.35 0.23 0.00 -2.08 0.00 0.00 39.78 38.04 1h20 n ASN 29 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1h20 h SER 30 N 0.00 0.28 0.27 0.53 4.64 -1.99 -3.22 113.55 114.06 1h20 h SER 30 Ca 0.00 -0.11 -0.34 0.00 -0.47 0.00 0.00 61.79 60.87 1h20 h SER 30 Cb 0.00 -0.08 0.03 0.00 -0.31 0.00 0.00 62.40 62.04 1h20 h SER 30 CO 0.00 0.65 -1.56 0.00 -0.87 0.00 0.00 176.83 175.05 1h20 h ALA 31 N 1.37 -0.04 -2.52 5.18 0.00 -1.97 -3.48 119.26 117.81 1h20 h ALA 31 Ca 0.02 -0.96 -0.36 0.00 0.00 0.00 0.00 54.91 53.61 1h20 h ALA 31 Cb 0.79 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 1h20 h ALA 31 CO 0.06 0.83 -0.46 0.54 0.00 0.00 0.00 179.25 180.22 1h20 n ARG 32 N -3.66 -1.44 -3.95 0.00 1.74 0.03 -5.00 116.66 104.39 1h20 n ARG 32 Ca -0.19 0.89 -0.10 0.00 -0.77 0.00 0.00 57.85 57.69 1h20 n ARG 32 Cb 1.09 -5.39 -0.11 0.00 -1.02 0.00 0.00 32.46 27.03 1h20 n ARG 32 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1h20 s THR 33 N -2.90 0.09 -0.84 0.55 -4.23 -1.26 -0.70 115.64 106.35 1h20 s THR 33 Ca 0.00 -0.77 -0.26 0.00 -1.18 0.00 0.00 61.69 59.48 1h20 s THR 33 Cb 0.00 -0.27 -0.15 0.00 1.34 0.00 0.00 72.50 73.42 1h20 s THR 33 CO 0.00 -0.42 2.34 0.00 -0.54 0.00 0.00 174.62 176.00 1h20 n GLY 35 N 6.72 1.34 3.58 0.00 0.00 0.57 -0.39 105.19 117.02 1h20 n GLY 35 Ca 0.46 -2.13 -0.30 0.00 0.00 0.00 0.00 46.02 44.04 1h20 n GLY 35 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1h20 n PRO 36 N -2.45 -1.05 0.26 1.61 -0.04 -1.26 -2.41 135.00 129.67 1h20 n PRO 36 Ca 0.15 -0.25 0.15 0.00 -0.04 0.00 0.00 63.50 63.51 1h20 n PRO 36 Cb 0.56 -2.26 0.69 0.00 -0.04 0.00 0.00 33.50 32.45 1h20 n PRO 36 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1h20 h TYR 37 N -2.11 0.00 0.00 0.54 5.03 -1.47 -3.37 116.97 115.59 1h20 h TYR 37 Ca -0.49 0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.82 1h20 h TYR 37 Cb 1.29 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.57 1h20 h TYR 37 CO 0.42 0.10 0.00 1.55 -1.32 0.00 0.00 178.16 178.90 1h20 n VAL 38 N -3.32 0.00 -0.23 1.81 3.14 -1.26 -4.79 118.33 113.68 1h20 n VAL 38 Ca -0.01 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 1h20 n VAL 38 Cb 0.30 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.08 1h20 n VAL 38 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98