#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 -2.07 3.44 -0.00 -1.26 -5.08 117.38 112.42 1h20 n GLN 2 Ca 0.00 -0.78 -0.01 0.00 -0.00 0.00 0.00 57.00 56.21 1h20 n GLN 2 Cb 0.00 0.41 0.00 0.00 -0.00 0.00 0.00 30.24 30.65 1h20 n GLN 2 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.06 174.67 1h20 n HIS 3 N 0.00 -1.72 1.84 2.61 1.44 -1.26 -4.99 115.22 113.14 1h20 n HIS 3 Ca -0.22 0.74 0.09 0.00 -2.01 0.00 0.00 57.72 56.33 1h20 n HIS 3 Cb 0.64 -2.65 0.56 0.00 0.12 0.00 0.00 29.99 28.66 1h20 n HIS 3 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1h20 n ALA 4 N 0.06 2.53 -1.77 1.59 0.00 -1.26 -4.95 120.51 116.71 1h20 n ALA 4 Ca 0.02 -0.12 -0.38 0.00 0.00 0.00 0.00 53.44 52.96 1h20 n ALA 4 Cb 0.07 -1.31 -0.05 0.00 0.00 0.00 0.00 19.45 18.16 1h20 n ALA 4 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1h20 s ASP 5 N -1.67 7.13 -0.14 0.00 1.47 -1.26 -4.94 116.67 117.25 1h20 s ASP 5 Ca 0.28 2.01 0.04 0.00 1.18 0.00 0.00 52.55 56.06 1h20 s ASP 5 Cb 0.13 -2.59 0.33 0.00 -0.34 0.00 0.00 42.92 40.45 1h20 s ASP 5 CO 0.22 -0.22 1.19 -0.81 0.68 0.00 0.00 175.17 176.23 1h20 n PRO 6 N 0.52 2.21 -0.07 2.11 -0.04 -1.26 -4.14 135.00 134.33 1h20 n PRO 6 Ca 0.02 -1.34 -0.07 0.00 -0.04 0.00 0.00 63.50 62.07 1h20 n PRO 6 Cb 0.49 -1.70 -0.11 0.00 -0.04 0.00 0.00 33.50 32.14 1h20 n PRO 6 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1h20 n ILE 7 N 0.07 0.94 -1.63 0.52 0.13 -1.26 -4.93 119.36 113.20 1h20 n ILE 7 Ca 0.18 -0.57 -0.50 0.00 -1.10 0.00 0.00 62.75 60.76 1h20 n ILE 7 Cb 0.81 -0.67 -0.06 0.00 -0.84 0.00 0.00 39.64 38.88 1h20 n ILE 7 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1h20 n ASN 9 N 7.64 -1.88 -4.71 0.00 3.02 -0.54 -4.96 115.26 113.82 1h20 n ASN 9 Ca 0.28 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.41 1h20 n ASN 9 Cb 0.27 -0.31 -0.03 0.00 -0.61 0.00 0.00 39.78 39.09 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 -0.79 4.29 0.04 3.52 2.36 0.33 -4.61 119.74 124.89 1h20 s LYS 10 Ca 0.00 2.14 -0.30 0.00 -2.55 0.00 0.00 55.97 55.26 1h20 s LYS 10 Cb 0.00 -3.27 -0.05 0.00 -1.05 0.00 0.00 37.83 33.46 1h20 s LYS 10 CO 0.00 -0.50 1.16 -2.14 1.55 0.00 0.00 175.35 175.42 1h20 s PRO 11 N 1.30 4.45 0.00 4.03 0.02 -1.26 -0.98 135.00 142.56 1h20 s PRO 11 Ca 0.66 1.69 0.00 0.00 0.02 0.00 0.00 61.00 63.38 1h20 s PRO 11 Cb -0.38 -3.38 0.00 0.00 0.02 0.00 0.00 34.50 30.76 1h20 s PRO 11 CO 0.30 -0.23 0.00 0.00 -0.33 0.00 0.00 177.00 176.74 1h20 n LYS 13 N 0.00 0.38 -2.63 0.00 3.00 -1.26 -4.09 118.16 113.55 1h20 n LYS 13 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 58.31 58.12 1h20 n LYS 13 Cb 0.00 -0.71 0.08 0.00 0.00 0.00 0.00 35.03 34.40 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 -1.74 0.00 -0.02 3.15 -2.24 -1.26 -4.63 114.28 107.54 1h20 n THR 14 Ca 0.00 -1.63 -0.05 0.00 -2.27 0.00 0.00 64.05 60.10 1h20 n THR 14 Cb 0.21 -0.72 -0.13 0.00 -2.10 0.00 0.00 70.33 67.59 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 -2.42 0.72 0.25 4.78 1.44 -1.26 -3.45 115.22 115.28 1h20 n HIS 15 Ca 0.15 0.25 0.09 0.00 -2.01 0.00 0.00 57.72 56.20 1h20 n HIS 15 Cb 0.55 -1.08 0.64 0.00 0.12 0.00 0.00 29.99 30.22 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 0.00 0.59 4.39 3.32 -1.97 -1.69 116.42 121.07 1h20 h ASP 16 Ca -0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.76 1h20 h ASP 16 Cb 1.87 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.42 1h20 h ASP 16 CO 0.05 0.09 0.00 0.44 -1.72 0.00 0.00 179.24 178.10 1h20 h ASP 17 N 0.00 0.00 -0.93 6.45 3.45 -1.93 -1.12 116.42 122.34 1h20 h ASP 17 Ca -0.00 0.00 -0.64 0.00 0.43 0.00 0.00 57.03 56.82 1h20 h ASP 17 Cb 0.16 0.00 -0.32 0.00 -0.56 0.00 0.00 39.33 38.61 1h20 h ASP 17 CO 0.01 0.00 0.44 0.00 -1.57 0.00 0.00 179.24 178.13 1h20 h SER 19 N 2.02 0.31 0.88 0.00 0.87 -1.36 -0.76 113.55 115.52 1h20 h SER 19 Ca 0.55 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 61.31 1h20 h SER 19 Cb 1.03 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.18 1h20 h SER 19 CO 1.37 -0.16 0.00 0.61 -0.53 0.00 0.00 176.83 178.12 1h20 n GLY 20 N -1.32 -1.44 3.77 5.77 0.00 -1.26 -4.87 105.19 105.83 1h20 n GLY 20 Ca 0.28 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.88 2.09 0.00 4.61 0.00 -0.29 -4.80 121.76 120.49 1h20 s ALA 21 Ca 0.18 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.18 1h20 s ALA 21 Cb 0.19 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 20.11 1h20 s ALA 21 CO 0.51 -1.87 0.00 -2.67 0.00 0.00 0.00 175.76 171.73 1h20 n TRP 22 N -3.56 0.00 -0.05 0.00 4.27 -1.26 -4.80 117.44 112.03 1h20 n TRP 22 Ca 0.08 0.00 -0.05 0.00 -3.89 0.00 0.00 57.50 53.63 1h20 n TRP 22 Cb 0.54 0.00 -0.02 0.00 -1.36 0.00 0.00 31.31 30.48 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 -1.30 0.00 -1.27 -2.67 -0.00 -1.26 -4.46 117.46 106.51 1h20 n PHE 23 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.45 57.24 1h20 n PHE 23 Cb 0.00 -0.31 -0.11 0.00 -0.00 0.00 0.00 39.48 39.07 1h20 n PHE 23 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1h20 n GLN 25 N 1.87 0.90 -4.11 0.00 1.13 -1.16 -4.04 117.38 111.97 1h20 n GLN 25 Ca 0.49 0.00 -0.15 0.00 -1.94 0.00 0.00 57.00 55.40 1h20 n GLN 25 Cb 0.70 -1.17 -0.13 0.00 0.11 0.00 0.00 30.24 29.74 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 -2.00 0.44 -0.34 -1.58 0.00 -1.00 -4.60 121.76 112.68 1h20 s ALA 26 Ca 0.15 -0.38 -0.13 0.00 0.00 0.00 0.00 51.96 51.60 1h20 s ALA 26 Cb 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.12 1h20 s ALA 26 CO 0.11 0.06 0.23 0.00 0.00 0.00 0.00 175.76 176.16 1h20 s TRP 28 N 1.71 3.57 0.08 0.00 0.52 -0.25 -4.59 118.94 119.97 1h20 s TRP 28 Ca 0.06 1.64 -0.36 0.00 0.02 0.00 0.00 56.10 57.46 1h20 s TRP 28 Cb -0.17 -3.30 -0.18 0.00 -1.15 0.00 0.00 33.47 28.67 1h20 s TRP 28 CO 0.10 -0.64 1.57 -0.91 0.02 0.00 0.00 176.95 177.09 1h20 h ASN 29 N 4.34 -1.25 -0.56 2.95 2.35 -1.91 -0.18 115.58 121.33 1h20 h ASN 29 Ca -0.46 0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.32 1h20 h ASN 29 Cb 1.21 0.38 -0.02 0.00 0.05 0.00 0.00 38.32 39.94 1h20 h ASN 29 CO 0.69 -0.69 0.12 0.77 -1.65 0.00 0.00 177.43 176.67 1h20 h SER 30 N -1.09 0.87 0.84 5.81 4.64 -1.97 -2.71 113.55 119.94 1h20 h SER 30 Ca -0.08 -0.24 -0.24 0.00 -0.47 0.00 0.00 61.79 60.76 1h20 h SER 30 Cb 0.90 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.73 1h20 h SER 30 CO 0.03 0.89 -1.20 0.00 -0.87 0.00 0.00 176.83 175.68 1h20 h ALA 31 N 1.01 0.43 -2.35 5.18 0.00 -1.99 -3.47 119.26 118.08 1h20 h ALA 31 Ca 0.17 -1.05 -0.39 0.00 0.00 0.00 0.00 54.91 53.65 1h20 h ALA 31 Cb 0.37 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 1h20 h ALA 31 CO 0.01 1.31 -0.47 0.54 0.00 0.00 0.00 179.25 180.64 1h20 n ARG 32 N -3.29 -1.50 -4.01 0.00 1.74 -0.08 -5.01 116.66 104.51 1h20 n ARG 32 Ca -0.05 0.99 -0.08 0.00 -0.77 0.00 0.00 57.85 57.95 1h20 n ARG 32 Cb 0.97 -5.51 -0.09 0.00 -1.02 0.00 0.00 32.46 26.81 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 -2.91 0.19 -0.75 0.55 -4.23 -1.21 -0.84 115.64 106.44 1h20 s THR 33 Ca 0.00 -1.58 -0.26 0.00 -1.18 0.00 0.00 61.69 58.67 1h20 s THR 33 Cb 0.00 -1.44 -0.13 0.00 1.34 0.00 0.00 72.50 72.27 1h20 s THR 33 CO 0.00 -0.87 2.41 0.00 -0.54 0.00 0.00 174.62 175.62 1h20 n GLY 35 N 6.70 0.94 3.53 0.00 0.00 0.56 -1.47 105.19 115.45 1h20 n GLY 35 Ca 0.45 -2.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 1h20 n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1h20 n PRO 36 N -2.67 -1.69 0.00 1.61 -0.02 -1.26 -2.38 135.00 128.59 1h20 n PRO 36 Ca 0.16 -0.45 0.09 0.00 -2.02 0.00 0.00 63.50 61.28 1h20 n PRO 36 Cb 0.58 -2.22 0.50 0.00 -0.02 0.00 0.00 33.50 32.33 1h20 n PRO 36 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1h20 n TYR 37 N -4.69 0.00 0.00 6.00 4.19 -0.27 -3.90 117.16 118.49 1h20 n TYR 37 Ca 0.06 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.27 1h20 n TYR 37 Cb 0.53 -0.11 0.00 0.00 0.49 0.00 0.00 39.34 40.25 1h20 n TYR 37 CO 0.00 0.00 0.00 0.28 0.91 0.00 0.00 176.86 178.05 1h20 n VAL 38 N -1.11 0.00 -0.32 2.97 0.31 -1.26 -4.77 118.33 114.14 1h20 n VAL 38 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1h20 n VAL 38 Cb 0.09 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.02 1h20 n VAL 38 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12