#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bds n ALA 2 N 0.00 -2.76 -0.91 0.00 0.00 -1.26 -3.39 120.51 112.18 2bds n ALA 2 Ca 0.00 0.46 -0.24 0.00 0.00 0.00 0.00 53.44 53.65 2bds n ALA 2 Cb 0.00 -1.66 -0.05 0.00 0.00 0.00 0.00 19.45 17.74 2bds n ALA 2 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2bds n PRO 3 N 1.06 2.45 -2.43 0.00 -0.04 -1.22 -0.36 135.00 134.46 2bds n PRO 3 Ca 0.18 -1.53 -0.40 0.00 -0.04 0.00 0.00 63.50 61.71 2bds n PRO 3 Cb 0.23 -2.43 -0.04 0.00 -0.04 0.00 0.00 33.50 31.23 2bds n PRO 3 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bds n PHE 5 N 1.44 -3.98 -3.27 0.00 3.01 -1.26 0.29 117.46 113.69 2bds n PHE 5 Ca 0.00 -1.07 0.00 0.00 1.01 0.00 0.00 57.45 57.39 2bds n PHE 5 Cb 0.45 -0.97 0.00 0.00 -0.01 0.00 0.00 39.48 38.94 2bds n PHE 5 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2bds n SER 7 N -0.38 3.34 0.00 0.00 7.64 -1.26 -2.24 113.62 120.71 2bds n SER 7 Ca 0.00 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2bds n SER 7 Cb 0.00 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 61.65 2bds n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bds n GLY 8 N 5.67 0.00 3.58 0.23 0.00 -1.26 -4.87 105.19 108.53 2bds n GLY 8 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.91 2bds n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bds s LYS 9 N -0.87 3.77 0.00 1.61 1.02 -0.95 -5.06 119.74 119.25 2bds s LYS 9 Ca 0.00 -0.06 0.00 0.00 0.02 0.00 0.00 55.97 55.93 2bds s LYS 9 Cb 0.00 -3.75 0.00 0.00 -0.52 0.00 0.00 37.83 33.56 2bds s LYS 9 CO 0.00 -0.51 0.00 -0.35 -0.92 0.00 0.00 175.35 173.57 2bds n PRO 10 N 5.60 -0.01 0.00 -1.68 -0.04 -1.26 -2.58 135.00 135.03 2bds n PRO 10 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 2bds n PRO 10 Cb 0.49 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 2bds n PRO 10 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bds n GLY 11 N 3.42 1.84 3.52 0.55 0.00 -1.26 -4.74 105.19 108.53 2bds n GLY 11 Ca 0.00 -0.65 -0.10 0.00 0.00 0.00 0.00 46.02 45.26 2bds n GLY 11 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2bds s ARG 12 N 0.00 1.32 0.02 1.61 1.70 -1.26 -4.66 118.95 117.67 2bds s ARG 12 Ca 0.00 -0.55 -0.00 0.00 -0.47 0.00 0.00 55.73 54.71 2bds s ARG 12 Cb 0.00 0.56 -0.02 0.00 -0.57 0.00 0.00 34.95 34.93 2bds s ARG 12 CO 0.00 -0.58 -0.02 0.20 -1.08 0.00 0.00 175.30 173.82 2bds s GLY 13 N -2.76 0.19 0.00 3.88 0.00 0.83 -4.58 107.32 104.89 2bds s GLY 13 Ca 0.04 -0.48 -0.30 0.00 0.00 0.00 0.00 44.72 43.98 2bds s GLY 13 CO -0.08 -0.54 1.12 0.99 0.00 0.00 0.00 173.10 174.59 2bds s ASP 14 N -1.21 7.17 -0.70 1.64 1.01 -0.43 0.79 116.67 124.94 2bds s ASP 14 Ca -0.13 1.82 -0.22 0.00 0.71 0.00 0.00 52.55 54.73 2bds s ASP 14 Cb -0.08 -2.57 0.08 0.00 1.01 0.00 0.00 42.92 41.36 2bds s ASP 14 CO -0.01 -0.44 0.98 -0.22 0.21 0.00 0.00 175.17 175.69 2bds s LEU 15 N 1.42 4.53 0.74 1.23 0.20 0.52 0.48 118.68 127.79 2bds s LEU 15 Ca 0.55 -1.17 -0.11 0.00 0.69 0.00 0.00 54.13 54.08 2bds s LEU 15 Cb -0.25 -2.41 0.03 0.00 -0.43 0.00 0.00 46.19 43.13 2bds s LEU 15 CO 0.26 -1.37 1.09 0.26 -0.29 0.00 0.00 176.35 176.30 2bds s TRP 16 N 3.80 3.11 0.00 5.38 0.52 0.95 -4.02 118.94 128.68 2bds s TRP 16 Ca 0.23 1.14 0.00 0.00 0.02 0.00 0.00 56.10 57.50 2bds s TRP 16 Cb -0.15 -3.05 0.00 0.00 -1.15 0.00 0.00 33.47 29.12 2bds s TRP 16 CO 0.07 -1.41 0.00 -0.89 0.02 0.00 0.00 176.95 174.74 2bds n ILE 17 N -3.18 0.00 -1.22 2.03 2.08 -1.26 -0.63 119.36 117.17 2bds n ILE 17 Ca 0.07 0.00 -0.39 0.00 0.56 0.00 0.00 62.75 62.99 2bds n ILE 17 Cb 0.56 -1.43 -0.07 0.00 -0.75 0.00 0.00 39.64 37.94 2bds n ILE 17 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2bds n LEU 18 N 0.00 3.11 -4.04 1.39 -0.00 0.15 -2.74 117.00 114.88 2bds n LEU 18 Ca 0.00 -2.65 -0.32 0.00 -0.00 0.00 0.00 56.01 53.05 2bds n LEU 18 Cb 0.00 -1.15 -0.15 0.00 -0.00 0.00 0.00 43.42 42.12 2bds n LEU 18 CO 0.00 -1.17 -0.45 -0.13 -0.00 0.00 0.00 177.39 175.64 2bds s ARG 19 N 5.89 2.08 0.66 1.47 0.52 -1.26 -4.92 118.95 123.40 2bds s ARG 19 Ca 0.63 -1.24 0.40 0.00 -0.52 0.00 0.00 55.73 55.00 2bds s ARG 19 Cb 0.11 -2.80 2.16 0.00 0.52 0.00 0.00 34.95 34.94 2bds s ARG 19 CO 0.17 -0.57 2.23 0.78 0.02 0.00 0.00 175.30 177.93 2bds h GLY 20 N 7.82 0.00 -4.20 -3.53 0.00 -1.92 -3.42 103.07 97.83 2bds h GLY 20 Ca -0.19 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 46.91 2bds h GLY 20 CO 0.45 0.00 -0.71 -0.51 0.00 0.00 0.00 176.54 175.77 2bds s THR 21 N -4.16 0.46 0.25 4.70 -4.23 -1.26 -5.11 115.64 106.29 2bds s THR 21 Ca -0.04 -1.35 -0.09 0.00 -1.18 0.00 0.00 61.69 59.03 2bds s THR 21 Cb 0.12 -0.92 -0.07 0.00 1.34 0.00 0.00 72.50 72.97 2bds s THR 21 CO 0.38 -0.60 0.56 0.00 -0.54 0.00 0.00 174.62 174.42 2bds n PRO 23 N -0.37 0.86 0.22 0.00 -0.02 -1.26 -4.75 135.00 129.68 2bds n PRO 23 Ca 0.00 0.26 0.16 0.00 -2.02 0.00 0.00 63.50 61.91 2bds n PRO 23 Cb 0.53 -2.16 0.83 0.00 -0.02 0.00 0.00 33.50 32.68 2bds n PRO 23 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2bds h GLY 24 N 10.32 0.00 2.00 -1.23 0.00 -1.98 0.30 103.07 112.48 2bds h GLY 24 Ca -0.28 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 2bds h GLY 24 CO 1.02 0.00 -0.08 -1.33 0.00 0.00 0.00 176.54 176.15 2bds h GLY 25 N 0.00 0.00 -0.78 4.60 0.00 -2.00 -3.44 103.07 101.46 2bds h GLY 25 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.95 2bds h GLY 25 CO -0.00 0.00 0.41 -0.19 0.00 0.00 0.00 176.54 176.76 2bds s TYR 26 N -3.94 1.93 -1.96 5.60 1.51 0.10 -4.96 117.35 115.64 2bds s TYR 26 Ca -0.01 0.45 0.17 0.00 -1.01 0.00 0.00 57.07 56.66 2bds s TYR 26 Cb 0.11 -3.92 0.49 0.00 -0.11 0.00 0.00 41.96 38.53 2bds s TYR 26 CO 0.55 -2.46 1.41 0.41 -1.11 0.00 0.00 175.55 174.34 2bds n GLY 27 N -3.51 1.60 3.49 0.71 0.00 -1.26 -4.95 105.19 101.27 2bds n GLY 27 Ca 0.13 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.27 2bds n GLY 27 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bds n TYR 28 N 1.09 -1.00 0.00 1.61 4.01 -1.26 -4.87 117.16 116.74 2bds n TYR 28 Ca 0.18 -0.09 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 2bds n TYR 28 Cb 0.48 -1.74 0.00 0.00 -0.31 0.00 0.00 39.34 37.77 2bds n TYR 28 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2bds n THR 29 N -4.91 0.00 -3.45 -0.72 -2.24 -1.25 -4.98 114.28 96.72 2bds n THR 29 Ca 0.04 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.43 2bds n THR 29 Cb 0.54 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.67 2bds n THR 29 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2bds s SER 30 N -1.30 6.16 0.01 3.42 1.04 -1.24 -4.97 113.70 116.82 2bds s SER 30 Ca 0.00 0.04 -0.12 0.00 0.48 0.00 0.00 55.95 56.35 2bds s SER 30 Cb 0.00 -2.18 0.01 0.00 0.10 0.00 0.00 66.02 63.95 2bds s SER 30 CO 0.00 -0.20 0.25 0.54 0.98 0.00 0.00 173.24 174.81 2bds s ASN 31 N 1.70 -0.09 0.17 7.02 2.20 -1.26 0.87 114.94 125.56 2bds s ASN 31 Ca 0.12 -0.13 0.04 0.00 -0.94 0.00 0.00 52.86 51.95 2bds s ASN 31 Cb -0.16 0.29 -0.03 0.00 -2.00 0.00 0.00 41.25 39.35 2bds s ASN 31 CO 0.11 -0.49 0.26 0.00 -2.94 0.00 0.00 177.10 174.03 2bds s TYR 33 N -1.81 0.70 -0.42 0.00 1.51 -1.26 -2.03 117.35 114.04 2bds s TYR 33 Ca 0.34 -0.19 0.07 0.00 -1.01 0.00 0.00 57.07 56.28 2bds s TYR 33 Cb -0.10 -0.71 0.24 0.00 -0.11 0.00 0.00 41.96 41.28 2bds s TYR 33 CO 0.27 -0.25 0.53 1.63 -1.11 0.00 0.00 175.55 176.62 2bds n LYS 34 N 4.49 0.86 -1.23 -0.62 5.02 -0.74 -4.94 118.16 121.00 2bds n LYS 34 Ca -0.18 -3.38 -0.40 0.00 -2.02 0.00 0.00 58.31 52.33 2bds n LYS 34 Cb 0.50 -1.37 -0.00 0.00 -0.02 0.00 0.00 35.03 34.14 2bds n LYS 34 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 2bds n TRP 35 N 1.50 -1.85 -0.24 2.13 -0.00 -1.26 -0.74 117.44 116.97 2bds n TRP 35 Ca 0.23 0.62 0.00 0.00 -0.00 0.00 0.00 57.50 58.34 2bds n TRP 35 Cb 0.51 -1.69 0.00 0.00 -0.00 0.00 0.00 31.31 30.13 2bds n TRP 35 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2bds n PRO 36 N 1.23 0.90 -1.28 5.87 -0.04 -1.26 -5.00 135.00 135.43 2bds n PRO 36 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2bds n PRO 36 Cb 0.36 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.77 2bds n PRO 36 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2bds n ASN 37 N 1.39 0.00 -3.58 3.54 3.02 0.08 -0.67 115.26 119.04 2bds n ASN 37 Ca 0.00 -0.80 -0.14 0.00 -0.03 0.00 0.00 54.58 53.60 2bds n ASN 37 Cb 0.45 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.56 2bds n ASN 37 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2bds s ILE 38 N -2.29 0.00 -0.02 2.41 2.07 0.19 -1.80 121.20 121.77 2bds s ILE 38 Ca 0.00 0.00 0.07 0.00 -1.41 0.00 0.00 60.65 59.31 2bds s ILE 38 Cb 0.00 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 2bds s ILE 38 CO 0.00 0.00 -0.23 0.00 -1.91 0.00 0.00 174.94 172.80 2bds n TYR 41 N 2.82 -0.92 -0.01 0.00 4.02 0.25 -1.31 117.16 122.02 2bds n TYR 41 Ca -0.18 -2.24 -0.12 0.00 -0.01 0.00 0.00 57.90 55.35 2bds n TYR 41 Cb 0.52 -0.46 -0.07 0.00 -0.02 0.00 0.00 39.34 39.31 2bds n TYR 41 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2bds h PRO 42 N 0.00 0.09 0.00 -0.72 0.11 -1.87 -3.30 132.00 126.31 2bds h PRO 42 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2bds h PRO 42 Cb 1.24 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2bds h PRO 42 CO 0.51 0.28 0.00 -2.39 -0.21 0.00 0.00 178.00 176.18