#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 -1.13 -0.48 0.00 0.00 -1.26 -4.81 120.51 112.83 2bds n ALA 2 Ca 0.00 0.15 -0.09 0.00 0.00 0.00 0.00 53.44 53.50 2bds n ALA 2 Cb 0.00 -1.84 0.03 0.00 0.00 0.00 0.00 19.45 17.64 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 0.39 1.42 -2.61 0.00 -0.04 -1.26 -3.87 135.00 129.03 2bds n PRO 3 Ca 0.11 -0.85 -0.42 0.00 -0.04 0.00 0.00 63.50 62.30 2bds n PRO 3 Cb 0.41 -1.33 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 2bds n PRO 3 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bds s PHE 5 N 2.19 3.18 0.57 0.00 0.08 -1.26 0.29 117.98 123.03 2bds s PHE 5 Ca 0.50 1.18 0.09 0.00 0.12 0.00 0.00 56.93 58.82 2bds s PHE 5 Cb -0.20 -3.00 0.09 0.00 -0.57 0.00 0.00 43.02 39.34 2bds s PHE 5 CO 0.18 -1.30 0.76 0.00 -0.10 0.00 0.00 175.22 174.76 2bds s SER 7 N -4.52 6.83 0.00 0.00 1.04 -1.26 -2.29 113.70 113.50 2bds s SER 7 Ca 0.58 2.02 0.00 0.00 0.48 0.00 0.00 55.95 59.03 2bds s SER 7 Cb -0.05 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.53 2bds s SER 7 CO 0.37 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.40 2bds n GLY 8 N 3.78 1.64 3.40 7.32 0.00 -1.26 -4.92 105.19 115.15 2bds n GLY 8 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 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 0.00 3.35 0.00 1.61 1.02 -0.97 -5.09 119.74 119.66 2bds s LYS 9 Ca 0.00 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.31 2bds s LYS 9 Cb 0.00 -3.39 0.00 0.00 -0.52 0.00 0.00 37.83 33.92 2bds s LYS 9 CO 0.00 -0.34 0.00 -0.35 -0.92 0.00 0.00 175.35 173.74 2bds n PRO 10 N 4.91 0.78 0.00 -1.68 -0.04 -1.26 -1.39 135.00 136.32 2bds n PRO 10 Ca -0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.31 2bds n PRO 10 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 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 4.28 1.37 3.41 0.55 0.00 -1.26 -4.59 105.19 108.95 2bds n GLY 11 Ca 0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.29 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 1.15 -0.00 1.61 1.70 -1.26 -4.67 118.95 117.49 2bds s ARG 12 Ca 0.00 -0.36 -0.04 0.00 -0.47 0.00 0.00 55.73 54.86 2bds s ARG 12 Cb 0.00 0.53 -0.00 0.00 -0.57 0.00 0.00 34.95 34.91 2bds s ARG 12 CO 0.00 -0.46 0.08 0.20 -1.08 0.00 0.00 175.30 174.03 2bds s GLY 13 N -2.37 0.08 -0.02 3.88 0.00 0.84 -4.71 107.32 105.01 2bds s GLY 13 Ca -0.02 -0.18 -0.30 0.00 0.00 0.00 0.00 44.72 44.23 2bds s GLY 13 CO -0.07 -0.27 1.05 0.99 0.00 0.00 0.00 173.10 174.80 2bds s ASP 14 N -1.05 7.25 -0.46 1.64 1.11 -0.88 -2.17 116.67 122.10 2bds s ASP 14 Ca -0.11 1.71 -0.24 0.00 0.18 0.00 0.00 52.55 54.09 2bds s ASP 14 Cb -0.07 -2.57 0.03 0.00 1.07 0.00 0.00 42.92 41.39 2bds s ASP 14 CO 0.00 -0.39 0.83 -0.22 1.18 0.00 0.00 175.17 176.58 2bds s LEU 15 N 1.43 4.19 0.62 1.23 2.96 -1.26 0.55 118.68 128.40 2bds s LEU 15 Ca 0.53 -0.10 0.07 0.00 -0.22 0.00 0.00 54.13 54.41 2bds s LEU 15 Cb -0.22 -3.00 0.10 0.00 0.50 0.00 0.00 46.19 43.57 2bds s LEU 15 CO 0.25 -0.98 0.86 0.26 -1.32 0.00 0.00 176.35 175.42 2bds s TRP 16 N 3.46 1.31 0.00 5.38 0.52 0.70 -4.75 118.94 125.56 2bds s TRP 16 Ca 0.31 -0.66 0.00 0.00 0.02 0.00 0.00 56.10 55.78 2bds s TRP 16 Cb -0.12 -2.38 0.00 0.00 -1.15 0.00 0.00 33.47 29.82 2bds s TRP 16 CO 0.23 -1.36 0.00 -0.89 0.02 0.00 0.00 176.95 174.95 2bds n ILE 17 N -2.42 0.00 -1.16 2.03 5.41 -1.26 -2.34 119.36 119.62 2bds n ILE 17 Ca 0.16 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.50 2bds n ILE 17 Cb 0.62 -0.82 -0.07 0.00 -0.71 0.00 0.00 39.64 38.66 2bds n ILE 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2bds n LEU 18 N 0.00 3.52 -4.39 1.39 -0.00 -0.24 -2.93 117.00 114.35 2bds n LEU 18 Ca 0.00 -2.72 -0.33 0.00 -0.00 0.00 0.00 56.01 52.96 2bds n LEU 18 Cb 0.00 -1.10 -0.14 0.00 -0.00 0.00 0.00 43.42 42.18 2bds n LEU 18 CO 0.00 -0.79 -0.45 -0.13 -0.00 0.00 0.00 177.39 176.02 2bds s ARG 19 N 5.48 3.23 0.38 1.47 0.52 -1.26 -4.95 118.95 123.82 2bds s ARG 19 Ca 0.61 -0.69 0.07 0.00 -0.52 0.00 0.00 55.73 55.20 2bds s ARG 19 Cb 0.13 -2.59 0.75 0.00 0.52 0.00 0.00 34.95 33.76 2bds s ARG 19 CO 0.15 0.29 1.94 0.78 0.02 0.00 0.00 175.30 178.48 2bds h GLY 20 N 6.46 0.42 -2.88 -3.53 0.00 -1.97 -3.45 103.07 98.12 2bds h GLY 20 Ca -0.29 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 46.72 2bds h GLY 20 CO 0.55 0.21 -0.28 -0.51 0.00 0.00 0.00 176.54 176.51 2bds s THR 21 N -4.97 0.08 0.65 4.70 -4.23 -1.26 -5.12 115.64 105.50 2bds s THR 21 Ca -0.07 -1.21 -0.11 0.00 -1.18 0.00 0.00 61.69 59.13 2bds s THR 21 Cb 0.16 -1.62 -0.02 0.00 1.34 0.00 0.00 72.50 72.36 2bds s THR 21 CO 0.74 -0.38 1.04 0.00 -0.54 0.00 0.00 174.62 175.48 2bds n PRO 23 N -2.90 0.40 0.00 0.00 -0.02 -1.26 -4.73 135.00 126.50 2bds n PRO 23 Ca 0.07 -0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.19 2bds n PRO 23 Cb 0.54 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 2bds n PRO 23 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bds n GLY 24 N 6.25 0.00 2.63 -1.23 0.00 -1.26 -1.96 105.19 109.61 2bds n GLY 24 Ca 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.48 2bds n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bds n GLY 25 N -0.40 2.87 0.00 -0.02 0.00 -1.26 -5.06 105.19 101.32 2bds n GLY 25 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2bds n GLY 25 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bds n TYR 26 N -0.49 -1.50 1.20 1.61 4.02 -0.83 -4.94 117.16 116.24 2bds n TYR 26 Ca 0.17 0.00 0.10 0.00 -0.01 0.00 0.00 57.90 58.16 2bds n TYR 26 Cb 0.82 0.00 0.59 0.00 -0.02 0.00 0.00 39.34 40.73 2bds n TYR 26 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bds n GLY 27 N 5.00 -0.73 3.93 2.72 0.00 -1.26 -4.80 105.19 110.04 2bds n GLY 27 Ca 0.00 -0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 2bds n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bds s TYR 28 N -2.16 2.96 0.00 1.61 2.02 -1.26 -4.70 117.35 115.82 2bds s TYR 28 Ca 0.28 0.44 0.00 0.00 -0.37 0.00 0.00 57.07 57.41 2bds s TYR 28 Cb 0.14 -3.10 0.00 0.00 -0.40 0.00 0.00 41.96 38.60 2bds s TYR 28 CO 0.26 -1.29 0.00 0.25 -1.57 0.00 0.00 175.55 173.20 2bds n THR 29 N -2.83 0.00 -3.74 -0.71 -2.24 -1.24 -4.96 114.28 98.56 2bds n THR 29 Ca 0.08 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.49 2bds n THR 29 Cb 0.60 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.77 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 -1.37 6.48 -0.03 3.42 1.04 -1.23 -4.96 113.70 117.06 2bds s SER 30 Ca 0.00 0.58 -0.29 0.00 0.48 0.00 0.00 55.95 56.71 2bds s SER 30 Cb 0.00 -2.13 0.07 0.00 0.10 0.00 0.00 66.02 64.06 2bds s SER 30 CO 0.00 0.34 0.64 0.54 0.98 0.00 0.00 173.24 175.74 2bds s ASN 31 N -0.76 -0.62 -0.02 7.02 2.20 -1.26 0.49 114.94 122.00 2bds s ASN 31 Ca 0.17 0.60 0.04 0.00 -0.94 0.00 0.00 52.86 52.73 2bds s ASN 31 Cb -0.13 0.53 -0.03 0.00 -2.00 0.00 0.00 41.25 39.62 2bds s ASN 31 CO 0.06 -0.63 -0.12 0.00 -2.94 0.00 0.00 177.10 173.47 2bds s TYR 33 N -0.86 2.81 -0.55 0.00 1.51 -1.26 -1.87 117.35 117.12 2bds s TYR 33 Ca 0.14 -0.71 0.07 0.00 -1.01 0.00 0.00 57.07 55.56 2bds s TYR 33 Cb -0.11 -1.86 0.27 0.00 -0.11 0.00 0.00 41.96 40.15 2bds s TYR 33 CO 0.04 -0.26 0.73 1.63 -1.11 0.00 0.00 175.55 176.58 2bds n LYS 34 N 3.65 2.12 -1.10 -0.62 5.02 -0.61 -4.94 118.16 121.67 2bds n LYS 34 Ca -0.18 -4.28 -0.36 0.00 -2.02 0.00 0.00 58.31 51.47 2bds n LYS 34 Cb 0.52 -1.97 -0.01 0.00 -0.02 0.00 0.00 35.03 33.55 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 0.76 -1.37 0.16 2.13 -0.00 -1.26 -0.99 117.44 116.87 2bds n TRP 35 Ca 0.28 0.60 0.00 0.00 -0.00 0.00 0.00 57.50 58.37 2bds n TRP 35 Cb 0.45 -1.51 0.00 0.00 -0.00 0.00 0.00 31.31 30.25 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 1.03 0.88 -0.02 5.87 -0.05 -1.26 -4.99 135.00 136.45 2bds n PRO 36 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.56 2bds n PRO 36 Cb 0.30 -1.06 0.00 0.00 -0.05 0.00 0.00 33.50 32.69 2bds n PRO 36 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 2bds n ASN 37 N 1.11 0.00 -3.60 3.54 3.02 -0.16 -1.08 115.26 118.09 2bds n ASN 37 Ca 0.00 -0.01 -0.11 0.00 -0.03 0.00 0.00 54.58 54.42 2bds n ASN 37 Cb 0.44 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.55 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 -1.58 0.00 0.06 2.41 2.07 -0.99 -1.58 121.20 121.59 2bds s ILE 38 Ca 0.00 0.00 0.06 0.00 -1.41 0.00 0.00 60.65 59.30 2bds s ILE 38 Cb 0.00 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.55 2bds s ILE 38 CO 0.00 0.00 -0.10 0.00 -1.91 0.00 0.00 174.94 172.93 2bds n TYR 41 N 1.72 -0.17 0.07 0.00 4.02 0.18 -2.06 117.16 120.92 2bds n TYR 41 Ca -0.16 -1.79 -0.13 0.00 -0.01 0.00 0.00 57.90 55.81 2bds n TYR 41 Cb 0.52 -0.30 -0.08 0.00 -0.02 0.00 0.00 39.34 39.46 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 -0.11 0.00 -0.72 0.11 -1.83 -3.27 132.00 126.18 2bds h PRO 42 Ca -0.28 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2bds h PRO 42 Cb 0.95 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2bds h PRO 42 CO 0.45 0.05 0.00 -2.39 -0.21 0.00 0.00 178.00 175.90