#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 -1.14 -1.02 0.00 0.00 -1.26 -3.95 120.51 113.14 2bds n ALA 2 Ca 0.00 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 2bds n ALA 2 Cb 0.00 -1.88 -0.04 0.00 0.00 0.00 0.00 19.45 17.53 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 0.81 2.80 -2.56 0.00 -0.04 -1.23 -0.98 135.00 133.80 2bds n PRO 3 Ca 0.12 -1.73 -0.41 0.00 -0.04 0.00 0.00 63.50 61.45 2bds n PRO 3 Cb 0.30 -2.55 -0.04 0.00 -0.04 0.00 0.00 33.50 31.16 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 -0.49 3.22 0.23 0.00 0.40 -1.26 0.30 117.98 120.38 2bds s PHE 5 Ca 0.47 1.18 0.03 0.00 -0.60 0.00 0.00 56.93 58.01 2bds s PHE 5 Cb -0.29 -2.99 0.03 0.00 0.51 0.00 0.00 43.02 40.28 2bds s PHE 5 CO 0.35 -1.25 0.25 0.00 0.70 0.00 0.00 175.22 175.27 2bds s SER 7 N -2.37 6.86 0.00 0.00 0.15 -1.26 -2.54 113.70 114.54 2bds s SER 7 Ca 0.19 2.00 0.00 0.00 0.70 0.00 0.00 55.95 58.84 2bds s SER 7 Cb -0.01 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 2bds s SER 7 CO 0.12 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.41 2bds n GLY 8 N 3.71 0.24 3.29 9.45 0.00 -1.26 -4.90 105.19 115.72 2bds n GLY 8 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.57 2.65 0.45 1.61 1.02 -1.05 -5.09 119.74 118.76 2bds s LYS 9 Ca 0.00 -1.24 -0.08 0.00 0.02 0.00 0.00 55.97 54.68 2bds s LYS 9 Cb 0.00 -3.61 0.11 0.00 -0.52 0.00 0.00 37.83 33.82 2bds s LYS 9 CO 0.00 -0.75 0.45 -0.35 -0.92 0.00 0.00 175.35 173.78 2bds n PRO 10 N 4.88 -1.53 0.00 -1.68 -0.04 -1.26 -2.21 135.00 133.16 2bds n PRO 10 Ca -0.11 -0.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.64 2bds n PRO 10 Cb 0.44 -0.61 0.00 0.00 -0.04 0.00 0.00 33.50 33.29 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 0.11 1.24 3.46 0.55 0.00 -1.26 -4.74 105.19 104.56 2bds n GLY 11 Ca 0.06 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.12 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 1.30 0.01 1.61 1.70 -1.26 -4.57 118.95 117.74 2bds s ARG 12 Ca 0.00 -0.51 -0.03 0.00 -0.47 0.00 0.00 55.73 54.72 2bds s ARG 12 Cb 0.00 0.58 -0.01 0.00 -0.57 0.00 0.00 34.95 34.95 2bds s ARG 12 CO 0.00 -0.57 0.04 0.20 -1.08 0.00 0.00 175.30 173.89 2bds s GLY 13 N -2.75 0.13 -0.04 3.88 0.00 0.88 -4.66 107.32 104.77 2bds s GLY 13 Ca 0.02 -0.33 -0.30 0.00 0.00 0.00 0.00 44.72 44.11 2bds s GLY 13 CO -0.11 -0.42 1.14 0.99 0.00 0.00 0.00 173.10 174.70 2bds s ASP 14 N -1.22 7.13 -0.59 1.64 1.01 -0.51 0.78 116.67 124.89 2bds s ASP 14 Ca -0.13 1.78 -0.26 0.00 0.71 0.00 0.00 52.55 54.65 2bds s ASP 14 Cb -0.08 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.33 2bds s ASP 14 CO 0.00 -0.50 1.09 -0.22 0.21 0.00 0.00 175.17 175.75 2bds s LEU 15 N 1.83 3.74 0.61 1.23 2.96 -0.16 0.20 118.68 129.09 2bds s LEU 15 Ca 0.55 -0.22 -0.05 0.00 -0.22 0.00 0.00 54.13 54.19 2bds s LEU 15 Cb -0.24 -2.90 0.03 0.00 0.50 0.00 0.00 46.19 43.58 2bds s LEU 15 CO 0.23 -1.42 0.90 0.26 -1.32 0.00 0.00 176.35 175.00 2bds s TRP 16 N 4.59 3.09 0.00 5.38 0.52 0.83 -4.19 118.94 129.16 2bds s TRP 16 Ca 0.35 0.45 0.00 0.00 0.02 0.00 0.00 56.10 56.93 2bds s TRP 16 Cb -0.10 -2.85 0.00 0.00 -1.15 0.00 0.00 33.47 29.37 2bds s TRP 16 CO 0.21 -0.98 0.00 0.44 0.02 0.00 0.00 176.95 176.64 2bds n ILE 17 N -2.62 0.00 -1.31 2.03 -5.35 -1.26 -1.03 119.36 109.82 2bds n ILE 17 Ca 0.06 0.00 -0.37 0.00 -0.27 0.00 0.00 62.75 62.17 2bds n ILE 17 Cb 0.59 -1.57 -0.08 0.00 -1.74 0.00 0.00 39.64 36.84 2bds n ILE 17 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bds n LEU 18 N 0.00 3.01 -4.54 7.28 -0.00 -0.05 -3.05 117.00 119.65 2bds n LEU 18 Ca 0.00 -2.68 -0.32 0.00 -0.00 0.00 0.00 56.01 53.01 2bds n LEU 18 Cb 0.00 -1.22 -0.11 0.00 -0.00 0.00 0.00 43.42 42.08 2bds n LEU 18 CO 0.00 -1.35 -0.42 -0.13 -0.00 0.00 0.00 177.39 175.49 2bds s ARG 19 N 6.07 2.42 0.42 1.47 0.52 -1.26 -4.92 118.95 123.66 2bds s ARG 19 Ca 0.65 -0.79 0.22 0.00 -0.52 0.00 0.00 55.73 55.29 2bds s ARG 19 Cb 0.09 -2.40 0.30 0.00 0.52 0.00 0.00 34.95 33.46 2bds s ARG 19 CO 0.17 0.59 1.58 0.78 0.02 0.00 0.00 175.30 178.44 2bds h GLY 20 N 4.66 0.00 -3.36 -3.53 0.00 -1.96 -3.46 103.07 95.43 2bds h GLY 20 Ca -0.48 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 2bds h GLY 20 CO 0.51 0.00 0.05 -0.51 0.00 0.00 0.00 176.54 176.59 2bds s THR 21 N -3.18 0.03 0.41 4.70 -4.23 -1.26 -5.15 115.64 106.96 2bds s THR 21 Ca 0.06 -0.27 -0.23 0.00 -1.18 0.00 0.00 61.69 60.07 2bds s THR 21 Cb 0.05 -1.03 -0.10 0.00 1.34 0.00 0.00 72.50 72.76 2bds s THR 21 CO 0.68 -0.15 0.97 0.00 -0.54 0.00 0.00 174.62 175.58 2bds n PRO 23 N -0.31 -1.54 0.00 0.00 -0.01 -1.26 -5.01 135.00 126.87 2bds n PRO 23 Ca 0.06 -0.40 0.00 0.00 -0.01 0.00 0.00 63.50 63.15 2bds n PRO 23 Cb 0.52 -0.64 0.00 0.00 -0.01 0.00 0.00 33.50 33.37 2bds n PRO 23 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2bds n GLY 24 N -1.21 0.86 1.66 -1.23 0.00 -1.26 -4.71 105.19 99.30 2bds n GLY 24 Ca 0.04 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.12 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 1.18 2.71 0.00 -0.02 0.00 -1.26 -4.52 105.19 103.28 2bds n GLY 25 Ca 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 0.59 0.00 0.00 1.61 4.02 -1.26 -5.06 117.16 117.05 2bds n TYR 26 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.12 2bds n TYR 26 Cb 1.03 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 40.32 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 1.90 -0.36 3.51 2.72 0.00 -1.26 -5.15 105.19 106.54 2bds n GLY 27 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 1.21 0.00 1.61 2.02 -1.26 -4.87 117.35 116.06 2bds s TYR 28 Ca 0.00 0.98 0.00 0.00 -0.37 0.00 0.00 57.07 57.68 2bds s TYR 28 Cb 0.00 -3.13 0.00 0.00 -0.40 0.00 0.00 41.96 38.43 2bds s TYR 28 CO 0.00 -3.84 0.00 0.25 -1.57 0.00 0.00 175.55 170.39 2bds n THR 29 N -4.86 0.00 -3.57 -0.71 -2.24 -1.25 -4.97 114.28 96.68 2bds n THR 29 Ca 0.05 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.45 2bds n THR 29 Cb 0.56 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.69 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 -1.49 6.10 0.00 3.42 1.04 -1.24 -4.97 113.70 116.57 2bds s SER 30 Ca 0.00 0.10 -0.10 0.00 0.48 0.00 0.00 55.95 56.42 2bds s SER 30 Cb 0.00 -2.14 0.01 0.00 0.10 0.00 0.00 66.02 63.99 2bds s SER 30 CO 0.00 -0.04 0.20 0.54 0.98 0.00 0.00 173.24 174.92 2bds s ASN 31 N 1.51 -0.04 0.04 7.02 6.03 -1.26 0.18 114.94 128.42 2bds s ASN 31 Ca 0.09 -0.14 0.03 0.00 -1.03 0.00 0.00 52.86 51.81 2bds s ASN 31 Cb -0.15 0.25 -0.04 0.00 -3.03 0.00 0.00 41.25 38.28 2bds s ASN 31 CO 0.09 -0.43 -0.00 0.00 -2.03 0.00 0.00 177.10 174.73 2bds s TYR 33 N -1.19 2.26 -0.40 0.00 1.51 -1.26 -1.96 117.35 116.32 2bds s TYR 33 Ca 0.22 -0.63 0.10 0.00 -1.01 0.00 0.00 57.07 55.75 2bds s TYR 33 Cb -0.12 -1.49 0.31 0.00 -0.11 0.00 0.00 41.96 40.56 2bds s TYR 33 CO 0.14 -0.18 0.67 1.63 -1.11 0.00 0.00 175.55 176.70 2bds n LYS 34 N 2.91 1.05 -0.84 -0.62 5.02 -0.86 -4.93 118.16 119.90 2bds n LYS 34 Ca -0.17 -3.44 -0.27 0.00 -2.02 0.00 0.00 58.31 52.40 2bds n LYS 34 Cb 0.52 -1.59 -0.00 0.00 -0.02 0.00 0.00 35.03 33.94 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 0.65 -1.19 -0.48 2.13 -0.00 -1.26 -1.74 117.44 115.54 2bds n TRP 35 Ca 0.24 0.43 -0.00 0.00 -0.00 0.00 0.00 57.50 58.17 2bds n TRP 35 Cb 0.59 -1.15 -0.01 0.00 -0.00 0.00 0.00 31.31 30.75 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 0.82 0.97 -0.55 5.87 -0.04 -1.26 -4.99 135.00 135.82 2bds n PRO 36 Ca 0.08 -0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 2bds n PRO 36 Cb 0.24 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 1.58 0.00 -3.58 3.54 3.02 -0.71 -0.87 115.26 118.24 2bds n ASN 37 Ca 0.02 -0.35 -0.12 0.00 -0.03 0.00 0.00 54.58 54.09 2bds n ASN 37 Cb 0.48 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.59 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 -2.09 0.00 -0.08 2.41 2.07 -0.19 -2.03 121.20 121.29 2bds s ILE 38 Ca 0.00 0.00 0.04 0.00 -1.41 0.00 0.00 60.65 59.28 2bds s ILE 38 Cb 0.00 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.59 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 0.85 0.52 0.06 0.00 4.02 0.13 -1.43 117.16 121.31 2bds n TYR 41 Ca -0.10 -2.33 -0.13 0.00 -0.01 0.00 0.00 57.90 55.33 2bds n TYR 41 Cb 0.52 -0.36 -0.08 0.00 -0.02 0.00 0.00 39.34 39.40 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 -0.10 0.00 -0.72 0.11 -1.85 -3.30 132.00 126.13 2bds h PRO 42 Ca -0.38 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2bds h PRO 42 Cb 1.21 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2bds h PRO 42 CO 0.62 0.10 0.00 -2.39 -0.21 0.00 0.00 178.00 176.12