#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 -2.98 -1.31 0.00 0.00 -1.26 -3.35 120.51 111.62 2bds n ALA 2 Ca 0.00 0.11 -0.38 0.00 0.00 0.00 0.00 53.44 53.17 2bds n ALA 2 Cb 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 19.45 17.97 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 1.32 3.65 -2.51 0.00 -0.04 -1.23 -0.89 135.00 135.30 2bds n PRO 3 Ca 0.11 -2.18 -0.39 0.00 -0.04 0.00 0.00 63.50 61.00 2bds n PRO 3 Cb 0.39 -2.75 -0.04 0.00 -0.04 0.00 0.00 33.50 31.06 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 -1.36 2.87 0.00 0.00 0.08 -1.26 0.28 117.98 118.59 2bds s PHE 5 Ca 0.50 0.83 0.00 0.00 0.12 0.00 0.00 56.93 58.38 2bds s PHE 5 Cb -0.28 -3.41 0.00 0.00 -0.57 0.00 0.00 43.02 38.77 2bds s PHE 5 CO 0.35 -1.87 0.00 0.00 -0.10 0.00 0.00 175.22 173.61 2bds s SER 7 N -0.47 5.60 0.00 0.00 0.15 -1.26 -2.26 113.70 115.47 2bds s SER 7 Ca 0.00 1.76 0.00 0.00 0.70 0.00 0.00 55.95 58.41 2bds s SER 7 Cb 0.00 -2.52 0.00 0.00 -1.71 0.00 0.00 66.02 61.79 2bds s SER 7 CO 0.00 -1.86 0.00 0.61 1.20 0.00 0.00 173.24 173.19 2bds n GLY 8 N 5.63 0.00 3.55 9.45 0.00 -1.26 -4.90 105.19 117.65 2bds n GLY 8 Ca 0.28 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.05 3.62 0.00 1.61 1.02 -0.96 -5.08 119.74 118.90 2bds s LYS 9 Ca 0.00 -0.51 0.00 0.00 0.02 0.00 0.00 55.97 55.48 2bds s LYS 9 Cb 0.00 -3.77 0.00 0.00 -0.52 0.00 0.00 37.83 33.54 2bds s LYS 9 CO 0.00 -0.40 0.00 -0.35 -0.92 0.00 0.00 175.35 173.68 2bds n PRO 10 N 5.15 -0.52 0.00 -1.68 -0.05 -1.26 -2.35 135.00 134.29 2bds n PRO 10 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.33 2bds n PRO 10 Cb 0.50 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.95 2bds n PRO 10 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 2bds n GLY 11 N 2.69 1.62 3.45 0.55 0.00 -1.26 -4.71 105.19 107.53 2bds n GLY 11 Ca 0.00 -0.76 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 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 1.14 0.04 1.61 1.04 -1.26 -4.69 118.95 116.83 2bds s ARG 12 Ca 0.00 -0.39 0.02 0.00 -1.04 0.00 0.00 55.73 54.31 2bds s ARG 12 Cb 0.00 0.53 -0.02 0.00 -2.04 0.00 0.00 34.95 33.41 2bds s ARG 12 CO 0.00 -0.49 -0.07 0.20 -0.04 0.00 0.00 175.30 174.90 2bds s GLY 13 N -2.61 0.45 -0.06 3.88 0.00 0.80 -4.62 107.32 105.15 2bds s GLY 13 Ca 0.02 -0.72 -0.30 0.00 0.00 0.00 0.00 44.72 43.72 2bds s GLY 13 CO -0.11 -0.77 1.13 0.99 0.00 0.00 0.00 173.10 174.34 2bds s ASP 14 N -1.52 7.13 -0.55 1.64 1.01 -0.31 -0.13 116.67 123.94 2bds s ASP 14 Ca -0.11 1.73 -0.26 0.00 0.71 0.00 0.00 52.55 54.62 2bds s ASP 14 Cb -0.10 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.31 2bds s ASP 14 CO 0.00 -0.52 1.06 -0.22 0.21 0.00 0.00 175.17 175.70 2bds s LEU 15 N 2.02 3.79 0.63 1.23 2.96 -0.07 0.08 118.68 129.32 2bds s LEU 15 Ca 0.53 -0.08 -0.02 0.00 -0.22 0.00 0.00 54.13 54.34 2bds s LEU 15 Cb -0.23 -3.03 0.06 0.00 0.50 0.00 0.00 46.19 43.49 2bds s LEU 15 CO 0.21 -1.33 0.89 0.26 -1.32 0.00 0.00 176.35 175.07 2bds s TRP 16 N 4.40 2.62 0.00 5.38 0.52 0.62 -4.17 118.94 128.31 2bds s TRP 16 Ca 0.37 0.08 0.00 0.00 0.02 0.00 0.00 56.10 56.57 2bds s TRP 16 Cb -0.10 -2.95 0.00 0.00 -1.15 0.00 0.00 33.47 29.27 2bds s TRP 16 CO 0.23 -1.22 0.00 -0.89 0.02 0.00 0.00 176.95 175.09 2bds n ILE 17 N -2.63 0.00 -1.22 2.03 -0.00 -1.26 -1.41 119.36 114.86 2bds n ILE 17 Ca 0.09 0.00 -0.40 0.00 -0.00 0.00 0.00 62.75 62.45 2bds n ILE 17 Cb 0.60 -1.55 -0.07 0.00 -0.00 0.00 0.00 39.64 38.62 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 3.23 -4.21 1.39 -0.00 0.13 -3.08 117.00 114.46 2bds n LEU 18 Ca 0.00 -2.68 -0.36 0.00 -0.00 0.00 0.00 56.01 52.97 2bds n LEU 18 Cb 0.00 -1.15 -0.13 0.00 -0.00 0.00 0.00 43.42 42.14 2bds n LEU 18 CO 0.00 -1.07 -0.33 -0.13 -0.00 0.00 0.00 177.39 175.85 2bds s ARG 19 N 5.78 2.58 0.60 1.47 0.52 -1.26 -4.92 118.95 123.72 2bds s ARG 19 Ca 0.63 -1.17 0.29 0.00 -0.52 0.00 0.00 55.73 54.96 2bds s ARG 19 Cb 0.11 -3.23 1.64 0.00 0.52 0.00 0.00 34.95 33.99 2bds s ARG 19 CO 0.17 -0.58 2.04 0.78 0.02 0.00 0.00 175.30 177.73 2bds h GLY 20 N 8.07 0.00 -4.64 -3.53 0.00 -1.95 -3.42 103.07 97.61 2bds h GLY 20 Ca -0.24 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 46.94 2bds h GLY 20 CO 0.56 0.00 -0.62 -0.51 0.00 0.00 0.00 176.54 175.97 2bds s THR 21 N -4.56 0.12 0.33 4.70 -4.23 -1.26 -5.08 115.64 105.66 2bds s THR 21 Ca -0.04 -0.96 -0.21 0.00 -1.18 0.00 0.00 61.69 59.30 2bds s THR 21 Cb 0.15 -0.50 -0.10 0.00 1.34 0.00 0.00 72.50 73.39 2bds s THR 21 CO 0.52 -0.53 0.85 0.00 -0.54 0.00 0.00 174.62 174.92 2bds n PRO 23 N 0.05 1.09 0.04 0.00 -0.01 -1.26 -4.91 135.00 130.00 2bds n PRO 23 Ca 0.03 0.41 -0.12 0.00 -0.01 0.00 0.00 63.50 63.81 2bds n PRO 23 Cb 0.52 -2.22 -0.14 0.00 -0.01 0.00 0.00 33.50 31.66 2bds n PRO 23 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 175.50 176.27 2bds h GLY 24 N 0.79 0.15 0.35 -1.23 0.00 -1.94 -3.28 103.07 97.91 2bds h GLY 24 Ca -0.48 -0.38 0.22 0.00 0.00 0.00 0.00 47.33 46.68 2bds h GLY 24 CO 0.53 0.33 0.62 -1.33 0.00 0.00 0.00 176.54 176.69 2bds h GLY 25 N 2.41 0.00 2.00 4.60 0.00 -1.98 1.16 103.07 111.26 2bds h GLY 25 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.02 2bds h GLY 25 CO 0.13 0.00 -0.57 -0.97 0.00 0.00 0.00 176.54 175.13 2bds h TYR 26 N 0.00 0.00 0.00 5.60 -1.99 -1.95 -3.47 116.97 115.16 2bds h TYR 26 Ca 0.35 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.08 2bds h TYR 26 Cb 1.58 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.31 2bds h TYR 26 CO 0.00 0.57 0.00 0.41 -0.00 0.00 0.00 178.16 179.14 2bds n GLY 27 N 1.15 0.67 3.34 3.88 0.00 0.40 -5.04 105.19 109.60 2bds n GLY 27 Ca 0.01 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.62 -2.01 0.00 1.61 4.01 -1.26 -4.90 117.16 112.00 2bds n TYR 28 Ca 0.00 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 2bds n TYR 28 Cb 0.00 -1.56 0.00 0.00 -0.31 0.00 0.00 39.34 37.47 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 -5.09 0.00 -3.36 -0.72 -2.24 -1.26 -4.97 114.28 96.63 2bds n THR 29 Ca 0.04 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.39 2bds n THR 29 Cb 0.56 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.70 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 -1.60 6.17 0.06 3.42 1.04 -1.26 -5.01 113.70 116.53 2bds s SER 30 Ca 0.00 -0.72 -0.15 0.00 0.48 0.00 0.00 55.95 55.56 2bds s SER 30 Cb 0.00 -2.20 0.02 0.00 0.10 0.00 0.00 66.02 63.94 2bds s SER 30 CO 0.00 -0.54 0.34 0.54 0.98 0.00 0.00 173.24 174.56 2bds s ASN 31 N 1.77 -0.16 0.05 7.02 2.20 -1.26 -0.59 114.94 123.97 2bds s ASN 31 Ca 0.10 -0.20 0.05 0.00 -0.94 0.00 0.00 52.86 51.87 2bds s ASN 31 Cb -0.18 0.39 -0.04 0.00 -2.00 0.00 0.00 41.25 39.43 2bds s ASN 31 CO 0.13 -0.68 -0.09 0.00 -2.94 0.00 0.00 177.10 173.52 2bds s TYR 33 N -1.09 2.63 -0.46 0.00 1.51 -1.26 -2.25 117.35 116.43 2bds s TYR 33 Ca 0.19 -0.67 0.07 0.00 -1.01 0.00 0.00 57.07 55.65 2bds s TYR 33 Cb -0.11 -1.71 0.25 0.00 -0.11 0.00 0.00 41.96 40.28 2bds s TYR 33 CO 0.10 -0.19 0.57 1.63 -1.11 0.00 0.00 175.55 176.56 2bds n LYS 34 N 3.15 1.17 -1.14 -0.62 5.02 -0.42 -4.95 118.16 120.37 2bds n LYS 34 Ca -0.18 -3.60 -0.36 0.00 -2.02 0.00 0.00 58.31 52.15 2bds n LYS 34 Cb 0.52 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.05 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 1.30 -2.24 0.38 2.13 -0.00 -1.26 -0.97 117.44 116.78 2bds n TRP 35 Ca 0.23 0.49 0.00 0.00 -0.00 0.00 0.00 57.50 58.22 2bds n TRP 35 Cb 0.50 -1.55 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 1.27 0.88 -1.18 5.87 -0.04 -1.26 -4.97 135.00 135.57 2bds n PRO 36 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 2bds n PRO 36 Cb 0.39 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.79 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 0.94 0.00 -3.50 3.54 3.02 -0.14 0.21 115.26 119.33 2bds n ASN 37 Ca 0.00 -0.72 -0.15 0.00 -0.03 0.00 0.00 54.58 53.68 2bds n ASN 37 Cb 0.44 0.00 -0.05 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 -2.17 0.00 -0.07 2.41 2.07 -0.50 -1.30 121.20 121.63 2bds s ILE 38 Ca 0.00 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.27 2bds s ILE 38 Cb 0.00 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.60 2bds s ILE 38 CO 0.00 0.00 -0.17 0.00 -1.91 0.00 0.00 174.94 172.86 2bds n TYR 41 N 1.95 -0.47 0.18 0.00 4.02 0.24 -1.16 117.16 121.92 2bds n TYR 41 Ca -0.18 -1.96 -0.14 0.00 -0.01 0.00 0.00 57.90 55.60 2bds n TYR 41 Cb 0.54 -0.36 -0.07 0.00 -0.02 0.00 0.00 39.34 39.43 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 -0.48 0.00 -0.72 0.11 -1.90 -3.35 132.00 125.66 2bds h PRO 42 Ca -0.30 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2bds h PRO 42 Cb 1.06 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2bds h PRO 42 CO 0.48 -0.32 0.00 -2.39 -0.21 0.00 0.00 178.00 175.55