#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 1.94 0.19 0.00 0.00 -1.26 -4.83 120.51 116.55 2bds n ALA 2 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2bds n ALA 2 Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.09 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 1.11 0.90 -2.76 0.00 -0.04 -1.26 -3.52 135.00 129.43 2bds n PRO 3 Ca 0.05 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.09 2bds n PRO 3 Cb 0.37 -1.05 -0.03 0.00 -0.04 0.00 0.00 33.50 32.74 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 2.23 3.10 0.49 0.00 0.08 -1.26 0.32 117.98 122.95 2bds s PHE 5 Ca 0.44 1.10 0.05 0.00 0.12 0.00 0.00 56.93 58.63 2bds s PHE 5 Cb -0.17 -3.09 0.05 0.00 -0.57 0.00 0.00 43.02 39.23 2bds s PHE 5 CO 0.14 -1.44 0.39 0.00 -0.10 0.00 0.00 175.22 174.21 2bds s SER 7 N -3.91 6.66 0.00 0.00 0.01 -1.26 -2.65 113.70 112.55 2bds s SER 7 Ca 0.30 0.52 0.00 0.00 1.31 0.00 0.00 55.95 58.07 2bds s SER 7 Cb -0.02 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2bds s SER 7 CO 0.19 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.32 2bds n GLY 8 N 4.67 1.03 2.81 3.44 0.00 -1.26 -5.04 105.19 110.83 2bds n GLY 8 Ca 0.11 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.74 0.98 0.00 1.61 1.02 -1.08 -5.13 119.74 116.39 2bds s LYS 9 Ca 0.00 -0.31 0.00 0.00 0.02 0.00 0.00 55.97 55.68 2bds s LYS 9 Cb 0.00 -1.74 0.00 0.00 -0.52 0.00 0.00 37.83 35.57 2bds s LYS 9 CO 0.00 -0.46 0.00 -0.35 -0.92 0.00 0.00 175.35 173.62 2bds n PRO 10 N 5.00 0.73 0.00 -1.68 -0.05 -1.26 -2.14 135.00 135.60 2bds n PRO 10 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.35 2bds n PRO 10 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.93 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 3.27 2.06 3.43 0.55 0.00 -1.26 -4.73 105.19 108.52 2bds n GLY 11 Ca 0.00 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.78 2bds n GLY 11 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bds s ARG 12 N 0.00 1.22 -0.06 1.61 3.52 -1.26 -4.66 118.95 119.32 2bds s ARG 12 Ca 0.00 -0.45 -0.07 0.00 -0.13 0.00 0.00 55.73 55.08 2bds s ARG 12 Cb 0.00 0.56 0.02 0.00 -1.56 0.00 0.00 34.95 33.97 2bds s ARG 12 CO 0.00 -0.53 0.20 0.20 -0.81 0.00 0.00 175.30 174.35 2bds s GLY 13 N -2.71 -0.12 -0.05 8.12 0.00 0.95 -4.56 107.32 108.95 2bds s GLY 13 Ca 0.02 0.45 -0.30 0.00 0.00 0.00 0.00 44.72 44.89 2bds s GLY 13 CO -0.12 0.36 1.20 0.99 0.00 0.00 0.00 173.10 175.52 2bds s ASP 14 N -0.19 7.05 0.02 1.64 1.11 -0.01 -2.60 116.67 123.69 2bds s ASP 14 Ca -0.03 1.83 -0.26 0.00 0.18 0.00 0.00 52.55 54.27 2bds s ASP 14 Cb -0.03 -2.56 -0.05 0.00 1.07 0.00 0.00 42.92 41.36 2bds s ASP 14 CO 0.01 -0.58 0.80 -0.22 1.18 0.00 0.00 175.17 176.35 2bds s LEU 15 N 2.15 4.41 0.43 1.23 0.20 -1.26 0.15 118.68 125.99 2bds s LEU 15 Ca 0.56 1.44 0.03 0.00 0.69 0.00 0.00 54.13 56.86 2bds s LEU 15 Cb -0.25 -3.27 -0.03 0.00 -0.43 0.00 0.00 46.19 42.20 2bds s LEU 15 CO 0.22 -0.06 0.06 0.26 -0.29 0.00 0.00 176.35 176.54 2bds s TRP 16 N 0.31 1.94 0.00 5.38 0.52 0.34 -4.69 118.94 122.75 2bds s TRP 16 Ca 0.41 -1.03 0.00 0.00 0.02 0.00 0.00 56.10 55.50 2bds s TRP 16 Cb -0.20 -1.42 0.00 0.00 -1.15 0.00 0.00 33.47 30.70 2bds s TRP 16 CO 0.23 0.04 0.00 -0.89 0.02 0.00 0.00 176.95 176.35 2bds n ILE 17 N -1.00 0.00 -0.88 2.03 5.41 -1.26 -2.17 119.36 121.48 2bds n ILE 17 Ca -0.10 0.00 -0.36 0.00 1.00 0.00 0.00 62.75 63.29 2bds n ILE 17 Cb 0.66 -1.03 -0.06 0.00 -0.71 0.00 0.00 39.64 38.50 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 3.47 -4.62 1.39 -0.00 -0.19 -3.14 117.00 113.91 2bds n LEU 18 Ca 0.00 -2.53 -0.35 0.00 -0.00 0.00 0.00 56.01 53.13 2bds n LEU 18 Cb 0.00 -0.97 -0.10 0.00 -0.00 0.00 0.00 43.42 42.35 2bds n LEU 18 CO 0.00 -0.50 -0.25 -0.13 -0.00 0.00 0.00 177.39 176.51 2bds s ARG 19 N 5.02 3.95 0.15 1.47 0.52 -1.26 -4.96 118.95 123.84 2bds s ARG 19 Ca 0.52 -0.35 -0.18 0.00 -0.52 0.00 0.00 55.73 55.20 2bds s ARG 19 Cb 0.13 -3.23 0.05 0.00 0.52 0.00 0.00 34.95 32.42 2bds s ARG 19 CO 0.12 0.23 1.70 0.78 0.02 0.00 0.00 175.30 178.14 2bds h GLY 20 N 6.86 0.29 -3.13 -3.53 0.00 -1.98 -3.44 103.07 98.13 2bds h GLY 20 Ca -0.37 0.06 -0.13 0.00 0.00 0.00 0.00 47.33 46.90 2bds h GLY 20 CO 0.69 -0.09 -0.61 -0.51 0.00 0.00 0.00 176.54 176.01 2bds s THR 21 N -6.20 0.18 0.45 4.70 -4.23 -1.26 -5.10 115.64 104.18 2bds s THR 21 Ca -0.13 -1.72 -0.20 0.00 -1.18 0.00 0.00 61.69 58.45 2bds s THR 21 Cb 0.13 -1.62 -0.10 0.00 1.34 0.00 0.00 72.50 72.25 2bds s THR 21 CO 0.70 -0.81 0.98 0.00 -0.54 0.00 0.00 174.62 174.96 2bds n PRO 23 N -0.82 2.52 -0.03 0.00 -0.04 -1.26 -4.90 135.00 130.47 2bds n PRO 23 Ca 0.08 0.91 -0.14 0.00 -0.04 0.00 0.00 63.50 64.30 2bds n PRO 23 Cb 0.54 -2.73 -0.11 0.00 -0.04 0.00 0.00 33.50 31.16 2bds n PRO 23 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2bds h GLY 24 N 6.71 0.16 1.17 0.55 0.00 -1.93 -3.10 103.07 106.64 2bds h GLY 24 Ca -0.44 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 46.65 2bds h GLY 24 CO 0.93 0.21 0.17 0.61 0.00 0.00 0.00 176.54 178.46 2bds n GLY 25 N 0.82 -0.28 0.00 4.60 0.00 -1.26 -2.77 105.19 106.30 2bds n GLY 25 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.26 0.00 0.00 1.61 4.02 -1.17 -5.02 117.16 115.34 2bds n TYR 26 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2bds n TYR 26 Cb 0.17 -0.20 0.00 0.00 -0.02 0.00 0.00 39.34 39.29 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 2.23 0.00 3.56 2.72 0.00 -1.12 -5.15 105.19 107.42 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 1.27 0.00 1.61 2.02 -1.26 -4.88 117.35 116.10 2bds s TYR 28 Ca 0.00 0.89 0.00 0.00 -0.37 0.00 0.00 57.07 57.59 2bds s TYR 28 Cb 0.00 -3.21 0.00 0.00 -0.40 0.00 0.00 41.96 38.35 2bds s TYR 28 CO 0.00 -3.66 0.00 0.25 -1.57 0.00 0.00 175.55 170.57 2bds n THR 29 N -4.71 0.00 -3.46 -0.71 -2.24 -1.23 -4.92 114.28 97.01 2bds n THR 29 Ca 0.06 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.45 2bds n THR 29 Cb 0.57 0.00 -0.10 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 -1.44 6.15 0.09 3.42 1.04 -1.20 -5.01 113.70 116.75 2bds s SER 30 Ca 0.00 0.06 -0.12 0.00 0.48 0.00 0.00 55.95 56.36 2bds s SER 30 Cb 0.00 -2.18 0.02 0.00 0.10 0.00 0.00 66.02 63.96 2bds s SER 30 CO 0.00 -0.17 0.29 0.54 0.98 0.00 0.00 173.24 174.88 2bds s ASN 31 N 1.70 -0.06 0.07 7.02 2.20 -1.26 0.16 114.94 124.77 2bds s ASN 31 Ca 0.11 -0.41 0.06 0.00 -0.94 0.00 0.00 52.86 51.69 2bds s ASN 31 Cb -0.16 0.39 -0.04 0.00 -2.00 0.00 0.00 41.25 39.44 2bds s ASN 31 CO 0.11 -0.73 -0.11 0.00 -2.94 0.00 0.00 177.10 173.43 2bds s TYR 33 N -1.11 2.59 -0.53 0.00 1.51 -1.26 -2.58 117.35 115.98 2bds s TYR 33 Ca 0.19 -1.61 0.06 0.00 -1.01 0.00 0.00 57.07 54.70 2bds s TYR 33 Cb -0.11 -1.77 0.21 0.00 -0.11 0.00 0.00 41.96 40.18 2bds s TYR 33 CO 0.11 -0.77 0.51 1.63 -1.11 0.00 0.00 175.55 175.92 2bds n LYS 34 N 4.65 1.23 -1.10 -0.62 5.02 -0.89 -5.00 118.16 121.44 2bds n LYS 34 Ca -0.18 -3.83 -0.37 0.00 -2.02 0.00 0.00 58.31 51.92 2bds n LYS 34 Cb 0.48 -1.83 0.04 0.00 -0.02 0.00 0.00 35.03 33.70 2bds n LYS 34 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2bds n TRP 35 N 1.82 -3.90 0.93 2.13 7.02 -1.26 -2.00 117.44 122.17 2bds n TRP 35 Ca 0.25 0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.91 2bds n TRP 35 Cb 0.45 -1.58 0.00 0.00 -2.42 0.00 0.00 31.31 27.76 2bds n TRP 35 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 2bds n PRO 36 N 1.71 0.93 -0.03 -0.99 -0.04 -1.26 -4.98 135.00 130.34 2bds n PRO 36 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2bds n PRO 36 Cb 0.52 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.89 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 0.47 0.00 -3.48 3.54 3.02 -0.85 -1.02 115.26 116.94 2bds n ASN 37 Ca 0.00 -0.01 -0.15 0.00 -0.03 0.00 0.00 54.58 54.39 2bds n ASN 37 Cb 0.43 0.00 -0.04 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 -1.51 0.00 -0.18 2.41 2.07 -0.92 -2.10 121.20 120.96 2bds s ILE 38 Ca 0.00 0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.25 2bds s ILE 38 Cb 0.00 -1.00 0.04 0.00 0.13 0.00 0.00 42.46 41.63 2bds s ILE 38 CO 0.00 0.00 -0.11 0.00 -1.91 0.00 0.00 174.94 172.92 2bds s TYR 41 N -1.86 2.46 0.70 0.00 1.51 0.12 -0.83 117.35 119.44 2bds s TYR 41 Ca 0.51 -0.60 -0.11 0.00 -1.01 0.00 0.00 57.07 55.85 2bds s TYR 41 Cb -0.12 -1.60 0.01 0.00 -0.11 0.00 0.00 41.96 40.15 2bds s TYR 41 CO 0.18 0.50 1.07 -1.25 -1.11 0.00 0.00 175.55 174.94 2bds s PRO 42 N -3.67 2.87 0.00 -1.71 0.04 -1.21 -3.27 135.00 128.05 2bds s PRO 42 Ca 0.34 1.03 0.00 0.00 0.04 0.00 0.00 61.00 62.41 2bds s PRO 42 Cb 0.07 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2bds s PRO 42 CO 0.17 -1.16 0.41 -2.39 0.04 0.00 0.00 177.00 174.07