#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 -2.33 -0.84 0.00 0.00 -1.26 -3.55 120.51 112.53 2bds n ALA 2 Ca 0.00 0.43 -0.14 0.00 0.00 0.00 0.00 53.44 53.73 2bds n ALA 2 Cb 0.00 -1.69 -0.11 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 0.94 1.85 -2.23 0.00 -0.04 -1.24 -1.42 135.00 132.86 2bds n PRO 3 Ca 0.16 -0.99 -0.40 0.00 -0.04 0.00 0.00 63.50 62.23 2bds n PRO 3 Cb 0.27 -2.04 -0.02 0.00 -0.04 0.00 0.00 33.50 31.66 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 -1.23 2.24 0.00 0.00 0.40 -1.26 0.29 117.98 118.41 2bds s PHE 5 Ca 0.51 0.60 0.00 0.00 -0.60 0.00 0.00 56.93 57.44 2bds s PHE 5 Cb -0.36 -3.69 0.00 0.00 0.51 0.00 0.00 43.02 39.48 2bds s PHE 5 CO 0.46 -2.33 0.00 0.00 0.70 0.00 0.00 175.22 174.05 2bds s SER 7 N -0.81 6.06 0.00 0.00 0.01 -1.26 -2.23 113.70 115.47 2bds s SER 7 Ca 0.00 1.81 0.00 0.00 1.31 0.00 0.00 55.95 59.07 2bds s SER 7 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2bds s SER 7 CO 0.00 -1.49 0.00 0.61 0.41 0.00 0.00 173.24 172.77 2bds n GLY 8 N 5.06 0.15 3.62 3.44 0.00 -1.26 -4.91 105.19 111.29 2bds n GLY 8 Ca 0.23 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.63 4.07 0.66 1.61 1.02 -0.95 -5.06 119.74 120.47 2bds s LYS 9 Ca 0.00 0.21 -0.14 0.00 0.02 0.00 0.00 55.97 56.06 2bds s LYS 9 Cb 0.00 -3.63 -0.00 0.00 -0.52 0.00 0.00 37.83 33.68 2bds s LYS 9 CO 0.00 -0.27 1.09 -1.25 -0.92 0.00 0.00 175.35 174.00 2bds s PRO 10 N 2.05 2.85 0.00 -1.68 0.04 -1.26 -2.62 135.00 134.38 2bds s PRO 10 Ca 0.19 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.52 2bds s PRO 10 Cb -0.16 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.42 2bds s PRO 10 CO 0.09 -1.19 0.00 0.41 0.04 0.00 0.00 177.00 176.35 2bds n GLY 11 N -0.81 0.62 3.53 0.56 0.00 -1.26 -4.83 105.19 103.00 2bds n GLY 11 Ca 0.10 -1.16 -0.17 0.00 0.00 0.00 0.00 46.02 44.78 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 1.00 0.09 1.61 1.04 -1.26 -4.35 118.95 117.08 2bds s ARG 12 Ca 0.00 0.30 0.02 0.00 -1.04 0.00 0.00 55.73 55.01 2bds s ARG 12 Cb 0.00 0.47 -0.04 0.00 -2.04 0.00 0.00 34.95 33.34 2bds s ARG 12 CO 0.00 -0.30 -0.07 0.20 -0.04 0.00 0.00 175.30 175.09 2bds s GLY 13 N -1.08 0.76 -0.36 3.88 0.00 0.83 -4.64 107.32 106.71 2bds s GLY 13 Ca -0.09 -1.27 -0.29 0.00 0.00 0.00 0.00 44.72 43.07 2bds s GLY 13 CO 0.09 -1.36 1.23 0.99 0.00 0.00 0.00 173.10 174.04 2bds s ASP 14 N -2.81 6.68 -1.11 1.64 1.11 -0.48 -2.22 116.67 119.49 2bds s ASP 14 Ca 0.09 0.96 -0.19 0.00 0.18 0.00 0.00 52.55 53.58 2bds s ASP 14 Cb 0.02 -2.54 0.09 0.00 1.07 0.00 0.00 42.92 41.56 2bds s ASP 14 CO -0.03 -1.12 1.46 -0.22 1.18 0.00 0.00 175.17 176.44 2bds s LEU 15 N 4.36 4.14 0.22 1.23 0.20 -0.50 -0.93 118.68 127.40 2bds s LEU 15 Ca 0.53 -2.08 -0.32 0.00 0.69 0.00 0.00 54.13 52.95 2bds s LEU 15 Cb -0.13 -2.51 -0.12 0.00 -0.43 0.00 0.00 46.19 42.99 2bds s LEU 15 CO 0.24 -1.21 1.69 0.79 -0.29 0.00 0.00 176.35 177.57 2bds n TRP 16 N 7.80 2.73 0.88 5.38 7.02 0.53 -3.99 117.44 137.80 2bds n TRP 16 Ca 0.36 0.10 0.10 0.00 -1.02 0.00 0.00 57.50 57.04 2bds n TRP 16 Cb 0.48 -2.65 -0.01 0.00 -2.42 0.00 0.00 31.31 26.71 2bds n TRP 16 CO 0.00 0.00 0.00 -0.89 -2.02 0.00 0.00 177.69 174.78 2bds n ILE 17 N 3.55 0.00 -2.90 -0.99 5.41 -1.26 0.15 119.36 123.32 2bds n ILE 17 Ca 0.15 -0.27 -0.12 0.00 1.00 0.00 0.00 62.75 63.50 2bds n ILE 17 Cb 0.35 1.21 0.04 0.00 -0.71 0.00 0.00 39.64 40.53 2bds n ILE 17 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2bds n LEU 18 N -0.17 -0.44 -3.60 1.39 4.77 -0.56 -3.67 117.00 114.72 2bds n LEU 18 Ca 0.08 -4.20 -0.10 0.00 -0.03 0.00 0.00 56.01 51.76 2bds n LEU 18 Cb 0.41 0.66 -0.02 0.00 -2.33 0.00 0.00 43.42 42.14 2bds n LEU 18 CO 0.26 2.06 0.43 -0.13 -1.33 0.00 0.00 177.39 178.68 2bds s ARG 19 N -1.34 1.49 -0.00 3.23 0.52 0.47 -4.98 118.95 118.34 2bds s ARG 19 Ca 0.30 -0.69 0.02 0.00 -0.52 0.00 0.00 55.73 54.84 2bds s ARG 19 Cb 0.35 0.60 -0.03 0.00 0.52 0.00 0.00 34.95 36.39 2bds s ARG 19 CO -0.05 -0.67 0.06 0.41 0.02 0.00 0.00 175.30 175.07 2bds n GLY 20 N -0.41 0.24 3.32 -3.53 0.00 -1.26 -4.26 105.19 99.29 2bds n GLY 20 Ca -0.12 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 2bds n GLY 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bds s THR 21 N -1.79 1.77 -0.03 2.61 -4.23 -1.26 -5.01 115.64 107.70 2bds s THR 21 Ca -0.00 -1.92 -0.02 0.00 -1.18 0.00 0.00 61.69 58.57 2bds s THR 21 Cb 0.01 -1.83 -0.04 0.00 1.34 0.00 0.00 72.50 71.99 2bds s THR 21 CO 0.09 -0.34 0.10 0.00 -0.54 0.00 0.00 174.62 173.93 2bds n PRO 23 N 1.31 2.37 0.20 0.00 -0.04 -1.26 -4.85 135.00 132.73 2bds n PRO 23 Ca -0.14 0.85 0.13 0.00 -0.04 0.00 0.00 63.50 64.31 2bds n PRO 23 Cb 0.53 -2.64 0.35 0.00 -0.04 0.00 0.00 33.50 31.70 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 5.98 0.00 2.00 0.55 0.00 -1.96 -2.97 103.07 106.66 2bds h GLY 24 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2bds h GLY 24 CO 0.89 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.04 2bds n GLY 25 N 0.84 -1.53 0.05 4.60 0.00 -1.26 -3.86 105.19 104.03 2bds n GLY 25 Ca 0.03 -0.02 -0.00 0.00 0.00 0.00 0.00 46.02 46.03 2bds n GLY 25 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2bds h TYR 26 N 0.00 -0.02 0.00 1.61 -1.99 -1.90 -3.49 116.97 111.18 2bds h TYR 26 Ca 0.00 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2bds h TYR 26 Cb 0.58 0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.31 2bds h TYR 26 CO 0.00 -0.01 0.00 0.41 -0.00 0.00 0.00 178.16 178.56 2bds n GLY 27 N 1.75 0.31 3.47 3.88 0.00 -1.25 -5.14 105.19 108.21 2bds n GLY 27 Ca -0.00 0.00 -0.28 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 1.22 0.00 1.61 2.02 -1.26 -4.90 117.35 116.04 2bds s TYR 28 Ca 0.00 1.10 0.00 0.00 -0.37 0.00 0.00 57.07 57.80 2bds s TYR 28 Cb 0.00 -3.08 0.00 0.00 -0.40 0.00 0.00 41.96 38.48 2bds s TYR 28 CO 0.00 -4.01 0.00 0.25 -1.57 0.00 0.00 175.55 170.22 2bds n THR 29 N -5.00 0.00 -3.32 -0.71 -2.24 -1.25 -4.91 114.28 96.84 2bds n THR 29 Ca 0.03 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.39 2bds n THR 29 Cb 0.55 0.00 -0.09 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 6.22 0.00 3.42 1.04 -1.25 -5.00 113.70 116.64 2bds s SER 30 Ca 0.00 -0.36 -0.14 0.00 0.48 0.00 0.00 55.95 55.93 2bds s SER 30 Cb 0.00 -2.23 0.02 0.00 0.10 0.00 0.00 66.02 63.91 2bds s SER 30 CO 0.00 -0.48 0.29 0.54 0.98 0.00 0.00 173.24 174.58 2bds s ASN 31 N 1.78 -0.16 -0.10 7.02 2.20 -1.26 -0.92 114.94 123.50 2bds s ASN 31 Ca 0.14 -0.01 -0.06 0.00 -0.94 0.00 0.00 52.86 51.99 2bds s ASN 31 Cb -0.16 0.31 -0.04 0.00 -2.00 0.00 0.00 41.25 39.36 2bds s ASN 31 CO 0.13 -0.48 0.12 0.00 -2.94 0.00 0.00 177.10 173.93 2bds s TYR 33 N -1.05 2.36 -0.43 0.00 1.51 -1.26 -1.91 117.35 116.57 2bds s TYR 33 Ca 0.16 -0.73 0.08 0.00 -1.01 0.00 0.00 57.07 55.58 2bds s TYR 33 Cb -0.12 -1.55 0.27 0.00 -0.11 0.00 0.00 41.96 40.45 2bds s TYR 33 CO 0.06 -0.23 0.76 0.36 -1.11 0.00 0.00 175.55 175.39 2bds n LYS 34 N 3.03 0.82 -0.68 -0.62 0.00 -0.99 -4.97 118.16 114.74 2bds n LYS 34 Ca -0.18 -2.57 -0.22 0.00 -0.00 0.00 0.00 58.31 55.34 2bds n LYS 34 Cb 0.52 -1.35 -0.00 0.00 -0.00 0.00 0.00 35.03 34.20 2bds n LYS 34 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.40 179.27 2bds n TRP 35 N 1.15 -1.17 1.14 5.58 -0.00 -1.26 -1.86 117.44 121.01 2bds n TRP 35 Ca 0.16 0.32 0.07 0.00 -0.00 0.00 0.00 57.50 58.04 2bds n TRP 35 Cb 0.61 -0.93 0.39 0.00 -0.00 0.00 0.00 31.31 31.38 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 0.72 0.57 -0.81 5.87 -0.05 -1.26 -4.98 135.00 135.06 2bds n PRO 36 Ca 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.51 2bds n PRO 36 Cb 0.22 -1.36 0.00 0.00 -0.05 0.00 0.00 33.50 32.30 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 -0.86 1.02 -3.65 3.54 3.02 -0.78 -0.39 115.26 117.16 2bds n ASN 37 Ca 0.10 -0.54 0.02 0.00 -0.03 0.00 0.00 54.58 54.13 2bds n ASN 37 Cb 0.05 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.15 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 0.68 0.00 -0.35 2.41 2.07 0.40 -2.36 121.20 124.05 2bds s ILE 38 Ca 0.00 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.17 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 0.14 0.00 -1.91 0.00 0.00 174.94 173.17 2bds n TYR 41 N 2.77 -1.25 0.31 0.00 4.02 -0.10 -1.38 117.16 121.54 2bds n TYR 41 Ca -0.06 -1.99 -0.18 0.00 -0.01 0.00 0.00 57.90 55.67 2bds n TYR 41 Cb 0.51 -0.42 -0.09 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 -0.97 0.00 -0.72 0.11 -1.87 -3.33 132.00 125.22 2bds h PRO 42 Ca -0.28 0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2bds h PRO 42 Cb 1.11 0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2bds h PRO 42 CO 0.43 -0.65 0.00 -2.39 -0.21 0.00 0.00 178.00 175.19