#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 -1.22 0.16 0.00 0.00 -1.26 -4.77 120.51 113.42 2bds n ALA 2 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2bds n ALA 2 Cb 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.51 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 1.43 0.95 -2.28 0.00 -0.04 -1.26 -3.67 135.00 130.14 2bds n PRO 3 Ca 0.15 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.18 2bds n PRO 3 Cb 0.25 -1.02 -0.03 0.00 -0.04 0.00 0.00 33.50 32.66 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 3.08 1.18 0.32 0.00 0.08 -1.26 0.34 117.98 121.72 2bds s PHE 5 Ca 0.62 0.32 0.03 0.00 0.12 0.00 0.00 56.93 58.02 2bds s PHE 5 Cb -0.28 -4.00 -0.01 0.00 -0.57 0.00 0.00 43.02 38.16 2bds s PHE 5 CO 0.22 -3.05 0.12 0.00 -0.10 0.00 0.00 175.22 172.42 2bds s SER 7 N -2.96 6.69 0.00 0.00 0.01 -1.26 -2.54 113.70 113.64 2bds s SER 7 Ca 0.17 0.95 0.00 0.00 1.31 0.00 0.00 55.95 58.38 2bds s SER 7 Cb 0.01 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2bds s SER 7 CO 0.12 -1.11 0.00 0.61 0.41 0.00 0.00 173.24 173.27 2bds n GLY 8 N 4.41 2.26 3.06 3.44 0.00 -1.26 -4.98 105.19 112.12 2bds n GLY 8 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.25 2.04 1.06 1.61 1.02 -1.05 -5.11 119.74 119.06 2bds s LYS 9 Ca 0.00 -1.50 -0.16 0.00 0.02 0.00 0.00 55.97 54.34 2bds s LYS 9 Cb 0.00 -3.01 0.22 0.00 -0.52 0.00 0.00 37.83 34.52 2bds s LYS 9 CO 0.00 -0.68 1.14 -1.25 -0.92 0.00 0.00 175.35 173.64 2bds s PRO 10 N 1.06 -0.05 0.00 -1.68 0.05 -1.26 -1.84 135.00 131.27 2bds s PRO 10 Ca -0.03 0.10 0.00 0.00 0.05 0.00 0.00 61.00 61.12 2bds s PRO 10 Cb -0.20 -1.72 0.00 0.00 0.05 0.00 0.00 34.50 32.63 2bds s PRO 10 CO -0.06 -2.96 0.00 0.41 0.05 0.00 0.00 177.00 174.44 2bds n GLY 11 N -1.67 0.95 3.41 0.56 0.00 -1.26 -4.82 105.19 102.36 2bds n GLY 11 Ca 0.10 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.23 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 1.26 -0.03 1.61 3.52 -1.26 -4.55 118.95 119.50 2bds s ARG 12 Ca 0.00 -0.49 -0.05 0.00 -0.13 0.00 0.00 55.73 55.07 2bds s ARG 12 Cb 0.00 0.58 0.01 0.00 -1.56 0.00 0.00 34.95 33.97 2bds s ARG 12 CO 0.00 -0.54 0.11 0.20 -0.81 0.00 0.00 175.30 174.26 2bds s GLY 13 N -2.74 -0.02 -0.01 8.12 0.00 1.02 -4.71 107.32 108.98 2bds s GLY 13 Ca 0.01 0.11 -0.30 0.00 0.00 0.00 0.00 44.72 44.54 2bds s GLY 13 CO -0.13 0.04 1.15 0.99 0.00 0.00 0.00 173.10 175.15 2bds s ASP 14 N -0.51 7.13 -0.30 1.64 1.11 -0.60 -2.70 116.67 122.46 2bds s ASP 14 Ca -0.06 1.83 -0.25 0.00 0.18 0.00 0.00 52.55 54.25 2bds s ASP 14 Cb -0.04 -2.57 0.01 0.00 1.07 0.00 0.00 42.92 41.39 2bds s ASP 14 CO 0.00 -0.48 0.89 -0.22 1.18 0.00 0.00 175.17 176.54 2bds s LEU 15 N 1.59 4.05 0.26 1.23 2.96 -1.26 0.52 118.68 128.03 2bds s LEU 15 Ca 0.56 0.86 0.09 0.00 -0.22 0.00 0.00 54.13 55.41 2bds s LEU 15 Cb -0.25 -3.25 -0.04 0.00 0.50 0.00 0.00 46.19 43.15 2bds s LEU 15 CO 0.25 -0.68 0.05 0.26 -1.32 0.00 0.00 176.35 174.91 2bds s TRP 16 N 3.15 2.81 0.00 5.38 0.52 0.47 -4.76 118.94 126.50 2bds s TRP 16 Ca 0.37 -0.19 0.00 0.00 0.02 0.00 0.00 56.10 56.30 2bds s TRP 16 Cb -0.14 -1.26 0.00 0.00 -1.15 0.00 0.00 33.47 30.93 2bds s TRP 16 CO 0.12 0.59 0.00 -0.89 0.02 0.00 0.00 176.95 176.79 2bds n ILE 17 N -0.92 0.00 -1.09 2.03 5.41 -1.26 -0.75 119.36 122.77 2bds n ILE 17 Ca -0.07 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.26 2bds n ILE 17 Cb 0.58 -1.90 -0.07 0.00 -0.71 0.00 0.00 39.64 37.54 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 3.40 -4.72 1.39 -0.00 0.49 -3.13 117.00 114.42 2bds n LEU 18 Ca 0.00 -2.64 -0.35 0.00 -0.00 0.00 0.00 56.01 53.03 2bds n LEU 18 Cb 0.00 -1.04 -0.09 0.00 -0.00 0.00 0.00 43.42 42.29 2bds n LEU 18 CO 0.00 -0.81 -0.28 -0.13 -0.00 0.00 0.00 177.39 176.17 2bds s ARG 19 N 5.52 3.03 0.16 1.47 0.52 -1.26 -4.92 118.95 123.47 2bds s ARG 19 Ca 0.61 -0.41 -0.00 0.00 -0.52 0.00 0.00 55.73 55.40 2bds s ARG 19 Cb 0.13 -2.84 0.01 0.00 0.52 0.00 0.00 34.95 32.78 2bds s ARG 19 CO 0.16 0.69 1.39 0.78 0.02 0.00 0.00 175.30 178.35 2bds h GLY 20 N 4.85 0.36 -3.58 -3.53 0.00 -1.95 -3.46 103.07 95.76 2bds h GLY 20 Ca -0.51 -0.57 -0.12 0.00 0.00 0.00 0.00 47.33 46.13 2bds h GLY 20 CO 0.56 0.51 -0.56 -0.51 0.00 0.00 0.00 176.54 176.55 2bds s THR 21 N -3.40 0.17 0.39 4.70 -4.23 -1.26 -5.10 115.64 106.91 2bds s THR 21 Ca -0.05 -1.37 -0.19 0.00 -1.18 0.00 0.00 61.69 58.90 2bds s THR 21 Cb 0.10 -1.20 -0.10 0.00 1.34 0.00 0.00 72.50 72.64 2bds s THR 21 CO 0.84 -0.76 0.88 0.00 -0.54 0.00 0.00 174.62 175.04 2bds s PRO 23 N -3.11 3.49 0.19 0.00 0.04 -1.26 -4.91 135.00 129.45 2bds s PRO 23 Ca 0.59 2.28 0.25 0.00 0.04 0.00 0.00 61.00 64.17 2bds s PRO 23 Cb -0.09 -2.49 0.59 0.00 0.04 0.00 0.00 34.50 32.55 2bds s PRO 23 CO 0.15 -0.93 1.58 0.78 0.04 0.00 0.00 177.00 178.62 2bds h GLY 24 N 1.98 0.00 2.00 0.56 0.00 -1.95 -3.27 103.07 102.40 2bds h GLY 24 Ca -0.51 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 2bds h GLY 24 CO 0.60 0.00 -0.14 -1.33 0.00 0.00 0.00 176.54 175.67 2bds h GLY 25 N 4.47 0.00 0.28 4.60 0.00 -1.95 0.36 103.07 110.82 2bds h GLY 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bds h GLY 25 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.82 2bds n TYR 26 N -4.34 0.04 -1.23 5.60 4.02 -1.23 -4.86 117.16 115.16 2bds n TYR 26 Ca -0.03 -0.02 -0.08 0.00 -0.01 0.00 0.00 57.90 57.77 2bds n TYR 26 Cb 0.21 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.49 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 0.84 0.91 3.59 2.72 0.00 0.12 -4.96 105.19 108.40 2bds n GLY 27 Ca 0.13 -0.28 -0.28 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.06 1.76 0.00 1.61 2.02 -1.26 -4.89 117.35 114.53 2bds s TYR 28 Ca 0.00 1.06 0.00 0.00 -0.37 0.00 0.00 57.07 57.76 2bds s TYR 28 Cb 0.00 -3.19 0.00 0.00 -0.40 0.00 0.00 41.96 38.37 2bds s TYR 28 CO 0.00 -3.35 0.00 0.25 -1.57 0.00 0.00 175.55 170.88 2bds n THR 29 N -4.52 0.00 -3.48 -0.71 -2.24 -1.26 -4.90 114.28 97.17 2bds n THR 29 Ca 0.04 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.43 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 -1.70 6.13 0.10 3.42 1.04 -1.25 -5.02 113.70 116.43 2bds s SER 30 Ca 0.00 -0.03 -0.17 0.00 0.48 0.00 0.00 55.95 56.23 2bds s SER 30 Cb 0.00 -2.17 0.04 0.00 0.10 0.00 0.00 66.02 63.99 2bds s SER 30 CO 0.00 -0.19 0.41 0.54 0.98 0.00 0.00 173.24 174.99 2bds s ASN 31 N 1.71 -0.26 0.10 7.02 4.22 -1.26 -0.18 114.94 126.29 2bds s ASN 31 Ca 0.10 -0.21 0.09 0.00 -2.14 0.00 0.00 52.86 50.71 2bds s ASN 31 Cb -0.16 0.46 -0.03 0.00 1.28 0.00 0.00 41.25 42.80 2bds s ASN 31 CO 0.11 -0.80 -0.24 0.00 -2.04 0.00 0.00 177.10 174.13 2bds s TYR 33 N -1.02 2.68 -0.42 0.00 1.51 -1.26 -1.97 117.35 116.87 2bds s TYR 33 Ca 0.10 -0.31 0.06 0.00 -1.01 0.00 0.00 57.07 55.92 2bds s TYR 33 Cb -0.10 -1.66 0.22 0.00 -0.11 0.00 0.00 41.96 40.31 2bds s TYR 33 CO 0.04 0.07 0.47 1.63 -1.11 0.00 0.00 175.55 176.65 2bds n LYS 34 N 2.59 0.65 -1.14 -0.62 5.02 -0.82 -4.92 118.16 118.92 2bds n LYS 34 Ca -0.17 -3.31 -0.36 0.00 -2.02 0.00 0.00 58.31 52.45 2bds n LYS 34 Cb 0.52 -1.45 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 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 1.88 -2.13 -0.14 2.13 -0.00 -1.26 -0.95 117.44 116.97 2bds n TRP 35 Ca 0.24 0.50 0.00 0.00 -0.00 0.00 0.00 57.50 58.24 2bds n TRP 35 Cb 0.50 -1.55 0.00 0.00 -0.00 0.00 0.00 31.31 30.26 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 1.24 0.91 0.00 5.87 -0.05 -1.26 -4.97 135.00 136.74 2bds n PRO 36 Ca 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.54 2bds n PRO 36 Cb 0.38 -1.05 0.00 0.00 -0.05 0.00 0.00 33.50 32.78 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 1.31 0.00 -3.63 3.54 3.02 -0.13 -0.38 115.26 119.00 2bds n ASN 37 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.47 2bds n ASN 37 Cb 0.45 0.00 -0.07 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 -0.81 0.00 0.01 2.41 2.07 0.07 -1.94 121.20 123.00 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 -0.03 0.00 0.13 0.00 0.00 42.46 41.56 2bds s ILE 38 CO 0.00 0.00 -0.06 0.00 -1.91 0.00 0.00 174.94 172.97 2bds s TYR 41 N -0.20 2.14 0.07 0.00 1.51 0.75 -1.55 117.35 120.08 2bds s TYR 41 Ca -0.02 -0.59 -0.31 0.00 -1.01 0.00 0.00 57.07 55.15 2bds s TYR 41 Cb -0.13 -2.22 -0.15 0.00 -0.11 0.00 0.00 41.96 39.35 2bds s TYR 41 CO 0.03 -0.63 1.48 -1.35 -1.11 0.00 0.00 175.55 173.97 2bds h PRO 42 N 0.57 -0.85 0.00 -1.71 0.11 -1.90 -3.32 132.00 124.89 2bds h PRO 42 Ca -0.36 0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2bds h PRO 42 Cb 1.28 0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.59 2bds h PRO 42 CO 0.47 -0.57 0.00 -2.39 -0.21 0.00 0.00 178.00 175.31