#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bds s ALA 2 N 0.00 3.11 -0.10 0.00 0.00 -1.25 -4.86 121.76 118.66 2bds s ALA 2 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.42 2bds s ALA 2 Cb 0.00 -3.16 0.14 0.00 0.00 0.00 0.00 23.12 20.10 2bds s ALA 2 CO 0.00 0.14 1.21 -0.35 0.00 0.00 0.00 175.76 176.76 2bds n PRO 3 N -0.17 1.27 -2.23 0.00 -0.04 -1.26 -3.64 135.00 128.93 2bds n PRO 3 Ca 0.05 -0.64 -0.43 0.00 -0.04 0.00 0.00 63.50 62.44 2bds n PRO 3 Cb 0.52 -1.25 -0.02 0.00 -0.04 0.00 0.00 33.50 32.71 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 3.93 3.28 0.58 0.00 0.08 -1.26 0.32 117.98 124.91 2bds s PHE 5 Ca 0.64 1.33 0.09 0.00 0.12 0.00 0.00 56.93 59.11 2bds s PHE 5 Cb -0.26 -2.85 0.09 0.00 -0.57 0.00 0.00 43.02 39.42 2bds s PHE 5 CO 0.22 -1.08 0.75 0.00 -0.10 0.00 0.00 175.22 175.01 2bds s SER 7 N -4.63 7.01 0.00 0.00 1.04 -1.26 -2.64 113.70 113.22 2bds s SER 7 Ca 0.58 1.23 0.00 0.00 0.48 0.00 0.00 55.95 58.23 2bds s SER 7 Cb -0.05 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.55 2bds s SER 7 CO 0.36 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.49 2bds n GLY 8 N 3.55 1.74 2.90 7.32 0.00 -1.26 -5.00 105.19 114.44 2bds n GLY 8 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.49 1.47 0.00 1.61 1.02 -1.08 -5.12 119.74 117.15 2bds s LYS 9 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.16 2bds s LYS 9 Cb 0.00 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.88 2bds s LYS 9 CO 0.00 -0.57 0.00 -0.35 -0.92 0.00 0.00 175.35 173.51 2bds n PRO 10 N 4.76 0.00 0.00 -1.68 -0.05 -1.26 -1.78 135.00 134.99 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 0.45 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.90 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 3.31 1.45 3.44 0.55 0.00 -1.26 -4.70 105.19 107.98 2bds n GLY 11 Ca 0.00 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 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 1.24 -0.06 1.61 3.52 -1.26 -4.68 118.95 119.32 2bds s ARG 12 Ca 0.00 -0.47 -0.06 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 -0.54 0.16 0.20 -0.81 0.00 0.00 175.30 174.31 2bds s GLY 13 N -2.72 -0.12 0.02 8.12 0.00 0.95 -4.54 107.32 109.03 2bds s GLY 13 Ca 0.02 0.43 -0.30 0.00 0.00 0.00 0.00 44.72 44.87 2bds s GLY 13 CO -0.12 0.37 1.14 0.99 0.00 0.00 0.00 173.10 175.48 2bds s ASP 14 N 0.02 7.15 -0.12 1.64 1.11 -0.57 -2.27 116.67 123.64 2bds s ASP 14 Ca -0.01 1.88 -0.26 0.00 0.18 0.00 0.00 52.55 54.34 2bds s ASP 14 Cb -0.01 -2.57 -0.02 0.00 1.07 0.00 0.00 42.92 41.38 2bds s ASP 14 CO 0.00 -0.43 0.86 -0.22 1.18 0.00 0.00 175.17 176.56 2bds s LEU 15 N 1.24 4.23 0.27 1.23 2.96 -1.26 0.85 118.68 128.21 2bds s LEU 15 Ca 0.56 1.29 0.10 0.00 -0.22 0.00 0.00 54.13 55.87 2bds s LEU 15 Cb -0.26 -3.31 -0.05 0.00 0.50 0.00 0.00 46.19 43.07 2bds s LEU 15 CO 0.28 -0.35 -0.15 0.26 -1.32 0.00 0.00 176.35 175.06 2bds s TRP 16 N 1.79 2.15 0.00 5.38 0.52 0.47 -4.74 118.94 124.51 2bds s TRP 16 Ca 0.41 -0.45 0.00 0.00 0.02 0.00 0.00 56.10 56.08 2bds s TRP 16 Cb -0.17 -1.03 0.00 0.00 -1.15 0.00 0.00 33.47 31.12 2bds s TRP 16 CO 0.16 0.57 0.00 -0.89 0.02 0.00 0.00 176.95 176.81 2bds n ILE 17 N -0.59 0.00 -0.97 2.03 5.41 -1.26 -0.76 119.36 123.21 2bds n ILE 17 Ca -0.06 0.00 -0.41 0.00 1.00 0.00 0.00 62.75 63.28 2bds n ILE 17 Cb 0.61 -1.81 -0.06 0.00 -0.71 0.00 0.00 39.64 37.67 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 3.51 -4.47 1.39 -0.00 0.13 -2.47 117.00 115.08 2bds n LEU 18 Ca 0.00 -2.60 -0.41 0.00 -0.00 0.00 0.00 56.01 53.01 2bds n LEU 18 Cb 0.00 -0.99 -0.11 0.00 -0.00 0.00 0.00 43.42 42.33 2bds n LEU 18 CO 0.00 -0.60 -0.14 -0.13 -0.00 0.00 0.00 177.39 176.53 2bds s ARG 19 N 5.23 3.23 0.40 1.47 0.52 -1.26 -4.93 118.95 123.60 2bds s ARG 19 Ca 0.57 -0.82 0.16 0.00 -0.52 0.00 0.00 55.73 55.11 2bds s ARG 19 Cb 0.14 -3.78 1.04 0.00 0.52 0.00 0.00 34.95 32.87 2bds s ARG 19 CO 0.14 -0.55 1.83 0.78 0.02 0.00 0.00 175.30 177.52 2bds h GLY 20 N 8.48 1.07 -3.76 -3.53 0.00 -1.99 -3.42 103.07 99.92 2bds h GLY 20 Ca -0.30 -0.22 -0.12 0.00 0.00 0.00 0.00 47.33 46.69 2bds h GLY 20 CO 0.66 -0.03 -0.59 -0.51 0.00 0.00 0.00 176.54 176.07 2bds s THR 21 N -5.50 0.16 0.30 4.70 -4.23 -1.26 -5.08 115.64 104.73 2bds s THR 21 Ca -0.09 -1.35 -0.19 0.00 -1.18 0.00 0.00 61.69 58.88 2bds s THR 21 Cb 0.23 -1.10 -0.09 0.00 1.34 0.00 0.00 72.50 72.89 2bds s THR 21 CO 0.79 -0.74 0.79 0.00 -0.54 0.00 0.00 174.62 174.92 2bds n PRO 23 N 0.15 -3.46 -0.07 0.00 -0.04 -1.26 -4.98 135.00 125.33 2bds n PRO 23 Ca 0.02 -0.82 -0.10 0.00 -0.04 0.00 0.00 63.50 62.55 2bds n PRO 23 Cb 0.52 -1.10 -0.06 0.00 -0.04 0.00 0.00 33.50 32.82 2bds n PRO 23 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bds n GLY 24 N -3.19 -0.20 0.45 0.55 0.00 -1.26 -4.38 105.19 97.16 2bds n GLY 24 Ca 0.08 -0.09 0.26 0.00 0.00 0.00 0.00 46.02 46.27 2bds n GLY 24 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bds h GLY 25 N 0.88 0.00 -0.79 -0.02 0.00 -1.96 0.98 103.07 102.16 2bds h GLY 25 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2bds h GLY 25 CO -0.07 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.75 2bds n TYR 26 N -3.90 0.14 -0.60 5.60 4.02 -1.26 -4.84 117.16 116.32 2bds n TYR 26 Ca 0.15 -0.06 -0.01 0.00 -0.01 0.00 0.00 57.90 57.97 2bds n TYR 26 Cb 0.91 -0.08 -0.01 0.00 -0.02 0.00 0.00 39.34 40.15 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 0.31 0.14 3.58 2.72 0.00 0.34 -4.87 105.19 107.40 2bds n GLY 27 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.68 1.66 0.00 1.61 2.02 -1.26 -4.88 117.35 115.82 2bds s TYR 28 Ca 0.00 1.23 0.00 0.00 -0.37 0.00 0.00 57.07 57.93 2bds s TYR 28 Cb 0.00 -3.17 0.00 0.00 -0.40 0.00 0.00 41.96 38.39 2bds s TYR 28 CO 0.00 -3.36 0.00 0.25 -1.57 0.00 0.00 175.55 170.87 2bds n THR 29 N -4.56 0.00 -3.55 -0.71 -2.24 -1.25 -4.93 114.28 97.04 2bds n THR 29 Ca 0.05 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.46 2bds n THR 29 Cb 0.55 0.00 -0.08 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 -1.38 6.26 0.18 3.42 1.04 -1.24 -5.00 113.70 116.99 2bds s SER 30 Ca 0.00 0.30 -0.23 0.00 0.48 0.00 0.00 55.95 56.50 2bds s SER 30 Cb 0.00 -2.16 0.06 0.00 0.10 0.00 0.00 66.02 64.02 2bds s SER 30 CO 0.00 0.02 0.66 0.54 0.98 0.00 0.00 173.24 175.44 2bds s ASN 31 N 0.97 -0.47 -0.06 7.02 6.03 -1.26 0.75 114.94 127.92 2bds s ASN 31 Ca 0.12 -0.18 0.05 0.00 -1.03 0.00 0.00 52.86 51.82 2bds s ASN 31 Cb -0.14 0.62 -0.02 0.00 -3.03 0.00 0.00 41.25 38.69 2bds s ASN 31 CO 0.05 -1.05 -0.19 0.00 -2.03 0.00 0.00 177.10 173.88 2bds s TYR 33 N -0.40 2.94 -0.40 0.00 1.51 -1.26 -2.52 117.35 117.22 2bds s TYR 33 Ca 0.04 -0.97 0.07 0.00 -1.01 0.00 0.00 57.07 55.19 2bds s TYR 33 Cb -0.12 -2.08 0.22 0.00 -0.11 0.00 0.00 41.96 39.87 2bds s TYR 33 CO 0.02 -0.55 0.46 1.63 -1.11 0.00 0.00 175.55 176.00 2bds n LYS 34 N 4.73 0.54 -1.00 -0.62 5.02 -0.85 -5.03 118.16 120.96 2bds n LYS 34 Ca -0.18 -3.22 -0.35 0.00 -2.02 0.00 0.00 58.31 52.53 2bds n LYS 34 Cb 0.51 -1.39 0.07 0.00 -0.02 0.00 0.00 35.03 34.20 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 1.92 -2.80 0.90 2.13 7.02 -1.26 -2.26 117.44 123.09 2bds n TRP 35 Ca 0.24 0.18 -0.01 0.00 -1.02 0.00 0.00 57.50 56.90 2bds n TRP 35 Cb 0.51 -1.68 0.01 0.00 -2.42 0.00 0.00 31.31 27.74 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 0.28 1.11 -4.16 -0.99 -0.04 -1.26 -4.99 135.00 124.94 2bds n PRO 36 Ca 0.04 -0.15 -0.16 0.00 -0.04 0.00 0.00 63.50 63.19 2bds n PRO 36 Cb 0.53 -1.23 -0.06 0.00 -0.04 0.00 0.00 33.50 32.71 2bds n PRO 36 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2bds s ASN 37 N 0.56 1.16 -0.02 3.54 0.01 -0.96 0.18 114.94 119.40 2bds s ASN 37 Ca 0.03 -1.58 -0.12 0.00 -0.71 0.00 0.00 52.86 50.48 2bds s ASN 37 Cb 0.02 0.61 0.02 0.00 0.41 0.00 0.00 41.25 42.31 2bds s ASN 37 CO 0.01 -1.19 0.26 -0.51 -1.51 0.00 0.00 177.10 174.16 2bds s ILE 38 N -3.25 0.06 0.13 0.60 2.07 0.06 -2.00 121.20 118.86 2bds s ILE 38 Ca 0.35 -0.47 0.08 0.00 -1.41 0.00 0.00 60.65 59.20 2bds s ILE 38 Cb 0.01 -0.54 -0.04 0.00 0.13 0.00 0.00 42.46 42.02 2bds s ILE 38 CO 0.23 -0.26 -0.12 0.00 -1.91 0.00 0.00 174.94 172.88 2bds s TYR 41 N -0.26 1.86 0.08 0.00 1.51 0.23 -1.50 117.35 119.26 2bds s TYR 41 Ca 0.02 -0.69 -0.28 0.00 -1.01 0.00 0.00 57.07 55.11 2bds s TYR 41 Cb -0.11 -2.12 -0.12 0.00 -0.11 0.00 0.00 41.96 39.50 2bds s TYR 41 CO 0.01 -0.67 1.44 -1.35 -1.11 0.00 0.00 175.55 173.87 2bds h PRO 42 N 0.57 -0.66 0.00 -1.71 0.11 -1.90 -3.28 132.00 125.13 2bds h PRO 42 Ca -0.35 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2bds h PRO 42 Cb 1.29 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.55 2bds h PRO 42 CO 0.50 -0.44 0.00 -2.39 -0.21 0.00 0.00 178.00 175.46