#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 -2.30 -0.45 0.00 0.00 -1.25 -4.79 120.51 111.70 2bds n ALA 2 Ca 0.00 0.25 -0.06 0.00 0.00 0.00 0.00 53.44 53.64 2bds n ALA 2 Cb 0.00 -1.65 0.02 0.00 0.00 0.00 0.00 19.45 17.82 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 0.97 1.27 -2.89 0.00 -0.04 -1.26 -3.77 135.00 129.29 2bds n PRO 3 Ca 0.13 -0.54 -0.41 0.00 -0.04 0.00 0.00 63.50 62.64 2bds n PRO 3 Cb 0.34 -1.21 -0.04 0.00 -0.04 0.00 0.00 33.50 32.55 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 1.48 3.48 0.16 0.00 0.08 -1.26 0.33 117.98 122.26 2bds s PHE 5 Ca 0.42 1.33 0.02 0.00 0.12 0.00 0.00 56.93 58.81 2bds s PHE 5 Cb -0.18 -2.77 0.02 0.00 -0.57 0.00 0.00 43.02 39.52 2bds s PHE 5 CO 0.18 -0.84 0.14 0.00 -0.10 0.00 0.00 175.22 174.60 2bds n SER 7 N -2.10 3.26 -0.05 0.00 7.64 -1.26 -2.59 113.62 118.52 2bds n SER 7 Ca 0.00 1.22 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2bds n SER 7 Cb 0.18 -1.55 0.00 0.00 -1.01 0.00 0.00 64.21 61.83 2bds n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bds n GLY 8 N 0.61 0.00 3.17 0.23 0.00 -1.26 -4.81 105.19 103.13 2bds n GLY 8 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.10 2.23 0.00 1.61 1.02 -1.07 -5.09 119.74 118.34 2bds s LYS 9 Ca 0.00 -1.68 0.00 0.00 0.02 0.00 0.00 55.97 54.31 2bds s LYS 9 Cb 0.00 -3.62 0.00 0.00 -0.52 0.00 0.00 37.83 33.69 2bds s LYS 9 CO 0.00 -1.02 0.00 -0.35 -0.92 0.00 0.00 175.35 173.06 2bds n PRO 10 N 4.70 0.03 0.00 -1.68 -0.05 -1.26 -2.48 135.00 134.26 2bds n PRO 10 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.39 2bds n PRO 10 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.87 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 1.76 1.90 3.68 0.55 0.00 -1.26 -4.73 105.19 107.09 2bds n GLY 11 Ca 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 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 1.50 0.03 1.61 1.70 -1.26 -4.60 118.95 117.93 2bds s ARG 12 Ca 0.00 -0.74 -0.05 0.00 -0.47 0.00 0.00 55.73 54.47 2bds s ARG 12 Cb 0.00 0.57 -0.01 0.00 -0.57 0.00 0.00 34.95 34.93 2bds s ARG 12 CO 0.00 -0.68 0.07 0.20 -1.08 0.00 0.00 175.30 173.82 2bds s GLY 13 N -2.84 0.20 -0.07 3.88 0.00 1.00 -4.62 107.32 104.86 2bds s GLY 13 Ca 0.08 -0.58 -0.30 0.00 0.00 0.00 0.00 44.72 43.92 2bds s GLY 13 CO -0.01 -0.70 1.02 0.99 0.00 0.00 0.00 173.10 174.40 2bds s ASP 14 N -2.04 7.26 -0.49 1.64 1.11 -0.76 -2.97 116.67 120.42 2bds s ASP 14 Ca -0.06 1.60 -0.23 0.00 0.18 0.00 0.00 52.55 54.03 2bds s ASP 14 Cb -0.02 -2.56 0.03 0.00 1.07 0.00 0.00 42.92 41.44 2bds s ASP 14 CO -0.04 -0.41 0.83 -0.22 1.18 0.00 0.00 175.17 176.51 2bds s LEU 15 N 1.76 4.24 0.28 1.23 2.96 -1.26 0.70 118.68 128.58 2bds s LEU 15 Ca 0.50 -0.22 0.05 0.00 -0.22 0.00 0.00 54.13 54.24 2bds s LEU 15 Cb -0.20 -2.91 -0.02 0.00 0.50 0.00 0.00 46.19 43.56 2bds s LEU 15 CO 0.21 -1.02 0.41 0.26 -1.32 0.00 0.00 176.35 174.89 2bds s TRP 16 N 3.49 3.34 0.00 5.38 0.52 0.70 -4.77 118.94 127.59 2bds s TRP 16 Ca 0.30 -0.06 0.00 0.00 0.02 0.00 0.00 56.10 56.35 2bds s TRP 16 Cb -0.13 -1.73 0.00 0.00 -1.15 0.00 0.00 33.47 30.46 2bds s TRP 16 CO 0.21 0.27 0.00 -0.89 0.02 0.00 0.00 176.95 176.56 2bds n ILE 17 N -1.51 0.00 -0.80 2.03 2.08 -1.26 -0.42 119.36 119.48 2bds n ILE 17 Ca -0.06 0.00 -0.33 0.00 0.56 0.00 0.00 62.75 62.93 2bds n ILE 17 Cb 0.57 -1.39 -0.05 0.00 -0.75 0.00 0.00 39.64 38.02 2bds n ILE 17 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2bds n LEU 18 N 0.00 3.40 -4.27 1.39 4.32 -0.49 -2.49 117.00 118.87 2bds n LEU 18 Ca 0.00 -2.47 -0.40 0.00 -0.02 0.00 0.00 56.01 53.13 2bds n LEU 18 Cb 0.00 -0.95 -0.11 0.00 -1.62 0.00 0.00 43.42 40.75 2bds n LEU 18 CO 0.00 -0.43 -0.14 -0.13 -1.22 0.00 0.00 177.39 175.47 2bds s ARG 19 N 4.84 2.59 0.44 3.23 0.52 -1.26 -4.94 118.95 124.37 2bds s ARG 19 Ca 0.47 -1.41 0.28 0.00 -0.52 0.00 0.00 55.73 54.56 2bds s ARG 19 Cb 0.12 -3.72 1.36 0.00 0.52 0.00 0.00 34.95 33.23 2bds s ARG 19 CO 0.10 -0.89 1.68 0.78 0.02 0.00 0.00 175.30 176.98 2bds h GLY 20 N 8.36 1.08 -3.01 -3.53 0.00 -1.97 -3.41 103.07 100.59 2bds h GLY 20 Ca -0.23 -0.12 -0.15 0.00 0.00 0.00 0.00 47.33 46.84 2bds h GLY 20 CO 0.72 -0.26 -0.60 -0.51 0.00 0.00 0.00 176.54 175.89 2bds s THR 21 N -5.30 0.14 0.45 4.70 -4.23 -1.26 -5.12 115.64 105.03 2bds s THR 21 Ca -0.08 -1.76 -0.08 0.00 -1.18 0.00 0.00 61.69 58.59 2bds s THR 21 Cb 0.28 -1.80 -0.05 0.00 1.34 0.00 0.00 72.50 72.27 2bds s THR 21 CO 0.82 -0.63 0.79 0.00 -0.54 0.00 0.00 174.62 175.06 2bds n PRO 23 N -1.80 1.67 -0.96 0.00 -0.02 -1.26 -4.93 135.00 127.70 2bds n PRO 23 Ca 0.02 0.61 -0.30 0.00 -2.02 0.00 0.00 63.50 61.81 2bds n PRO 23 Cb 0.54 -2.40 0.24 0.00 -0.02 0.00 0.00 33.50 31.86 2bds n PRO 23 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2bds s GLY 24 N 4.08 1.55 0.00 -1.23 0.00 -1.26 -3.57 107.32 106.89 2bds s GLY 24 Ca 0.96 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 44.84 2bds s GLY 24 CO 0.58 0.03 0.00 0.61 0.00 0.00 0.00 173.10 174.32 2bds n GLY 25 N -0.54 0.17 0.00 0.20 0.00 -1.26 -4.95 105.19 98.81 2bds n GLY 25 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -2.23 -2.65 1.44 1.61 4.02 -1.23 -5.00 117.16 113.11 2bds n TYR 26 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 57.90 58.03 2bds n TYR 26 Cb 0.29 0.00 0.47 0.00 -0.02 0.00 0.00 39.34 40.08 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 5.00 0.12 3.82 2.72 0.00 -1.26 -4.92 105.19 110.67 2bds n GLY 27 Ca 0.00 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.00 2.59 0.00 1.61 2.02 -1.26 -4.75 117.35 115.56 2bds s TYR 28 Ca 0.37 0.80 0.00 0.00 -0.37 0.00 0.00 57.07 57.87 2bds s TYR 28 Cb 0.21 -3.44 0.00 0.00 -0.40 0.00 0.00 41.96 38.32 2bds s TYR 28 CO 0.33 -2.22 0.00 0.25 -1.57 0.00 0.00 175.55 172.34 2bds n THR 29 N -3.65 0.00 -3.65 -0.71 -2.24 -1.22 -4.96 114.28 97.86 2bds n THR 29 Ca 0.07 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.49 2bds n THR 29 Cb 0.60 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.47 6.23 -0.10 3.42 1.04 -1.22 -4.97 113.70 116.63 2bds s SER 30 Ca 0.00 0.26 -0.13 0.00 0.48 0.00 0.00 55.95 56.56 2bds s SER 30 Cb 0.00 -2.12 0.03 0.00 0.10 0.00 0.00 66.02 64.03 2bds s SER 30 CO 0.00 0.11 0.33 0.54 0.98 0.00 0.00 173.24 175.20 2bds s ASN 31 N 0.65 -0.31 -0.14 7.02 2.20 -1.26 0.46 114.94 123.56 2bds s ASN 31 Ca 0.10 0.52 -0.08 0.00 -0.94 0.00 0.00 52.86 52.46 2bds s ASN 31 Cb -0.12 0.59 -0.04 0.00 -2.00 0.00 0.00 41.25 39.68 2bds s ASN 31 CO 0.02 -0.21 0.15 0.00 -2.94 0.00 0.00 177.10 174.12 2bds s TYR 33 N -0.63 2.88 -0.41 0.00 1.51 -1.26 -2.18 117.35 117.26 2bds s TYR 33 Ca 0.14 -1.15 0.05 0.00 -1.01 0.00 0.00 57.07 55.10 2bds s TYR 33 Cb -0.12 -2.01 0.19 0.00 -0.11 0.00 0.00 41.96 39.91 2bds s TYR 33 CO 0.03 -0.60 0.40 1.63 -1.11 0.00 0.00 175.55 175.89 2bds n LYS 34 N 4.60 0.33 -1.00 -0.62 4.76 -0.96 -5.01 118.16 120.26 2bds n LYS 34 Ca -0.19 -3.16 -0.35 0.00 -2.87 0.00 0.00 58.31 51.74 2bds n LYS 34 Cb 0.51 -1.54 0.03 0.00 -1.84 0.00 0.00 35.03 32.19 2bds n LYS 34 CO 0.00 0.00 0.00 1.87 -1.37 0.00 0.00 177.40 177.90 2bds n TRP 35 N 2.45 -4.77 0.92 2.13 -0.00 -1.26 -2.26 117.44 114.65 2bds n TRP 35 Ca 0.27 0.03 0.00 0.00 -0.00 0.00 0.00 57.50 57.80 2bds n TRP 35 Cb 0.50 -1.42 0.00 0.00 -0.00 0.00 0.00 31.31 30.38 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 2.29 0.93 -2.02 5.87 -0.05 -1.26 -4.98 135.00 135.78 2bds n PRO 36 Ca -0.01 0.00 -0.02 0.00 -0.05 0.00 0.00 63.50 63.42 2bds n PRO 36 Cb 0.53 -1.04 -0.01 0.00 -0.05 0.00 0.00 33.50 32.94 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 0.54 -0.15 -3.71 3.54 3.02 -0.96 -1.40 115.26 116.15 2bds n ASN 37 Ca 0.00 -1.26 -0.14 0.00 -0.03 0.00 0.00 54.58 53.15 2bds n ASN 37 Cb 0.46 0.30 -0.09 0.00 -0.61 0.00 0.00 39.78 39.85 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 -2.39 0.01 -0.24 2.41 2.07 0.44 -2.26 121.20 121.24 2bds s ILE 38 Ca 0.04 -0.05 -0.03 0.00 -1.41 0.00 0.00 60.65 59.19 2bds s ILE 38 Cb -0.00 -0.68 0.01 0.00 0.13 0.00 0.00 42.46 41.92 2bds s ILE 38 CO 0.03 -0.03 -0.03 0.00 -1.91 0.00 0.00 174.94 173.00 2bds s TYR 41 N -1.91 2.09 0.42 0.00 1.51 0.17 -1.83 117.35 117.80 2bds s TYR 41 Ca 0.52 -0.90 -0.10 0.00 -1.01 0.00 0.00 57.07 55.58 2bds s TYR 41 Cb -0.11 -1.58 -0.06 0.00 -0.11 0.00 0.00 41.96 40.10 2bds s TYR 41 CO 0.18 0.22 0.78 -1.25 -1.11 0.00 0.00 175.55 174.36 2bds s PRO 42 N -3.80 3.76 0.00 -1.71 0.04 -1.18 -3.37 135.00 128.74 2bds s PRO 42 Ca 0.21 0.45 0.08 0.00 0.04 0.00 0.00 61.00 61.79 2bds s PRO 42 Cb 0.05 -2.38 0.07 0.00 0.04 0.00 0.00 34.50 32.28 2bds s PRO 42 CO 0.11 -0.06 0.76 -2.39 0.04 0.00 0.00 177.00 175.46