#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 -2.97 0.10 0.00 0.00 -1.24 -4.82 120.51 111.58 2bds n ALA 2 Ca 0.00 0.18 -0.09 0.00 0.00 0.00 0.00 53.44 53.52 2bds n ALA 2 Cb 0.00 -1.49 0.07 0.00 0.00 0.00 0.00 19.45 18.03 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 1.27 1.49 -2.87 0.00 -0.04 -1.26 -3.92 135.00 129.66 2bds n PRO 3 Ca 0.12 -1.17 -0.41 0.00 -0.04 0.00 0.00 63.50 62.00 2bds n PRO 3 Cb 0.37 -1.46 -0.04 0.00 -0.04 0.00 0.00 33.50 32.33 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 2.12 3.56 0.47 0.00 0.40 -1.26 0.28 117.98 123.54 2bds s PHE 5 Ca 0.39 1.03 0.02 0.00 -0.60 0.00 0.00 56.93 57.78 2bds s PHE 5 Cb -0.17 -2.48 -0.01 0.00 0.51 0.00 0.00 43.02 40.87 2bds s PHE 5 CO 0.13 -0.37 0.07 0.00 0.70 0.00 0.00 175.22 175.74 2bds s SER 7 N -3.76 7.18 0.00 0.00 0.15 -1.26 -2.66 113.70 113.35 2bds s SER 7 Ca 0.13 1.75 0.00 0.00 0.70 0.00 0.00 55.95 58.52 2bds s SER 7 Cb 0.01 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2bds s SER 7 CO 0.08 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.68 2bds n GLY 8 N 3.16 2.53 2.89 9.45 0.00 -1.26 -4.98 105.19 116.98 2bds n GLY 8 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.31 1.40 0.00 1.61 3.01 -1.09 -5.12 119.74 119.23 2bds s LYS 9 Ca 0.00 -0.63 0.00 0.00 -1.01 0.00 0.00 55.97 54.33 2bds s LYS 9 Cb 0.00 -2.18 0.00 0.00 -1.01 0.00 0.00 37.83 34.64 2bds s LYS 9 CO 0.00 -0.50 0.00 -0.35 0.51 0.00 0.00 175.35 175.01 2bds n PRO 10 N 4.84 1.19 0.00 -1.68 -0.05 -1.26 -2.68 135.00 135.36 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 0.47 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.92 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 2.55 1.46 2.36 0.55 0.00 -1.26 -4.71 105.19 106.15 2bds n GLY 11 Ca 0.00 0.08 -0.06 0.00 0.00 0.00 0.00 46.02 46.04 2bds n GLY 11 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2bds n ARG 12 N 0.00 0.71 -4.11 1.61 1.85 -1.26 -4.39 116.66 111.07 2bds n ARG 12 Ca 0.00 -1.39 -0.08 0.00 -1.00 0.00 0.00 57.85 55.38 2bds n ARG 12 Cb 0.00 1.74 -0.10 0.00 -1.05 0.00 0.00 32.46 33.05 2bds n ARG 12 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 2bds s GLY 13 N -2.31 0.55 -0.02 2.89 0.00 0.78 -4.51 107.32 104.71 2bds s GLY 13 Ca 0.10 -1.25 -0.30 0.00 0.00 0.00 0.00 44.72 43.27 2bds s GLY 13 CO 0.07 -1.34 1.03 0.99 0.00 0.00 0.00 173.10 173.85 2bds s ASP 14 N -2.95 7.29 -0.55 1.64 1.11 0.39 -3.64 116.67 119.96 2bds s ASP 14 Ca 0.09 1.69 -0.20 0.00 0.18 0.00 0.00 52.55 54.31 2bds s ASP 14 Cb 0.08 -2.57 0.07 0.00 1.07 0.00 0.00 42.92 41.57 2bds s ASP 14 CO -0.08 -0.34 0.72 -0.22 1.18 0.00 0.00 175.17 176.42 2bds s LEU 15 N 1.28 4.91 -0.43 1.23 2.96 -1.26 0.96 118.68 128.32 2bds s LEU 15 Ca 0.52 -0.99 -0.20 0.00 -0.22 0.00 0.00 54.13 53.25 2bds s LEU 15 Cb -0.22 -2.45 0.02 0.00 0.50 0.00 0.00 46.19 44.04 2bds s LEU 15 CO 0.26 -1.05 0.59 0.26 -1.32 0.00 0.00 176.35 175.09 2bds s TRP 16 N 2.95 3.09 -0.97 5.38 0.52 0.32 -4.83 118.94 125.41 2bds s TRP 16 Ca 0.17 -0.13 0.28 0.00 0.02 0.00 0.00 56.10 56.43 2bds s TRP 16 Cb -0.19 -3.23 1.09 0.00 -1.15 0.00 0.00 33.47 29.99 2bds s TRP 16 CO 0.11 -0.83 1.84 -0.89 0.02 0.00 0.00 176.95 177.21 2bds n ILE 17 N 5.75 0.06 -2.93 2.03 5.41 -1.26 0.18 119.36 128.60 2bds n ILE 17 Ca -0.03 -0.03 -0.11 0.00 1.00 0.00 0.00 62.75 63.58 2bds n ILE 17 Cb 0.48 -0.41 -0.02 0.00 -0.71 0.00 0.00 39.64 38.98 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 -1.58 -2.53 -3.56 1.39 4.77 -1.21 -3.11 117.00 111.17 2bds n LEU 18 Ca 0.07 -3.39 -0.15 0.00 -0.03 0.00 0.00 56.01 52.51 2bds n LEU 18 Cb 0.35 0.71 -0.06 0.00 -2.33 0.00 0.00 43.42 42.09 2bds n LEU 18 CO 0.28 1.93 0.56 -0.13 -1.33 0.00 0.00 177.39 178.71 2bds s ARG 19 N 0.57 0.85 0.01 3.23 0.52 0.43 -4.97 118.95 119.58 2bds s ARG 19 Ca 0.31 0.33 0.22 0.00 -0.52 0.00 0.00 55.73 56.08 2bds s ARG 19 Cb 0.04 0.40 -0.24 0.00 0.52 0.00 0.00 34.95 35.68 2bds s ARG 19 CO -0.11 -0.24 0.67 0.41 0.02 0.00 0.00 175.30 176.05 2bds n GLY 20 N 1.16 -1.08 3.22 -3.53 0.00 -1.26 -4.59 105.19 99.10 2bds n GLY 20 Ca -0.15 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 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 -3.39 0.13 0.10 2.61 -4.23 -1.26 -5.12 115.64 104.48 2bds s THR 21 Ca -0.03 -1.36 0.03 0.00 -1.18 0.00 0.00 61.69 59.15 2bds s THR 21 Cb 0.14 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.41 2bds s THR 21 CO 0.88 -0.60 0.09 0.00 -0.54 0.00 0.00 174.62 174.45 2bds s PRO 23 N -2.53 0.07 -0.05 0.00 0.04 -1.26 -4.97 135.00 126.30 2bds s PRO 23 Ca 0.30 1.08 0.16 0.00 0.04 0.00 0.00 61.00 62.58 2bds s PRO 23 Cb -0.12 -1.65 -0.25 0.00 0.04 0.00 0.00 34.50 32.53 2bds s PRO 23 CO 0.22 -3.13 0.30 0.41 0.04 0.00 0.00 177.00 174.84 2bds n GLY 24 N 0.30 -0.77 0.07 0.56 0.00 -1.26 -4.28 105.19 99.81 2bds n GLY 24 Ca 0.07 -0.37 0.12 0.00 0.00 0.00 0.00 46.02 45.83 2bds n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bds n GLY 25 N 1.66 -1.39 0.07 -0.02 0.00 -1.26 -2.34 105.19 101.91 2bds n GLY 25 Ca -0.08 -0.01 0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.94 0.65 0.00 1.61 4.02 -1.26 -4.90 117.16 115.34 2bds n TYR 26 Ca 0.04 0.19 0.00 0.00 -0.01 0.00 0.00 57.90 58.12 2bds n TYR 26 Cb 0.30 -0.80 0.00 0.00 -0.02 0.00 0.00 39.34 38.82 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 1.37 0.58 3.81 2.72 0.00 -0.99 -5.07 105.19 107.61 2bds n GLY 27 Ca 0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 2.70 0.00 1.61 2.02 -1.26 -4.73 117.35 115.69 2bds s TYR 28 Ca 0.00 0.95 0.00 0.00 -0.37 0.00 0.00 57.07 57.65 2bds s TYR 28 Cb 0.00 -3.30 0.00 0.00 -0.40 0.00 0.00 41.96 38.26 2bds s TYR 28 CO 0.00 -2.05 0.00 0.25 -1.57 0.00 0.00 175.55 172.18 2bds n THR 29 N -3.57 0.00 -3.46 -0.71 -2.24 -1.23 -4.85 114.28 98.21 2bds n THR 29 Ca 0.07 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.43 2bds n THR 29 Cb 0.58 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.71 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 -1.51 6.12 0.03 3.42 1.04 -1.23 -5.03 113.70 116.55 2bds s SER 30 Ca 0.00 -0.52 0.01 0.00 0.48 0.00 0.00 55.95 55.92 2bds s SER 30 Cb 0.00 -2.17 -0.02 0.00 0.10 0.00 0.00 66.02 63.93 2bds s SER 30 CO 0.00 -0.35 -0.05 0.54 0.98 0.00 0.00 173.24 174.36 2bds s ASN 31 N 1.72 0.56 0.10 7.02 2.20 -1.26 -0.96 114.94 124.34 2bds s ASN 31 Ca 0.08 -0.56 0.04 0.00 -0.94 0.00 0.00 52.86 51.48 2bds s ASN 31 Cb -0.18 0.07 -0.04 0.00 -2.00 0.00 0.00 41.25 39.11 2bds s ASN 31 CO 0.11 -0.27 0.08 0.00 -2.94 0.00 0.00 177.10 174.08 2bds s TYR 33 N -1.47 1.33 -0.48 0.00 1.51 -1.26 -2.04 117.35 114.95 2bds s TYR 33 Ca 0.29 -0.35 0.06 0.00 -1.01 0.00 0.00 57.07 56.06 2bds s TYR 33 Cb -0.12 -0.80 0.20 0.00 -0.11 0.00 0.00 41.96 41.13 2bds s TYR 33 CO 0.22 0.04 0.63 0.36 -1.11 0.00 0.00 175.55 175.69 2bds n LYS 34 N 1.93 0.48 -1.22 -0.62 0.00 -1.08 -4.91 118.16 112.74 2bds n LYS 34 Ca -0.18 -2.39 -0.38 0.00 -0.00 0.00 0.00 58.31 55.37 2bds n LYS 34 Cb 0.54 -1.51 0.03 0.00 -0.00 0.00 0.00 35.03 34.10 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 2.64 -2.60 1.24 5.58 -0.00 -1.26 -1.39 117.44 121.65 2bds n TRP 35 Ca 0.20 0.33 0.11 0.00 -0.00 0.00 0.00 57.50 58.14 2bds n TRP 35 Cb 0.55 -1.72 0.60 0.00 -0.00 0.00 0.00 31.31 30.74 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 0.97 0.56 -0.43 5.87 -0.04 -1.26 -4.96 135.00 135.69 2bds n PRO 36 Ca 0.07 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2bds n PRO 36 Cb 0.50 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 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 -1.09 0.00 -3.64 3.54 5.03 -0.48 -0.43 115.26 118.19 2bds n ASN 37 Ca 0.14 -0.61 -0.06 0.00 0.87 0.00 0.00 54.58 54.91 2bds n ASN 37 Cb 0.10 0.00 -0.07 0.00 -1.02 0.00 0.00 39.78 38.79 2bds n ASN 37 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 2bds s ILE 38 N 0.80 0.00 -0.41 2.41 2.07 0.48 -2.62 121.20 123.94 2bds s ILE 38 Ca 0.00 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.18 2bds s ILE 38 Cb 0.00 -1.00 0.09 0.00 0.13 0.00 0.00 42.46 41.68 2bds s ILE 38 CO 0.00 0.00 0.23 0.00 -1.91 0.00 0.00 174.94 173.26 2bds s TYR 41 N -1.46 2.52 0.66 0.00 1.51 -0.13 -0.46 117.35 119.99 2bds s TYR 41 Ca 0.48 -0.47 -0.11 0.00 -1.01 0.00 0.00 57.07 55.96 2bds s TYR 41 Cb -0.22 -1.51 -0.01 0.00 -0.11 0.00 0.00 41.96 40.10 2bds s TYR 41 CO 0.28 0.48 1.05 -1.25 -1.11 0.00 0.00 175.55 174.99 2bds s PRO 42 N -3.71 3.23 0.00 -1.71 0.04 -1.20 -3.52 135.00 128.13 2bds s PRO 42 Ca 0.35 0.85 0.06 0.00 0.04 0.00 0.00 61.00 62.30 2bds s PRO 42 Cb 0.01 -2.03 0.04 0.00 0.04 0.00 0.00 34.50 32.57 2bds s PRO 42 CO 0.19 -0.86 0.68 -2.39 0.04 0.00 0.00 177.00 174.65