#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 -1.60 -0.33 0.00 0.00 -1.26 -4.80 120.51 112.51 2bds n ALA 2 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2bds n ALA 2 Cb 0.00 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 17.63 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 0.95 -2.49 0.00 -0.04 -1.26 -3.77 135.00 129.35 2bds n PRO 3 Ca 0.14 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.18 2bds n PRO 3 Cb 0.27 -1.03 -0.02 0.00 -0.04 0.00 0.00 33.50 32.68 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 3.14 3.22 0.39 0.00 0.40 -1.26 0.33 117.98 124.20 2bds s PHE 5 Ca 0.53 1.14 0.03 0.00 -0.60 0.00 0.00 56.93 58.03 2bds s PHE 5 Cb -0.21 -3.02 -0.04 0.00 0.51 0.00 0.00 43.02 40.27 2bds s PHE 5 CO 0.14 -1.27 0.09 0.00 0.70 0.00 0.00 175.22 174.88 2bds s SER 7 N -3.60 6.86 0.00 0.00 0.01 -1.26 -2.66 113.70 113.04 2bds s SER 7 Ca 0.26 0.93 0.00 0.00 1.31 0.00 0.00 55.95 58.45 2bds s SER 7 Cb 0.05 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.77 2bds s SER 7 CO 0.13 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.58 2bds n GLY 8 N 3.97 2.13 2.85 3.44 0.00 -1.26 -5.00 105.19 111.31 2bds n GLY 8 Ca 0.10 0.00 -0.29 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 -0.74 1.19 0.60 1.61 1.02 -1.09 -5.13 119.74 117.21 2bds s LYS 9 Ca 0.00 -0.63 -0.10 0.00 0.02 0.00 0.00 55.97 55.26 2bds s LYS 9 Cb 0.00 -2.22 0.15 0.00 -0.52 0.00 0.00 37.83 35.24 2bds s LYS 9 CO 0.00 -0.56 0.65 -0.35 -0.92 0.00 0.00 175.35 174.17 2bds n PRO 10 N 4.88 -1.50 0.00 -1.68 -0.04 -1.26 -2.32 135.00 133.07 2bds n PRO 10 Ca -0.11 -1.02 0.00 0.00 -0.04 0.00 0.00 63.50 62.33 2bds n PRO 10 Cb 0.46 -0.82 0.00 0.00 -0.04 0.00 0.00 33.50 33.10 2bds n PRO 10 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2bds n GLY 11 N -0.66 1.25 3.66 0.55 0.00 -1.26 -4.79 105.19 103.94 2bds n GLY 11 Ca 0.09 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.39 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 1.54 0.03 1.61 1.70 -1.26 -4.51 118.95 118.06 2bds s ARG 12 Ca 0.00 -0.74 0.01 0.00 -0.47 0.00 0.00 55.73 54.53 2bds s ARG 12 Cb 0.00 0.59 -0.02 0.00 -0.57 0.00 0.00 34.95 34.95 2bds s ARG 12 CO 0.00 -0.69 -0.05 0.20 -1.08 0.00 0.00 175.30 173.67 2bds s GLY 13 N -2.84 0.36 -0.09 3.88 0.00 0.99 -4.76 107.32 104.87 2bds s GLY 13 Ca 0.06 -0.67 -0.30 0.00 0.00 0.00 0.00 44.72 43.82 2bds s GLY 13 CO -0.02 -0.73 1.13 0.99 0.00 0.00 0.00 173.10 174.47 2bds s ASP 14 N -1.51 7.11 -0.44 1.64 1.11 -0.62 -2.97 116.67 121.00 2bds s ASP 14 Ca -0.13 1.68 -0.26 0.00 0.18 0.00 0.00 52.55 54.03 2bds s ASP 14 Cb -0.10 -2.55 0.02 0.00 1.07 0.00 0.00 42.92 41.36 2bds s ASP 14 CO -0.00 -0.56 0.93 -0.22 1.18 0.00 0.00 175.17 176.50 2bds s LEU 15 N 2.32 3.99 0.45 1.23 2.96 -1.26 0.48 118.68 128.85 2bds s LEU 15 Ca 0.52 0.24 0.08 0.00 -0.22 0.00 0.00 54.13 54.76 2bds s LEU 15 Cb -0.22 -3.22 0.02 0.00 0.50 0.00 0.00 46.19 43.27 2bds s LEU 15 CO 0.19 -1.01 0.60 0.26 -1.32 0.00 0.00 176.35 175.06 2bds s TRP 16 N 3.71 2.52 0.00 5.38 0.52 0.51 -4.77 118.94 126.82 2bds s TRP 16 Ca 0.38 -0.47 0.00 0.00 0.02 0.00 0.00 56.10 56.02 2bds s TRP 16 Cb -0.10 -2.33 0.00 0.00 -1.15 0.00 0.00 33.47 29.89 2bds s TRP 16 CO 0.25 -0.54 0.00 -0.89 0.02 0.00 0.00 176.95 175.79 2bds n ILE 17 N -1.90 0.00 -1.08 2.03 5.41 -1.26 -1.81 119.36 120.75 2bds n ILE 17 Ca 0.09 0.00 -0.42 0.00 1.00 0.00 0.00 62.75 63.42 2bds n ILE 17 Cb 0.60 -0.78 -0.07 0.00 -0.71 0.00 0.00 39.64 38.67 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 3.29 -0.00 1.39 -0.00 -0.36 -3.17 117.00 118.15 2bds n LEU 18 Ca 0.00 -2.60 0.02 0.00 -0.00 0.00 0.00 56.01 53.43 2bds n LEU 18 Cb 0.00 -1.03 -0.03 0.00 -0.00 0.00 0.00 43.42 42.36 2bds n LEU 18 CO 0.00 -0.88 -0.17 0.54 -0.00 0.00 0.00 177.39 176.87 2bds n ARG 19 N 7.33 3.94 -0.30 1.47 1.74 -1.26 -4.96 116.66 124.61 2bds n ARG 19 Ca 0.49 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.55 2bds n ARG 19 Cb 0.41 -0.82 0.00 0.00 -1.02 0.00 0.00 32.46 31.03 2bds n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bds n GLY 20 N 1.45 0.00 3.29 -0.13 0.00 -1.26 -4.78 105.19 103.77 2bds n GLY 20 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.41 0.07 0.13 2.61 -4.23 -1.26 -5.11 115.64 107.43 2bds s THR 21 Ca 0.00 -0.55 0.09 0.00 -1.18 0.00 0.00 61.69 60.06 2bds s THR 21 Cb 0.00 -0.95 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 2bds s THR 21 CO 0.00 -0.30 -0.17 0.00 -0.54 0.00 0.00 174.62 173.61 2bds n PRO 23 N 0.60 1.34 -2.43 0.00 -0.01 -1.26 -4.85 135.00 128.39 2bds n PRO 23 Ca -0.14 0.27 -0.37 0.00 -0.01 0.00 0.00 63.50 63.24 2bds n PRO 23 Cb 0.53 -3.03 -0.04 0.00 -0.01 0.00 0.00 33.50 30.96 2bds n PRO 23 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 175.50 175.69 2bds s GLY 24 N 9.45 0.98 0.00 -1.23 0.00 -1.26 -2.92 107.32 112.33 2bds s GLY 24 Ca 1.04 -2.06 0.00 0.00 0.00 0.00 0.00 44.72 43.70 2bds s GLY 24 CO 0.36 2.90 0.00 0.61 0.00 0.00 0.00 173.10 176.97 2bds n GLY 25 N 6.88 0.24 0.17 0.20 0.00 -1.26 -4.98 105.19 106.43 2bds n GLY 25 Ca 0.35 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.49 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 0.00 0.00 1.61 -1.99 -1.94 -3.46 116.97 111.19 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 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2bds h TYR 26 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2bds n GLY 27 N 1.17 0.69 3.84 3.88 0.00 -1.26 -5.14 105.19 108.37 2bds n GLY 27 Ca 0.03 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 0.00 2.86 0.00 1.61 2.02 -1.26 -4.77 117.35 117.81 2bds s TYR 28 Ca 0.00 0.93 0.00 0.00 -0.37 0.00 0.00 57.07 57.63 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 -1.84 0.00 0.25 -1.57 0.00 0.00 175.55 172.39 2bds n THR 29 N -3.42 0.00 -3.59 -0.71 -2.24 -1.26 -4.57 114.28 98.49 2bds n THR 29 Ca 0.07 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.48 2bds n THR 29 Cb 0.59 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.72 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 -1.61 6.17 0.05 3.42 1.04 -1.25 -5.01 113.70 116.52 2bds s SER 30 Ca 0.00 0.19 -0.11 0.00 0.48 0.00 0.00 55.95 56.50 2bds s SER 30 Cb 0.00 -2.14 0.01 0.00 0.10 0.00 0.00 66.02 64.00 2bds s SER 30 CO 0.00 0.02 0.25 0.54 0.98 0.00 0.00 173.24 175.03 2bds s ASN 31 N 1.14 -0.03 0.07 7.02 2.20 -1.26 -0.62 114.94 123.46 2bds s ASN 31 Ca 0.10 -0.35 0.07 0.00 -0.94 0.00 0.00 52.86 51.74 2bds s ASN 31 Cb -0.14 0.34 -0.04 0.00 -2.00 0.00 0.00 41.25 39.41 2bds s ASN 31 CO 0.06 -0.63 -0.14 0.00 -2.94 0.00 0.00 177.10 173.45 2bds s TYR 33 N -1.06 1.54 -0.41 0.00 1.51 -1.26 -2.36 117.35 115.32 2bds s TYR 33 Ca 0.18 -0.54 0.05 0.00 -1.01 0.00 0.00 57.07 55.74 2bds s TYR 33 Cb -0.11 -1.10 0.19 0.00 -0.11 0.00 0.00 41.96 40.83 2bds s TYR 33 CO 0.09 -0.26 0.38 1.63 -1.11 0.00 0.00 175.55 176.29 2bds n LYS 34 N 3.65 0.31 -0.97 -0.62 4.01 -0.96 -4.98 118.16 118.60 2bds n LYS 34 Ca -0.22 -3.17 -0.35 0.00 -0.51 0.00 0.00 58.31 54.06 2bds n LYS 34 Cb 0.52 -1.56 0.07 0.00 -0.51 0.00 0.00 35.03 33.55 2bds n LYS 34 CO 0.00 0.00 0.00 0.91 -1.11 0.00 0.00 177.40 177.20 2bds n TRP 35 N 2.51 -3.56 0.20 2.13 7.02 -1.26 -2.24 117.44 122.24 2bds n TRP 35 Ca 0.28 0.11 0.00 0.00 -1.02 0.00 0.00 57.50 56.86 2bds n TRP 35 Cb 0.49 -1.59 0.00 0.00 -2.42 0.00 0.00 31.31 27.79 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 0.85 0.94 -1.04 -0.99 -0.04 -1.26 -4.99 135.00 128.47 2bds n PRO 36 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 2bds n PRO 36 Cb 0.54 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 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 1.05 0.00 -3.61 3.54 3.02 -0.95 -1.23 115.26 117.08 2bds n ASN 37 Ca 0.00 -0.65 -0.16 0.00 -0.03 0.00 0.00 54.58 53.74 2bds n ASN 37 Cb 0.47 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.57 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 -2.17 0.01 -0.06 2.41 2.07 -0.75 -2.26 121.20 120.45 2bds s ILE 38 Ca 0.00 -0.12 0.05 0.00 -1.41 0.00 0.00 60.65 59.17 2bds s ILE 38 Cb 0.00 -0.87 -0.02 0.00 0.13 0.00 0.00 42.46 41.71 2bds s ILE 38 CO 0.00 -0.07 -0.20 0.00 -1.91 0.00 0.00 174.94 172.76 2bds s TYR 41 N -0.88 1.82 0.09 0.00 1.51 0.21 -1.58 117.35 118.51 2bds s TYR 41 Ca 0.13 -0.75 -0.28 0.00 -1.01 0.00 0.00 57.07 55.16 2bds s TYR 41 Cb -0.11 -2.01 -0.15 0.00 -0.11 0.00 0.00 41.96 39.57 2bds s TYR 41 CO 0.02 -0.50 1.67 -1.35 -1.11 0.00 0.00 175.55 174.28 2bds h PRO 42 N 0.73 -0.49 0.00 -1.71 0.11 -1.85 -3.34 132.00 125.46 2bds h PRO 42 Ca -0.37 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2bds h PRO 42 Cb 1.29 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.51 2bds h PRO 42 CO 0.55 -0.33 0.00 -2.39 -0.21 0.00 0.00 178.00 175.62