#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 -2.59 0.37 0.00 0.00 -1.21 -4.80 120.51 112.29 2bds n ALA 2 Ca 0.00 0.08 -0.06 0.00 0.00 0.00 0.00 53.44 53.46 2bds n ALA 2 Cb 0.00 -1.54 0.06 0.00 0.00 0.00 0.00 19.45 17.97 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 1.12 1.48 -3.03 0.00 -0.04 -1.26 -3.53 135.00 129.75 2bds n PRO 3 Ca 0.11 -0.88 -0.42 0.00 -0.04 0.00 0.00 63.50 62.28 2bds n PRO 3 Cb 0.42 -1.40 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 2bds n PRO 3 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bds n PHE 5 N 6.10 -3.96 -4.49 0.00 3.01 -1.26 0.32 117.46 117.17 2bds n PHE 5 Ca 0.01 -0.84 -0.22 0.00 1.01 0.00 0.00 57.45 57.42 2bds n PHE 5 Cb 0.48 -0.75 -0.04 0.00 -0.01 0.00 0.00 39.48 39.16 2bds n PHE 5 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2bds s SER 7 N -2.89 6.93 0.00 0.00 0.15 -1.26 -2.63 113.70 114.01 2bds s SER 7 Ca 0.00 1.12 0.00 0.00 0.70 0.00 0.00 55.95 57.77 2bds s SER 7 Cb -0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 2bds s SER 7 CO 0.00 -0.87 0.00 0.61 1.20 0.00 0.00 173.24 174.19 2bds n GLY 8 N 3.83 1.42 3.12 9.45 0.00 -1.26 -5.02 105.19 116.73 2bds n GLY 8 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 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 2.85 0.99 1.61 3.01 -1.08 -5.12 119.74 121.50 2bds s LYS 9 Ca 0.00 -0.93 -0.16 0.00 -1.01 0.00 0.00 55.97 53.87 2bds s LYS 9 Cb 0.00 -2.65 0.21 0.00 -1.01 0.00 0.00 37.83 34.38 2bds s LYS 9 CO 0.00 -0.28 1.32 -1.25 0.51 0.00 0.00 175.35 175.65 2bds s PRO 10 N 1.26 0.44 0.00 -1.68 0.04 -1.26 -2.58 135.00 131.21 2bds s PRO 10 Ca 0.02 -0.43 0.00 0.00 0.04 0.00 0.00 61.00 60.63 2bds s PRO 10 Cb -0.14 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2bds s PRO 10 CO -0.11 -2.55 0.00 0.41 0.04 0.00 0.00 177.00 174.79 2bds n GLY 11 N -3.64 0.93 3.83 0.56 0.00 -1.26 -4.83 105.19 100.77 2bds n GLY 11 Ca 0.16 -0.77 -0.07 0.00 0.00 0.00 0.00 46.02 45.33 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 1.99 0.17 1.61 1.70 -1.26 -4.62 118.95 118.53 2bds s ARG 12 Ca 0.00 -1.27 -0.24 0.00 -0.47 0.00 0.00 55.73 53.76 2bds s ARG 12 Cb 0.00 0.56 0.06 0.00 -0.57 0.00 0.00 34.95 35.00 2bds s ARG 12 CO 0.00 -0.93 0.76 0.20 -1.08 0.00 0.00 175.30 174.25 2bds s GLY 13 N -3.14 -0.34 -0.03 3.88 0.00 0.96 -4.47 107.32 104.18 2bds s GLY 13 Ca 0.17 0.24 -0.23 0.00 0.00 0.00 0.00 44.72 44.90 2bds s GLY 13 CO 0.10 0.07 0.67 0.99 0.00 0.00 0.00 173.10 174.93 2bds s ASP 14 N -2.80 7.01 -0.57 1.64 1.11 -0.09 -3.22 116.67 119.74 2bds s ASP 14 Ca 0.07 1.21 -0.18 0.00 0.18 0.00 0.00 52.55 53.83 2bds s ASP 14 Cb -0.03 -2.40 0.12 0.00 1.07 0.00 0.00 42.92 41.68 2bds s ASP 14 CO -0.03 -0.02 0.61 -0.22 1.18 0.00 0.00 175.17 176.69 2bds s LEU 15 N 0.35 5.76 0.39 1.23 2.96 -1.26 0.16 118.68 128.27 2bds s LEU 15 Ca 0.35 -1.60 -0.00 0.00 -0.22 0.00 0.00 54.13 52.66 2bds s LEU 15 Cb -0.18 -2.26 -0.03 0.00 0.50 0.00 0.00 46.19 44.22 2bds s LEU 15 CO 0.18 -1.00 0.61 0.26 -1.32 0.00 0.00 176.35 175.09 2bds s TRP 16 N 2.18 3.46 0.00 5.38 0.52 0.57 -4.85 118.94 126.20 2bds s TRP 16 Ca 0.08 0.40 0.00 0.00 0.02 0.00 0.00 56.10 56.59 2bds s TRP 16 Cb -0.27 -2.04 0.00 0.00 -1.15 0.00 0.00 33.47 30.01 2bds s TRP 16 CO 0.05 -0.04 0.00 -0.89 0.02 0.00 0.00 176.95 176.09 2bds n ILE 17 N -1.92 0.00 -1.19 2.03 -0.00 -1.26 -0.21 119.36 116.80 2bds n ILE 17 Ca -0.03 0.00 -0.41 0.00 -0.00 0.00 0.00 62.75 62.32 2bds n ILE 17 Cb 0.56 -1.78 -0.07 0.00 -0.00 0.00 0.00 39.64 38.36 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 3.35 -3.88 1.39 -0.00 0.12 -2.94 117.00 115.04 2bds n LEU 18 Ca 0.00 -2.69 -0.29 0.00 -0.00 0.00 0.00 56.01 53.02 2bds n LEU 18 Cb 0.00 -1.12 -0.13 0.00 -0.00 0.00 0.00 43.42 42.17 2bds n LEU 18 CO 0.00 -0.94 -0.15 -0.13 -0.00 0.00 0.00 177.39 176.17 2bds s ARG 19 N 5.65 1.99 0.06 1.47 0.52 -1.26 -4.92 118.95 122.45 2bds s ARG 19 Ca 0.62 -2.73 0.05 0.00 -0.52 0.00 0.00 55.73 53.14 2bds s ARG 19 Cb 0.12 -3.14 0.16 0.00 0.52 0.00 0.00 34.95 32.60 2bds s ARG 19 CO 0.16 -1.18 0.16 0.41 0.02 0.00 0.00 175.30 174.88 2bds n GLY 20 N 2.83 -0.10 3.25 -3.53 0.00 -1.26 -4.32 105.19 102.05 2bds n GLY 20 Ca 0.11 0.06 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.84 0.06 0.35 2.61 -4.23 -1.26 -5.11 115.64 105.23 2bds s THR 21 Ca -0.00 -0.52 -0.14 0.00 -1.18 0.00 0.00 61.69 59.85 2bds s THR 21 Cb 0.02 -0.72 -0.08 0.00 1.34 0.00 0.00 72.50 73.07 2bds s THR 21 CO 0.08 -0.28 0.75 0.00 -0.54 0.00 0.00 174.62 174.63 2bds n PRO 23 N -0.69 0.99 0.00 0.00 -0.01 -1.26 -4.81 135.00 129.22 2bds n PRO 23 Ca 0.03 0.37 0.06 0.00 -0.01 0.00 0.00 63.50 63.95 2bds n PRO 23 Cb 0.53 -1.97 0.36 0.00 -0.01 0.00 0.00 33.50 32.41 2bds n PRO 23 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 2bds n GLY 24 N 1.38 -0.58 0.00 -1.23 0.00 -1.26 -3.92 105.19 99.59 2bds n GLY 24 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 0.13 -0.20 0.85 -0.02 0.00 -1.26 -4.77 105.19 99.91 2bds n GLY 25 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.22 0.67 -0.08 1.61 4.02 -1.25 -4.84 117.16 117.07 2bds n TYR 26 Ca 0.00 -0.27 0.00 0.00 -0.01 0.00 0.00 57.90 57.62 2bds n TYR 26 Cb 0.36 -0.14 0.00 0.00 -0.02 0.00 0.00 39.34 39.55 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 0.65 1.45 3.69 2.72 0.00 -1.26 -5.02 105.19 107.41 2bds n GLY 27 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.61 2.15 0.00 1.61 2.02 -1.26 -4.80 117.35 114.45 2bds s TYR 28 Ca 0.00 1.04 0.00 0.00 -0.37 0.00 0.00 57.07 57.74 2bds s TYR 28 Cb 0.00 -3.25 0.00 0.00 -0.40 0.00 0.00 41.96 38.31 2bds s TYR 28 CO 0.00 -2.79 0.00 0.25 -1.57 0.00 0.00 175.55 171.44 2bds n THR 29 N -4.12 0.00 -3.55 -0.71 -2.24 -1.25 -4.96 114.28 97.46 2bds n THR 29 Ca 0.06 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.45 2bds n THR 29 Cb 0.57 0.00 -0.11 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 -1.67 6.07 0.03 3.42 1.04 -1.25 -4.99 113.70 116.35 2bds s SER 30 Ca 0.00 0.02 -0.06 0.00 0.48 0.00 0.00 55.95 56.39 2bds s SER 30 Cb 0.00 -2.14 -0.01 0.00 0.10 0.00 0.00 66.02 63.97 2bds s SER 30 CO 0.00 -0.09 0.11 0.54 0.98 0.00 0.00 173.24 174.78 2bds s ASN 31 N 1.73 0.12 0.08 7.02 2.20 -1.26 -0.66 114.94 124.18 2bds s ASN 31 Ca 0.09 -0.42 0.04 0.00 -0.94 0.00 0.00 52.86 51.63 2bds s ASN 31 Cb -0.16 0.22 -0.04 0.00 -2.00 0.00 0.00 41.25 39.27 2bds s ASN 31 CO 0.11 -0.46 -0.00 0.00 -2.94 0.00 0.00 177.10 173.81 2bds s TYR 33 N -1.27 1.73 -0.46 0.00 1.51 -1.26 -2.21 117.35 115.38 2bds s TYR 33 Ca 0.25 -0.53 0.06 0.00 -1.01 0.00 0.00 57.07 55.84 2bds s TYR 33 Cb -0.12 -1.18 0.20 0.00 -0.11 0.00 0.00 41.96 40.76 2bds s TYR 33 CO 0.17 -0.19 0.62 0.36 -1.11 0.00 0.00 175.55 175.40 2bds n LYS 34 N 3.25 0.51 -1.08 -0.62 0.00 -0.90 -4.98 118.16 114.34 2bds n LYS 34 Ca -0.19 -2.46 -0.37 0.00 -0.00 0.00 0.00 58.31 55.29 2bds n LYS 34 Cb 0.53 -1.49 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 2.43 -4.27 0.23 5.58 -0.00 -1.26 -2.25 117.44 117.91 2bds n TRP 35 Ca 0.20 0.14 0.00 0.00 -0.00 0.00 0.00 57.50 57.84 2bds n TRP 35 Cb 0.55 -1.54 0.00 0.00 -0.00 0.00 0.00 31.31 30.32 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 1.98 0.95 -1.91 5.87 -0.04 -1.26 -4.99 135.00 135.61 2bds n PRO 36 Ca 0.02 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.46 2bds n PRO 36 Cb 0.53 -1.02 -0.00 0.00 -0.04 0.00 0.00 33.50 32.96 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 1.03 -0.21 -3.67 3.54 3.02 -0.95 0.15 115.26 118.16 2bds n ASN 37 Ca 0.00 -1.28 -0.15 0.00 -0.03 0.00 0.00 54.58 53.12 2bds n ASN 37 Cb 0.48 0.38 -0.08 0.00 -0.61 0.00 0.00 39.78 39.95 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 -2.50 0.01 -0.33 2.41 2.07 0.70 -2.12 121.20 121.44 2bds s ILE 38 Ca 0.04 -0.12 -0.03 0.00 -1.41 0.00 0.00 60.65 59.14 2bds s ILE 38 Cb -0.00 -0.77 0.06 0.00 0.13 0.00 0.00 42.46 41.88 2bds s ILE 38 CO 0.03 -0.06 0.06 0.00 -1.91 0.00 0.00 174.94 173.06 2bds n TYR 41 N 3.62 -1.76 0.03 0.00 4.02 0.17 -0.92 117.16 122.32 2bds n TYR 41 Ca 0.01 -1.76 -0.12 0.00 -0.01 0.00 0.00 57.90 56.02 2bds n TYR 41 Cb 0.51 -0.41 -0.08 0.00 -0.02 0.00 0.00 39.34 39.34 2bds n TYR 41 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2bds h PRO 42 N 0.00 -0.02 0.00 -0.72 0.11 -1.83 -3.34 132.00 126.20 2bds h PRO 42 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2bds h PRO 42 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2bds h PRO 42 CO 0.36 0.14 0.00 -2.39 -0.21 0.00 0.00 178.00 175.90