#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wb1 n GLY 7 N 0.00 2.94 3.54 0.00 0.00 -1.23 -4.70 105.19 105.74 2wb1 n GLY 7 Ca 0.00 -0.35 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 2wb1 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wb1 s LYS 8 N -1.65 2.01 0.05 1.61 1.02 -0.66 -2.84 119.74 119.29 2wb1 s LYS 8 Ca 0.00 -2.25 -0.03 0.00 0.02 0.00 0.00 55.97 53.71 2wb1 s LYS 8 Cb 0.00 -0.61 -0.03 0.00 -0.52 0.00 0.00 37.83 36.67 2wb1 s LYS 8 CO 0.00 -0.53 0.03 0.00 -0.92 0.00 0.00 175.35 173.93 2wb1 s TRP 10 N -3.58 3.02 0.00 0.00 -0.00 -1.26 -3.62 118.94 113.50 2wb1 s TRP 10 Ca 0.04 0.59 0.00 0.00 -0.00 0.00 0.00 56.10 56.72 2wb1 s TRP 10 Cb 0.05 -3.97 0.00 0.00 -0.00 0.00 0.00 33.47 29.55 2wb1 s TRP 10 CO -0.09 -3.59 0.00 1.63 -0.00 0.00 0.00 176.95 174.90 2wb1 n LYS 11 N 3.85 0.00 -3.34 5.86 4.76 -1.26 -4.75 118.16 123.29 2wb1 n LYS 11 Ca 0.14 0.00 -0.46 0.00 -2.87 0.00 0.00 58.31 55.11 2wb1 n LYS 11 Cb 0.38 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.55 2wb1 n LYS 11 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2wb1 s THR 12 N 0.00 5.71 -0.97 -0.18 -4.23 -1.25 -4.97 115.64 109.75 2wb1 s THR 12 Ca 0.00 -2.74 -0.20 0.00 -1.18 0.00 0.00 61.69 57.57 2wb1 s THR 12 Cb 0.00 -4.50 -0.10 0.00 1.34 0.00 0.00 72.50 69.24 2wb1 s THR 12 CO 0.00 -1.07 1.99 0.49 -0.54 0.00 0.00 174.62 175.49 2wb1 n PHE 13 N 3.61 2.39 -3.74 3.99 3.01 -1.24 -3.63 117.46 121.85 2wb1 n PHE 13 Ca 0.17 -2.09 -0.36 0.00 1.01 0.00 0.00 57.45 56.17 2wb1 n PHE 13 Cb 0.45 -1.98 -0.10 0.00 -0.01 0.00 0.00 39.48 37.83 2wb1 n PHE 13 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2wb1 s THR 14 N 4.89 5.07 0.18 4.37 2.01 -1.26 -4.86 115.64 126.04 2wb1 s THR 14 Ca 0.55 0.08 -0.31 0.00 0.31 0.00 0.00 61.69 62.33 2wb1 s THR 14 Cb 0.13 -3.36 -0.09 0.00 0.01 0.00 0.00 72.50 69.20 2wb1 s THR 14 CO 0.07 0.36 1.38 -1.81 -0.69 0.00 0.00 174.62 173.92 2wb1 s ASP 15 N 1.08 6.80 -0.04 3.53 -0.00 -1.26 -4.26 116.67 122.53 2wb1 s ASP 15 Ca 0.06 2.44 -0.02 0.00 -0.00 0.00 0.00 52.55 55.04 2wb1 s ASP 15 Cb -0.14 -2.60 0.03 0.00 -0.00 0.00 0.00 42.92 40.21 2wb1 s ASP 15 CO 0.04 -0.62 0.08 -1.83 -0.00 0.00 0.00 175.17 172.85 2wb1 s GLU 16 N 0.30 0.00 0.91 8.23 -1.05 -1.13 -5.00 118.70 120.97 2wb1 s GLU 16 Ca 0.61 0.31 -0.10 0.00 -0.15 0.00 0.00 54.97 55.64 2wb1 s GLU 16 Cb -0.38 -0.26 0.14 0.00 -0.44 0.00 0.00 34.13 33.18 2wb1 s GLU 16 CO 0.36 -0.20 1.14 -1.14 0.95 0.00 0.00 175.26 176.37 2wb1 s GLN 17 N 1.38 1.09 0.00 -4.83 2.00 -1.26 -3.50 119.66 114.54 2wb1 s GLN 17 Ca -0.06 1.49 0.00 0.00 -2.00 0.00 0.00 55.36 54.79 2wb1 s GLN 17 Cb -0.12 -1.74 0.00 0.00 0.80 0.00 0.00 33.01 31.95 2wb1 s GLN 17 CO -0.04 -2.56 0.23 1.28 -0.50 0.00 0.00 175.29 173.69 2wb1 n LEU 18 N -4.18 0.00 -4.47 3.68 4.77 -1.26 -4.36 117.00 111.17 2wb1 n LEU 18 Ca 0.11 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.66 2wb1 n LEU 18 Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2wb1 n LEU 18 CO 0.50 0.00 1.00 -0.54 -1.33 0.00 0.00 177.39 177.02 2wb1 s LYS 19 N -1.55 3.42 -0.05 3.23 -0.14 -1.26 -4.97 119.74 118.42 2wb1 s LYS 19 Ca 0.00 -1.30 0.03 0.00 -1.36 0.00 0.00 55.97 53.34 2wb1 s LYS 19 Cb 0.00 -4.74 0.01 0.00 -1.68 0.00 0.00 37.83 31.42 2wb1 s LYS 19 CO 0.00 -1.88 -0.14 0.14 -0.76 0.00 0.00 175.35 172.72 2wb1 s VAL 20 N 3.63 1.22 -0.28 3.17 -7.23 -1.26 -5.03 120.40 114.62 2wb1 s VAL 20 Ca 0.32 -0.56 -0.16 0.00 -1.81 0.00 0.00 61.98 59.76 2wb1 s VAL 20 Cb -0.08 -1.08 0.09 0.00 0.56 0.00 0.00 36.38 35.87 2wb1 s VAL 20 CO -0.02 0.37 0.72 -0.22 -0.31 0.00 0.00 175.10 175.64 2wb1 s LEU 21 N 0.38 -0.91 0.00 1.32 1.98 -1.26 -4.83 118.68 115.36 2wb1 s LEU 21 Ca -0.10 1.44 0.22 0.00 -2.89 0.00 0.00 54.13 52.80 2wb1 s LEU 21 Cb -0.13 2.31 -0.15 0.00 0.66 0.00 0.00 46.19 48.88 2wb1 s LEU 21 CO 0.03 -0.23 0.89 -0.81 -1.89 0.00 0.00 176.35 174.34 2wb1 n PRO 22 N 4.29 0.15 0.00 0.98 -0.04 -1.26 -5.07 135.00 134.06 2wb1 n PRO 22 Ca -0.20 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.23 2wb1 n PRO 22 Cb 0.58 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 2wb1 n PRO 22 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wb1 n GLY 23 N 1.44 5.75 2.84 0.55 0.00 -1.26 -5.08 105.19 109.42 2wb1 n GLY 23 Ca 0.02 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.80 2wb1 n GLY 23 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wb1 n VAL 24 N 0.00 3.38 -4.33 1.61 3.14 -1.26 -4.94 118.33 115.92 2wb1 n VAL 24 Ca 0.00 -5.37 -0.21 0.00 -2.96 0.00 0.00 64.34 55.80 2wb1 n VAL 24 Cb 0.00 -2.20 -0.08 0.00 -1.06 0.00 0.00 33.84 30.50 2wb1 n VAL 24 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 2wb1 s ARG 25 N -2.15 1.80 -0.24 1.45 0.52 -1.26 -4.80 118.95 114.27 2wb1 s ARG 25 Ca 0.33 -2.06 -0.12 0.00 -0.52 0.00 0.00 55.73 53.36 2wb1 s ARG 25 Cb 0.04 0.14 -0.05 0.00 0.52 0.00 0.00 34.95 35.60 2wb1 s ARG 25 CO -0.03 -0.62 0.21 0.00 0.02 0.00 0.00 175.30 174.88 2wb1 s PRO 27 N 1.19 4.15 -0.80 0.00 0.02 -1.26 -2.84 135.00 135.46 2wb1 s PRO 27 Ca 0.10 2.54 -0.02 0.00 0.02 0.00 0.00 61.00 63.64 2wb1 s PRO 27 Cb -0.14 -3.95 -0.01 0.00 0.02 0.00 0.00 34.50 30.43 2wb1 s PRO 27 CO 0.06 -0.89 0.71 0.98 -0.33 0.00 0.00 177.00 177.52 2wb1 n TYR 28 N 6.84 -2.74 0.14 6.54 9.36 -1.26 -4.94 117.16 131.10 2wb1 n TYR 28 Ca 0.19 1.03 0.00 0.00 3.32 0.00 0.00 57.90 62.44 2wb1 n TYR 28 Cb 0.40 -3.87 0.00 0.00 -0.63 0.00 0.00 39.34 35.24 2wb1 n TYR 28 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2wb1 n GLY 30 N 0.17 0.34 3.07 0.00 0.00 -1.25 -5.06 105.19 102.45 2wb1 n GLY 30 Ca 0.00 -0.81 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 2wb1 n GLY 30 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2wb1 s TYR 31 N -2.14 0.58 -0.02 1.61 5.04 -1.26 -5.04 117.35 116.12 2wb1 s TYR 31 Ca 0.00 -0.73 0.12 0.00 -2.44 0.00 0.00 57.07 54.03 2wb1 s TYR 31 Cb -0.00 -0.37 -0.18 0.00 0.35 0.00 0.00 41.96 41.75 2wb1 s TYR 31 CO 0.00 -0.19 0.26 1.63 -1.34 0.00 0.00 175.55 175.91 2wb1 n LYS 32 N 0.86 0.43 -3.00 4.97 5.02 -1.26 -2.13 118.16 123.05 2wb1 n LYS 32 Ca -0.19 -0.11 -0.42 0.00 -2.02 0.00 0.00 58.31 55.58 2wb1 n LYS 32 Cb 0.57 -1.29 -0.06 0.00 -0.02 0.00 0.00 35.03 34.24 2wb1 n LYS 32 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wb1 s ILE 33 N -2.81 4.78 -0.09 -0.18 1.09 -1.26 -4.82 121.20 117.92 2wb1 s ILE 33 Ca -0.04 0.82 -0.01 0.00 -1.10 0.00 0.00 60.65 60.31 2wb1 s ILE 33 Cb 0.08 -4.16 0.03 0.00 -1.06 0.00 0.00 42.46 37.34 2wb1 s ILE 33 CO 0.50 -0.38 -0.04 -0.51 -0.10 0.00 0.00 174.94 174.41 2wb1 s ILE 34 N 2.97 0.69 0.57 2.92 2.07 -1.26 -3.98 121.20 125.17 2wb1 s ILE 34 Ca 0.29 -0.08 -0.08 0.00 -1.41 0.00 0.00 60.65 59.37 2wb1 s ILE 34 Cb -0.14 -0.77 -0.03 0.00 0.13 0.00 0.00 42.46 41.65 2wb1 s ILE 34 CO 0.16 0.31 0.93 -0.36 -1.91 0.00 0.00 174.94 174.06 2wb1 s PHE 35 N 1.77 3.56 -0.09 3.50 2.99 -1.16 -4.88 117.98 123.67 2wb1 s PHE 35 Ca 0.04 1.04 -0.10 0.00 0.00 0.00 0.00 56.93 57.91 2wb1 s PHE 35 Cb -0.13 -2.57 -0.05 0.00 0.00 0.00 0.00 43.02 40.28 2wb1 s PHE 35 CO -0.06 -0.56 0.23 1.41 -0.00 0.00 0.00 175.22 176.24 2wb1 s MET 36 N -5.00 3.68 0.53 0.44 -2.45 -1.26 -1.65 119.30 113.58 2wb1 s MET 36 Ca 0.52 0.05 -0.05 0.00 -1.25 0.00 0.00 55.69 54.96 2wb1 s MET 36 Cb -0.11 -3.23 -0.01 0.00 1.25 0.00 0.00 34.83 32.74 2wb1 s MET 36 CO 0.50 0.69 0.82 0.54 1.05 0.00 0.00 175.02 178.62 2wb1 s VAL 37 N -0.87 4.20 0.18 10.11 0.11 -1.26 -4.87 120.40 128.00 2wb1 s VAL 37 Ca 0.17 -0.00 -0.32 0.00 -2.93 0.00 0.00 61.98 58.91 2wb1 s VAL 37 Cb -0.13 -3.62 -0.11 0.00 -1.53 0.00 0.00 36.38 30.99 2wb1 s VAL 37 CO 0.07 -0.59 1.64 -0.60 -3.33 0.00 0.00 175.10 172.28 2wb1 s ARG 38 N -4.82 4.18 -0.13 1.54 3.52 -1.26 -4.76 118.95 117.21 2wb1 s ARG 38 Ca 0.50 2.47 -0.41 0.00 -0.13 0.00 0.00 55.73 58.16 2wb1 s ARG 38 Cb -0.10 -3.14 -0.19 0.00 -1.56 0.00 0.00 34.95 29.96 2wb1 s ARG 38 CO 0.44 -0.67 1.27 1.17 -0.81 0.00 0.00 175.30 176.70 2wb1 n LYS 39 N 4.04 0.20 0.00 5.12 4.81 -1.26 -4.83 118.16 126.23 2wb1 n LYS 39 Ca 0.15 0.07 0.09 0.00 -0.87 0.00 0.00 58.31 57.75 2wb1 n LYS 39 Cb 0.37 -1.60 0.50 0.00 0.02 0.00 0.00 35.03 34.32 2wb1 n LYS 39 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2wb1 n PRO 40 N 2.47 0.37 -2.69 1.64 -0.04 -1.26 -4.88 135.00 130.61 2wb1 n PRO 40 Ca 0.23 0.08 -0.36 0.00 -0.04 0.00 0.00 63.50 63.41 2wb1 n PRO 40 Cb 0.06 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.96 2wb1 n PRO 40 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2wb1 s THR 41 N -2.37 4.04 0.03 0.52 2.01 -1.26 -5.00 115.64 113.61 2wb1 s THR 41 Ca 0.21 1.54 -0.30 0.00 0.31 0.00 0.00 61.69 63.45 2wb1 s THR 41 Cb 0.13 -3.79 -0.08 0.00 0.01 0.00 0.00 72.50 68.77 2wb1 s THR 41 CO 0.26 -0.01 1.71 -0.51 -0.69 0.00 0.00 174.62 175.37 2wb1 s ILE 42 N -1.75 3.17 -0.09 1.82 2.07 -1.26 -5.01 121.20 120.15 2wb1 s ILE 42 Ca 0.56 0.46 -0.01 0.00 -1.41 0.00 0.00 60.65 60.25 2wb1 s ILE 42 Cb -0.18 -3.30 -0.03 0.00 0.13 0.00 0.00 42.46 39.08 2wb1 s ILE 42 CO 0.23 -0.02 -0.05 -0.54 -1.91 0.00 0.00 174.94 172.66 2wb1 s LYS 43 N 3.33 3.04 -0.40 3.50 -0.14 -1.26 -5.09 119.74 122.71 2wb1 s LYS 43 Ca 0.76 -0.51 -0.09 0.00 -1.36 0.00 0.00 55.97 54.78 2wb1 s LYS 43 Cb -0.39 -2.72 0.07 0.00 -1.68 0.00 0.00 37.83 33.12 2wb1 s LYS 43 CO 0.33 0.56 0.23 0.42 -0.76 0.00 0.00 175.35 176.14 2wb1 s ILE 44 N -0.52 4.15 -0.12 2.17 1.09 -1.26 -5.07 121.20 121.64 2wb1 s ILE 44 Ca 0.08 -1.36 -0.08 0.00 -1.10 0.00 0.00 60.65 58.19 2wb1 s ILE 44 Cb -0.12 -3.51 -0.04 0.00 -1.06 0.00 0.00 42.46 37.73 2wb1 s ILE 44 CO 0.02 -0.45 0.15 -0.69 -0.10 0.00 0.00 174.94 173.87 2wb1 s VAL 45 N 1.42 5.48 0.05 2.92 1.01 -1.26 -5.10 120.40 124.92 2wb1 s VAL 45 Ca 0.03 0.24 -0.14 0.00 0.00 0.00 0.00 61.98 62.10 2wb1 s VAL 45 Cb -0.22 -3.42 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 2wb1 s VAL 45 CO 0.02 0.61 0.45 -0.54 0.00 0.00 0.00 175.10 175.64 2wb1 s LYS 46 N -0.97 3.93 -1.31 2.72 1.02 -1.26 -5.00 119.74 118.87 2wb1 s LYS 46 Ca 0.15 0.42 -0.06 0.00 0.02 0.00 0.00 55.97 56.50 2wb1 s LYS 46 Cb -0.12 -3.13 0.13 0.00 -0.52 0.00 0.00 37.83 34.19 2wb1 s LYS 46 CO 0.04 0.63 2.26 0.00 -0.92 0.00 0.00 175.35 177.36 2wb1 n ALA 47 N 1.46 6.46 1.53 5.17 0.00 -1.26 -5.36 120.51 128.52 2wb1 n ALA 47 Ca -0.11 -4.14 0.14 0.00 0.00 0.00 0.00 53.44 49.33 2wb1 n ALA 47 Cb 0.52 -2.82 0.55 0.00 0.00 0.00 0.00 19.45 17.70 2wb1 n ALA 47 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61