#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh9 n GLY 2 N 0.00 -0.65 0.11 0.62 0.00 -1.26 -5.02 105.19 98.98 2wh9 n GLY 2 Ca 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 2wh9 n GLY 2 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2wh9 h GLU 3 N 0.10 0.26 0.00 1.61 4.11 -2.05 -3.45 114.58 115.16 2wh9 h GLU 3 Ca -0.05 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.35 2wh9 h GLU 3 Cb 1.01 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2wh9 h GLU 3 CO -0.02 0.26 0.00 0.00 0.07 0.00 0.00 179.01 179.32 2wh9 s GLY 5 N -1.68 0.81 0.00 0.00 0.00 -1.22 -4.85 107.32 100.38 2wh9 s GLY 5 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.49 2wh9 s GLY 5 CO 0.00 3.04 0.00 0.61 0.00 0.00 0.00 173.10 176.75 2wh9 n GLY 6 N 5.33 1.21 0.24 0.20 0.00 -1.26 -3.45 105.19 107.46 2wh9 n GLY 6 Ca 0.18 -1.51 0.12 0.00 0.00 0.00 0.00 46.02 44.81 2wh9 n GLY 6 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2wh9 h PHE 7 N 0.00 0.00 -0.99 1.61 3.57 -1.94 -3.13 116.94 116.06 2wh9 h PHE 7 Ca 0.00 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.30 2wh9 h PHE 7 Cb 0.00 0.00 -0.18 0.00 2.79 0.00 0.00 35.95 38.56 2wh9 h PHE 7 CO 0.00 0.17 -0.54 1.87 -2.23 0.00 0.00 178.31 177.58 2wh9 n TRP 8 N -3.41 -3.48 -3.88 0.41 -0.00 0.47 -3.90 117.44 103.65 2wh9 n TRP 8 Ca -0.00 -1.61 -0.36 0.00 -0.00 0.00 0.00 57.50 55.53 2wh9 n TRP 8 Cb 0.37 1.37 -0.14 0.00 -0.00 0.00 0.00 31.31 32.91 2wh9 n TRP 8 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 177.69 177.23 2wh9 s TRP 9 N 0.75 3.07 -0.33 5.87 -0.00 -0.93 -4.74 118.94 122.63 2wh9 s TRP 9 Ca 0.31 -1.21 -0.34 0.00 -0.00 0.00 0.00 56.10 54.85 2wh9 s TRP 9 Cb 0.04 -2.14 -0.11 0.00 -0.00 0.00 0.00 33.47 31.26 2wh9 s TRP 9 CO -0.09 -0.63 2.19 1.63 -0.00 0.00 0.00 176.95 180.05 2wh9 n LYS 10 N 4.77 1.17 -4.92 5.86 4.76 -1.26 0.72 118.16 129.27 2wh9 n LYS 10 Ca -0.16 0.32 -0.31 0.00 -2.87 0.00 0.00 58.31 55.28 2wh9 n LYS 10 Cb 0.48 -2.55 -0.14 0.00 -1.84 0.00 0.00 35.03 30.99 2wh9 n LYS 10 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wh9 n GLY 12 N 2.00 -0.84 3.62 0.00 0.00 -1.26 -4.33 105.19 104.39 2wh9 n GLY 12 Ca -0.16 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.20 2wh9 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wh9 s SER 13 N -4.00 6.78 0.00 1.61 0.01 -1.26 -3.67 113.70 113.17 2wh9 s SER 13 Ca 0.00 0.75 0.00 0.00 1.31 0.00 0.00 55.95 58.01 2wh9 s SER 13 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2wh9 s SER 13 CO 0.00 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.19 2wh9 n GLY 14 N 4.37 0.95 3.71 3.44 0.00 -1.26 -5.12 105.19 111.29 2wh9 n GLY 14 Ca 0.12 -0.02 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 2wh9 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wh9 s LYS 15 N -0.03 1.99 0.07 1.61 1.02 -1.24 -5.16 119.74 117.99 2wh9 s LYS 15 Ca 0.00 -1.41 -0.01 0.00 0.02 0.00 0.00 55.97 54.58 2wh9 s LYS 15 Cb 0.00 0.56 0.01 0.00 -0.52 0.00 0.00 37.83 37.88 2wh9 s LYS 15 CO 0.00 -0.89 0.09 -0.35 -0.92 0.00 0.00 175.35 173.28 2wh9 n PRO 16 N -0.50 0.19 -3.69 -1.68 -0.05 -1.26 -4.88 135.00 123.12 2wh9 n PRO 16 Ca -0.05 -0.18 -0.21 0.00 -0.05 0.00 0.00 63.50 63.02 2wh9 n PRO 16 Cb 0.60 -0.08 -0.04 0.00 -0.05 0.00 0.00 33.50 33.94 2wh9 n PRO 16 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2wh9 s ALA 17 N -3.47 3.94 0.34 0.55 0.00 -1.26 -4.74 121.76 117.12 2wh9 s ALA 17 Ca 0.05 -1.80 -0.15 0.00 0.00 0.00 0.00 51.96 50.07 2wh9 s ALA 17 Cb -0.00 -1.05 -0.09 0.00 0.00 0.00 0.00 23.12 21.98 2wh9 s ALA 17 CO 0.04 -0.12 0.76 0.00 0.00 0.00 0.00 175.76 176.44 2wh9 h PRO 20 N -2.88 0.00 0.21 0.00 0.11 -1.97 -2.28 132.00 125.19 2wh9 h PRO 20 Ca -0.60 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.17 2wh9 h PRO 20 Cb 1.34 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.47 2wh9 h PRO 20 CO 0.46 0.00 -1.54 0.87 -0.21 0.00 0.00 178.00 177.58 2wh9 h LYS 21 N 0.00 0.44 -6.35 1.05 6.56 -1.92 -3.47 116.57 112.87 2wh9 h LYS 21 Ca 0.03 -0.75 -0.49 0.00 -1.06 0.00 0.00 60.65 58.38 2wh9 h LYS 21 Cb 0.17 0.28 -0.00 0.00 -0.57 0.00 0.00 32.23 32.11 2wh9 h LYS 21 CO -0.00 1.35 -0.24 0.71 -2.06 0.00 0.00 179.45 179.21 2wh9 s TYR 22 N -2.60 2.09 0.10 -1.35 2.02 -0.86 -4.28 117.35 112.46 2wh9 s TYR 22 Ca -0.10 -0.62 -0.25 0.00 -0.37 0.00 0.00 57.07 55.73 2wh9 s TYR 22 Cb 0.05 -2.18 0.07 0.00 -0.40 0.00 0.00 41.96 39.49 2wh9 s TYR 22 CO 0.90 -0.61 0.62 0.14 -1.57 0.00 0.00 175.55 175.03 2wh9 s VAL 23 N -2.57 0.00 -0.29 0.71 -7.23 0.24 -4.18 120.40 107.09 2wh9 s VAL 23 Ca 0.52 -0.02 -0.29 0.00 -1.81 0.00 0.00 61.98 60.38 2wh9 s VAL 23 Cb -0.05 -1.00 0.01 0.00 0.56 0.00 0.00 36.38 35.90 2wh9 s VAL 23 CO 0.32 -0.01 1.07 0.00 -0.31 0.00 0.00 175.10 176.16 2wh9 s SER 25 N 1.53 6.04 0.21 0.00 0.15 -0.79 -4.92 113.70 115.91 2wh9 s SER 25 Ca 0.45 2.97 -0.05 0.00 0.70 0.00 0.00 55.95 60.02 2wh9 s SER 25 Cb -0.13 -2.66 0.17 0.00 -1.71 0.00 0.00 66.02 61.69 2wh9 s SER 25 CO 0.13 -1.07 1.64 1.55 1.20 0.00 0.00 173.24 176.68 2wh9 h PRO 26 N 2.57 0.84 0.00 5.44 0.13 -1.94 -3.34 132.00 135.70 2wh9 h PRO 26 Ca -0.51 -0.32 -0.00 0.00 -0.87 0.00 0.00 66.00 64.30 2wh9 h PRO 26 Cb 1.26 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2wh9 h PRO 26 CO 0.62 0.95 -0.00 -0.22 -0.23 0.00 0.00 178.00 179.12 2wh9 h LYS 27 N 0.74 -0.00 -5.99 0.86 1.63 -2.00 -3.46 116.57 108.35 2wh9 h LYS 27 Ca 0.11 0.00 -0.61 0.00 -0.85 0.00 0.00 60.65 59.30 2wh9 h LYS 27 Cb 0.69 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.27 2wh9 h LYS 27 CO 0.05 -0.00 -0.36 -1.58 -3.45 0.00 0.00 179.45 174.11 2wh9 s TRP 28 N -1.54 3.56 -1.35 1.91 0.52 -1.25 -5.01 118.94 115.77 2wh9 s TRP 28 Ca -0.00 0.59 -0.09 0.00 0.02 0.00 0.00 56.10 56.62 2wh9 s TRP 28 Cb 0.00 -2.01 0.11 0.00 -1.15 0.00 0.00 33.47 30.42 2wh9 s TRP 28 CO 0.00 0.56 2.20 0.41 0.02 0.00 0.00 176.95 180.15 2wh9 n GLY 29 N 0.84 4.82 2.97 0.98 0.00 -1.26 -3.41 105.19 110.13 2wh9 n GLY 29 Ca -0.09 -1.96 -0.11 0.00 0.00 0.00 0.00 46.02 43.86 2wh9 n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wh9 s LEU 30 N -0.49 1.82 -0.16 0.99 1.43 -1.26 0.18 118.68 121.20 2wh9 s LEU 30 Ca 0.48 -0.05 -0.25 0.00 -1.03 0.00 0.00 54.13 53.28 2wh9 s LEU 30 Cb 0.14 0.26 -0.02 0.00 0.03 0.00 0.00 46.19 46.61 2wh9 s LEU 30 CO -0.05 -0.13 0.81 0.00 0.23 0.00 0.00 176.35 177.22 2wh9 n ASN 32 N 5.05 -1.18 -4.74 0.00 0.23 0.21 -0.39 115.26 114.43 2wh9 n ASN 32 Ca 0.04 -2.42 -0.31 0.00 -0.53 0.00 0.00 54.58 51.35 2wh9 n ASN 32 Cb 0.49 2.14 0.10 0.00 -2.08 0.00 0.00 39.78 40.44 2wh9 n ASN 32 CO 0.00 0.00 0.00 -0.36 -0.93 0.00 0.00 177.26 175.97 2wh9 s PHE 33 N -3.48 2.31 -0.44 -2.53 0.40 -1.26 0.83 117.98 113.81 2wh9 s PHE 33 Ca 0.20 1.62 -0.32 0.00 -0.60 0.00 0.00 56.93 57.83 2wh9 s PHE 33 Cb -0.01 -3.16 -0.11 0.00 0.51 0.00 0.00 43.02 40.24 2wh9 s PHE 33 CO 0.15 -2.09 2.30 -2.30 0.70 0.00 0.00 175.22 173.98 2wh9 n PRO 34 N -3.52 1.03 -2.72 0.24 -0.02 -1.26 -3.48 135.00 125.27 2wh9 n PRO 34 Ca 0.10 0.22 -0.01 0.00 -2.02 0.00 0.00 63.50 61.79 2wh9 n PRO 34 Cb 0.52 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.38 2wh9 n PRO 34 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2wh9 n MET 35 N 8.47 -3.38 0.00 -0.52 1.56 -1.26 -5.16 117.12 116.82 2wh9 n MET 35 Ca 0.42 2.72 0.00 0.00 -0.27 0.00 0.00 57.70 60.58 2wh9 n MET 35 Cb 0.29 -5.41 0.00 0.00 2.15 0.00 0.00 33.22 30.25 2wh9 n MET 35 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94