#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wh9 s GLY 2 N 0.00 -0.35 -0.44 -1.84 0.00 -1.26 -5.09 107.32 98.35 2wh9 s GLY 2 Ca 0.00 1.51 0.06 0.00 0.00 0.00 0.00 44.72 46.29 2wh9 s GLY 2 CO 0.00 2.15 0.45 1.18 0.00 0.00 0.00 173.10 176.88 2wh9 n GLU 3 N 4.98 0.66 -4.19 2.90 4.71 -1.26 -5.11 120.64 123.33 2wh9 n GLU 3 Ca -0.14 -3.38 -0.25 0.00 -0.01 0.00 0.00 57.16 53.38 2wh9 n GLU 3 Cb 0.52 -1.57 -0.08 0.00 -1.01 0.00 0.00 31.44 29.30 2wh9 n GLU 3 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2wh9 s GLY 5 N -3.87 1.40 0.00 0.00 0.00 -1.25 -4.82 107.32 98.78 2wh9 s GLY 5 Ca 0.40 -1.78 0.00 0.00 0.00 0.00 0.00 44.72 43.34 2wh9 s GLY 5 CO 0.22 2.03 0.00 0.61 0.00 0.00 0.00 173.10 175.96 2wh9 n GLY 6 N 5.30 0.88 0.14 0.20 0.00 -1.26 -3.09 105.19 107.36 2wh9 n GLY 6 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.04 1.61 3.57 -1.93 -3.13 116.94 116.01 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 0.59 -0.54 1.87 -2.23 0.00 0.00 178.31 178.00 2wh9 n TRP 8 N -3.62 -3.51 -4.12 0.41 -0.00 0.29 -3.81 117.44 103.08 2wh9 n TRP 8 Ca -0.00 -1.59 -0.34 0.00 -0.00 0.00 0.00 57.50 55.56 2wh9 n TRP 8 Cb 0.64 1.37 -0.15 0.00 -0.00 0.00 0.00 31.31 33.17 2wh9 n TRP 8 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 177.69 176.11 2wh9 s TRP 9 N 0.76 2.86 -0.12 5.87 0.52 -0.92 -4.76 118.94 123.14 2wh9 s TRP 9 Ca 0.31 -1.20 -0.36 0.00 0.02 0.00 0.00 56.10 54.86 2wh9 s TRP 9 Cb 0.03 -1.99 -0.13 0.00 -1.15 0.00 0.00 33.47 30.22 2wh9 s TRP 9 CO -0.08 -0.62 1.79 1.63 0.02 0.00 0.00 176.95 179.69 2wh9 n LYS 10 N 4.56 1.79 -4.28 4.98 4.01 -1.26 0.11 118.16 128.06 2wh9 n LYS 10 Ca -0.19 0.66 -0.18 0.00 -0.51 0.00 0.00 58.31 58.08 2wh9 n LYS 10 Cb 0.51 -2.43 -0.13 0.00 -0.51 0.00 0.00 35.03 32.46 2wh9 n LYS 10 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2wh9 n GLY 12 N 2.13 -0.70 3.57 0.00 0.00 -1.26 -4.31 105.19 104.61 2wh9 n GLY 12 Ca -0.17 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 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 6.66 0.00 1.61 0.01 -1.26 -3.09 113.70 113.63 2wh9 s SER 13 Ca 0.00 -1.91 0.00 0.00 1.31 0.00 0.00 55.95 55.35 2wh9 s SER 13 Cb 0.00 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.66 2wh9 s SER 13 CO 0.00 -1.35 0.00 0.61 0.41 0.00 0.00 173.24 172.91 2wh9 n GLY 14 N 6.21 1.03 3.97 3.44 0.00 -1.26 -5.14 105.19 113.44 2wh9 n GLY 14 Ca 0.40 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 3.34 1.16 1.61 -0.14 -1.18 -5.11 119.74 119.42 2wh9 s LYS 15 Ca 0.00 -0.83 -0.17 0.00 -1.36 0.00 0.00 55.97 53.60 2wh9 s LYS 15 Cb 0.00 -2.87 0.26 0.00 -1.68 0.00 0.00 37.83 33.55 2wh9 s LYS 15 CO 0.00 0.33 1.10 -1.25 -0.76 0.00 0.00 175.35 174.77 2wh9 s PRO 16 N -4.03 -0.86 0.48 -1.68 0.04 -1.26 -4.52 135.00 123.17 2wh9 s PRO 16 Ca 0.37 0.09 -0.08 0.00 0.04 0.00 0.00 61.00 61.42 2wh9 s PRO 16 Cb -0.09 -1.62 -0.05 0.00 0.04 0.00 0.00 34.50 32.78 2wh9 s PRO 16 CO 0.30 -3.50 0.83 0.00 0.04 0.00 0.00 177.00 174.66 2wh9 s ALA 17 N -2.97 3.32 0.51 8.56 0.00 -1.26 -4.68 121.76 125.24 2wh9 s ALA 17 Ca 0.69 -0.30 -0.18 0.00 0.00 0.00 0.00 51.96 52.18 2wh9 s ALA 17 Cb -0.12 -2.73 -0.08 0.00 0.00 0.00 0.00 23.12 20.19 2wh9 s ALA 17 CO 0.57 -0.27 1.00 0.00 0.00 0.00 0.00 175.76 177.05 2wh9 h PRO 20 N -2.13 0.00 0.00 0.00 0.13 -1.96 -1.34 132.00 126.70 2wh9 h PRO 20 Ca -0.50 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.46 2wh9 h PRO 20 Cb 1.30 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 2wh9 h PRO 20 CO 0.42 0.00 -1.29 0.87 -0.23 0.00 0.00 178.00 177.77 2wh9 h LYS 21 N 0.00 0.00 -5.46 0.86 6.56 -1.90 -3.48 116.57 113.15 2wh9 h LYS 21 Ca 0.00 0.00 -0.65 0.00 -1.06 0.00 0.00 60.65 58.94 2wh9 h LYS 21 Cb 0.06 0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 31.59 2wh9 h LYS 21 CO 0.00 0.36 -0.56 0.71 -2.06 0.00 0.00 179.45 177.90 2wh9 s TYR 22 N -2.89 2.23 0.10 -1.35 2.02 -0.51 -4.54 117.35 112.41 2wh9 s TYR 22 Ca -0.02 -0.80 -0.11 0.00 -0.37 0.00 0.00 57.07 55.77 2wh9 s TYR 22 Cb 0.08 -1.70 0.01 0.00 -0.40 0.00 0.00 41.96 39.96 2wh9 s TYR 22 CO 0.80 0.35 0.27 0.14 -1.57 0.00 0.00 175.55 175.54 2wh9 s VAL 23 N -2.79 0.12 -0.26 0.71 -7.23 0.27 -4.25 120.40 106.97 2wh9 s VAL 23 Ca 0.23 -0.96 -0.29 0.00 -1.81 0.00 0.00 61.98 59.14 2wh9 s VAL 23 Cb 0.06 -1.28 0.01 0.00 0.56 0.00 0.00 36.38 35.74 2wh9 s VAL 23 CO 0.12 -0.53 1.06 0.00 -0.31 0.00 0.00 175.10 175.44 2wh9 n SER 25 N 6.56 3.16 -0.07 0.00 7.64 -0.02 -4.94 113.62 125.94 2wh9 n SER 25 Ca 0.12 1.09 -0.13 0.00 1.01 0.00 0.00 58.87 60.96 2wh9 n SER 25 Cb 0.46 -1.59 -0.06 0.00 -1.01 0.00 0.00 64.21 62.01 2wh9 n SER 25 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2wh9 h PRO 26 N 2.11 0.49 0.00 1.43 0.13 -1.94 -3.35 132.00 130.87 2wh9 h PRO 26 Ca -0.51 -0.26 -0.00 0.00 -0.87 0.00 0.00 66.00 64.37 2wh9 h PRO 26 Cb 1.28 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 2wh9 h PRO 26 CO 0.60 0.83 -0.00 -0.22 -0.23 0.00 0.00 178.00 178.98 2wh9 h LYS 27 N 0.17 0.00 -5.45 0.86 1.63 -1.99 -3.45 116.57 108.34 2wh9 h LYS 27 Ca 0.03 0.00 -0.62 0.00 -0.85 0.00 0.00 60.65 59.21 2wh9 h LYS 27 Cb 0.74 0.00 -0.10 0.00 -0.60 0.00 0.00 32.23 32.27 2wh9 h LYS 27 CO 0.05 0.99 -0.46 -1.58 -3.45 0.00 0.00 179.45 175.00 2wh9 s TRP 28 N -2.21 3.49 -1.62 1.91 0.52 -1.25 -5.00 118.94 114.77 2wh9 s TRP 28 Ca -0.19 0.45 -0.10 0.00 0.02 0.00 0.00 56.10 56.28 2wh9 s TRP 28 Cb -0.03 -2.11 -0.09 0.00 -1.15 0.00 0.00 33.47 30.09 2wh9 s TRP 28 CO 0.68 0.45 2.95 0.41 0.02 0.00 0.00 176.95 181.46 2wh9 n GLY 29 N 2.93 4.24 3.03 0.98 0.00 -1.26 -3.27 105.19 111.84 2wh9 n GLY 29 Ca -0.17 -1.50 -0.08 0.00 0.00 0.00 0.00 46.02 44.28 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 0.20 2.34 -0.19 0.99 1.43 -1.26 -0.29 118.68 121.89 2wh9 s LEU 30 Ca 0.69 -0.73 -0.16 0.00 -1.03 0.00 0.00 54.13 52.90 2wh9 s LEU 30 Cb 0.18 0.16 -0.04 0.00 0.03 0.00 0.00 46.19 46.52 2wh9 s LEU 30 CO -0.06 -0.44 0.41 0.00 0.23 0.00 0.00 176.35 176.49 2wh9 n ASN 32 N 4.38 -1.01 -4.75 0.00 0.23 -0.31 -0.55 115.26 113.25 2wh9 n ASN 32 Ca -0.08 -2.15 -0.35 0.00 -0.53 0.00 0.00 54.58 51.47 2wh9 n ASN 32 Cb 0.51 1.82 0.05 0.00 -2.08 0.00 0.00 39.78 40.08 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 -3.96 2.36 0.01 -2.53 0.40 -1.26 -0.56 117.98 112.43 2wh9 s PHE 33 Ca 0.16 1.55 0.25 0.00 -0.60 0.00 0.00 56.93 58.30 2wh9 s PHE 33 Cb -0.01 -3.40 0.86 0.00 0.51 0.00 0.00 43.02 40.98 2wh9 s PHE 33 CO 0.12 -2.17 1.80 -1.00 0.70 0.00 0.00 175.22 174.66 2wh9 h PRO 34 N 0.36 0.00 -4.88 0.24 0.13 -1.93 -3.45 132.00 122.48 2wh9 h PRO 34 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2wh9 h PRO 34 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2wh9 h PRO 34 CO 0.53 0.16 -0.36 -0.12 -0.23 0.00 0.00 178.00 177.98 2wh9 n MET 35 N -3.25 -1.86 0.00 0.86 1.56 -1.26 -5.14 117.12 108.03 2wh9 n MET 35 Ca 0.01 1.78 0.00 0.00 -0.27 0.00 0.00 57.70 59.22 2wh9 n MET 35 Cb 0.44 -4.94 0.00 0.00 2.15 0.00 0.00 33.22 30.87 2wh9 n MET 35 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94