#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 -0.17 3.81 -1.84 0.00 -1.26 -5.14 105.19 100.60 2wh9 n GLY 2 Ca 0.00 -0.75 -0.22 0.00 0.00 0.00 0.00 46.02 45.05 2wh9 n GLY 2 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wh9 s GLU 3 N -2.00 2.46 0.47 1.61 0.41 -1.26 -5.13 118.70 115.26 2wh9 s GLU 3 Ca 0.00 -1.57 -0.08 0.00 -0.41 0.00 0.00 54.97 52.92 2wh9 s GLU 3 Cb 0.00 -2.26 0.12 0.00 -1.78 0.00 0.00 34.13 30.21 2wh9 s GLU 3 CO 0.00 -0.06 0.29 0.00 -0.49 0.00 0.00 175.26 174.99 2wh9 s GLY 5 N -2.44 1.27 0.00 0.00 0.00 -1.17 -4.84 107.32 100.14 2wh9 s GLY 5 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.88 2wh9 s GLY 5 CO 0.18 2.63 0.00 0.61 0.00 0.00 0.00 173.10 176.52 2wh9 n GLY 6 N 4.64 1.25 0.24 0.20 0.00 -1.26 -3.13 105.19 107.13 2wh9 n GLY 6 Ca 0.15 -1.52 0.10 0.00 0.00 0.00 0.00 46.02 44.76 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 -1.11 1.61 -0.00 -1.94 -3.20 116.94 112.31 2wh9 h PHE 7 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.97 57.76 2wh9 h PHE 7 Cb 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 35.95 35.76 2wh9 h PHE 7 CO 0.00 0.20 -0.56 1.87 -0.00 0.00 0.00 178.31 179.82 2wh9 n TRP 8 N -3.57 -3.42 -4.04 0.41 -0.00 0.38 -3.80 117.44 103.40 2wh9 n TRP 8 Ca -0.01 -1.65 -0.34 0.00 -0.00 0.00 0.00 57.50 55.50 2wh9 n TRP 8 Cb 0.34 1.32 -0.15 0.00 -0.00 0.00 0.00 31.31 32.82 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 0.74 2.88 -0.09 5.87 0.52 -0.93 -4.76 118.94 123.18 2wh9 s TRP 9 Ca 0.31 -1.46 -0.38 0.00 0.02 0.00 0.00 56.10 54.59 2wh9 s TRP 9 Cb 0.02 -1.99 -0.15 0.00 -1.15 0.00 0.00 33.47 30.20 2wh9 s TRP 9 CO -0.08 -0.73 1.61 1.63 0.02 0.00 0.00 176.95 179.40 2wh9 n LYS 10 N 4.67 1.38 -4.50 4.98 4.01 -1.26 0.11 118.16 127.54 2wh9 n LYS 10 Ca -0.19 0.50 -0.21 0.00 -0.51 0.00 0.00 58.31 57.90 2wh9 n LYS 10 Cb 0.50 -2.20 -0.14 0.00 -0.51 0.00 0.00 35.03 32.67 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 2.38 -0.67 3.55 0.00 0.00 -1.26 -4.43 105.19 104.76 2wh9 n GLY 12 Ca -0.16 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.00 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 6.26 0.00 1.61 0.01 -1.26 -3.31 113.70 113.01 2wh9 s SER 13 Ca 0.00 -0.76 0.00 0.00 1.31 0.00 0.00 55.95 56.50 2wh9 s SER 13 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2wh9 s SER 13 CO 0.00 -1.74 0.00 0.61 0.41 0.00 0.00 173.24 172.52 2wh9 n GLY 14 N 5.83 1.92 3.38 3.44 0.00 -1.26 -5.14 105.19 113.36 2wh9 n GLY 14 Ca 0.12 0.00 -0.11 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 -0.24 1.38 0.55 1.61 3.01 -1.21 -5.12 119.74 119.72 2wh9 s LYS 15 Ca 0.00 -1.47 -0.07 0.00 -1.01 0.00 0.00 55.97 53.42 2wh9 s LYS 15 Cb 0.00 0.36 -0.02 0.00 -1.01 0.00 0.00 37.83 37.16 2wh9 s LYS 15 CO 0.00 -0.52 0.89 -1.25 0.51 0.00 0.00 175.35 174.98 2wh9 s PRO 16 N -4.05 3.37 0.66 -1.68 0.05 -1.26 -4.77 135.00 127.31 2wh9 s PRO 16 Ca 0.32 0.30 -0.11 0.00 0.05 0.00 0.00 61.00 61.55 2wh9 s PRO 16 Cb 0.03 -2.26 -0.02 0.00 0.05 0.00 0.00 34.50 32.31 2wh9 s PRO 16 CO 0.11 -0.46 1.06 0.00 0.05 0.00 0.00 177.00 177.76 2wh9 s ALA 17 N -2.94 3.01 0.39 8.56 0.00 -1.26 -4.77 121.76 124.74 2wh9 s ALA 17 Ca 0.51 -0.20 -0.20 0.00 0.00 0.00 0.00 51.96 52.07 2wh9 s ALA 17 Cb -0.11 -3.06 -0.10 0.00 0.00 0.00 0.00 23.12 19.85 2wh9 s ALA 17 CO 0.47 -0.89 0.89 0.00 0.00 0.00 0.00 175.76 176.24 2wh9 h PRO 20 N -3.11 0.00 0.04 0.00 0.11 -1.97 -2.26 132.00 124.82 2wh9 h PRO 20 Ca -0.54 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.26 2wh9 h PRO 20 Cb 1.34 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.41 2wh9 h PRO 20 CO 0.40 0.01 -1.68 -0.22 -0.21 0.00 0.00 178.00 176.29 2wh9 h LYS 21 N 0.00 0.09 -6.18 1.05 1.63 -1.92 -3.48 116.57 107.77 2wh9 h LYS 21 Ca -0.00 -0.15 -0.49 0.00 -0.85 0.00 0.00 60.65 59.15 2wh9 h LYS 21 Cb 0.03 0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.68 2wh9 h LYS 21 CO 0.00 0.77 -0.40 0.71 -3.45 0.00 0.00 179.45 177.08 2wh9 s TYR 22 N -2.60 2.75 0.12 1.91 2.02 -0.85 -4.16 117.35 116.54 2wh9 s TYR 22 Ca -0.08 -0.45 -0.20 0.00 -0.37 0.00 0.00 57.07 55.97 2wh9 s TYR 22 Cb 0.08 -2.07 0.05 0.00 -0.40 0.00 0.00 41.96 39.61 2wh9 s TYR 22 CO 0.82 -0.04 0.49 0.14 -1.57 0.00 0.00 175.55 175.39 2wh9 s VAL 23 N -2.43 0.04 -0.47 0.71 -7.23 0.18 -4.05 120.40 107.14 2wh9 s VAL 23 Ca 0.46 -0.33 -0.29 0.00 -1.81 0.00 0.00 61.98 60.02 2wh9 s VAL 23 Cb -0.04 -1.07 0.03 0.00 0.56 0.00 0.00 36.38 35.86 2wh9 s VAL 23 CO 0.27 -0.18 1.14 0.00 -0.31 0.00 0.00 175.10 176.03 2wh9 s SER 25 N 2.47 6.01 0.28 0.00 0.15 -0.71 -4.92 113.70 116.99 2wh9 s SER 25 Ca 0.48 2.94 0.08 0.00 0.70 0.00 0.00 55.95 60.15 2wh9 s SER 25 Cb -0.07 -2.66 0.41 0.00 -1.71 0.00 0.00 66.02 61.99 2wh9 s SER 25 CO 0.31 -1.09 1.66 1.55 1.20 0.00 0.00 173.24 176.87 2wh9 h PRO 26 N 2.51 0.13 0.00 5.44 0.13 -1.94 -3.29 132.00 134.98 2wh9 h PRO 26 Ca -0.51 -0.08 -0.00 0.00 -0.87 0.00 0.00 66.00 64.55 2wh9 h PRO 26 Cb 1.26 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 2wh9 h PRO 26 CO 0.62 0.62 -0.00 -0.22 -0.23 0.00 0.00 178.00 178.79 2wh9 h LYS 27 N 0.10 0.00 -6.06 0.86 1.63 -1.99 -3.46 116.57 107.66 2wh9 h LYS 27 Ca 0.00 0.00 -0.68 0.00 -0.85 0.00 0.00 60.65 59.12 2wh9 h LYS 27 Cb 0.95 0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 32.39 2wh9 h LYS 27 CO 0.07 0.87 -0.69 -1.58 -3.45 0.00 0.00 179.45 174.67 2wh9 s TRP 28 N -2.13 2.95 -1.59 1.91 0.52 -1.24 -5.02 118.94 114.34 2wh9 s TRP 28 Ca -0.17 -0.00 -0.11 0.00 0.02 0.00 0.00 56.10 55.84 2wh9 s TRP 28 Cb -0.03 -1.73 -0.06 0.00 -1.15 0.00 0.00 33.47 30.50 2wh9 s TRP 28 CO 0.60 0.30 2.80 0.41 0.02 0.00 0.00 176.95 181.09 2wh9 n GLY 29 N 2.34 4.28 3.09 0.98 0.00 -1.26 -3.43 105.19 111.19 2wh9 n GLY 29 Ca -0.18 -1.52 -0.09 0.00 0.00 0.00 0.00 46.02 44.24 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 0.62 2.02 -0.23 0.99 1.43 -1.26 -0.76 118.68 121.49 2wh9 s LEU 30 Ca 0.65 -0.63 -0.18 0.00 -1.03 0.00 0.00 54.13 52.93 2wh9 s LEU 30 Cb 0.17 0.44 -0.03 0.00 0.03 0.00 0.00 46.19 46.80 2wh9 s LEU 30 CO -0.07 -0.50 0.53 0.00 0.23 0.00 0.00 176.35 176.54 2wh9 n ASN 32 N 5.18 -0.75 -4.71 0.00 0.23 0.00 -0.47 115.26 114.75 2wh9 n ASN 32 Ca -0.04 -1.99 -0.35 0.00 -0.53 0.00 0.00 54.58 51.67 2wh9 n ASN 32 Cb 0.50 1.39 0.11 0.00 -2.08 0.00 0.00 39.78 39.70 2wh9 n ASN 32 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 2wh9 n PHE 33 N -0.30 1.52 -1.88 -2.53 3.72 -1.26 0.47 117.46 117.20 2wh9 n PHE 33 Ca -0.00 0.41 -0.32 0.00 -0.05 0.00 0.00 57.45 57.49 2wh9 n PHE 33 Cb 0.31 -2.17 0.02 0.00 -0.94 0.00 0.00 39.48 36.71 2wh9 n PHE 33 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2wh9 s PRO 34 N -3.84 3.20 0.01 -1.08 0.04 -1.26 -4.71 135.00 127.36 2wh9 s PRO 34 Ca 0.77 1.10 0.04 0.00 0.04 0.00 0.00 61.00 62.94 2wh9 s PRO 34 Cb -0.32 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 2wh9 s PRO 34 CO 0.47 -0.90 -0.11 1.41 0.04 0.00 0.00 177.00 177.91 2wh9 s MET 35 N -4.45 0.82 0.00 4.56 1.75 -1.26 -5.12 119.30 115.60 2wh9 s MET 35 Ca 0.61 -0.51 0.17 0.00 -1.25 0.00 0.00 55.69 54.71 2wh9 s MET 35 Cb -0.15 -0.79 1.02 0.00 2.84 0.00 0.00 34.83 37.75 2wh9 s MET 35 CO 0.44 0.21 1.43 -0.35 -0.65 0.00 0.00 175.02 176.09