#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sxm s ILE 2 N 0.00 1.54 0.34 1.09 1.01 -1.26 -2.16 121.20 121.76 1sxm s ILE 2 Ca 0.00 -0.63 0.05 0.00 0.00 0.00 0.00 60.65 60.06 1sxm s ILE 2 Cb 0.00 -1.46 0.05 0.00 0.01 0.00 0.00 42.46 41.05 1sxm s ILE 2 CO 0.00 0.44 0.39 2.30 0.00 0.00 0.00 174.94 178.07 1sxm n ILE 3 N 4.78 0.00 -3.63 2.92 -5.35 -0.99 -4.96 119.36 112.12 1sxm n ILE 3 Ca -0.17 -1.23 -0.27 0.00 -0.27 0.00 0.00 62.75 60.82 1sxm n ILE 3 Cb 0.50 -0.52 -0.11 0.00 -1.74 0.00 0.00 39.64 37.77 1sxm n ILE 3 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1sxm n ASN 4 N -2.33 1.59 -3.98 7.28 4.13 -1.26 -4.18 115.26 116.52 1sxm n ASN 4 Ca 0.06 -2.88 -0.26 0.00 1.68 0.00 0.00 54.58 53.17 1sxm n ASN 4 Cb 0.37 -0.67 -0.17 0.00 -1.54 0.00 0.00 39.78 37.77 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1sxm s VAL 5 N -0.96 1.17 0.11 2.41 1.01 -1.26 -4.98 120.40 117.90 1sxm s VAL 5 Ca 0.30 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.55 1sxm s VAL 5 Cb 0.02 -1.12 -0.06 0.00 0.00 0.00 0.00 36.38 35.22 1sxm s VAL 5 CO -0.17 0.38 0.92 -0.54 0.00 0.00 0.00 175.10 175.70 1sxm s LYS 6 N 1.21 4.67 0.32 2.72 -0.14 -1.26 -2.15 119.74 125.11 1sxm s LYS 6 Ca -0.04 1.38 0.05 0.00 -1.36 0.00 0.00 55.97 56.01 1sxm s LYS 6 Cb -0.14 -3.37 -0.02 0.00 -1.68 0.00 0.00 37.83 32.62 1sxm s LYS 6 CO -0.03 0.24 0.32 0.00 -0.76 0.00 0.00 175.35 175.12 1sxm n THR 8 N -0.59 0.00 -3.58 0.00 5.66 -1.26 -4.57 114.28 109.94 1sxm n THR 8 Ca 0.06 0.00 -0.06 0.00 -3.05 0.00 0.00 64.05 60.99 1sxm n THR 8 Cb 0.57 0.31 -0.03 0.00 -1.55 0.00 0.00 70.33 69.63 1sxm n THR 8 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1sxm s SER 9 N -0.48 -0.21 0.46 1.09 1.04 -1.26 -5.02 113.70 109.31 1sxm s SER 9 Ca 0.00 0.10 0.31 0.00 0.48 0.00 0.00 55.95 56.84 1sxm s SER 9 Cb 0.00 0.20 1.28 0.00 0.10 0.00 0.00 66.02 67.60 1sxm s SER 9 CO 0.00 -0.29 1.91 -0.65 0.98 0.00 0.00 173.24 175.19 1sxm h PRO 10 N 2.14 0.00 0.00 4.02 0.11 -1.89 -3.17 132.00 133.22 1sxm h PRO 10 Ca -0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1sxm h PRO 10 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1sxm h PRO 10 CO 0.26 0.00 0.00 0.87 -0.21 0.00 0.00 178.00 178.92 1sxm h LYS 11 N 0.00 0.00 -0.00 1.05 6.56 -1.95 -2.26 116.57 119.97 1sxm h LYS 11 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1sxm h LYS 11 Cb 0.44 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 1sxm h LYS 11 CO 0.00 0.00 -0.46 0.94 -2.06 0.00 0.00 179.45 177.87 1sxm n GLN 12 N -2.64 0.38 -0.00 3.15 -0.06 -1.20 -3.85 117.38 113.17 1sxm n GLN 12 Ca 0.03 -0.24 0.06 0.00 -2.00 0.00 0.00 57.00 54.85 1sxm n GLN 12 Cb 0.39 -1.50 -0.08 0.00 -4.06 0.00 0.00 30.24 25.00 1sxm n GLN 12 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1sxm n SER 14 N -1.50 0.58 -0.05 0.00 7.64 -0.87 -2.86 113.62 116.56 1sxm n SER 14 Ca 0.01 -0.96 -0.01 0.00 1.01 0.00 0.00 58.87 58.92 1sxm n SER 14 Cb 0.23 -0.03 -0.01 0.00 -1.01 0.00 0.00 64.21 63.39 1sxm n SER 14 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1sxm h LYS 15 N 0.84 -0.00 -0.30 1.43 1.57 -1.75 -3.17 116.57 115.18 1sxm h LYS 15 Ca 0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1sxm h LYS 15 Cb 0.27 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1sxm h LYS 15 CO 0.00 0.06 -0.43 -1.00 -0.57 0.00 0.00 179.45 177.51 1sxm h PRO 16 N -1.00 0.82 -0.06 3.15 0.13 -1.81 -3.05 132.00 130.18 1sxm h PRO 16 Ca -0.00 -0.48 -0.10 0.00 -0.87 0.00 0.00 66.00 64.54 1sxm h PRO 16 Cb 0.07 0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.22 1sxm h PRO 16 CO 0.00 1.12 -0.44 0.00 -0.23 0.00 0.00 178.00 178.45 1sxm n LYS 18 N -4.01 0.55 0.11 0.00 5.02 -1.20 -0.79 118.16 117.85 1sxm n LYS 18 Ca -0.02 -0.28 0.11 0.00 -2.02 0.00 0.00 58.31 56.10 1sxm n LYS 18 Cb 0.48 -1.49 0.02 0.00 -0.02 0.00 0.00 35.03 34.01 1sxm n LYS 18 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1sxm h GLU 19 N 0.69 0.00 0.00 1.97 4.57 -1.35 -3.24 114.58 117.22 1sxm h GLU 19 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1sxm h GLU 19 Cb 0.47 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1sxm h GLU 19 CO 0.00 0.02 -0.21 1.28 -1.18 0.00 0.00 179.01 178.93 1sxm n LEU 20 N -2.75 0.58 0.04 1.64 4.77 -0.59 -4.74 117.00 115.94 1sxm n LEU 20 Ca -0.00 0.28 0.11 0.00 -0.03 0.00 0.00 56.01 56.38 1sxm n LEU 20 Cb 0.57 -0.60 0.05 0.00 -2.33 0.00 0.00 43.42 41.11 1sxm n LEU 20 CO 0.39 -0.47 0.07 -1.22 -1.33 0.00 0.00 177.39 174.83 1sxm n TYR 21 N -3.03 0.35 0.00 -1.77 4.02 0.03 -5.02 117.16 111.74 1sxm n TYR 21 Ca -0.03 0.10 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1sxm n TYR 21 Cb 0.11 -0.51 0.00 0.00 -0.02 0.00 0.00 39.34 38.92 1sxm n TYR 21 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1sxm n GLY 22 N 1.35 1.96 0.00 2.72 0.00 -1.22 -3.97 105.19 106.04 1sxm n GLY 22 Ca 0.02 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1sxm n GLY 22 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sxm n SER 23 N 3.40 0.00 -4.20 1.61 3.41 -1.26 -4.67 113.62 111.91 1sxm n SER 23 Ca 0.00 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.17 1sxm n SER 23 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1sxm n SER 23 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1sxm n SER 24 N -1.02 5.43 -3.94 4.04 2.88 -1.25 -4.93 113.62 114.82 1sxm n SER 24 Ca 0.00 -3.10 -0.27 0.00 -1.33 0.00 0.00 58.87 54.17 1sxm n SER 24 Cb 0.00 -1.46 -0.17 0.00 -0.75 0.00 0.00 64.21 61.83 1sxm n SER 24 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sxm s ALA 25 N 0.01 1.42 -1.00 -1.46 0.00 -1.26 -3.83 121.76 115.64 1sxm s ALA 25 Ca 0.38 -0.60 -0.13 0.00 0.00 0.00 0.00 51.96 51.61 1sxm s ALA 25 Cb 0.01 -0.90 0.22 0.00 0.00 0.00 0.00 23.12 22.45 1sxm s ALA 25 CO 0.00 -0.35 1.03 0.20 0.00 0.00 0.00 175.76 176.64 1sxm s GLY 26 N 1.55 2.76 -0.36 0.00 0.00 -1.19 -4.52 107.32 105.56 1sxm s GLY 26 Ca 0.03 -3.46 -0.19 0.00 0.00 0.00 0.00 44.72 41.10 1sxm s GLY 26 CO -0.07 1.48 0.56 0.00 0.00 0.00 0.00 173.10 175.07 1sxm s ALA 27 N 0.12 3.46 0.02 3.20 0.00 -1.26 -1.97 121.76 125.33 1sxm s ALA 27 Ca 0.28 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.34 1sxm s ALA 27 Cb -0.08 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 19.93 1sxm s ALA 27 CO -0.08 -1.29 -0.21 0.15 0.00 0.00 0.00 175.76 174.33 1sxm s LYS 28 N 2.52 1.53 -0.13 0.00 1.02 -0.97 -4.85 119.74 118.86 1sxm s LYS 28 Ca 0.21 -0.89 -0.04 0.00 0.02 0.00 0.00 55.97 55.27 1sxm s LYS 28 Cb -0.15 -1.59 0.05 0.00 -0.52 0.00 0.00 37.83 35.62 1sxm s LYS 28 CO 0.14 0.42 0.08 0.00 -0.92 0.00 0.00 175.35 175.06 1sxm s MET 30 N 2.14 3.25 0.78 0.00 -1.94 -0.97 -4.68 119.30 117.88 1sxm s MET 30 Ca 0.03 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.30 1sxm s MET 30 Cb -0.15 -2.78 0.00 0.00 2.01 0.00 0.00 34.83 33.91 1sxm s MET 30 CO -0.07 -0.11 0.00 0.09 -0.01 0.00 0.00 175.02 174.92 1sxm n ASN 31 N 4.45 0.00 -2.66 3.03 3.02 -1.26 -2.50 115.26 119.33 1sxm n ASN 31 Ca -0.19 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.31 1sxm n ASN 31 Cb 0.51 0.00 0.07 0.00 -0.61 0.00 0.00 39.78 39.75 1sxm n ASN 31 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1sxm n GLY 32 N 0.00 0.54 3.29 7.41 0.00 -1.26 -4.82 105.19 110.34 1sxm n GLY 32 Ca 0.00 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 1sxm n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sxm s LYS 33 N 0.13 0.71 0.08 1.61 1.02 -1.04 -3.40 119.74 118.85 1sxm s LYS 33 Ca 0.14 -0.07 0.03 0.00 0.02 0.00 0.00 55.97 56.09 1sxm s LYS 33 Cb 0.27 0.32 -0.04 0.00 -0.52 0.00 0.00 37.83 37.86 1sxm s LYS 33 CO -0.06 -0.20 0.09 0.00 -0.92 0.00 0.00 175.35 174.26 1sxm s LYS 35 N -2.41 0.87 -0.21 0.00 1.02 -0.38 -2.36 119.74 116.26 1sxm s LYS 35 Ca 0.30 -0.34 0.01 0.00 0.02 0.00 0.00 55.97 55.96 1sxm s LYS 35 Cb -0.12 -0.83 0.05 0.00 -0.52 0.00 0.00 37.83 36.41 1sxm s LYS 35 CO 0.23 0.18 -0.09 0.00 -0.92 0.00 0.00 175.35 174.74 1sxm n TYR 37 N 4.67 0.00 -4.17 0.00 4.01 -0.83 -4.58 117.16 116.26 1sxm n TYR 37 Ca -0.14 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.46 1sxm n TYR 37 Cb 0.46 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.38 1sxm n TYR 37 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1sxm s ASN 38 N 0.30 1.35 0.00 7.72 -0.87 -1.26 -3.16 114.94 119.02 1sxm s ASN 38 Ca 0.00 -0.83 0.29 0.00 -1.57 0.00 0.00 52.86 50.75 1sxm s ASN 38 Cb 0.00 0.03 1.31 0.00 -0.02 0.00 0.00 41.25 42.57 1sxm s ASN 38 CO 0.00 -0.30 1.89 0.59 -2.57 0.00 0.00 177.10 176.71