#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 2.18 0.56 12.58 1.01 -1.26 -1.98 121.20 134.28 1sxm s ILE 2 Ca 0.00 -1.08 0.09 0.00 0.00 0.00 0.00 60.65 59.66 1sxm s ILE 2 Cb 0.00 -2.01 0.08 0.00 0.01 0.00 0.00 42.46 40.54 1sxm s ILE 2 CO 0.00 0.39 0.75 0.27 0.00 0.00 0.00 174.94 176.35 1sxm s ILE 3 N 1.26 2.17 -0.79 2.92 -4.36 -1.05 -4.97 121.20 116.37 1sxm s ILE 3 Ca 0.02 -1.04 0.02 0.00 -0.26 0.00 0.00 60.65 59.39 1sxm s ILE 3 Cb -0.15 -2.21 0.26 0.00 1.25 0.00 0.00 42.46 41.62 1sxm s ILE 3 CO -0.10 0.00 0.95 -3.20 0.24 0.00 0.00 174.94 172.83 1sxm n ASN 4 N -2.18 4.55 -4.05 4.36 2.85 -1.26 -4.40 115.26 115.13 1sxm n ASN 4 Ca 0.14 -3.40 -0.17 0.00 -0.11 0.00 0.00 54.58 51.04 1sxm n ASN 4 Cb 0.62 -0.88 -0.13 0.00 1.24 0.00 0.00 39.78 40.62 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1sxm s VAL 5 N -2.44 0.72 -0.10 3.44 1.01 -1.26 -5.04 120.40 116.73 1sxm s VAL 5 Ca 0.36 -0.68 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 1sxm s VAL 5 Cb 0.09 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 1sxm s VAL 5 CO 0.01 -0.01 0.07 -0.54 0.00 0.00 0.00 175.10 174.63 1sxm s LYS 6 N -0.77 3.23 0.32 2.72 -0.14 -1.26 -1.18 119.74 122.66 1sxm s LYS 6 Ca -0.01 -0.26 0.02 0.00 -1.36 0.00 0.00 55.97 54.37 1sxm s LYS 6 Cb -0.06 -3.00 -0.02 0.00 -1.68 0.00 0.00 37.83 33.07 1sxm s LYS 6 CO 0.00 0.74 0.34 0.00 -0.76 0.00 0.00 175.35 175.68 1sxm n THR 8 N -0.56 0.00 -3.62 0.00 5.66 -1.26 -4.36 114.28 110.14 1sxm n THR 8 Ca 0.04 -0.07 -0.05 0.00 -3.05 0.00 0.00 64.05 60.91 1sxm n THR 8 Cb 0.62 0.27 -0.05 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 -0.55 -0.18 0.17 1.09 1.04 -1.26 -5.03 113.70 108.99 1sxm s SER 9 Ca 0.03 0.23 0.22 0.00 0.48 0.00 0.00 55.95 56.90 1sxm s SER 9 Cb 0.03 0.19 0.88 0.00 0.10 0.00 0.00 66.02 67.22 1sxm s SER 9 CO -0.01 -0.14 1.67 -2.65 0.98 0.00 0.00 173.24 173.09 1sxm n PRO 10 N 0.85 0.14 0.24 4.02 -0.02 -1.26 -2.94 135.00 136.03 1sxm n PRO 10 Ca -0.06 0.33 0.13 0.00 -2.02 0.00 0.00 63.50 61.88 1sxm n PRO 10 Cb 0.58 -1.75 0.44 0.00 -0.02 0.00 0.00 33.50 32.75 1sxm n PRO 10 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1sxm h LYS 11 N 0.00 0.00 0.00 -0.52 1.79 -1.96 -2.37 116.57 113.51 1sxm h LYS 11 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1sxm h LYS 11 Cb 0.39 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1sxm h LYS 11 CO 0.00 0.10 -0.56 0.37 -1.08 0.00 0.00 179.45 178.28 1sxm h GLN 12 N 0.00 0.00 0.00 3.15 5.75 -1.93 -3.34 115.11 118.74 1sxm h GLN 12 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1sxm h GLN 12 Cb 0.77 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.32 1sxm h GLN 12 CO 0.01 0.00 -1.20 0.00 -2.65 0.00 0.00 178.83 174.99 1sxm n SER 14 N -1.69 1.33 -0.03 0.00 3.41 -0.90 -3.07 113.62 112.68 1sxm n SER 14 Ca 0.00 -1.60 -0.01 0.00 -0.26 0.00 0.00 58.87 57.00 1sxm n SER 14 Cb 0.34 -0.07 -0.01 0.00 -0.26 0.00 0.00 64.21 64.21 1sxm n SER 14 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1sxm h LYS 15 N 1.83 -0.05 -0.31 4.33 1.57 -1.73 -3.16 116.57 119.05 1sxm h LYS 15 Ca 0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 1sxm h LYS 15 Cb 0.40 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 1sxm h LYS 15 CO 0.00 0.00 -0.49 -1.00 -0.57 0.00 0.00 179.45 177.39 1sxm h PRO 16 N -1.01 0.86 -0.02 3.15 0.13 -1.80 -3.06 132.00 130.24 1sxm h PRO 16 Ca -0.01 -0.51 -0.12 0.00 -0.87 0.00 0.00 66.00 64.49 1sxm h PRO 16 Cb 0.08 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.24 1sxm h PRO 16 CO 0.01 1.15 -0.55 0.00 -0.23 0.00 0.00 178.00 178.38 1sxm n LYS 18 N -3.89 0.40 0.13 0.00 5.02 -1.19 -0.79 118.16 117.84 1sxm n LYS 18 Ca -0.02 -0.21 0.12 0.00 -2.02 0.00 0.00 58.31 56.19 1sxm n LYS 18 Cb 0.56 -1.50 0.09 0.00 -0.02 0.00 0.00 35.03 34.16 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 0.50 0.00 0.00 1.97 4.81 -1.37 -3.21 114.58 117.29 1sxm h GLU 19 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1sxm h GLU 19 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1sxm h GLU 19 CO 0.00 0.00 -0.22 1.28 -0.73 0.00 0.00 179.01 179.34 1sxm n LEU 20 N -2.69 0.59 -0.04 1.64 4.77 -0.68 -4.77 117.00 115.84 1sxm n LEU 20 Ca 0.02 0.27 0.11 0.00 -0.03 0.00 0.00 56.01 56.38 1sxm n LEU 20 Cb 0.52 -0.60 0.07 0.00 -2.33 0.00 0.00 43.42 41.08 1sxm n LEU 20 CO 0.37 -0.47 0.22 -1.22 -1.33 0.00 0.00 177.39 174.97 1sxm n TYR 21 N -3.06 0.00 0.00 -1.77 4.02 0.03 -5.03 117.16 111.36 1sxm n TYR 21 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 1sxm n TYR 21 Cb 0.12 -0.11 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 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 1.49 2.07 0.00 2.72 0.00 -1.21 -3.76 105.19 106.50 1sxm n GLY 22 Ca 0.05 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1sxm n GLY 22 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1sxm n SER 23 N 3.32 0.00 -3.99 1.61 7.64 -1.26 -4.64 113.62 116.30 1sxm n SER 23 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 1sxm n SER 23 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1sxm n SER 23 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1sxm n SER 24 N 0.00 5.76 -3.95 6.43 2.88 -1.25 -4.94 113.62 118.55 1sxm n SER 24 Ca 0.00 -3.34 -0.25 0.00 -1.33 0.00 0.00 58.87 53.95 1sxm n SER 24 Cb 0.00 -1.19 -0.17 0.00 -0.75 0.00 0.00 64.21 62.10 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 -2.41 1.24 -1.00 -1.46 0.00 -1.26 -3.71 121.76 113.16 1sxm s ALA 25 Ca 0.32 -0.45 -0.12 0.00 0.00 0.00 0.00 51.96 51.71 1sxm s ALA 25 Cb 0.03 -0.73 0.24 0.00 0.00 0.00 0.00 23.12 22.66 1sxm s ALA 25 CO 0.04 -0.17 1.01 0.20 0.00 0.00 0.00 175.76 176.84 1sxm s GLY 26 N 1.23 2.89 -0.33 0.00 0.00 -1.20 -4.53 107.32 105.38 1sxm s GLY 26 Ca -0.04 -3.56 -0.18 0.00 0.00 0.00 0.00 44.72 40.94 1sxm s GLY 26 CO -0.03 1.39 0.51 0.00 0.00 0.00 0.00 173.10 174.98 1sxm s ALA 27 N -0.31 3.50 -0.02 3.20 0.00 -1.26 -2.04 121.76 124.83 1sxm s ALA 27 Ca 0.27 -0.91 0.07 0.00 0.00 0.00 0.00 51.96 51.38 1sxm s ALA 27 Cb -0.09 -2.99 -0.02 0.00 0.00 0.00 0.00 23.12 20.03 1sxm s ALA 27 CO -0.08 -1.11 -0.22 0.15 0.00 0.00 0.00 175.76 174.50 1sxm s LYS 28 N 2.38 1.82 -0.24 0.00 1.02 -0.95 -4.83 119.74 118.94 1sxm s LYS 28 Ca 0.19 -0.79 0.02 0.00 0.02 0.00 0.00 55.97 55.42 1sxm s LYS 28 Cb -0.15 -1.74 0.05 0.00 -0.52 0.00 0.00 37.83 35.47 1sxm s LYS 28 CO 0.12 0.47 -0.12 0.00 -0.92 0.00 0.00 175.35 174.90 1sxm s MET 30 N 1.19 3.01 0.92 0.00 -1.94 -1.02 -4.84 119.30 116.61 1sxm s MET 30 Ca -0.06 -0.84 0.00 0.00 -1.71 0.00 0.00 55.69 53.08 1sxm s MET 30 Cb -0.18 -2.49 0.00 0.00 2.01 0.00 0.00 34.83 34.17 1sxm s MET 30 CO -0.07 -0.09 0.00 0.09 -0.01 0.00 0.00 175.02 174.95 1sxm n ASN 31 N 4.27 0.00 -2.68 3.03 3.02 -1.26 -2.32 115.26 119.32 1sxm n ASN 31 Ca -0.20 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.30 1sxm n ASN 31 Cb 0.51 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.76 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 -0.39 3.34 7.41 0.00 -1.26 -4.87 105.19 109.41 1sxm n GLY 32 Ca 0.00 0.30 -0.15 0.00 0.00 0.00 0.00 46.02 46.17 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 0.11 0.76 -0.03 1.61 1.02 -0.98 -3.19 119.74 119.04 1sxm s LYS 33 Ca 0.17 0.08 -0.00 0.00 0.02 0.00 0.00 55.97 56.23 1sxm s LYS 33 Cb 0.25 0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 37.88 1sxm s LYS 33 CO -0.10 -0.20 0.03 0.00 -0.92 0.00 0.00 175.35 174.15 1sxm s LYS 35 N -1.39 1.39 -0.15 0.00 1.02 -0.56 -2.53 119.74 117.52 1sxm s LYS 35 Ca 0.18 -0.76 0.01 0.00 0.02 0.00 0.00 55.97 55.42 1sxm s LYS 35 Cb -0.12 -1.40 0.02 0.00 -0.52 0.00 0.00 37.83 35.82 1sxm s LYS 35 CO 0.09 0.37 -0.15 0.00 -0.92 0.00 0.00 175.35 174.74 1sxm n TYR 37 N 4.70 0.00 -4.15 0.00 4.01 -0.87 -3.34 117.16 117.51 1sxm n TYR 37 Ca -0.18 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.44 1sxm n TYR 37 Cb 0.50 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.43 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 1.00 1.16 0.00 7.72 -0.87 -1.26 -3.22 114.94 119.47 1sxm s ASN 38 Ca 0.00 -0.85 0.28 0.00 -1.57 0.00 0.00 52.86 50.72 1sxm s ASN 38 Cb 0.00 0.06 1.02 0.00 -0.02 0.00 0.00 41.25 42.30 1sxm s ASN 38 CO 0.00 -0.35 1.73 0.59 -2.57 0.00 0.00 177.10 176.50