#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 1.60 0.40 2.28 1.01 -1.26 -2.30 121.20 122.93 1sxm s ILE 2 Ca 0.00 -0.91 0.05 0.00 0.00 0.00 0.00 60.65 59.80 1sxm s ILE 2 Cb 0.00 -1.64 0.05 0.00 0.01 0.00 0.00 42.46 40.88 1sxm s ILE 2 CO 0.00 0.23 0.44 2.30 0.00 0.00 0.00 174.94 177.91 1sxm n ILE 3 N 4.71 0.00 -3.69 2.92 -5.35 -0.88 -4.98 119.36 112.10 1sxm n ILE 3 Ca -0.15 -1.43 -0.29 0.00 -0.27 0.00 0.00 62.75 60.61 1sxm n ILE 3 Cb 0.47 -0.44 -0.16 0.00 -1.74 0.00 0.00 39.64 37.77 1sxm n ILE 3 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 1sxm s ASN 4 N -3.41 3.46 -0.08 7.28 -0.87 -1.26 -3.93 114.94 116.13 1sxm s ASN 4 Ca 0.34 -1.23 -0.04 0.00 -1.57 0.00 0.00 52.86 50.36 1sxm s ASN 4 Cb -0.03 -0.63 -0.03 0.00 -0.02 0.00 0.00 41.25 40.54 1sxm s ASN 4 CO 0.21 -0.38 -0.10 0.52 -2.57 0.00 0.00 177.10 174.78 1sxm n VAL 5 N 5.03 0.43 -0.38 1.60 0.31 -1.26 -4.93 118.33 119.12 1sxm n VAL 5 Ca -0.06 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 1sxm n VAL 5 Cb 0.44 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 1sxm n VAL 5 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1sxm n LYS 6 N -3.35 0.00 -3.53 5.55 4.76 -1.25 -5.00 118.16 115.34 1sxm n LYS 6 Ca -0.15 0.38 -0.12 0.00 -2.87 0.00 0.00 58.31 55.55 1sxm n LYS 6 Cb 0.61 0.00 -0.03 0.00 -1.84 0.00 0.00 35.03 33.77 1sxm n LYS 6 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1sxm n THR 8 N -0.47 0.00 -3.60 0.00 5.66 -1.26 -4.57 114.28 110.04 1sxm n THR 8 Ca 0.01 -0.15 -0.07 0.00 -3.05 0.00 0.00 64.05 60.79 1sxm n THR 8 Cb 0.47 0.39 -0.05 0.00 -1.55 0.00 0.00 70.33 69.60 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 -0.79 -0.23 0.24 1.09 1.04 -1.26 -5.02 113.70 108.77 1sxm s SER 9 Ca 0.05 0.24 0.23 0.00 0.48 0.00 0.00 55.95 56.95 1sxm s SER 9 Cb 0.06 0.19 0.95 0.00 0.10 0.00 0.00 66.02 67.32 1sxm s SER 9 CO -0.03 -0.22 1.69 -2.65 0.98 0.00 0.00 173.24 173.02 1sxm n PRO 10 N 0.61 0.18 0.13 4.02 -0.02 -1.26 -2.92 135.00 135.73 1sxm n PRO 10 Ca -0.06 0.41 0.13 0.00 -2.02 0.00 0.00 63.50 61.96 1sxm n PRO 10 Cb 0.58 -1.84 0.43 0.00 -0.02 0.00 0.00 33.50 32.64 1sxm n PRO 10 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1sxm h LYS 11 N 0.00 0.00 -0.59 -0.52 1.63 -1.95 -2.36 116.57 112.78 1sxm h LYS 11 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1sxm h LYS 11 Cb 0.35 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.98 1sxm h LYS 11 CO 0.00 0.00 0.00 0.94 -3.45 0.00 0.00 179.45 176.94 1sxm n GLN 12 N -2.34 2.50 0.00 1.90 7.27 -1.15 -3.96 117.38 121.60 1sxm n GLN 12 Ca 0.04 -2.31 0.00 0.00 0.07 0.00 0.00 57.00 54.80 1sxm n GLN 12 Cb 0.38 -1.51 0.00 0.00 2.41 0.00 0.00 30.24 31.52 1sxm n GLN 12 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1sxm n SER 14 N -0.95 0.53 -0.07 0.00 7.64 -0.90 -2.73 113.62 117.14 1sxm n SER 14 Ca 0.00 -0.41 -0.09 0.00 1.01 0.00 0.00 58.87 59.38 1sxm n SER 14 Cb 0.00 -0.01 -0.07 0.00 -1.01 0.00 0.00 64.21 63.12 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 0.48 0.00 -0.24 1.43 1.79 -1.82 -3.16 116.57 115.05 1sxm h LYS 15 Ca 0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 1sxm h LYS 15 Cb 0.45 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.09 1sxm h LYS 15 CO 0.00 0.56 -0.01 -1.00 -1.08 0.00 0.00 179.45 177.92 1sxm h PRO 16 N -1.00 0.43 -0.04 3.15 0.13 -1.82 -3.00 132.00 129.86 1sxm h PRO 16 Ca -0.05 -0.14 -0.10 0.00 -0.87 0.00 0.00 66.00 64.84 1sxm h PRO 16 Cb 0.65 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.73 1sxm h PRO 16 CO -0.03 0.62 -0.44 0.00 -0.23 0.00 0.00 178.00 177.92 1sxm n LYS 18 N -4.01 0.60 0.10 0.00 5.02 -1.19 -0.56 118.16 118.13 1sxm n LYS 18 Ca -0.02 -0.30 0.09 0.00 -2.02 0.00 0.00 58.31 56.06 1sxm n LYS 18 Cb 0.48 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 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 0.74 0.00 0.00 1.97 4.81 -1.33 -3.24 114.58 117.53 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 0.46 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1sxm h GLU 19 CO 0.00 0.08 -0.21 1.28 -0.73 0.00 0.00 179.01 179.43 1sxm n LEU 20 N -2.79 0.62 -0.22 1.64 4.77 -0.75 -4.75 117.00 115.51 1sxm n LEU 20 Ca -0.02 0.31 0.11 0.00 -0.03 0.00 0.00 56.01 56.39 1sxm n LEU 20 Cb 0.62 -0.61 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1sxm n LEU 20 CO 0.40 -0.47 0.26 -1.22 -1.33 0.00 0.00 177.39 175.03 1sxm n TYR 21 N -3.07 0.00 0.00 -1.77 4.01 0.28 -5.03 117.16 111.57 1sxm n TYR 21 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 1sxm n TYR 21 Cb 0.11 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1sxm n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sxm n GLY 22 N 1.45 2.01 0.00 2.72 0.00 -1.22 -3.46 105.19 106.68 1sxm n GLY 22 Ca 0.07 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 4.07 0.00 -3.79 1.61 7.64 -1.26 -4.62 113.62 117.27 1sxm n SER 23 Ca 0.00 -0.04 -0.38 0.00 1.01 0.00 0.00 58.87 59.46 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 -4.00 6.43 2.88 -1.22 -4.97 113.62 118.49 1sxm n SER 24 Ca 0.00 -3.45 -0.27 0.00 -1.33 0.00 0.00 58.87 53.82 1sxm n SER 24 Cb 0.01 -1.09 -0.17 0.00 -0.75 0.00 0.00 64.21 62.22 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 -2.86 1.47 -0.80 -1.46 0.00 -1.20 -3.80 121.76 113.11 1sxm s ALA 25 Ca 0.34 -0.59 -0.12 0.00 0.00 0.00 0.00 51.96 51.59 1sxm s ALA 25 Cb 0.09 -0.79 0.21 0.00 0.00 0.00 0.00 23.12 22.63 1sxm s ALA 25 CO 0.05 -0.14 0.72 0.20 0.00 0.00 0.00 175.76 176.59 1sxm s GLY 26 N 1.13 2.65 -0.39 0.00 0.00 -1.09 -4.40 107.32 105.22 1sxm s GLY 26 Ca -0.05 -3.33 -0.17 0.00 0.00 0.00 0.00 44.72 41.17 1sxm s GLY 26 CO -0.03 1.23 0.43 0.00 0.00 0.00 0.00 173.10 174.74 1sxm s ALA 27 N 0.09 3.45 -0.01 3.20 0.00 -1.26 -1.91 121.76 125.31 1sxm s ALA 27 Ca 0.18 -1.38 0.06 0.00 0.00 0.00 0.00 51.96 50.82 1sxm s ALA 27 Cb -0.12 -3.00 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 1sxm s ALA 27 CO -0.08 -1.42 -0.19 0.15 0.00 0.00 0.00 175.76 174.22 1sxm s LYS 28 N 2.15 1.51 -0.19 0.00 1.02 -0.96 -4.87 119.74 118.41 1sxm s LYS 28 Ca 0.13 -0.68 -0.03 0.00 0.02 0.00 0.00 55.97 55.41 1sxm s LYS 28 Cb -0.17 -1.47 0.06 0.00 -0.52 0.00 0.00 37.83 35.73 1sxm s LYS 28 CO 0.13 0.40 0.03 0.00 -0.92 0.00 0.00 175.35 174.99 1sxm s MET 30 N 1.84 2.69 0.00 0.00 -1.94 -0.98 -4.71 119.30 116.20 1sxm s MET 30 Ca -0.01 -0.75 0.00 0.00 -1.71 0.00 0.00 55.69 53.22 1sxm s MET 30 Cb -0.17 -2.07 0.00 0.00 2.01 0.00 0.00 34.83 34.60 1sxm s MET 30 CO -0.08 0.12 0.00 0.09 -0.01 0.00 0.00 175.02 175.15 1sxm n ASN 31 N 3.65 0.00 -0.11 3.03 4.13 -1.26 -2.63 115.26 122.07 1sxm n ASN 31 Ca -0.20 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.06 1sxm n ASN 31 Cb 0.53 -0.34 0.00 0.00 -1.54 0.00 0.00 39.78 38.42 1sxm n ASN 31 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1sxm n GLY 32 N -2.00 0.89 3.33 7.41 0.00 -1.26 -5.02 105.19 108.54 1sxm n GLY 32 Ca 0.00 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.73 1.01 0.17 1.61 1.02 -1.08 -3.51 119.74 118.23 1sxm s LYS 33 Ca 0.00 -0.48 0.05 0.00 0.02 0.00 0.00 55.97 55.56 1sxm s LYS 33 Cb 0.00 0.45 -0.04 0.00 -0.52 0.00 0.00 37.83 37.72 1sxm s LYS 33 CO 0.00 -0.37 0.16 0.00 -0.92 0.00 0.00 175.35 174.22 1sxm s LYS 35 N -3.21 0.96 -0.18 0.00 1.02 -0.20 -2.06 119.74 116.06 1sxm s LYS 35 Ca 0.32 -0.27 0.01 0.00 0.02 0.00 0.00 55.97 56.04 1sxm s LYS 35 Cb -0.10 -0.90 0.03 0.00 -0.52 0.00 0.00 37.83 36.35 1sxm s LYS 35 CO 0.24 0.07 -0.14 0.00 -0.92 0.00 0.00 175.35 174.60 1sxm n TYR 37 N 4.68 -0.40 -3.78 0.00 4.01 -0.80 -1.75 117.16 119.12 1sxm n TYR 37 Ca -0.17 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.27 1sxm n TYR 37 Cb 0.48 0.00 -0.13 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 -0.33 3.87 0.00 7.72 0.01 -1.26 -2.67 114.94 122.28 1sxm s ASN 38 Ca 0.00 -2.63 0.00 0.00 -0.71 0.00 0.00 52.86 49.52 1sxm s ASN 38 Cb 0.00 -1.18 0.00 0.00 0.41 0.00 0.00 41.25 40.48 1sxm s ASN 38 CO 0.00 -0.27 0.05 0.59 -1.51 0.00 0.00 177.10 175.96