#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 1.00 0.00 2.28 1.01 -1.26 -1.97 121.20 122.26 1sxm s ILE 2 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.31 1sxm s ILE 2 Cb 0.00 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.49 1sxm s ILE 2 CO 0.00 0.35 0.00 2.30 0.00 0.00 0.00 174.94 177.59 1sxm n ILE 3 N 4.38 0.00 -3.52 2.92 -5.35 -0.94 -4.91 119.36 111.94 1sxm n ILE 3 Ca -0.18 0.00 -0.27 0.00 -0.27 0.00 0.00 62.75 62.03 1sxm n ILE 3 Cb 0.51 -0.32 -0.11 0.00 -1.74 0.00 0.00 39.64 37.98 1sxm n ILE 3 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1sxm s ASN 4 N -0.99 2.34 -0.08 7.28 2.20 -1.26 -4.30 114.94 120.12 1sxm s ASN 4 Ca 0.00 -3.21 0.02 0.00 -0.94 0.00 0.00 52.86 48.73 1sxm s ASN 4 Cb 0.00 -0.73 0.02 0.00 -2.00 0.00 0.00 41.25 38.53 1sxm s ASN 4 CO 0.00 -0.16 -0.12 -0.69 -2.94 0.00 0.00 177.10 173.20 1sxm s VAL 5 N -0.25 1.17 0.11 3.54 1.01 -1.26 -4.96 120.40 119.76 1sxm s VAL 5 Ca 0.30 -0.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.52 1sxm s VAL 5 Cb 0.00 -1.09 -0.06 0.00 0.00 0.00 0.00 36.38 35.23 1sxm s VAL 5 CO -0.18 0.37 1.01 -0.54 0.00 0.00 0.00 175.10 175.77 1sxm s LYS 6 N 0.95 4.64 0.21 2.72 -0.14 -1.26 -1.59 119.74 125.28 1sxm s LYS 6 Ca -0.09 1.53 -0.07 0.00 -1.36 0.00 0.00 55.97 55.98 1sxm s LYS 6 Cb -0.15 -3.36 -0.02 0.00 -1.68 0.00 0.00 37.83 32.62 1sxm s LYS 6 CO 0.00 0.13 0.29 0.00 -0.76 0.00 0.00 175.35 175.01 1sxm n THR 8 N -0.29 0.00 -3.58 0.00 5.66 -1.26 -4.36 114.28 110.45 1sxm n THR 8 Ca -0.02 -0.26 -0.10 0.00 -3.05 0.00 0.00 64.05 60.62 1sxm n THR 8 Cb 0.64 0.52 -0.05 0.00 -1.55 0.00 0.00 70.33 69.89 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 -1.04 -0.37 0.18 1.09 1.04 -1.26 -5.04 113.70 108.30 1sxm s SER 9 Ca 0.09 0.41 0.22 0.00 0.48 0.00 0.00 55.95 57.15 1sxm s SER 9 Cb 0.10 0.31 0.90 0.00 0.10 0.00 0.00 66.02 67.43 1sxm s SER 9 CO -0.04 -0.34 1.68 -2.65 0.98 0.00 0.00 173.24 172.87 1sxm n PRO 10 N 0.76 0.15 -0.09 4.02 -0.02 -1.26 -2.65 135.00 135.91 1sxm n PRO 10 Ca -0.10 0.34 0.07 0.00 -2.02 0.00 0.00 63.50 61.79 1sxm n PRO 10 Cb 0.58 -1.77 0.28 0.00 -0.02 0.00 0.00 33.50 32.57 1sxm n PRO 10 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1sxm n LYS 11 N -2.05 1.53 -0.46 -0.52 4.76 -1.26 -2.33 118.16 117.83 1sxm n LYS 11 Ca 0.03 -0.81 0.06 0.00 -2.87 0.00 0.00 58.31 54.72 1sxm n LYS 11 Cb 0.25 -1.28 0.23 0.00 -1.84 0.00 0.00 35.03 32.38 1sxm n LYS 11 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 1sxm n GLN 12 N 0.09 2.38 0.00 1.97 7.27 -1.09 -4.43 117.38 123.58 1sxm n GLN 12 Ca 0.12 -2.88 0.00 0.00 0.07 0.00 0.00 57.00 54.31 1sxm n GLN 12 Cb 0.23 -1.78 0.00 0.00 2.41 0.00 0.00 30.24 31.10 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 0.00 0.35 -0.06 0.00 7.64 -0.98 -2.82 113.62 117.75 1sxm n SER 14 Ca 0.00 -0.95 -0.06 0.00 1.01 0.00 0.00 58.87 58.87 1sxm n SER 14 Cb 0.00 -0.04 -0.04 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 0.53 0.00 -0.40 1.43 1.79 -1.87 -3.15 116.57 114.90 1sxm h LYS 15 Ca 0.00 0.00 -0.15 0.00 -2.18 0.00 0.00 60.65 58.32 1sxm h LYS 15 Cb 0.18 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.82 1sxm h LYS 15 CO 0.00 0.32 -0.32 -1.00 -1.08 0.00 0.00 179.45 177.37 1sxm h PRO 16 N -1.00 0.92 -0.07 3.15 0.13 -1.90 -3.04 132.00 130.19 1sxm h PRO 16 Ca -0.03 -0.46 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 1sxm h PRO 16 Cb 0.43 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.55 1sxm h PRO 16 CO -0.02 1.11 -0.45 0.00 -0.23 0.00 0.00 178.00 178.42 1sxm n LYS 18 N -4.00 0.50 0.13 0.00 5.02 -1.19 -0.73 118.16 117.89 1sxm n LYS 18 Ca -0.02 -0.25 0.12 0.00 -2.02 0.00 0.00 58.31 56.14 1sxm n LYS 18 Cb 0.50 -1.49 0.06 0.00 -0.02 0.00 0.00 35.03 34.07 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 0.62 0.00 0.00 1.97 4.81 -1.35 -3.23 114.58 117.39 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 0.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1sxm h GLU 19 CO 0.00 0.00 -0.18 1.28 -0.73 0.00 0.00 179.01 179.38 1sxm n LEU 20 N -2.72 0.49 0.00 1.64 4.77 -0.68 -4.76 117.00 115.74 1sxm n LEU 20 Ca 0.01 0.25 0.11 0.00 -0.03 0.00 0.00 56.01 56.36 1sxm n LEU 20 Cb 0.53 -0.59 0.06 0.00 -2.33 0.00 0.00 43.42 41.10 1sxm n LEU 20 CO 0.38 -0.47 0.18 -1.22 -1.33 0.00 0.00 177.39 174.93 1sxm n TYR 21 N -2.93 0.03 0.00 -1.77 4.02 0.09 -5.03 117.16 111.57 1sxm n TYR 21 Ca -0.03 0.01 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 1sxm n TYR 21 Cb 0.09 -0.17 0.00 0.00 -0.02 0.00 0.00 39.34 39.25 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 1.48 2.10 0.00 2.72 0.00 -1.22 -3.83 105.19 106.44 1sxm n GLY 22 Ca 0.04 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 3.16 0.00 -4.09 1.61 7.64 -1.26 -4.63 113.62 116.04 1sxm n SER 23 Ca 0.00 0.00 -0.42 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 5.65 -3.88 6.43 2.88 -1.25 -4.94 113.62 118.51 1sxm n SER 24 Ca 0.00 -3.25 -0.24 0.00 -1.33 0.00 0.00 58.87 54.04 1sxm n SER 24 Cb 0.00 -1.24 -0.17 0.00 -0.75 0.00 0.00 64.21 62.05 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 -2.09 1.04 -0.94 -1.46 0.00 -1.26 -3.78 121.76 113.27 1sxm s ALA 25 Ca 0.31 -0.33 -0.13 0.00 0.00 0.00 0.00 51.96 51.81 1sxm s ALA 25 Cb -0.01 -0.74 0.23 0.00 0.00 0.00 0.00 23.12 22.60 1sxm s ALA 25 CO 0.00 -0.29 0.94 0.20 0.00 0.00 0.00 175.76 176.61 1sxm s GLY 26 N 1.51 2.77 -0.33 0.00 0.00 -1.21 -4.54 107.32 105.51 1sxm s GLY 26 Ca -0.00 -3.44 -0.17 0.00 0.00 0.00 0.00 44.72 41.10 1sxm s GLY 26 CO -0.04 1.38 0.46 0.00 0.00 0.00 0.00 173.10 174.90 1sxm s ALA 27 N 0.00 3.50 0.03 3.20 0.00 -1.26 -2.03 121.76 125.19 1sxm s ALA 27 Ca 0.24 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.27 1sxm s ALA 27 Cb -0.09 -2.92 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 1sxm s ALA 27 CO -0.08 -1.08 -0.21 0.15 0.00 0.00 0.00 175.76 174.53 1sxm s LYS 28 N 2.25 1.52 -0.20 0.00 1.02 -0.89 -4.84 119.74 118.60 1sxm s LYS 28 Ca 0.17 -0.90 0.01 0.00 0.02 0.00 0.00 55.97 55.27 1sxm s LYS 28 Cb -0.16 -1.59 0.04 0.00 -0.52 0.00 0.00 37.83 35.60 1sxm s LYS 28 CO 0.12 0.42 -0.12 0.00 -0.92 0.00 0.00 175.35 174.85 1sxm s MET 30 N 1.33 2.15 0.83 0.00 -1.94 -1.04 -4.86 119.30 115.76 1sxm s MET 30 Ca -0.01 -0.53 0.00 0.00 -1.71 0.00 0.00 55.69 53.44 1sxm s MET 30 Cb -0.16 -1.88 0.00 0.00 2.01 0.00 0.00 34.83 34.80 1sxm s MET 30 CO -0.08 -0.11 0.00 0.09 -0.01 0.00 0.00 175.02 174.91 1sxm n ASN 31 N 4.35 0.00 -2.68 3.03 3.02 -1.26 -2.46 115.26 119.27 1sxm n ASN 31 Ca -0.18 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.32 1sxm n ASN 31 Cb 0.51 0.00 0.05 0.00 -0.61 0.00 0.00 39.78 39.73 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 -0.25 3.31 7.41 0.00 -1.26 -4.89 105.19 109.51 1sxm n GLY 32 Ca 0.00 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 0.10 0.89 -0.00 1.61 1.02 -1.03 -3.41 119.74 118.91 1sxm s LYS 33 Ca 0.13 -0.32 -0.00 0.00 0.02 0.00 0.00 55.97 55.80 1sxm s LYS 33 Cb 0.22 0.40 -0.04 0.00 -0.52 0.00 0.00 37.83 37.88 1sxm s LYS 33 CO -0.07 -0.29 0.06 0.00 -0.92 0.00 0.00 175.35 174.13 1sxm s LYS 35 N -1.71 1.52 -0.21 0.00 1.02 -0.47 -2.21 119.74 117.69 1sxm s LYS 35 Ca 0.22 -0.62 0.01 0.00 0.02 0.00 0.00 55.97 55.60 1sxm s LYS 35 Cb -0.12 -1.42 0.05 0.00 -0.52 0.00 0.00 37.83 35.82 1sxm s LYS 35 CO 0.13 0.34 -0.08 0.00 -0.92 0.00 0.00 175.35 174.83 1sxm n TYR 37 N 4.69 0.00 -4.13 0.00 4.01 -0.86 -2.75 117.16 118.12 1sxm n TYR 37 Ca -0.13 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.49 1sxm n TYR 37 Cb 0.45 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 0.36 1.06 0.00 7.72 -0.87 -1.26 -3.32 114.94 118.63 1sxm s ASN 38 Ca 0.00 -0.82 0.28 0.00 -1.57 0.00 0.00 52.86 50.75 1sxm s ASN 38 Cb 0.00 0.07 1.11 0.00 -0.02 0.00 0.00 41.25 42.40 1sxm s ASN 38 CO 0.00 -0.35 1.78 0.59 -2.57 0.00 0.00 177.10 176.54