#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 4.52 0.10 1.09 1.01 -1.26 -2.08 121.20 124.57 1sxm s ILE 2 Ca 0.00 -0.11 0.02 0.00 0.00 0.00 0.00 60.65 60.55 1sxm s ILE 2 Cb 0.00 -3.08 0.02 0.00 0.01 0.00 0.00 42.46 39.41 1sxm s ILE 2 CO 0.00 0.38 0.13 2.30 0.00 0.00 0.00 174.94 177.75 1sxm n ILE 3 N 4.37 0.00 -3.63 2.92 -5.35 -0.98 -4.96 119.36 111.73 1sxm n ILE 3 Ca -0.16 -0.33 -0.28 0.00 -0.27 0.00 0.00 62.75 61.71 1sxm n ILE 3 Cb 0.52 -0.88 -0.11 0.00 -1.74 0.00 0.00 39.64 37.43 1sxm n ILE 3 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1sxm s ASN 4 N -1.60 3.10 -0.06 7.28 2.47 -1.26 -4.29 114.94 120.59 1sxm s ASN 4 Ca 0.10 -3.22 0.01 0.00 0.42 0.00 0.00 52.86 50.17 1sxm s ASN 4 Cb -0.01 -0.97 0.02 0.00 -1.45 0.00 0.00 41.25 38.84 1sxm s ASN 4 CO 0.06 -0.17 -0.06 -0.69 -3.72 0.00 0.00 177.10 172.53 1sxm s VAL 5 N -0.37 0.69 0.01 -5.21 1.01 -1.26 -4.98 120.40 110.30 1sxm s VAL 5 Ca 0.26 -0.19 -0.27 0.00 0.00 0.00 0.00 61.98 61.78 1sxm s VAL 5 Cb -0.06 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.58 1sxm s VAL 5 CO -0.14 0.27 0.84 -0.54 0.00 0.00 0.00 175.10 175.53 1sxm s LYS 6 N 1.02 4.53 0.20 2.72 -0.14 -1.26 -1.47 119.74 125.34 1sxm s LYS 6 Ca -0.09 1.19 -0.02 0.00 -1.36 0.00 0.00 55.97 55.69 1sxm s LYS 6 Cb -0.14 -3.42 -0.04 0.00 -1.68 0.00 0.00 37.83 32.55 1sxm s LYS 6 CO -0.00 0.11 0.15 0.00 -0.76 0.00 0.00 175.35 174.86 1sxm n THR 8 N -0.28 0.00 -3.58 0.00 5.66 -1.26 -4.39 114.28 110.43 1sxm n THR 8 Ca 0.02 -0.23 -0.10 0.00 -3.05 0.00 0.00 64.05 60.68 1sxm n THR 8 Cb 0.66 0.49 -0.05 0.00 -1.55 0.00 0.00 70.33 69.88 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 -0.98 -0.38 0.30 1.09 1.04 -1.26 -5.04 113.70 108.47 1sxm s SER 9 Ca 0.08 0.43 0.25 0.00 0.48 0.00 0.00 55.95 57.20 1sxm s SER 9 Cb 0.09 0.34 1.00 0.00 0.10 0.00 0.00 66.02 67.55 1sxm s SER 9 CO -0.04 -0.33 1.76 -0.65 0.98 0.00 0.00 173.24 174.96 1sxm h PRO 10 N 2.67 0.00 0.00 4.02 0.11 -1.89 -2.98 132.00 133.93 1sxm h PRO 10 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1sxm h PRO 10 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1sxm h PRO 10 CO 0.30 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.72 1sxm n LYS 11 N -2.37 0.09 0.00 1.05 4.01 -1.26 -1.94 118.16 117.73 1sxm n LYS 11 Ca 0.02 0.11 0.12 0.00 -0.51 0.00 0.00 58.31 58.06 1sxm n LYS 11 Cb 0.27 -1.61 0.25 0.00 -0.51 0.00 0.00 35.03 33.43 1sxm n LYS 11 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 1sxm n GLN 12 N -1.76 1.18 -0.00 1.97 7.27 -1.13 -4.02 117.38 120.89 1sxm n GLN 12 Ca 0.06 -0.83 0.01 0.00 0.07 0.00 0.00 57.00 56.31 1sxm n GLN 12 Cb 0.34 -1.48 -0.01 0.00 2.41 0.00 0.00 30.24 31.50 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 -1.23 1.24 -0.04 0.00 7.64 -0.82 -3.24 113.62 117.18 1sxm n SER 14 Ca 0.00 -1.46 -0.02 0.00 1.01 0.00 0.00 58.87 58.40 1sxm n SER 14 Cb 0.04 -0.02 -0.02 0.00 -1.01 0.00 0.00 64.21 63.20 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 1.88 -0.02 -0.30 1.43 1.57 -1.77 -3.15 116.57 116.21 1sxm h LYS 15 Ca 0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.60 1sxm h LYS 15 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1sxm h LYS 15 CO 0.00 0.11 -0.54 -1.00 -0.57 0.00 0.00 179.45 177.44 1sxm h PRO 16 N -1.00 0.89 0.00 3.15 0.13 -1.83 -3.03 132.00 130.31 1sxm h PRO 16 Ca -0.00 -0.56 -0.09 0.00 -0.87 0.00 0.00 66.00 64.48 1sxm h PRO 16 Cb 0.13 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.31 1sxm h PRO 16 CO 0.00 1.20 -0.41 0.00 -0.23 0.00 0.00 178.00 178.57 1sxm n LYS 18 N -3.43 0.28 0.14 0.00 5.02 -1.19 -0.89 118.16 118.09 1sxm n LYS 18 Ca 0.00 -0.14 0.12 0.00 -2.02 0.00 0.00 58.31 56.27 1sxm n LYS 18 Cb 0.57 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 34.14 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 0.35 0.00 0.00 1.97 4.81 -1.34 -3.18 114.58 117.19 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 -0.28 1.28 -0.73 0.00 0.00 179.01 179.28 1sxm n LEU 20 N -2.77 0.76 -0.24 1.64 4.77 -0.63 -4.75 117.00 115.77 1sxm n LEU 20 Ca 0.01 0.31 0.12 0.00 -0.03 0.00 0.00 56.01 56.42 1sxm n LEU 20 Cb 0.54 -0.63 0.13 0.00 -2.33 0.00 0.00 43.42 41.12 1sxm n LEU 20 CO 0.38 -0.46 0.36 -1.22 -1.33 0.00 0.00 177.39 175.12 1sxm n TYR 21 N -3.25 0.00 0.00 -1.77 4.02 -0.07 -5.03 117.16 111.07 1sxm n TYR 21 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 1sxm n TYR 21 Cb 0.14 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.39 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 1.42 1.98 0.00 2.72 0.00 -1.20 -3.50 105.19 106.61 1sxm n GLY 22 Ca 0.08 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 3.86 0.00 -4.05 1.61 7.64 -1.26 -4.63 113.62 116.78 1sxm n SER 23 Ca 0.00 -0.41 -0.42 0.00 1.01 0.00 0.00 58.87 59.05 1sxm n SER 23 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 5.86 -3.55 6.43 2.88 -1.23 -4.93 113.62 119.09 1sxm n SER 24 Ca 0.00 -3.31 -0.08 0.00 -1.33 0.00 0.00 58.87 54.15 1sxm n SER 24 Cb 0.10 -1.24 -0.09 0.00 -0.75 0.00 0.00 64.21 62.24 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 -2.31 -1.16 -0.90 -1.46 0.00 -1.08 -3.71 121.76 111.15 1sxm s ALA 25 Ca 0.31 1.32 -0.00 0.00 0.00 0.00 0.00 51.96 53.59 1sxm s ALA 25 Cb 0.01 -1.45 0.27 0.00 0.00 0.00 0.00 23.12 21.95 1sxm s ALA 25 CO 0.04 -0.93 1.08 0.41 0.00 0.00 0.00 175.76 176.35 1sxm n GLY 26 N 5.38 4.80 3.76 0.00 0.00 -1.25 -4.74 105.19 113.14 1sxm n GLY 26 Ca -0.07 -2.69 -0.39 0.00 0.00 0.00 0.00 46.02 42.87 1sxm n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sxm s ALA 27 N -2.34 3.36 0.02 4.61 0.00 -1.26 -4.44 121.76 121.71 1sxm s ALA 27 Ca 0.33 0.54 0.08 0.00 0.00 0.00 0.00 51.96 52.91 1sxm s ALA 27 Cb 0.05 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 1sxm s ALA 27 CO 0.01 0.23 -0.24 0.15 0.00 0.00 0.00 175.76 175.91 1sxm s LYS 28 N -1.28 1.71 -0.33 0.00 1.02 -0.99 -4.79 119.74 115.08 1sxm s LYS 28 Ca 0.41 -0.96 0.02 0.00 0.02 0.00 0.00 55.97 55.45 1sxm s LYS 28 Cb -0.24 -1.78 0.09 0.00 -0.52 0.00 0.00 37.83 35.37 1sxm s LYS 28 CO 0.30 0.47 0.04 0.00 -0.92 0.00 0.00 175.35 175.23 1sxm s MET 30 N 1.04 3.41 0.93 0.00 -1.94 -1.07 -4.86 119.30 116.82 1sxm s MET 30 Ca 0.04 -0.62 0.00 0.00 -1.71 0.00 0.00 55.69 53.40 1sxm s MET 30 Cb -0.20 -2.97 0.00 0.00 2.01 0.00 0.00 34.83 33.67 1sxm s MET 30 CO -0.06 -0.11 0.00 0.09 -0.01 0.00 0.00 175.02 174.93 1sxm n ASN 31 N 4.55 0.00 -2.68 3.03 3.02 -1.26 -2.45 115.26 119.48 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 0.06 0.00 -0.61 0.00 0.00 39.78 39.74 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 -0.36 3.30 7.41 0.00 -1.26 -4.90 105.19 109.38 1sxm n GLY 32 Ca 0.00 0.18 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 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 0.09 0.80 -0.07 1.61 1.02 -1.03 -3.14 119.74 119.03 1sxm s LYS 33 Ca 0.13 -0.22 -0.03 0.00 0.02 0.00 0.00 55.97 55.88 1sxm s LYS 33 Cb 0.21 0.36 -0.04 0.00 -0.52 0.00 0.00 37.83 37.85 1sxm s LYS 33 CO -0.08 -0.25 0.05 0.00 -0.92 0.00 0.00 175.35 174.15 1sxm s LYS 35 N -1.10 1.63 -0.05 0.00 1.02 -0.53 -2.32 119.74 118.39 1sxm s LYS 35 Ca 0.16 -1.21 0.05 0.00 0.02 0.00 0.00 55.97 54.99 1sxm s LYS 35 Cb -0.12 -1.94 -0.02 0.00 -0.52 0.00 0.00 37.83 35.24 1sxm s LYS 35 CO 0.05 0.48 -0.20 0.00 -0.92 0.00 0.00 175.35 174.77 1sxm n TYR 37 N 2.64 -0.04 -3.78 0.00 4.01 -1.26 -3.46 117.16 115.26 1sxm n TYR 37 Ca -0.17 -2.77 -0.29 0.00 -0.16 0.00 0.00 57.90 54.51 1sxm n TYR 37 Cb 0.52 0.05 -0.13 0.00 -0.31 0.00 0.00 39.34 39.47 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 -3.58 3.86 0.00 7.72 0.01 -1.26 -4.10 114.94 117.58 1sxm s ASN 38 Ca 0.25 -2.93 0.00 0.00 -0.71 0.00 0.00 52.86 49.48 1sxm s ASN 38 Cb 0.01 -1.25 0.00 0.00 0.41 0.00 0.00 41.25 40.43 1sxm s ASN 38 CO 0.18 -0.23 0.21 0.59 -1.51 0.00 0.00 177.10 176.35