#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 4.51 0.30 12.58 1.01 -1.26 -1.56 121.20 136.77 1sxm s ILE 2 Ca 0.00 -0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.47 1sxm s ILE 2 Cb 0.00 -3.18 0.05 0.00 0.01 0.00 0.00 42.46 39.34 1sxm s ILE 2 CO 0.00 0.24 0.41 2.30 0.00 0.00 0.00 174.94 177.89 1sxm n ILE 3 N 4.96 0.00 -3.71 2.92 -5.35 -0.93 -4.99 119.36 112.26 1sxm n ILE 3 Ca -0.15 -0.95 -0.28 0.00 -0.27 0.00 0.00 62.75 61.10 1sxm n ILE 3 Cb 0.51 -0.79 -0.12 0.00 -1.74 0.00 0.00 39.64 37.49 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 -2.82 3.52 -0.06 7.28 3.84 -1.26 -4.14 114.94 121.30 1sxm s ASN 4 Ca 0.31 -3.29 0.00 0.00 0.21 0.00 0.00 52.86 50.09 1sxm s ASN 4 Cb -0.02 -1.14 0.02 0.00 -0.55 0.00 0.00 41.25 39.56 1sxm s ASN 4 CO 0.20 -0.16 -0.03 -0.69 -2.79 0.00 0.00 177.10 173.63 1sxm s VAL 5 N -0.52 0.49 0.21 -5.21 1.01 -1.26 -4.98 120.40 110.14 1sxm s VAL 5 Ca 0.25 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 1sxm s VAL 5 Cb -0.08 -0.56 -0.08 0.00 0.00 0.00 0.00 36.38 35.66 1sxm s VAL 5 CO -0.13 0.24 0.93 -0.54 0.00 0.00 0.00 175.10 175.60 1sxm s LYS 6 N 1.28 4.80 0.24 2.72 -0.14 -1.26 -1.97 119.74 125.41 1sxm s LYS 6 Ca -0.05 1.46 -0.05 0.00 -1.36 0.00 0.00 55.97 55.96 1sxm s LYS 6 Cb -0.14 -3.30 -0.02 0.00 -1.68 0.00 0.00 37.83 32.69 1sxm s LYS 6 CO -0.02 0.45 0.30 0.00 -0.76 0.00 0.00 175.35 175.32 1sxm n THR 8 N -0.35 0.00 -4.20 0.00 5.66 -1.26 -4.54 114.28 109.59 1sxm n THR 8 Ca 0.01 -0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.89 1sxm n THR 8 Cb 0.64 0.07 -0.10 0.00 -1.55 0.00 0.00 70.33 69.39 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 -2.30 1.07 0.40 1.09 1.04 -1.26 -5.05 113.70 108.69 1sxm s SER 9 Ca -0.00 -1.10 0.28 0.00 0.48 0.00 0.00 55.95 55.61 1sxm s SER 9 Cb 0.00 0.13 1.19 0.00 0.10 0.00 0.00 66.02 67.44 1sxm s SER 9 CO 0.01 -0.54 1.84 -0.65 0.98 0.00 0.00 173.24 174.88 1sxm h PRO 10 N 2.84 0.00 0.00 4.02 0.11 -1.89 -3.02 132.00 134.06 1sxm h PRO 10 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 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 0.63 0.00 0.00 1.17 -0.21 0.00 0.00 178.00 179.59 1sxm n LYS 11 N -2.62 0.06 -0.25 1.05 3.00 -1.26 -1.99 118.16 116.14 1sxm n LYS 11 Ca 0.01 0.07 0.11 0.00 -0.00 0.00 0.00 58.31 58.50 1sxm n LYS 11 Cb 0.25 -1.57 0.27 0.00 0.00 0.00 0.00 35.03 33.98 1sxm n LYS 11 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 1sxm n GLN 12 N -1.68 2.48 0.00 1.64 7.27 -1.14 -3.85 117.38 122.10 1sxm n GLN 12 Ca 0.06 -2.27 0.00 0.00 0.07 0.00 0.00 57.00 54.87 1sxm n GLN 12 Cb 0.35 -1.51 0.00 0.00 2.41 0.00 0.00 30.24 31.49 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 -0.94 0.74 -0.06 0.00 7.64 -0.84 -2.90 113.62 117.26 1sxm n SER 14 Ca 0.00 -1.12 -0.05 0.00 1.01 0.00 0.00 58.87 58.71 1sxm n SER 14 Cb 0.00 -0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.15 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 1.12 0.00 -0.30 1.43 1.79 -1.81 -3.16 116.57 115.65 1sxm h LYS 15 Ca 0.00 0.00 -0.12 0.00 -2.18 0.00 0.00 60.65 58.35 1sxm h LYS 15 Cb 0.29 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.94 1sxm h LYS 15 CO 0.00 0.28 -0.29 -1.00 -1.08 0.00 0.00 179.45 177.36 1sxm h PRO 16 N -1.00 0.72 0.00 3.15 0.13 -1.85 -3.08 132.00 130.07 1sxm h PRO 16 Ca -0.02 -0.38 -0.10 0.00 -0.87 0.00 0.00 66.00 64.63 1sxm h PRO 16 Cb 0.36 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.49 1sxm h PRO 16 CO -0.01 1.00 -0.47 0.00 -0.23 0.00 0.00 178.00 178.28 1sxm n LYS 18 N -3.90 0.21 0.08 0.00 5.02 -1.19 -0.76 118.16 117.62 1sxm n LYS 18 Ca -0.01 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 1sxm n LYS 18 Cb 0.50 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.98 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 0.26 0.00 0.00 1.97 4.22 -1.37 -3.20 114.58 116.46 1sxm h GLU 19 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1sxm h GLU 19 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1sxm h GLU 19 CO 0.00 0.45 -0.32 -0.07 -2.18 0.00 0.00 179.01 176.89 1sxm h LEU 20 N 0.00 0.00 -0.18 1.64 3.38 -1.23 -3.43 115.31 115.49 1sxm h LEU 20 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1sxm h LEU 20 Cb 1.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1sxm h LEU 20 CO 0.06 0.49 -0.83 -1.22 0.09 0.00 0.00 178.44 177.03 1sxm n TYR 21 N -3.81 0.00 0.00 1.13 4.02 0.06 -5.04 117.16 113.52 1sxm n TYR 21 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 1sxm n TYR 21 Cb 0.17 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 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 1.86 0.00 2.72 0.00 -1.21 -3.58 105.19 106.46 1sxm n GLY 22 Ca 0.05 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 3.78 0.00 -3.82 1.61 7.64 -1.26 -4.62 113.62 116.95 1sxm n SER 23 Ca 0.00 -0.03 -0.38 0.00 1.01 0.00 0.00 58.87 59.47 1sxm n SER 23 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 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 5.63 -4.01 6.43 2.88 -1.24 -4.96 113.62 118.36 1sxm n SER 24 Ca 0.00 -3.43 -0.26 0.00 -1.33 0.00 0.00 58.87 53.85 1sxm n SER 24 Cb 0.01 -1.08 -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 -2.73 1.37 -0.81 -1.46 0.00 -1.17 -3.81 121.76 113.16 1sxm s ALA 25 Ca 0.34 -0.51 -0.08 0.00 0.00 0.00 0.00 51.96 51.71 1sxm s ALA 25 Cb 0.08 -0.69 0.21 0.00 0.00 0.00 0.00 23.12 22.72 1sxm s ALA 25 CO 0.07 -0.02 0.71 0.20 0.00 0.00 0.00 175.76 176.71 1sxm s GLY 26 N 0.93 2.76 -0.31 0.00 0.00 -1.09 -4.29 107.32 105.32 1sxm s GLY 26 Ca -0.09 -3.47 -0.21 0.00 0.00 0.00 0.00 44.72 40.95 1sxm s GLY 26 CO 0.00 1.20 0.66 0.00 0.00 0.00 0.00 173.10 174.97 1sxm s ALA 27 N -0.37 3.53 -0.02 3.20 0.00 -1.26 -1.85 121.76 125.00 1sxm s ALA 27 Ca 0.21 -0.60 0.07 0.00 0.00 0.00 0.00 51.96 51.64 1sxm s ALA 27 Cb -0.13 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 1sxm s ALA 27 CO -0.08 -1.10 -0.22 0.15 0.00 0.00 0.00 175.76 174.51 1sxm s LYS 28 N 2.68 1.79 -0.21 0.00 1.02 -1.06 -4.86 119.74 119.09 1sxm s LYS 28 Ca 0.27 -0.80 -0.03 0.00 0.02 0.00 0.00 55.97 55.43 1sxm s LYS 28 Cb -0.15 -1.73 0.07 0.00 -0.52 0.00 0.00 37.83 35.50 1sxm s LYS 28 CO 0.12 0.47 0.07 0.00 -0.92 0.00 0.00 175.35 175.09 1sxm s MET 30 N 1.93 3.50 1.23 0.00 -1.94 -1.01 -4.72 119.30 118.29 1sxm s MET 30 Ca 0.02 -0.58 0.00 0.00 -1.71 0.00 0.00 55.69 53.42 1sxm s MET 30 Cb -0.17 -2.98 0.00 0.00 2.01 0.00 0.00 34.83 33.69 1sxm s MET 30 CO -0.14 -0.03 0.00 -1.71 -0.01 0.00 0.00 175.02 173.13 1sxm n ASN 31 N 4.32 0.00 -2.66 3.03 2.85 -1.26 -2.58 115.26 118.96 1sxm n ASN 31 Ca -0.18 0.00 -0.05 0.00 -0.11 0.00 0.00 54.58 54.24 1sxm n ASN 31 Cb 0.52 0.00 0.06 0.00 1.24 0.00 0.00 39.78 41.59 1sxm n ASN 31 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1sxm n GLY 32 N 0.00 0.41 3.29 8.20 0.00 -1.26 -4.91 105.19 110.92 1sxm n GLY 32 Ca 0.00 -0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 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 0.12 0.75 0.08 1.61 1.02 -1.06 -3.18 119.74 119.08 1sxm s LYS 33 Ca 0.13 -0.15 0.03 0.00 0.02 0.00 0.00 55.97 55.99 1sxm s LYS 33 Cb 0.25 0.34 -0.04 0.00 -0.52 0.00 0.00 37.83 37.85 1sxm s LYS 33 CO -0.06 -0.22 0.09 0.00 -0.92 0.00 0.00 175.35 174.25 1sxm s LYS 35 N -2.44 0.80 -0.08 0.00 1.02 -0.50 -2.20 119.74 116.35 1sxm s LYS 35 Ca 0.30 -0.61 0.02 0.00 0.02 0.00 0.00 55.97 55.69 1sxm s LYS 35 Cb -0.12 -0.76 0.01 0.00 -0.52 0.00 0.00 37.83 36.44 1sxm s LYS 35 CO 0.23 0.19 -0.13 0.00 -0.92 0.00 0.00 175.35 174.72 1sxm n TYR 37 N 4.05 0.00 -3.78 0.00 4.01 -0.77 -3.42 117.16 117.26 1sxm n TYR 37 Ca -0.20 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.24 1sxm n TYR 37 Cb 0.51 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.40 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 0.34 4.09 0.00 7.72 -0.87 -1.26 -2.69 114.94 122.27 1sxm s ASN 38 Ca 0.00 -1.96 0.00 0.00 -1.57 0.00 0.00 52.86 49.33 1sxm s ASN 38 Cb 0.00 -1.05 0.00 0.00 -0.02 0.00 0.00 41.25 40.18 1sxm s ASN 38 CO 0.00 -0.38 0.02 0.59 -2.57 0.00 0.00 177.10 174.77