#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 1.21 0.30 1.09 1.01 -1.26 -2.13 121.20 121.42 1sxm s ILE 2 Ca 0.00 -0.41 0.04 0.00 0.00 0.00 0.00 60.65 60.27 1sxm s ILE 2 Cb 0.00 -1.18 0.04 0.00 0.01 0.00 0.00 42.46 41.32 1sxm s ILE 2 CO 0.00 0.40 0.30 2.30 0.00 0.00 0.00 174.94 177.94 1sxm n ILE 3 N 4.79 0.00 -3.60 2.92 -5.35 -0.97 -4.96 119.36 112.19 1sxm n ILE 3 Ca -0.15 -1.10 -0.27 0.00 -0.27 0.00 0.00 62.75 60.96 1sxm n ILE 3 Cb 0.50 -0.45 -0.10 0.00 -1.74 0.00 0.00 39.64 37.84 1sxm n ILE 3 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1sxm n ASN 4 N -2.22 1.45 -4.00 7.28 3.02 -1.26 -4.21 115.26 115.32 1sxm n ASN 4 Ca 0.03 -2.85 -0.25 0.00 -0.03 0.00 0.00 54.58 51.47 1sxm n ASN 4 Cb 0.32 -0.66 -0.17 0.00 -0.61 0.00 0.00 39.78 38.67 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1sxm s VAL 5 N -0.92 1.14 0.06 2.41 1.01 -1.26 -4.98 120.40 117.86 1sxm s VAL 5 Ca 0.30 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 1sxm s VAL 5 Cb 0.02 -1.06 -0.05 0.00 0.00 0.00 0.00 36.38 35.29 1sxm s VAL 5 CO -0.16 0.36 0.95 -0.54 0.00 0.00 0.00 175.10 175.71 1sxm s LYS 6 N 0.90 4.63 0.25 2.72 -0.14 -1.26 -1.63 119.74 125.22 1sxm s LYS 6 Ca -0.10 1.41 -0.01 0.00 -1.36 0.00 0.00 55.97 55.91 1sxm s LYS 6 Cb -0.15 -3.41 -0.03 0.00 -1.68 0.00 0.00 37.83 32.56 1sxm s LYS 6 CO 0.01 0.12 0.26 0.00 -0.76 0.00 0.00 175.35 174.98 1sxm n THR 8 N -0.40 0.00 -4.03 0.00 -1.04 -1.26 -4.39 114.28 103.16 1sxm n THR 8 Ca 0.03 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.82 1sxm n THR 8 Cb 0.64 -0.45 -0.05 0.00 -1.82 0.00 0.00 70.33 68.65 1sxm n THR 8 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1sxm s SER 9 N -4.69 5.15 0.44 8.00 1.04 -1.26 -5.05 113.70 117.34 1sxm s SER 9 Ca 0.00 -0.49 0.29 0.00 0.48 0.00 0.00 55.95 56.24 1sxm s SER 9 Cb 0.00 -1.05 1.10 0.00 0.10 0.00 0.00 66.02 66.17 1sxm s SER 9 CO 0.00 -0.19 1.86 -0.65 0.98 0.00 0.00 173.24 175.23 1sxm h PRO 10 N 1.47 0.00 -0.00 4.02 0.11 -1.89 -3.12 132.00 132.58 1sxm h PRO 10 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1sxm h PRO 10 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1sxm h PRO 10 CO 0.60 0.00 -0.02 1.63 -0.21 0.00 0.00 178.00 180.01 1sxm n LYS 11 N -2.83 0.84 0.00 1.05 4.76 -1.26 -2.06 118.16 118.66 1sxm n LYS 11 Ca 0.02 -0.11 0.11 0.00 -2.87 0.00 0.00 58.31 55.46 1sxm n LYS 11 Cb 0.33 -1.50 0.13 0.00 -1.84 0.00 0.00 35.03 32.15 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 -0.98 0.02 -0.00 1.97 -0.06 -1.18 -4.08 117.38 113.06 1sxm n GLN 12 Ca 0.20 0.00 0.04 0.00 -2.00 0.00 0.00 57.00 55.23 1sxm n GLN 12 Cb 0.19 -1.51 -0.05 0.00 -4.06 0.00 0.00 30.24 24.81 1sxm n GLN 12 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1sxm n SER 14 N -1.46 0.42 -0.06 0.00 7.64 -0.88 -2.68 113.62 116.61 1sxm n SER 14 Ca 0.00 -1.05 -0.04 0.00 1.01 0.00 0.00 58.87 58.79 1sxm n SER 14 Cb 0.16 -0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.31 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 0.64 0.00 -0.27 1.43 1.79 -1.75 -3.16 116.57 115.24 1sxm h LYS 15 Ca 0.00 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.38 1sxm h LYS 15 Cb 0.17 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1sxm h LYS 15 CO 0.00 0.24 -0.19 -1.00 -1.08 0.00 0.00 179.45 177.41 1sxm h PRO 16 N -1.00 0.62 -0.02 3.15 0.13 -1.82 -3.13 132.00 129.93 1sxm h PRO 16 Ca -0.02 -0.30 -0.09 0.00 -0.87 0.00 0.00 66.00 64.73 1sxm h PRO 16 Cb 0.33 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 1sxm h PRO 16 CO -0.01 0.89 -0.40 0.00 -0.23 0.00 0.00 178.00 178.25 1sxm n LYS 18 N -4.06 0.11 0.11 0.00 5.02 -1.19 -0.96 118.16 117.17 1sxm n LYS 18 Ca -0.02 -0.05 0.07 0.00 -2.02 0.00 0.00 58.31 56.29 1sxm n LYS 18 Cb 0.44 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 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 0.13 0.00 0.00 1.97 4.81 -1.39 -3.32 114.58 116.78 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 0.49 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.87 1sxm h GLU 19 CO 0.00 0.13 0.00 1.28 -0.73 0.00 0.00 179.01 179.69 1sxm n LEU 20 N -2.86 0.06 0.04 1.64 4.77 -0.38 -4.80 117.00 115.46 1sxm n LEU 20 Ca -0.02 0.08 -0.00 0.00 -0.03 0.00 0.00 56.01 56.04 1sxm n LEU 20 Cb 0.65 -0.44 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 1sxm n LEU 20 CO 0.40 -0.44 -0.25 1.88 -1.33 0.00 0.00 177.39 177.65 1sxm h TYR 21 N 0.00 0.00 0.00 -1.77 -1.99 -1.31 -3.51 116.97 108.39 1sxm h TYR 21 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 1sxm h TYR 21 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 1sxm h TYR 21 CO 0.00 0.59 0.00 0.41 -0.00 0.00 0.00 178.16 179.16 1sxm n GLY 22 N 1.39 -1.12 0.00 3.88 0.00 -1.06 -4.42 105.19 103.86 1sxm n GLY 22 Ca -0.09 -1.89 0.09 0.00 0.00 0.00 0.00 46.02 44.14 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 0.03 0.00 -3.94 1.61 7.64 -1.26 -3.16 113.62 114.54 1sxm n SER 23 Ca 0.00 -0.12 -0.40 0.00 1.01 0.00 0.00 58.87 59.37 1sxm n SER 23 Cb 0.00 -0.23 -0.01 0.00 -1.01 0.00 0.00 64.21 62.96 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 -1.23 5.69 -3.93 6.43 2.88 -1.26 -4.96 113.62 117.24 1sxm n SER 24 Ca 0.10 -3.37 -0.23 0.00 -1.33 0.00 0.00 58.87 54.04 1sxm n SER 24 Cb 0.13 -1.15 -0.17 0.00 -0.75 0.00 0.00 64.21 62.27 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 -2.50 1.02 -0.88 -1.46 0.00 -1.19 -3.98 121.76 112.78 1sxm s ALA 25 Ca 0.32 -0.29 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 1sxm s ALA 25 Cb 0.04 -0.60 0.23 0.00 0.00 0.00 0.00 23.12 22.79 1sxm s ALA 25 CO 0.05 -0.08 0.82 0.20 0.00 0.00 0.00 175.76 176.74 1sxm s GLY 26 N 1.07 2.80 -0.41 0.00 0.00 -1.14 -4.35 107.32 105.29 1sxm s GLY 26 Ca -0.08 -3.46 -0.18 0.00 0.00 0.00 0.00 44.72 41.00 1sxm s GLY 26 CO -0.01 1.26 0.50 0.00 0.00 0.00 0.00 173.10 174.86 1sxm s ALA 27 N -0.25 3.42 0.00 3.20 0.00 -1.26 -1.87 121.76 125.00 1sxm s ALA 27 Ca 0.21 -1.31 0.08 0.00 0.00 0.00 0.00 51.96 50.94 1sxm s ALA 27 Cb -0.11 -3.10 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 1sxm s ALA 27 CO -0.08 -1.53 -0.25 0.15 0.00 0.00 0.00 175.76 174.04 1sxm s LYS 28 N 2.37 1.92 -0.23 0.00 1.02 -0.92 -4.82 119.74 119.06 1sxm s LYS 28 Ca 0.16 -0.96 0.02 0.00 0.02 0.00 0.00 55.97 55.21 1sxm s LYS 28 Cb -0.16 -1.93 0.05 0.00 -0.52 0.00 0.00 37.83 35.27 1sxm s LYS 28 CO 0.15 0.52 -0.10 0.00 -0.92 0.00 0.00 175.35 175.00 1sxm s MET 30 N 1.26 2.93 0.00 0.00 -1.94 -1.07 -4.87 119.30 115.61 1sxm s MET 30 Ca -0.05 -0.82 0.00 0.00 -1.71 0.00 0.00 55.69 53.11 1sxm s MET 30 Cb -0.18 -2.38 0.00 0.00 2.01 0.00 0.00 34.83 34.28 1sxm s MET 30 CO -0.07 -0.03 0.00 0.27 -0.01 0.00 0.00 175.02 175.18 1sxm n ASN 31 N 4.11 0.00 -2.67 3.03 0.23 -1.26 -2.33 115.26 116.37 1sxm n ASN 31 Ca -0.20 0.00 -0.04 0.00 -0.53 0.00 0.00 54.58 53.81 1sxm n ASN 31 Cb 0.51 0.00 0.05 0.00 -2.08 0.00 0.00 39.78 38.26 1sxm n ASN 31 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1sxm n GLY 32 N 0.00 -0.70 3.33 4.83 0.00 -1.26 -4.88 105.19 106.51 1sxm n GLY 32 Ca 0.00 0.27 -0.14 0.00 0.00 0.00 0.00 46.02 46.15 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 0.07 0.84 -0.02 1.61 1.02 -0.98 -3.33 119.74 118.95 1sxm s LYS 33 Ca 0.12 -0.14 -0.01 0.00 0.02 0.00 0.00 55.97 55.97 1sxm s LYS 33 Cb 0.19 0.38 -0.04 0.00 -0.52 0.00 0.00 37.83 37.84 1sxm s LYS 33 CO -0.09 -0.26 0.06 0.00 -0.92 0.00 0.00 175.35 174.14 1sxm s LYS 35 N -1.57 1.55 -0.23 0.00 1.02 -0.49 -2.29 119.74 117.75 1sxm s LYS 35 Ca 0.21 -0.73 0.01 0.00 0.02 0.00 0.00 55.97 55.48 1sxm s LYS 35 Cb -0.12 -1.52 0.06 0.00 -0.52 0.00 0.00 37.83 35.73 1sxm s LYS 35 CO 0.11 0.41 -0.06 0.00 -0.92 0.00 0.00 175.35 174.89 1sxm n TYR 37 N 4.67 -0.26 -3.69 0.00 4.01 -0.78 -4.54 117.16 116.56 1sxm n TYR 37 Ca -0.12 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.32 1sxm n TYR 37 Cb 0.44 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.33 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 3.79 0.00 7.72 0.01 -1.26 -2.89 114.94 121.97 1sxm s ASN 38 Ca 0.00 -2.00 0.00 0.00 -0.71 0.00 0.00 52.86 50.15 1sxm s ASN 38 Cb 0.00 -0.86 0.00 0.00 0.41 0.00 0.00 41.25 40.80 1sxm s ASN 38 CO 0.00 -0.36 0.01 0.59 -1.51 0.00 0.00 177.10 175.83