#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 1.89 0.16 1.09 1.01 -1.26 -2.42 121.20 121.67 1sxm s ILE 2 Ca 0.00 -1.00 0.03 0.00 0.00 0.00 0.00 60.65 59.68 1sxm s ILE 2 Cb 0.00 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.68 1sxm s ILE 2 CO 0.00 0.36 0.21 2.30 0.00 0.00 0.00 174.94 177.81 1sxm n ILE 3 N 4.64 0.00 -3.36 2.92 -5.35 -0.94 -4.97 119.36 112.30 1sxm n ILE 3 Ca -0.18 -0.54 -0.26 0.00 -0.27 0.00 0.00 62.75 61.50 1sxm n ILE 3 Cb 0.48 -0.82 -0.08 0.00 -1.74 0.00 0.00 39.64 37.48 1sxm n ILE 3 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1sxm n ASN 4 N -2.73 1.15 -4.06 7.28 0.23 -1.26 -4.26 115.26 111.62 1sxm n ASN 4 Ca 0.04 -2.85 -0.28 0.00 -0.53 0.00 0.00 54.58 50.96 1sxm n ASN 4 Cb 0.17 -0.64 -0.17 0.00 -2.08 0.00 0.00 39.78 37.06 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1sxm s VAL 5 N -1.25 1.49 -0.17 3.53 1.01 -1.26 -4.98 120.40 118.77 1sxm s VAL 5 Ca 0.35 -0.64 -0.21 0.00 0.00 0.00 0.00 61.98 61.48 1sxm s VAL 5 Cb 0.12 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.11 1sxm s VAL 5 CO -0.11 0.44 0.64 -0.54 0.00 0.00 0.00 175.10 175.52 1sxm s LYS 6 N 0.98 4.26 0.37 2.72 -0.14 -1.26 -1.44 119.74 125.23 1sxm s LYS 6 Ca -0.07 0.66 0.04 0.00 -1.36 0.00 0.00 55.97 55.24 1sxm s LYS 6 Cb -0.15 -3.55 -0.03 0.00 -1.68 0.00 0.00 37.83 32.42 1sxm s LYS 6 CO -0.01 -0.16 0.13 0.00 -0.76 0.00 0.00 175.35 174.54 1sxm n THR 8 N -0.80 0.00 -3.61 0.00 5.66 -1.26 -4.32 114.28 109.95 1sxm n THR 8 Ca -0.03 -0.08 -0.07 0.00 -3.05 0.00 0.00 64.05 60.82 1sxm n THR 8 Cb 0.65 0.29 -0.05 0.00 -1.55 0.00 0.00 70.33 69.68 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 -0.59 -0.22 0.40 1.09 1.04 -1.26 -5.03 113.70 109.14 1sxm s SER 9 Ca 0.03 0.25 0.29 0.00 0.48 0.00 0.00 55.95 56.99 1sxm s SER 9 Cb 0.03 0.19 1.15 0.00 0.10 0.00 0.00 66.02 67.50 1sxm s SER 9 CO -0.01 -0.19 1.84 -0.65 0.98 0.00 0.00 173.24 175.21 1sxm h PRO 10 N 2.38 0.00 0.00 4.02 0.11 -1.88 -3.10 132.00 133.54 1sxm h PRO 10 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1sxm h PRO 10 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1sxm h PRO 10 CO 0.26 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 179.68 1sxm n LYS 11 N -2.67 0.22 0.02 1.05 4.01 -1.26 -1.90 118.16 117.63 1sxm n LYS 11 Ca 0.02 0.24 0.12 0.00 -0.51 0.00 0.00 58.31 58.17 1sxm n LYS 11 Cb 0.28 -1.79 0.26 0.00 -0.51 0.00 0.00 35.03 33.27 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 -2.18 0.09 -0.00 1.97 -0.06 -1.17 -3.82 117.38 112.20 1sxm n GLN 12 Ca 0.05 0.02 0.06 0.00 -2.00 0.00 0.00 57.00 55.13 1sxm n GLN 12 Cb 0.38 -1.55 -0.07 0.00 -4.06 0.00 0.00 30.24 24.93 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 -1.49 0.70 -0.05 0.00 7.64 -0.80 -2.81 113.62 116.81 1sxm n SER 14 Ca 0.01 -1.18 -0.01 0.00 1.01 0.00 0.00 58.87 58.69 1sxm n SER 14 Cb 0.22 -0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.41 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 1.08 0.00 -0.26 1.43 1.57 -1.74 -3.17 116.57 115.48 1sxm h LYS 15 Ca 0.00 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 1sxm h LYS 15 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 1sxm h LYS 15 CO 0.00 0.09 -0.42 -1.00 -0.57 0.00 0.00 179.45 177.56 1sxm h PRO 16 N -1.00 0.75 -0.00 3.15 0.13 -1.81 -3.09 132.00 130.13 1sxm h PRO 16 Ca -0.00 -0.45 -0.11 0.00 -0.87 0.00 0.00 66.00 64.57 1sxm h PRO 16 Cb 0.10 0.04 -0.02 0.00 0.13 0.00 0.00 31.00 31.26 1sxm h PRO 16 CO -0.00 1.08 -0.53 0.00 -0.23 0.00 0.00 178.00 178.32 1sxm n LYS 18 N -3.91 0.16 0.13 0.00 5.02 -1.20 -0.77 118.16 117.59 1sxm n LYS 18 Ca -0.01 -0.08 0.09 0.00 -2.02 0.00 0.00 58.31 56.28 1sxm n LYS 18 Cb 0.54 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 34.09 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 0.20 0.00 0.00 1.97 4.81 -1.39 -3.17 114.58 117.00 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 0.09 -0.22 1.28 -0.73 0.00 0.00 179.01 179.43 1sxm n LEU 20 N -2.88 0.68 -0.12 1.64 4.77 -0.53 -4.75 117.00 115.82 1sxm n LEU 20 Ca -0.00 0.34 0.11 0.00 -0.03 0.00 0.00 56.01 56.43 1sxm n LEU 20 Cb 0.61 -0.63 0.02 0.00 -2.33 0.00 0.00 43.42 41.09 1sxm n LEU 20 CO 0.39 -0.48 0.18 -1.22 -1.33 0.00 0.00 177.39 174.93 1sxm n TYR 21 N -3.15 0.00 0.00 -1.77 4.01 0.05 -5.03 117.16 111.27 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 0.12 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.08 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 1.47 2.01 0.00 2.72 0.00 -1.20 -3.41 105.19 106.78 1sxm n GLY 22 Ca 0.06 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 4.08 0.00 -3.61 1.61 7.64 -1.26 -4.63 113.62 117.45 1sxm n SER 23 Ca 0.00 -0.29 -0.36 0.00 1.01 0.00 0.00 58.87 59.24 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 5.57 -4.05 6.43 2.88 -1.22 -4.98 113.62 118.25 1sxm n SER 24 Ca 0.00 -3.52 -0.28 0.00 -1.33 0.00 0.00 58.87 53.74 1sxm n SER 24 Cb 0.07 -0.97 -0.17 0.00 -0.75 0.00 0.00 64.21 62.39 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 -3.11 1.66 -0.96 -1.46 0.00 -1.21 -3.77 121.76 112.92 1sxm s ALA 25 Ca 0.38 -0.71 -0.08 0.00 0.00 0.00 0.00 51.96 51.54 1sxm s ALA 25 Cb 0.14 -0.83 0.24 0.00 0.00 0.00 0.00 23.12 22.67 1sxm s ALA 25 CO -0.01 -0.09 0.90 0.20 0.00 0.00 0.00 175.76 176.77 1sxm s GLY 26 N 1.01 3.00 -0.37 0.00 0.00 -1.05 -4.42 107.32 105.49 1sxm s GLY 26 Ca -0.06 -3.67 -0.18 0.00 0.00 0.00 0.00 44.72 40.82 1sxm s GLY 26 CO -0.02 1.27 0.48 0.00 0.00 0.00 0.00 173.10 174.82 1sxm s ALA 27 N -0.82 3.46 0.12 3.20 0.00 -1.26 -2.14 121.76 124.31 1sxm s ALA 27 Ca 0.26 -1.17 0.11 0.00 0.00 0.00 0.00 51.96 51.15 1sxm s ALA 27 Cb -0.10 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 1sxm s ALA 27 CO -0.09 -1.31 -0.26 0.15 0.00 0.00 0.00 175.76 174.25 1sxm s LYS 28 N 2.30 1.47 -0.15 0.00 -0.14 -0.92 -4.81 119.74 117.49 1sxm s LYS 28 Ca 0.16 -1.31 -0.01 0.00 -1.36 0.00 0.00 55.97 53.45 1sxm s LYS 28 Cb -0.16 -1.92 0.04 0.00 -1.68 0.00 0.00 37.83 34.11 1sxm s LYS 28 CO 0.14 0.46 -0.03 0.00 -0.76 0.00 0.00 175.35 175.16 1sxm s MET 30 N 1.74 2.36 0.66 0.00 -1.94 -1.16 -4.83 119.30 116.13 1sxm s MET 30 Ca 0.01 -0.63 0.00 0.00 -1.71 0.00 0.00 55.69 53.37 1sxm s MET 30 Cb -0.15 -1.93 0.00 0.00 2.01 0.00 0.00 34.83 34.77 1sxm s MET 30 CO -0.07 0.01 0.00 0.09 -0.01 0.00 0.00 175.02 175.04 1sxm n ASN 31 N 3.96 0.00 -2.67 3.03 3.02 -1.26 -2.58 115.26 118.76 1sxm n ASN 31 Ca -0.20 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.31 1sxm n ASN 31 Cb 0.52 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.77 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 -1.10 3.31 7.41 0.00 -1.26 -4.86 105.19 108.69 1sxm n GLY 32 Ca 0.00 0.56 -0.14 0.00 0.00 0.00 0.00 46.02 46.43 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 0.06 0.77 -0.05 1.61 1.02 -1.06 -3.16 119.74 118.92 1sxm s LYS 33 Ca 0.16 -0.10 -0.01 0.00 0.02 0.00 0.00 55.97 56.04 1sxm s LYS 33 Cb 0.24 0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 37.86 1sxm s LYS 33 CO -0.14 -0.22 0.05 0.00 -0.92 0.00 0.00 175.35 174.12 1sxm s LYS 35 N -1.35 1.70 -0.18 0.00 1.02 -0.66 -2.22 119.74 118.05 1sxm s LYS 35 Ca 0.18 -0.79 0.01 0.00 0.02 0.00 0.00 55.97 55.39 1sxm s LYS 35 Cb -0.12 -1.67 0.02 0.00 -0.52 0.00 0.00 37.83 35.55 1sxm s LYS 35 CO 0.08 0.45 -0.19 0.00 -0.92 0.00 0.00 175.35 174.78 1sxm n TYR 37 N 4.63 -0.30 -3.80 0.00 4.01 -0.91 -2.02 117.16 118.77 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 0.49 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.39 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 -0.65 3.89 0.00 7.72 0.01 -1.26 -2.52 114.94 122.13 1sxm s ASN 38 Ca 0.00 -2.81 0.00 0.00 -0.71 0.00 0.00 52.86 49.34 1sxm s ASN 38 Cb 0.00 -1.25 0.00 0.00 0.41 0.00 0.00 41.25 40.41 1sxm s ASN 38 CO 0.00 -0.25 0.06 0.59 -1.51 0.00 0.00 177.10 175.99