#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 0.38 12.58 1.01 -1.26 -2.04 121.20 136.39 1sxm s ILE 2 Ca 0.00 -0.10 0.05 0.00 0.00 0.00 0.00 60.65 60.60 1sxm s ILE 2 Cb 0.00 -3.11 0.05 0.00 0.01 0.00 0.00 42.46 39.41 1sxm s ILE 2 CO 0.00 0.34 0.44 2.30 0.00 0.00 0.00 174.94 178.02 1sxm n ILE 3 N 4.79 0.00 -3.71 2.92 -5.35 -1.04 -4.98 119.36 111.99 1sxm n ILE 3 Ca -0.16 -1.37 -0.28 0.00 -0.27 0.00 0.00 62.75 60.67 1sxm n ILE 3 Cb 0.52 -0.49 -0.11 0.00 -1.74 0.00 0.00 39.64 37.82 1sxm n ILE 3 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1sxm n ASN 4 N -2.30 1.75 -3.96 7.28 5.15 -1.26 -4.21 115.26 117.70 1sxm n ASN 4 Ca 0.06 -2.91 -0.27 0.00 -0.60 0.00 0.00 54.58 50.87 1sxm n ASN 4 Cb 0.41 -0.68 -0.17 0.00 -0.53 0.00 0.00 39.78 38.81 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1sxm s VAL 5 N -0.93 1.16 -0.01 3.44 1.01 -1.26 -4.98 120.40 118.82 1sxm s VAL 5 Ca 0.28 -0.41 -0.28 0.00 0.00 0.00 0.00 61.98 61.57 1sxm s VAL 5 Cb -0.01 -1.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1sxm s VAL 5 CO -0.18 0.38 0.90 -0.54 0.00 0.00 0.00 175.10 175.66 1sxm s LYS 6 N 1.35 4.53 0.23 2.72 -0.14 -1.26 -1.57 119.74 125.60 1sxm s LYS 6 Ca -0.01 1.27 0.01 0.00 -1.36 0.00 0.00 55.97 55.88 1sxm s LYS 6 Cb -0.14 -3.45 -0.04 0.00 -1.68 0.00 0.00 37.83 32.52 1sxm s LYS 6 CO -0.05 -0.00 0.15 0.00 -0.76 0.00 0.00 175.35 174.69 1sxm n THR 8 N -0.36 0.00 -3.60 0.00 5.66 -1.26 -4.37 114.28 110.34 1sxm n THR 8 Ca 0.02 -0.12 -0.08 0.00 -3.05 0.00 0.00 64.05 60.83 1sxm n THR 8 Cb 0.65 0.35 -0.05 0.00 -1.55 0.00 0.00 70.33 69.73 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 -0.69 -0.29 0.19 1.09 1.04 -1.26 -5.03 113.70 108.75 1sxm s SER 9 Ca 0.04 0.37 0.22 0.00 0.48 0.00 0.00 55.95 57.06 1sxm s SER 9 Cb 0.05 0.31 0.90 0.00 0.10 0.00 0.00 66.02 67.38 1sxm s SER 9 CO -0.02 -0.23 1.68 -2.65 0.98 0.00 0.00 173.24 173.00 1sxm n PRO 10 N 0.94 0.16 0.15 4.02 -0.02 -1.26 -2.98 135.00 136.01 1sxm n PRO 10 Ca -0.08 0.35 0.13 0.00 -2.02 0.00 0.00 63.50 61.88 1sxm n PRO 10 Cb 0.58 -1.78 0.44 0.00 -0.02 0.00 0.00 33.50 32.72 1sxm n PRO 10 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1sxm h LYS 11 N 0.00 0.00 0.00 -0.52 1.79 -1.96 -2.44 116.57 113.44 1sxm h LYS 11 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1sxm h LYS 11 Cb 0.39 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1sxm h LYS 11 CO 0.00 0.00 -0.59 0.94 -1.08 0.00 0.00 179.45 178.72 1sxm n GLN 12 N -2.48 0.12 -0.00 3.15 -0.06 -1.16 -4.08 117.38 112.87 1sxm n GLN 12 Ca 0.04 0.03 0.04 0.00 -2.00 0.00 0.00 57.00 55.10 1sxm n GLN 12 Cb 0.36 -1.57 -0.06 0.00 -4.06 0.00 0.00 30.24 24.92 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 -1.38 1.11 -0.00 0.00 3.41 -0.93 -3.10 113.62 112.73 1sxm n SER 14 Ca 0.01 -1.24 -0.04 0.00 -0.26 0.00 0.00 58.87 57.33 1sxm n SER 14 Cb 0.16 0.01 -0.03 0.00 -0.26 0.00 0.00 64.21 64.10 1sxm n SER 14 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1sxm h LYS 15 N 1.66 -0.11 -0.23 4.33 1.57 -1.76 -3.17 116.57 118.86 1sxm h LYS 15 Ca 0.00 0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.69 1sxm h LYS 15 Cb 0.41 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 1sxm h LYS 15 CO 0.00 0.06 -0.24 -1.00 -0.57 0.00 0.00 179.45 177.70 1sxm h PRO 16 N -1.02 0.57 -0.19 3.15 0.13 -1.82 -3.05 132.00 129.79 1sxm h PRO 16 Ca -0.01 -0.31 -0.09 0.00 -0.87 0.00 0.00 66.00 64.72 1sxm h PRO 16 Cb 0.22 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.35 1sxm h PRO 16 CO 0.02 0.90 -0.30 0.00 -0.23 0.00 0.00 178.00 178.39 1sxm n LYS 18 N -4.10 0.76 0.07 0.00 5.02 -1.20 -0.99 118.16 117.73 1sxm n LYS 18 Ca -0.01 -0.39 0.05 0.00 -2.02 0.00 0.00 58.31 55.94 1sxm n LYS 18 Cb 0.42 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.90 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 0.94 0.00 0.00 1.97 4.81 -1.37 -3.30 114.58 117.64 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 0.45 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1sxm h GLU 19 CO 0.00 0.19 -0.32 1.28 -0.73 0.00 0.00 179.01 179.43 1sxm n LEU 20 N -2.85 1.06 -0.01 1.64 4.77 -0.62 -4.75 117.00 116.24 1sxm n LEU 20 Ca -0.05 0.46 -0.12 0.00 -0.03 0.00 0.00 56.01 56.27 1sxm n LEU 20 Cb 0.72 -0.71 -0.14 0.00 -2.33 0.00 0.00 43.42 40.95 1sxm n LEU 20 CO 0.41 -0.48 -0.59 -1.22 -1.33 0.00 0.00 177.39 174.18 1sxm n TYR 21 N -3.64 1.10 -0.63 -1.77 4.02 -0.16 -5.06 117.16 111.02 1sxm n TYR 21 Ca -0.04 0.34 0.00 0.00 -0.01 0.00 0.00 57.90 58.19 1sxm n TYR 21 Cb 0.16 -1.18 0.00 0.00 -0.02 0.00 0.00 39.34 38.30 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 1.68 -1.26 4.11 2.72 0.00 -1.23 -4.79 105.19 106.41 1sxm n GLY 22 Ca -0.21 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 0.00 0.00 -3.80 1.61 7.64 -1.24 -4.71 113.62 113.12 1sxm n SER 23 Ca 0.00 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 1sxm n SER 23 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 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 3.12 5.06 -4.64 6.43 2.88 -1.26 -5.00 113.62 120.22 1sxm n SER 24 Ca 0.00 -3.38 -0.31 0.00 -1.33 0.00 0.00 58.87 53.85 1sxm n SER 24 Cb 0.00 -1.01 -0.09 0.00 -0.75 0.00 0.00 64.21 62.36 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 -2.44 3.14 -0.82 -1.46 0.00 -1.25 -4.04 121.76 114.89 1sxm s ALA 25 Ca 0.34 -1.07 -0.12 0.00 0.00 0.00 0.00 51.96 51.11 1sxm s ALA 25 Cb 0.07 -1.16 0.22 0.00 0.00 0.00 0.00 23.12 22.25 1sxm s ALA 25 CO 0.02 0.65 0.75 0.20 0.00 0.00 0.00 175.76 177.38 1sxm s GLY 26 N -1.82 2.69 -0.33 0.00 0.00 -1.14 -4.46 107.32 102.26 1sxm s GLY 26 Ca 0.21 -3.36 -0.16 0.00 0.00 0.00 0.00 44.72 41.41 1sxm s GLY 26 CO 0.12 1.25 0.43 0.00 0.00 0.00 0.00 173.10 174.89 1sxm s ALA 27 N 0.04 3.50 -0.01 3.20 0.00 -1.26 -1.64 121.76 125.58 1sxm s ALA 27 Ca 0.19 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 51.16 1sxm s ALA 27 Cb -0.11 -2.88 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 1sxm s ALA 27 CO -0.08 -1.06 -0.22 0.15 0.00 0.00 0.00 175.76 174.54 1sxm s LYS 28 N 2.18 1.80 -0.26 0.00 1.02 -1.01 -4.82 119.74 118.64 1sxm s LYS 28 Ca 0.15 -0.81 0.02 0.00 0.02 0.00 0.00 55.97 55.35 1sxm s LYS 28 Cb -0.16 -1.75 0.06 0.00 -0.52 0.00 0.00 37.83 35.46 1sxm s LYS 28 CO 0.12 0.48 -0.10 0.00 -0.92 0.00 0.00 175.35 174.93 1sxm s MET 30 N 1.12 3.00 0.92 0.00 -1.94 -1.05 -4.86 119.30 116.50 1sxm s MET 30 Ca -0.08 -0.84 0.00 0.00 -1.71 0.00 0.00 55.69 53.06 1sxm s MET 30 Cb -0.20 -2.49 0.00 0.00 2.01 0.00 0.00 34.83 34.16 1sxm s MET 30 CO -0.05 -0.10 0.00 0.09 -0.01 0.00 0.00 175.02 174.95 1sxm n ASN 31 N 4.30 0.00 -2.68 3.03 4.13 -1.26 -2.43 115.26 120.36 1sxm n ASN 31 Ca -0.20 0.00 -0.05 0.00 1.68 0.00 0.00 54.58 56.01 1sxm n ASN 31 Cb 0.51 0.00 0.07 0.00 -1.54 0.00 0.00 39.78 38.82 1sxm n ASN 31 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1sxm n GLY 32 N 0.00 -0.42 3.34 7.41 0.00 -1.26 -4.89 105.19 109.37 1sxm n GLY 32 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.88 -0.04 1.61 1.02 -1.02 -3.41 119.74 118.88 1sxm s LYS 33 Ca 0.16 -0.17 -0.01 0.00 0.02 0.00 0.00 55.97 55.97 1sxm s LYS 33 Cb 0.24 0.40 -0.04 0.00 -0.52 0.00 0.00 37.83 37.91 1sxm s LYS 33 CO -0.10 -0.28 0.05 0.00 -0.92 0.00 0.00 175.35 174.10 1sxm s LYS 35 N -1.38 1.40 -0.05 0.00 1.02 -0.44 -2.49 119.74 117.79 1sxm s LYS 35 Ca 0.19 -1.19 0.04 0.00 0.02 0.00 0.00 55.97 55.02 1sxm s LYS 35 Cb -0.12 -1.72 0.00 0.00 -0.52 0.00 0.00 37.83 35.48 1sxm s LYS 35 CO 0.09 0.42 -0.17 0.00 -0.92 0.00 0.00 175.35 174.77 1sxm n TYR 37 N 3.32 0.00 -3.15 0.00 4.01 -0.65 -4.52 117.16 116.16 1sxm n TYR 37 Ca -0.19 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.34 1sxm n TYR 37 Cb 0.53 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.52 1sxm n TYR 37 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1sxm n ASN 38 N -0.03 1.59 -0.86 7.72 4.13 -1.26 -2.87 115.26 123.68 1sxm n ASN 38 Ca 0.00 -3.11 0.11 0.00 1.68 0.00 0.00 54.58 53.25 1sxm n ASN 38 Cb 0.00 -0.61 0.09 0.00 -1.54 0.00 0.00 39.78 37.72 1sxm n ASN 38 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13