#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 1.64 0.58 12.58 1.09 -1.26 -2.10 121.20 133.73 1sxm s ILE 2 Ca 0.00 -0.68 0.09 0.00 -1.10 0.00 0.00 60.65 58.95 1sxm s ILE 2 Cb 0.00 -1.53 0.09 0.00 -1.06 0.00 0.00 42.46 39.96 1sxm s ILE 2 CO 0.00 0.47 0.71 2.30 -0.10 0.00 0.00 174.94 178.32 1sxm n ILE 3 N 4.69 0.00 -3.46 2.92 -5.35 -1.07 -4.96 119.36 112.13 1sxm n ILE 3 Ca -0.18 -2.01 -0.27 0.00 -0.27 0.00 0.00 62.75 60.03 1sxm n ILE 3 Cb 0.50 -0.39 -0.09 0.00 -1.74 0.00 0.00 39.64 37.93 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 -2.20 2.96 -4.03 7.28 4.13 -1.26 -4.17 115.26 117.97 1sxm n ASN 4 Ca 0.12 -3.26 -0.24 0.00 1.68 0.00 0.00 54.58 52.88 1sxm n ASN 4 Cb 0.61 -0.67 -0.16 0.00 -1.54 0.00 0.00 39.78 38.01 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1sxm s VAL 5 N -2.04 1.11 0.14 2.41 1.01 -1.26 -5.00 120.40 116.77 1sxm s VAL 5 Ca 0.37 -0.48 -0.23 0.00 0.00 0.00 0.00 61.98 61.63 1sxm s VAL 5 Cb 0.12 -1.01 -0.08 0.00 0.00 0.00 0.00 36.38 35.41 1sxm s VAL 5 CO -0.06 0.35 0.71 -0.54 0.00 0.00 0.00 175.10 175.56 1sxm s LYS 6 N 0.55 4.44 0.20 2.72 3.01 -1.26 -1.26 119.74 128.16 1sxm s LYS 6 Ca -0.12 1.02 -0.07 0.00 -1.01 0.00 0.00 55.97 55.78 1sxm s LYS 6 Cb -0.15 -3.24 -0.02 0.00 -1.01 0.00 0.00 37.83 33.42 1sxm s LYS 6 CO 0.03 0.59 0.29 0.00 0.51 0.00 0.00 175.35 176.77 1sxm n THR 8 N -0.29 0.00 -3.58 0.00 5.66 -1.26 -1.59 114.28 113.22 1sxm n THR 8 Ca -0.02 -0.20 -0.11 0.00 -3.05 0.00 0.00 64.05 60.67 1sxm n THR 8 Cb 0.64 0.47 -0.06 0.00 -1.55 0.00 0.00 70.33 69.83 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 -0.93 -0.42 0.25 1.09 1.04 -1.26 -5.02 113.70 108.44 1sxm s SER 9 Ca 0.07 0.53 0.24 0.00 0.48 0.00 0.00 55.95 57.27 1sxm s SER 9 Cb 0.08 0.44 0.94 0.00 0.10 0.00 0.00 66.02 67.58 1sxm s SER 9 CO -0.03 -0.34 1.73 -2.65 0.98 0.00 0.00 173.24 172.93 1sxm n PRO 10 N 1.02 0.22 0.14 4.02 -0.02 -1.26 -2.72 135.00 136.40 1sxm n PRO 10 Ca -0.12 0.37 0.13 0.00 -2.02 0.00 0.00 63.50 61.86 1sxm n PRO 10 Cb 0.57 -1.86 0.41 0.00 -0.02 0.00 0.00 33.50 32.61 1sxm n PRO 10 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1sxm h LYS 11 N 0.00 0.00 -0.01 -0.52 1.63 -1.97 -2.10 116.57 113.60 1sxm h LYS 11 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1sxm h LYS 11 Cb 0.46 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.09 1sxm h LYS 11 CO 0.00 0.00 -0.16 0.94 -3.45 0.00 0.00 179.45 176.78 1sxm n GLN 12 N -2.45 0.98 -0.00 1.90 7.27 -1.10 -3.55 117.38 120.43 1sxm n GLN 12 Ca 0.04 -0.52 0.01 0.00 0.07 0.00 0.00 57.00 56.60 1sxm n GLN 12 Cb 0.39 -1.49 -0.02 0.00 2.41 0.00 0.00 30.24 31.53 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 -1.27 0.79 0.02 0.00 7.64 -0.80 -2.99 113.62 117.01 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 0.05 -0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.22 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 1.15 -0.15 -0.26 1.43 1.57 -1.78 -3.15 116.57 115.37 1sxm h LYS 15 Ca 0.00 0.01 -0.17 0.00 -1.87 0.00 0.00 60.65 58.62 1sxm h LYS 15 Cb 0.34 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1sxm h LYS 15 CO 0.00 -0.02 -0.50 -1.00 -0.57 0.00 0.00 179.45 177.37 1sxm h PRO 16 N -1.03 0.80 0.00 3.15 0.13 -1.84 -3.09 132.00 130.12 1sxm h PRO 16 Ca -0.02 -0.51 -0.10 0.00 -0.87 0.00 0.00 66.00 64.50 1sxm h PRO 16 Cb 0.21 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 1sxm h PRO 16 CO 0.03 1.14 -0.49 0.00 -0.23 0.00 0.00 178.00 178.45 1sxm n LYS 18 N -3.86 0.01 0.16 0.00 5.02 -1.19 -0.77 118.16 117.53 1sxm n LYS 18 Ca -0.01 -0.01 0.12 0.00 -2.02 0.00 0.00 58.31 56.39 1sxm n LYS 18 Cb 0.52 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 34.10 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 0.02 0.00 0.00 1.97 4.81 -1.38 -3.19 114.58 116.81 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 0.50 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1sxm h GLU 19 CO 0.00 0.01 -0.24 1.28 -0.73 0.00 0.00 179.01 179.33 1sxm n LEU 20 N -2.87 0.64 -0.18 1.64 4.77 -0.57 -4.76 117.00 115.67 1sxm n LEU 20 Ca 0.02 0.28 0.11 0.00 -0.03 0.00 0.00 56.01 56.39 1sxm n LEU 20 Cb 0.54 -0.61 0.08 0.00 -2.33 0.00 0.00 43.42 41.10 1sxm n LEU 20 CO 0.37 -0.47 0.28 -1.22 -1.33 0.00 0.00 177.39 175.03 1sxm n TYR 21 N -3.11 0.00 0.00 -1.77 4.02 0.05 -5.03 117.16 111.31 1sxm n TYR 21 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 1sxm n TYR 21 Cb 0.12 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.37 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 1.45 1.99 0.00 2.72 0.00 -1.21 -3.61 105.19 106.54 1sxm n GLY 22 Ca 0.07 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1sxm n GLY 22 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sxm n SER 23 N 3.77 0.00 -3.77 1.61 2.88 -1.26 -4.65 113.62 112.20 1sxm n SER 23 Ca 0.00 -0.16 -0.38 0.00 -1.33 0.00 0.00 58.87 57.01 1sxm n SER 23 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1sxm n SER 23 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1sxm n SER 24 N 0.00 5.71 -4.06 -3.46 2.88 -1.24 -5.00 113.62 108.46 1sxm n SER 24 Ca 0.00 -3.46 -0.28 0.00 -1.33 0.00 0.00 58.87 53.80 1sxm n SER 24 Cb 0.04 -1.07 -0.17 0.00 -0.75 0.00 0.00 64.21 62.26 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 -2.88 1.64 -0.90 -1.46 0.00 -1.25 -3.97 121.76 112.94 1sxm s ALA 25 Ca 0.35 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.52 1sxm s ALA 25 Cb 0.10 -0.78 0.23 0.00 0.00 0.00 0.00 23.12 22.67 1sxm s ALA 25 CO 0.05 -0.02 0.84 0.20 0.00 0.00 0.00 175.76 176.83 1sxm s GLY 26 N 0.88 2.86 -0.38 0.00 0.00 -1.10 -4.28 107.32 105.30 1sxm s GLY 26 Ca -0.09 -3.52 -0.18 0.00 0.00 0.00 0.00 44.72 40.93 1sxm s GLY 26 CO 0.00 1.26 0.52 0.00 0.00 0.00 0.00 173.10 174.88 1sxm s ALA 27 N -0.42 3.44 -0.04 3.20 0.00 -1.26 -1.70 121.76 124.98 1sxm s ALA 27 Ca 0.22 -1.16 0.07 0.00 0.00 0.00 0.00 51.96 51.09 1sxm s ALA 27 Cb -0.11 -3.07 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 1sxm s ALA 27 CO -0.08 -1.39 -0.23 0.15 0.00 0.00 0.00 175.76 174.20 1sxm s LYS 28 N 2.41 2.14 -0.15 0.00 -0.14 -1.01 -4.84 119.74 118.15 1sxm s LYS 28 Ca 0.18 -0.84 -0.00 0.00 -1.36 0.00 0.00 55.97 53.94 1sxm s LYS 28 Cb -0.16 -1.94 -0.01 0.00 -1.68 0.00 0.00 37.83 34.05 1sxm s LYS 28 CO 0.14 0.43 -0.13 0.00 -0.76 0.00 0.00 175.35 175.03 1sxm n MET 30 N 3.93 3.55 0.00 0.00 2.81 -0.68 -4.91 117.12 121.82 1sxm n MET 30 Ca -0.19 -4.64 0.00 0.00 -1.81 0.00 0.00 57.70 51.07 1sxm n MET 30 Cb 0.52 -2.38 0.00 0.00 -0.71 0.00 0.00 33.22 30.65 1sxm n MET 30 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1sxm n ASN 31 N 0.95 0.00 0.00 7.83 3.02 -1.26 -2.53 115.26 123.27 1sxm n ASN 31 Ca 0.29 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.84 1sxm n ASN 31 Cb 0.37 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 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 2.45 3.33 7.41 0.00 -0.62 -4.92 105.19 112.84 1sxm n GLY 32 Ca 0.00 -0.26 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 1.04 0.15 1.61 1.02 -1.05 -3.66 119.74 118.85 1sxm s LYS 33 Ca 0.00 -0.57 0.05 0.00 0.02 0.00 0.00 55.97 55.47 1sxm s LYS 33 Cb 0.00 0.46 -0.04 0.00 -0.52 0.00 0.00 37.83 37.73 1sxm s LYS 33 CO 0.00 -0.40 0.08 0.00 -0.92 0.00 0.00 175.35 174.11 1sxm s LYS 35 N -2.90 0.87 -0.12 0.00 1.02 -0.52 -2.59 119.74 115.48 1sxm s LYS 35 Ca 0.29 -0.54 0.01 0.00 0.02 0.00 0.00 55.97 55.75 1sxm s LYS 35 Cb -0.10 -0.84 0.02 0.00 -0.52 0.00 0.00 37.83 36.39 1sxm s LYS 35 CO 0.21 0.22 -0.14 0.00 -0.92 0.00 0.00 175.35 174.72 1sxm n TYR 37 N 4.53 0.00 -3.66 0.00 4.01 -0.69 -3.52 117.16 117.82 1sxm n TYR 37 Ca -0.17 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.27 1sxm n TYR 37 Cb 0.51 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.41 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 0.86 3.48 0.00 7.72 0.01 -1.26 -2.70 114.94 123.05 1sxm s ASN 38 Ca 0.00 -2.58 0.00 0.00 -0.71 0.00 0.00 52.86 49.57 1sxm s ASN 38 Cb 0.00 -0.91 0.00 0.00 0.41 0.00 0.00 41.25 40.75 1sxm s ASN 38 CO 0.00 -0.27 0.12 0.59 -1.51 0.00 0.00 177.10 176.03