#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 1.65 0.10 2.28 1.01 -1.26 -2.37 121.20 122.62 1sxm s ILE 2 Ca 0.00 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 59.98 1sxm s ILE 2 Cb 0.00 -1.54 0.01 0.00 0.01 0.00 0.00 42.46 40.95 1sxm s ILE 2 CO 0.00 0.47 0.12 2.30 0.00 0.00 0.00 174.94 177.83 1sxm n ILE 3 N 4.73 0.00 -3.48 2.92 -5.35 -0.97 -4.95 119.36 112.26 1sxm n ILE 3 Ca -0.18 -0.38 -0.27 0.00 -0.27 0.00 0.00 62.75 61.65 1sxm n ILE 3 Cb 0.50 -0.68 -0.10 0.00 -1.74 0.00 0.00 39.64 37.62 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 -2.46 0.47 -4.04 7.28 6.94 -1.26 -4.20 115.26 118.00 1sxm n ASN 4 Ca 0.01 -2.62 -0.27 0.00 -0.02 0.00 0.00 54.58 51.68 1sxm n ASN 4 Cb 0.11 -0.61 -0.17 0.00 -2.36 0.00 0.00 39.78 36.76 1sxm n ASN 4 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1sxm s VAL 5 N -0.49 1.35 -0.09 3.53 1.01 -1.26 -4.96 120.40 119.49 1sxm s VAL 5 Ca 0.32 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.52 1sxm s VAL 5 Cb 0.04 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 1sxm s VAL 5 CO -0.18 0.41 0.62 -0.54 0.00 0.00 0.00 175.10 175.41 1sxm s LYS 6 N 0.94 4.39 0.18 2.72 -0.14 -1.26 -1.98 119.74 124.60 1sxm s LYS 6 Ca -0.08 0.71 0.03 0.00 -1.36 0.00 0.00 55.97 55.27 1sxm s LYS 6 Cb -0.15 -3.45 -0.01 0.00 -1.68 0.00 0.00 37.83 32.54 1sxm s LYS 6 CO -0.00 0.08 0.09 0.00 -0.76 0.00 0.00 175.35 174.76 1sxm n THR 8 N -0.39 0.00 -3.61 0.00 5.66 -1.26 -4.61 114.28 110.06 1sxm n THR 8 Ca -0.01 -0.11 -0.05 0.00 -3.05 0.00 0.00 64.05 60.84 1sxm n THR 8 Cb 0.29 0.33 -0.04 0.00 -1.55 0.00 0.00 70.33 69.37 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 -0.67 -0.14 0.44 1.09 1.04 -1.26 -5.03 113.70 109.18 1sxm s SER 9 Ca 0.04 0.11 0.30 0.00 0.48 0.00 0.00 55.95 56.88 1sxm s SER 9 Cb 0.04 0.13 1.27 0.00 0.10 0.00 0.00 66.02 67.56 1sxm s SER 9 CO -0.02 -0.16 1.90 -0.65 0.98 0.00 0.00 173.24 175.28 1sxm h PRO 10 N 2.15 0.00 -0.00 4.02 0.11 -1.89 -3.13 132.00 133.26 1sxm h PRO 10 Ca -0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.01 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 0.24 0.00 -0.08 1.63 -0.21 0.00 0.00 178.00 179.58 1sxm n LYS 11 N -2.75 0.31 -0.22 1.05 4.76 -1.26 -2.01 118.16 118.02 1sxm n LYS 11 Ca 0.01 -0.06 0.12 0.00 -2.87 0.00 0.00 58.31 55.51 1sxm n LYS 11 Cb 0.26 -1.50 0.23 0.00 -1.84 0.00 0.00 35.03 32.18 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 -1.30 2.54 0.00 1.97 7.27 -1.18 -4.01 117.38 122.67 1sxm n GLN 12 Ca 0.11 -2.36 0.00 0.00 0.07 0.00 0.00 57.00 54.82 1sxm n GLN 12 Cb 0.29 -1.52 0.00 0.00 2.41 0.00 0.00 30.24 31.42 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 -1.22 0.72 -0.05 0.00 7.64 -0.85 -2.66 113.62 117.19 1sxm n SER 14 Ca 0.00 -1.31 -0.01 0.00 1.01 0.00 0.00 58.87 58.55 1sxm n SER 14 Cb 0.00 -0.01 -0.01 0.00 -1.01 0.00 0.00 64.21 63.18 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 -0.25 1.43 1.57 -1.80 -3.14 116.57 115.47 1sxm h LYS 15 Ca 0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 1sxm h LYS 15 Cb 0.23 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1sxm h LYS 15 CO 0.00 0.02 -0.58 -1.00 -0.57 0.00 0.00 179.45 177.32 1sxm h PRO 16 N -1.00 0.78 0.00 3.15 0.13 -1.84 -3.04 132.00 130.19 1sxm h PRO 16 Ca -0.00 -0.51 -0.09 0.00 -0.87 0.00 0.00 66.00 64.52 1sxm h PRO 16 Cb 0.11 0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.29 1sxm h PRO 16 CO -0.00 1.14 -0.45 0.00 -0.23 0.00 0.00 178.00 178.46 1sxm n LYS 18 N -3.67 0.53 0.10 0.00 5.02 -1.19 -0.54 118.16 118.42 1sxm n LYS 18 Ca -0.01 -0.27 0.12 0.00 -2.02 0.00 0.00 58.31 56.13 1sxm n LYS 18 Cb 0.53 -1.49 0.05 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 0.66 0.00 0.00 1.97 4.81 -1.33 -3.30 114.58 117.39 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 0.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1sxm h GLU 19 CO 0.00 0.00 0.00 1.28 -0.73 0.00 0.00 179.01 179.56 1sxm n LEU 20 N -2.58 0.03 -2.59 1.64 4.77 -0.55 -4.79 117.00 112.93 1sxm n LEU 20 Ca 0.01 0.01 -0.36 0.00 -0.03 0.00 0.00 56.01 55.64 1sxm n LEU 20 Cb 0.52 -0.32 0.05 0.00 -2.33 0.00 0.00 43.42 41.34 1sxm n LEU 20 CO 0.39 -0.32 1.27 -1.22 -1.33 0.00 0.00 177.39 176.18 1sxm n TYR 21 N -2.12 3.10 -2.46 -1.77 4.02 0.30 -4.99 117.16 113.25 1sxm n TYR 21 Ca 0.00 -2.65 -0.39 0.00 -0.01 0.00 0.00 57.90 54.85 1sxm n TYR 21 Cb 0.00 -1.11 -0.02 0.00 -0.02 0.00 0.00 39.34 38.19 1sxm n TYR 21 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1sxm s GLY 22 N -1.80 1.25 0.00 2.72 0.00 -1.23 -2.39 107.32 105.87 1sxm s GLY 22 Ca 0.56 -2.64 0.00 0.00 0.00 0.00 0.00 44.72 42.64 1sxm s GLY 22 CO -0.21 2.92 0.00 -1.14 0.00 0.00 0.00 173.10 174.67 1sxm n SER 23 N 9.86 0.00 -3.46 1.64 3.41 -1.26 -5.00 113.62 118.81 1sxm n SER 23 Ca 0.46 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.80 1sxm n SER 23 Cb 0.47 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.32 1sxm n SER 23 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1sxm n SER 24 N 0.00 0.97 -4.36 4.04 2.88 -1.09 -5.02 113.62 111.04 1sxm n SER 24 Ca 0.00 -2.77 -0.36 0.00 -1.33 0.00 0.00 58.87 54.42 1sxm n SER 24 Cb 0.00 -0.63 -0.13 0.00 -0.75 0.00 0.00 64.21 62.69 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 -0.89 2.96 -0.95 -1.46 0.00 -1.00 -3.80 121.76 116.61 1sxm s ALA 25 Ca 0.33 -1.19 -0.12 0.00 0.00 0.00 0.00 51.96 50.98 1sxm s ALA 25 Cb 0.07 -1.88 0.24 0.00 0.00 0.00 0.00 23.12 21.55 1sxm s ALA 25 CO -0.15 -0.51 0.91 0.20 0.00 0.00 0.00 175.76 176.21 1sxm s GLY 26 N 1.53 2.91 -0.33 0.00 0.00 -1.08 -4.64 107.32 105.70 1sxm s GLY 26 Ca 0.06 -3.56 -0.18 0.00 0.00 0.00 0.00 44.72 41.04 1sxm s GLY 26 CO -0.00 1.29 0.50 0.00 0.00 0.00 0.00 173.10 174.88 1sxm s ALA 27 N -0.48 3.49 0.03 3.20 0.00 -1.26 -1.86 121.76 124.89 1sxm s ALA 27 Ca 0.24 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.29 1sxm s ALA 27 Cb -0.10 -2.97 -0.02 0.00 0.00 0.00 0.00 23.12 20.02 1sxm s ALA 27 CO -0.09 -1.13 -0.20 0.15 0.00 0.00 0.00 175.76 174.50 1sxm s LYS 28 N 2.34 1.37 -0.14 0.00 1.02 -0.94 -4.86 119.74 118.52 1sxm s LYS 28 Ca 0.18 -0.86 -0.04 0.00 0.02 0.00 0.00 55.97 55.27 1sxm s LYS 28 Cb -0.16 -1.44 0.05 0.00 -0.52 0.00 0.00 37.83 35.77 1sxm s LYS 28 CO 0.13 0.37 0.08 0.00 -0.92 0.00 0.00 175.35 175.01 1sxm s MET 30 N 2.15 3.39 1.28 0.00 -1.94 -1.08 -4.69 119.30 118.41 1sxm s MET 30 Ca 0.03 -0.65 0.00 0.00 -1.71 0.00 0.00 55.69 53.36 1sxm s MET 30 Cb -0.15 -2.83 0.00 0.00 2.01 0.00 0.00 34.83 33.86 1sxm s MET 30 CO -0.08 0.01 0.00 0.09 -0.01 0.00 0.00 175.02 175.03 1sxm n ASN 31 N 4.16 0.00 -2.68 3.03 3.02 -1.26 -2.57 115.26 118.95 1sxm n ASN 31 Ca -0.18 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.31 1sxm n ASN 31 Cb 0.52 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.74 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 0.39 3.23 7.41 0.00 -1.26 -4.84 105.19 110.12 1sxm n GLY 32 Ca 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 46.02 45.82 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 0.61 0.10 1.61 3.01 -1.06 -3.22 119.74 120.91 1sxm s LYS 33 Ca 0.13 -0.07 0.03 0.00 -1.01 0.00 0.00 55.97 55.05 1sxm s LYS 33 Cb 0.25 0.27 -0.04 0.00 -1.01 0.00 0.00 37.83 37.30 1sxm s LYS 33 CO -0.06 -0.16 0.11 0.00 0.51 0.00 0.00 175.35 175.76 1sxm s LYS 35 N -2.59 0.76 -0.18 0.00 1.02 -0.54 -2.29 119.74 115.91 1sxm s LYS 35 Ca 0.30 -0.21 0.01 0.00 0.02 0.00 0.00 55.97 56.10 1sxm s LYS 35 Cb -0.12 -0.74 0.02 0.00 -0.52 0.00 0.00 37.83 36.48 1sxm s LYS 35 CO 0.23 0.05 -0.19 0.00 -0.92 0.00 0.00 175.35 174.52 1sxm n TYR 37 N 4.63 0.00 -4.27 0.00 4.01 -0.78 -1.86 117.16 118.89 1sxm n TYR 37 Ca -0.20 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.33 1sxm n TYR 37 Cb 0.50 0.00 -0.12 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 1.00 2.26 0.00 7.72 0.01 -1.26 -2.65 114.94 122.02 1sxm s ASN 38 Ca 0.00 -0.78 0.30 0.00 -0.71 0.00 0.00 52.86 51.67 1sxm s ASN 38 Cb 0.00 -0.11 1.49 0.00 0.41 0.00 0.00 41.25 43.04 1sxm s ASN 38 CO 0.00 -0.07 1.99 0.59 -1.51 0.00 0.00 177.10 178.11