#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4u n GLY 2 N 0.00 -0.07 3.47 7.55 0.00 -1.20 -4.80 105.19 110.14 2k4u n GLY 2 Ca 0.00 -1.33 -0.25 0.00 0.00 0.00 0.00 46.02 44.44 2k4u n GLY 2 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k4u s ILE 3 N 0.00 0.44 -0.54 -0.61 -4.36 -1.26 -4.90 121.20 109.96 2k4u s ILE 3 Ca 0.00 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.43 2k4u s ILE 3 Cb 0.00 -2.36 0.16 0.00 1.25 0.00 0.00 42.46 41.51 2k4u s ILE 3 CO 0.00 0.00 0.36 0.21 0.24 0.00 0.00 174.94 175.75 2k4u s ASN 4 N -3.56 3.60 0.01 4.36 2.47 -1.26 -4.74 114.94 115.82 2k4u s ASN 4 Ca 0.27 -3.24 0.00 0.00 0.42 0.00 0.00 52.86 50.31 2k4u s ASN 4 Cb 0.02 -1.16 -0.01 0.00 -1.45 0.00 0.00 41.25 38.65 2k4u s ASN 4 CO 0.17 -0.17 -0.02 -0.69 -3.72 0.00 0.00 177.10 172.68 2k4u s VAL 5 N -0.47 0.08 0.86 -5.21 1.01 -1.26 -5.04 120.40 110.38 2k4u s VAL 5 Ca 0.24 -0.49 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 2k4u s VAL 5 Cb -0.10 -0.16 0.11 0.00 0.00 0.00 0.00 36.38 36.23 2k4u s VAL 5 CO -0.11 -0.26 1.10 -0.75 0.00 0.00 0.00 175.10 175.07 2k4u s LYS 6 N -0.78 1.54 0.12 2.72 2.47 -1.26 -0.48 119.74 124.07 2k4u s LYS 6 Ca -0.08 0.73 -0.11 0.00 -1.56 0.00 0.00 55.97 54.95 2k4u s LYS 6 Cb -0.05 -1.85 0.01 0.00 -1.46 0.00 0.00 37.83 34.48 2k4u s LYS 6 CO -0.00 -2.02 0.29 0.00 0.16 0.00 0.00 175.35 173.77 2k4u n LYS 8 N -0.16 1.03 0.00 0.00 4.81 -1.26 -4.85 118.16 117.74 2k4u n LYS 8 Ca -0.13 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.31 2k4u n LYS 8 Cb 0.63 -0.92 0.00 0.00 0.02 0.00 0.00 35.03 34.76 2k4u n LYS 8 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2k4u n HIS 9 N -1.37 -0.25 0.00 5.64 8.25 -1.26 -5.12 115.22 121.12 2k4u n HIS 9 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2k4u n HIS 9 Cb 0.00 0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.24 2k4u n HIS 9 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2k4u n SER 10 N -1.40 -0.05 0.20 0.41 2.88 -1.26 -4.57 113.62 109.82 2k4u n SER 10 Ca 0.00 0.34 0.15 0.00 -1.33 0.00 0.00 58.87 58.03 2k4u n SER 10 Cb 0.00 0.38 0.77 0.00 -0.75 0.00 0.00 64.21 64.61 2k4u n SER 10 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2k4u h ARG 11 N 0.00 0.00 0.00 -1.46 3.08 -1.99 -1.05 114.38 112.96 2k4u h ARG 11 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2k4u h ARG 11 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2k4u h ARG 11 CO 0.00 0.00 0.00 1.96 -1.07 0.00 0.00 179.97 180.86 2k4u h GLN 12 N 0.00 0.00 0.00 0.04 4.20 -1.98 -2.60 115.11 114.77 2k4u h GLN 12 Ca 0.08 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.65 2k4u h GLN 12 Cb 0.36 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 2k4u h GLN 12 CO -0.00 0.00 -0.93 0.00 -0.67 0.00 0.00 178.83 177.23 2k4u h LEU 14 N 0.00 1.04 0.05 0.00 3.38 -1.51 -1.52 115.31 116.74 2k4u h LEU 14 Ca -0.07 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.87 2k4u h LEU 14 Cb 1.48 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 2k4u h LEU 14 CO 0.06 0.76 -0.34 0.11 0.09 0.00 0.00 178.44 179.13 2k4u h LYS 15 N 1.22 -0.44 -0.14 1.13 6.56 -1.69 -0.74 116.57 122.47 2k4u h LYS 15 Ca 0.33 0.03 -0.11 0.00 -1.06 0.00 0.00 60.65 59.84 2k4u h LYS 15 Cb -0.12 0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 31.62 2k4u h LYS 15 CO -0.07 -0.29 -0.39 -1.00 -2.06 0.00 0.00 179.45 175.63 2k4u h PRO 16 N -0.46 0.32 -0.09 3.15 0.13 -1.74 -2.31 132.00 131.00 2k4u h PRO 16 Ca 0.00 -0.15 -0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2k4u h PRO 16 Cb 0.47 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 2k4u h PRO 16 CO -0.20 0.66 0.04 0.00 -0.23 0.00 0.00 178.00 178.28 2k4u h LYS 18 N 0.03 0.83 -0.06 0.00 3.64 -1.10 -2.43 116.57 117.47 2k4u h LYS 18 Ca 0.03 -0.29 -0.08 0.00 -1.27 0.00 0.00 60.65 59.04 2k4u h LYS 18 Cb 0.11 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2k4u h LYS 18 CO -0.00 0.92 -0.33 0.22 -2.27 0.00 0.00 179.45 177.98 2k4u h ASP 19 N 0.67 0.12 0.73 4.20 3.58 -1.41 -2.27 116.42 122.04 2k4u h ASP 19 Ca 0.12 -0.04 0.00 0.00 0.42 0.00 0.00 57.03 57.53 2k4u h ASP 19 Cb 0.58 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.59 2k4u h ASP 19 CO 0.03 0.45 0.00 0.00 -2.88 0.00 0.00 179.24 176.84 2k4u h ALA 20 N 1.56 1.00 0.00 -0.78 0.00 -0.97 -3.47 119.26 116.60 2k4u h ALA 20 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2k4u h ALA 20 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2k4u h ALA 20 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2k4u n GLY 21 N -0.16 0.53 3.86 0.00 0.00 -0.85 -5.09 105.19 103.47 2k4u n GLY 21 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2k4u n GLY 21 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k4u s MET 22 N -0.91 1.95 -0.10 1.61 -1.94 -0.93 -4.94 119.30 114.04 2k4u s MET 22 Ca 0.00 0.29 -0.10 0.00 -1.71 0.00 0.00 55.69 54.18 2k4u s MET 22 Cb 0.00 -1.93 -0.03 0.00 2.01 0.00 0.00 34.83 34.88 2k4u s MET 22 CO 0.00 -1.64 -0.19 -2.13 -0.01 0.00 0.00 175.02 171.05 2k4u n ARG 23 N -3.38 0.31 -1.55 2.03 0.63 -0.69 -4.25 116.66 109.75 2k4u n ARG 23 Ca 0.07 0.20 -0.31 0.00 -0.92 0.00 0.00 57.85 56.89 2k4u n ARG 23 Cb 0.59 -1.13 0.05 0.00 0.45 0.00 0.00 32.46 32.42 2k4u n ARG 23 CO 0.00 0.00 0.00 -0.06 -2.51 0.00 0.00 177.63 175.06 2k4u s PHE 24 N -2.07 3.08 -0.29 -0.14 0.08 -1.16 -4.83 117.98 112.65 2k4u s PHE 24 Ca -0.16 1.43 -0.13 0.00 0.12 0.00 0.00 56.93 58.19 2k4u s PHE 24 Cb 0.02 -2.89 0.12 0.00 -0.57 0.00 0.00 43.02 39.70 2k4u s PHE 24 CO 0.23 -1.26 0.74 0.20 -0.10 0.00 0.00 175.22 175.03 2k4u s GLY 25 N -3.77 -0.55 0.03 4.36 0.00 -1.26 -3.55 107.32 102.59 2k4u s GLY 25 Ca 0.58 2.55 -0.19 0.00 0.00 0.00 0.00 44.72 47.66 2k4u s GLY 25 CO 0.55 2.79 0.42 1.25 0.00 0.00 0.00 173.10 178.11 2k4u s LYS 26 N 2.20 0.90 -0.22 2.90 2.20 -0.16 -4.48 119.74 123.09 2k4u s LYS 26 Ca -0.07 -0.30 -0.29 0.00 -0.36 0.00 0.00 55.97 54.95 2k4u s LYS 26 Cb -0.08 0.41 -0.00 0.00 -1.51 0.00 0.00 37.83 36.65 2k4u s LYS 26 CO -0.19 -0.30 1.18 0.00 -0.36 0.00 0.00 175.35 175.68 2k4u s THR 28 N 3.52 0.09 -0.92 0.00 -1.32 0.16 -4.88 115.64 112.28 2k4u s THR 28 Ca 0.50 -0.75 0.00 0.00 -1.21 0.00 0.00 61.69 60.23 2k4u s THR 28 Cb -0.18 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.57 2k4u s THR 28 CO 0.13 -0.41 0.00 -3.20 -2.21 0.00 0.00 174.62 168.92 2k4u n ASN 29 N 1.82 -3.34 -0.44 8.08 5.15 -1.26 -0.80 115.26 124.47 2k4u n ASN 29 Ca -0.22 0.25 -0.06 0.00 -0.60 0.00 0.00 54.58 53.95 2k4u n ASN 29 Cb 0.56 -2.91 -0.02 0.00 -0.53 0.00 0.00 39.78 36.87 2k4u n ASN 29 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k4u n GLY 30 N -0.67 0.81 3.15 8.20 0.00 -1.26 -5.02 105.19 110.40 2k4u n GLY 30 Ca -0.12 -0.61 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 2k4u n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k4u s LYS 31 N -2.25 0.69 0.06 1.61 1.02 0.02 -4.24 119.74 116.64 2k4u s LYS 31 Ca 0.00 -0.89 -0.31 0.00 0.02 0.00 0.00 55.97 54.79 2k4u s LYS 31 Cb 0.00 0.27 -0.06 0.00 -0.52 0.00 0.00 37.83 37.53 2k4u s LYS 31 CO 0.00 -0.19 1.21 0.00 -0.92 0.00 0.00 175.35 175.45 2k4u s HIS 33 N 1.15 1.93 0.18 0.00 5.04 -0.12 -4.32 115.29 119.15 2k4u s HIS 33 Ca 0.59 -0.57 0.03 0.00 -1.54 0.00 0.00 55.06 53.57 2k4u s HIS 33 Cb -0.29 -1.29 -0.05 0.00 0.04 0.00 0.00 32.58 30.99 2k4u s HIS 33 CO 0.29 -0.19 -0.03 0.00 -2.34 0.00 0.00 174.74 172.48 2k4u s THR 35 N -3.52 0.12 0.89 0.00 -4.23 -1.23 -3.24 115.64 104.42 2k4u s THR 35 Ca 0.23 -0.99 -0.12 0.00 -1.18 0.00 0.00 61.69 59.63 2k4u s THR 35 Cb 0.05 -0.99 0.12 0.00 1.34 0.00 0.00 72.50 73.03 2k4u s THR 35 CO 0.04 -0.55 1.09 -2.16 -0.54 0.00 0.00 174.62 172.51 2k4u s PRO 36 N -2.80 1.33 0.00 3.99 0.04 -1.26 -1.70 135.00 134.60 2k4u s PRO 36 Ca -0.03 0.77 0.08 0.00 0.04 0.00 0.00 61.00 61.85 2k4u s PRO 36 Cb 0.00 -1.82 0.47 0.00 0.04 0.00 0.00 34.50 33.19 2k4u s PRO 36 CO -0.05 -2.18 0.93 0.36 0.04 0.00 0.00 177.00 176.10