#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ck4 s VAL 2 N 0.00 3.73 -0.22 1.61 1.01 0.35 -4.90 120.40 121.97 2ck4 s VAL 2 Ca 0.00 -0.28 -0.17 0.00 0.00 0.00 0.00 61.98 61.53 2ck4 s VAL 2 Cb 0.00 -4.72 -0.03 0.00 0.00 0.00 0.00 36.38 31.62 2ck4 s VAL 2 CO 0.00 -1.64 0.48 -0.51 0.00 0.00 0.00 175.10 173.42 2ck4 s ILE 3 N 6.49 5.12 -0.03 2.22 1.10 -1.26 -0.78 121.20 134.06 2ck4 s ILE 3 Ca 0.49 0.84 0.02 0.00 -0.51 0.00 0.00 60.65 61.50 2ck4 s ILE 3 Cb -0.05 -3.80 -0.03 0.00 0.15 0.00 0.00 42.46 38.74 2ck4 s ILE 3 CO 0.01 0.17 -0.07 0.27 -2.11 0.00 0.00 174.94 173.21 2ck4 s ILE 4 N 1.78 3.63 -0.27 2.00 -4.36 -0.75 -5.01 121.20 118.21 2ck4 s ILE 4 Ca 0.21 -0.64 -0.05 0.00 -0.26 0.00 0.00 60.65 59.91 2ck4 s ILE 4 Cb -0.15 -2.52 -0.11 0.00 1.25 0.00 0.00 42.46 40.92 2ck4 s ILE 4 CO 0.09 0.50 3.22 -0.46 0.24 0.00 0.00 174.94 178.53 2ck4 n ASN 5 N 1.90 5.93 -4.55 4.36 6.94 -1.26 -3.15 115.26 125.42 2ck4 n ASN 5 Ca -0.17 -2.81 -0.34 0.00 -0.02 0.00 0.00 54.58 51.25 2ck4 n ASN 5 Cb 0.53 -1.34 -0.12 0.00 -2.36 0.00 0.00 39.78 36.49 2ck4 n ASN 5 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2ck4 s VAL 6 N -0.41 3.66 -0.45 3.53 1.01 -1.26 -5.05 120.40 121.43 2ck4 s VAL 6 Ca 0.63 -0.48 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 2ck4 s VAL 6 Cb 0.34 -2.51 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2ck4 s VAL 6 CO -0.10 0.58 1.26 -0.75 0.00 0.00 0.00 175.10 176.09 2ck4 s LYS 7 N -0.59 3.65 -1.05 2.72 2.36 -1.26 -3.43 119.74 122.14 2ck4 s LYS 7 Ca 0.09 0.71 -0.23 0.00 -2.55 0.00 0.00 55.97 53.99 2ck4 s LYS 7 Cb -0.12 -3.97 -0.04 0.00 -1.05 0.00 0.00 37.83 32.66 2ck4 s LYS 7 CO 0.02 -1.48 1.87 0.00 1.55 0.00 0.00 175.35 177.31 2ck4 h LYS 9 N 10.24 0.00 -2.69 0.00 1.79 -1.91 -3.43 116.57 120.57 2ck4 h LYS 9 Ca 0.18 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.74 2ck4 h LYS 9 Cb 0.97 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.53 2ck4 h LYS 9 CO 1.26 0.00 0.34 0.96 -1.08 0.00 0.00 179.45 180.93 2ck4 s ILE 10 N -4.47 0.00 0.23 1.86 -4.36 -1.26 -5.04 121.20 108.16 2ck4 s ILE 10 Ca -0.04 -0.55 -0.04 0.00 -0.26 0.00 0.00 60.65 59.76 2ck4 s ILE 10 Cb 0.14 -1.65 0.07 0.00 1.25 0.00 0.00 42.46 42.27 2ck4 s ILE 10 CO 0.48 0.00 1.69 0.28 0.24 0.00 0.00 174.94 177.62 2ck4 h SER 11 N 2.00 0.81 0.15 4.36 0.02 -1.84 -2.70 113.55 116.36 2ck4 h SER 11 Ca -0.24 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 2ck4 h SER 11 Cb 1.25 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.58 2ck4 h SER 11 CO 0.28 0.93 0.00 0.03 -1.14 0.00 0.00 176.83 176.93 2ck4 h ARG 12 N 0.75 0.00 -0.55 3.45 3.08 -1.97 -0.28 114.38 118.85 2ck4 h ARG 12 Ca 0.13 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.22 2ck4 h ARG 12 Cb 0.59 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 2ck4 h ARG 12 CO 0.04 0.00 0.37 1.96 -1.07 0.00 0.00 179.97 181.26 2ck4 h GLN 13 N 0.00 0.56 0.00 0.04 1.08 -1.84 -3.19 115.11 111.77 2ck4 h GLN 13 Ca 0.00 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 2ck4 h GLN 13 Cb 0.08 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 2ck4 h GLN 13 CO 0.00 0.37 -1.16 0.00 -0.95 0.00 0.00 178.83 177.09 2ck4 h LEU 15 N 0.00 0.87 0.03 0.00 5.85 -1.16 -0.26 115.31 120.65 2ck4 h LEU 15 Ca -0.04 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.51 2ck4 h LEU 15 Cb 0.69 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 2ck4 h LEU 15 CO 0.00 0.87 -0.06 0.50 -0.34 0.00 0.00 178.44 179.41 2ck4 h LYS 16 N 0.88 -0.11 -0.94 1.25 1.63 -1.81 0.46 116.57 117.94 2ck4 h LYS 16 Ca 0.19 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 2ck4 h LYS 16 Cb 0.36 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.97 2ck4 h LYS 16 CO 0.00 -0.07 0.59 -1.35 -3.45 0.00 0.00 179.45 175.17 2ck4 h PRO 17 N -0.12 1.25 0.37 1.90 0.11 -1.81 -3.02 132.00 130.69 2ck4 h PRO 17 Ca 0.02 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 2ck4 h PRO 17 Cb 0.13 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 30.97 2ck4 h PRO 17 CO -0.04 0.86 -0.18 0.00 -0.21 0.00 0.00 178.00 178.43 2ck4 h LYS 19 N -1.04 0.00 -0.08 0.00 3.64 -0.13 0.97 116.57 119.93 2ck4 h LYS 19 Ca -0.05 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.23 2ck4 h LYS 19 Cb 0.49 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 2ck4 h LYS 19 CO 0.08 0.13 -0.41 0.22 -2.27 0.00 0.00 179.45 177.21 2ck4 h ASP 20 N 0.00 0.18 -0.10 4.20 3.58 -1.53 -2.21 116.42 120.55 2ck4 h ASP 20 Ca -0.00 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.37 2ck4 h ASP 20 Cb 0.26 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.26 2ck4 h ASP 20 CO 0.02 0.58 0.00 0.00 -2.88 0.00 0.00 179.24 176.95 2ck4 n ALA 21 N -2.47 2.55 -0.34 -0.78 0.00 0.25 -4.91 120.51 114.81 2ck4 n ALA 21 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.97 2ck4 n ALA 21 Cb 0.47 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.77 2ck4 n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ck4 n GLY 22 N 1.11 0.69 2.75 0.00 0.00 -0.68 -4.96 105.19 104.11 2ck4 n GLY 22 Ca 0.17 -0.65 -0.18 0.00 0.00 0.00 0.00 46.02 45.36 2ck4 n GLY 22 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ck4 s MET 23 N -2.23 0.21 0.53 1.61 -1.94 -1.02 -0.41 119.30 116.06 2ck4 s MET 23 Ca 0.00 0.17 0.35 0.00 -1.71 0.00 0.00 55.69 54.50 2ck4 s MET 23 Cb 0.00 -1.11 1.70 0.00 2.01 0.00 0.00 34.83 37.43 2ck4 s MET 23 CO 0.00 -0.70 2.06 0.07 -0.01 0.00 0.00 175.02 176.44 2ck4 h ARG 24 N 8.30 0.00 -4.80 2.03 0.11 -0.45 -3.22 114.38 116.35 2ck4 h ARG 24 Ca -0.17 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.59 2ck4 h ARG 24 Cb 1.14 0.00 -0.22 0.00 1.11 0.00 0.00 29.97 32.00 2ck4 h ARG 24 CO 0.29 0.00 -0.75 -0.06 0.10 0.00 0.00 179.97 179.55 2ck4 s PHE 25 N -3.79 0.83 -0.48 4.08 0.08 0.11 -4.95 117.98 113.86 2ck4 s PHE 25 Ca -0.01 -0.46 0.06 0.00 0.12 0.00 0.00 56.93 56.64 2ck4 s PHE 25 Cb 0.10 -0.49 0.19 0.00 -0.57 0.00 0.00 43.02 42.25 2ck4 s PHE 25 CO 0.43 -0.04 0.60 0.41 -0.10 0.00 0.00 175.22 176.53 2ck4 n GLY 26 N 1.50 0.36 3.40 4.36 0.00 -1.26 -0.53 105.19 113.03 2ck4 n GLY 26 Ca -0.22 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 2ck4 n GLY 26 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ck4 s LYS 27 N 0.58 2.95 -0.11 1.61 2.20 -0.58 -3.87 119.74 122.51 2ck4 s LYS 27 Ca 0.31 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.91 2ck4 s LYS 27 Cb 0.02 -2.48 -0.02 0.00 -1.51 0.00 0.00 37.83 33.83 2ck4 s LYS 27 CO -0.10 0.40 1.28 0.00 -0.36 0.00 0.00 175.35 176.56 2ck4 s MET 29 N 3.08 0.62 -1.47 0.00 -1.94 0.79 -4.83 119.30 115.54 2ck4 s MET 29 Ca 0.57 -0.38 0.00 0.00 -1.71 0.00 0.00 55.69 54.17 2ck4 s MET 29 Cb -0.24 -2.04 0.00 0.00 2.01 0.00 0.00 34.83 34.56 2ck4 s MET 29 CO 0.19 -0.63 0.00 0.09 -0.01 0.00 0.00 175.02 174.66 2ck4 n ASN 30 N 5.07 -5.59 0.00 3.03 3.02 -1.26 -1.69 115.26 117.83 2ck4 n ASN 30 Ca -0.09 0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.81 2ck4 n ASN 30 Cb 0.47 -4.32 0.00 0.00 -0.61 0.00 0.00 39.78 35.33 2ck4 n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ck4 n GLY 31 N -0.05 1.24 3.55 7.41 0.00 -1.26 -5.09 105.19 111.00 2ck4 n GLY 31 Ca -0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 2ck4 n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ck4 s LYS 32 N -0.28 1.96 -0.53 1.61 1.02 -0.68 -2.74 119.74 120.10 2ck4 s LYS 32 Ca 0.00 -1.61 -0.19 0.00 0.02 0.00 0.00 55.97 54.18 2ck4 s LYS 32 Cb 0.00 -1.95 0.07 0.00 -0.52 0.00 0.00 37.83 35.43 2ck4 s LYS 32 CO 0.00 0.34 0.67 0.00 -0.92 0.00 0.00 175.35 175.44 2ck4 s HIS 34 N 2.74 2.88 -0.20 0.00 3.76 -0.07 -1.82 115.29 122.59 2ck4 s HIS 34 Ca 0.15 -0.83 -0.11 0.00 -0.15 0.00 0.00 55.06 54.12 2ck4 s HIS 34 Cb -0.20 -4.13 -0.05 0.00 1.11 0.00 0.00 32.58 29.30 2ck4 s HIS 34 CO 0.11 -1.44 0.16 0.00 -0.85 0.00 0.00 174.74 172.71 2ck4 s THR 36 N 0.46 4.58 0.66 0.00 2.01 0.30 -0.50 115.64 123.16 2ck4 s THR 36 Ca 0.09 -0.10 -0.14 0.00 0.31 0.00 0.00 61.69 61.85 2ck4 s THR 36 Cb -0.12 -3.09 -0.00 0.00 0.01 0.00 0.00 72.50 69.30 2ck4 s THR 36 CO -0.00 0.42 1.09 -2.84 -0.69 0.00 0.00 174.62 172.59 2ck4 s PRO 37 N 0.81 2.91 0.00 4.92 0.02 -1.26 0.07 135.00 142.46 2ck4 s PRO 37 Ca 0.03 1.26 0.17 0.00 0.02 0.00 0.00 61.00 62.48 2ck4 s PRO 37 Cb -0.14 -1.97 1.00 0.00 0.02 0.00 0.00 34.50 33.41 2ck4 s PRO 37 CO 0.02 -1.15 1.41 1.63 -0.33 0.00 0.00 177.00 178.58