#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 3.79 -0.29 1.61 1.01 -0.84 -4.91 120.40 120.78 2ck4 s VAL 2 Ca 0.00 0.70 -0.08 0.00 0.00 0.00 0.00 61.98 62.60 2ck4 s VAL 2 Cb 0.00 -4.39 -0.01 0.00 0.00 0.00 0.00 36.38 31.98 2ck4 s VAL 2 CO 0.00 -1.10 0.10 -0.63 0.00 0.00 0.00 175.10 173.48 2ck4 s ILE 3 N 6.03 4.33 0.07 2.22 -1.09 -1.26 -0.96 121.20 130.55 2ck4 s ILE 3 Ca 0.54 -0.41 0.06 0.00 -2.23 0.00 0.00 60.65 58.62 2ck4 s ILE 3 Cb -0.11 -3.15 -0.04 0.00 -1.58 0.00 0.00 42.46 37.58 2ck4 s ILE 3 CO 0.26 0.16 -0.12 0.27 -1.23 0.00 0.00 174.94 174.29 2ck4 s ILE 4 N 1.58 3.27 -1.42 2.92 -4.36 -0.99 -5.01 121.20 117.19 2ck4 s ILE 4 Ca 0.05 -1.16 -0.13 0.00 -0.26 0.00 0.00 60.65 59.16 2ck4 s ILE 4 Cb -0.16 -2.47 0.07 0.00 1.25 0.00 0.00 42.46 41.15 2ck4 s ILE 4 CO 0.04 0.22 2.17 -0.46 0.24 0.00 0.00 174.94 177.15 2ck4 n ASN 5 N 1.09 4.40 -3.95 4.36 6.94 -1.26 -3.17 115.26 123.67 2ck4 n ASN 5 Ca -0.15 -2.91 -0.22 0.00 -0.02 0.00 0.00 54.58 51.29 2ck4 n ASN 5 Cb 0.52 -1.61 -0.16 0.00 -2.36 0.00 0.00 39.78 36.17 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 2.38 0.82 -1.07 3.53 1.01 -1.26 -5.06 120.40 120.75 2ck4 s VAL 6 Ca 0.46 -0.29 -0.22 0.00 0.00 0.00 0.00 61.98 61.93 2ck4 s VAL 6 Cb 0.13 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.72 2ck4 s VAL 6 CO -0.06 0.29 1.73 -0.75 0.00 0.00 0.00 175.10 176.30 2ck4 s LYS 7 N 0.82 3.20 -0.56 2.72 2.36 -1.26 -3.74 119.74 123.27 2ck4 s LYS 7 Ca -0.12 -1.07 -0.26 0.00 -2.55 0.00 0.00 55.97 51.97 2ck4 s LYS 7 Cb -0.15 -5.29 -0.09 0.00 -1.05 0.00 0.00 37.83 31.25 2ck4 s LYS 7 CO 0.02 -2.84 2.43 0.00 1.55 0.00 0.00 175.35 176.50 2ck4 n LYS 9 N 8.92 0.09 -3.56 0.00 4.76 -1.26 -4.80 118.16 122.31 2ck4 n LYS 9 Ca 0.40 0.27 -0.09 0.00 -2.87 0.00 0.00 58.31 56.02 2ck4 n LYS 9 Cb 0.50 -1.65 -0.04 0.00 -1.84 0.00 0.00 35.03 32.01 2ck4 n LYS 9 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2ck4 s ILE 10 N -3.11 0.00 0.25 -0.18 -4.36 -1.26 -5.04 121.20 107.50 2ck4 s ILE 10 Ca 0.07 0.00 0.09 0.00 -0.26 0.00 0.00 60.65 60.55 2ck4 s ILE 10 Cb 0.11 -1.00 -0.05 0.00 1.25 0.00 0.00 42.46 42.77 2ck4 s ILE 10 CO 0.38 0.00 1.57 0.28 0.24 0.00 0.00 174.94 177.41 2ck4 h SER 11 N 2.32 0.06 0.17 4.36 0.02 -1.87 -3.17 113.55 115.43 2ck4 h SER 11 Ca -0.18 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.72 2ck4 h SER 11 Cb 1.19 -0.02 -0.00 0.00 0.14 0.00 0.00 62.40 63.71 2ck4 h SER 11 CO 0.30 0.69 -0.07 0.03 -1.14 0.00 0.00 176.83 176.65 2ck4 h ARG 12 N 0.04 0.00 0.00 3.45 3.08 -1.97 -0.02 114.38 118.96 2ck4 h ARG 12 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2ck4 h ARG 12 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.20 2ck4 h ARG 12 CO 0.09 0.07 0.00 -0.56 -1.07 0.00 0.00 179.97 178.49 2ck4 h GLN 13 N 0.00 0.00 0.01 0.04 3.07 -1.92 -3.16 115.11 113.14 2ck4 h GLN 13 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 58.65 58.39 2ck4 h GLN 13 Cb 0.17 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.66 2ck4 h GLN 13 CO 0.01 0.00 -2.18 0.00 0.09 0.00 0.00 178.83 176.75 2ck4 h LEU 15 N 0.00 0.67 0.10 0.00 5.85 -1.08 -2.27 115.31 118.59 2ck4 h LEU 15 Ca -0.47 -0.30 0.02 0.00 0.84 0.00 0.00 57.88 57.97 2ck4 h LEU 15 Cb 2.14 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.94 2ck4 h LEU 15 CO 0.04 1.00 -0.34 0.50 -0.34 0.00 0.00 178.44 179.30 2ck4 h LYS 16 N 0.51 -0.54 0.00 1.25 1.63 -1.76 0.29 116.57 117.96 2ck4 h LYS 16 Ca 0.04 0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.86 2ck4 h LYS 16 Cb 0.94 0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 32.69 2ck4 h LYS 16 CO 0.08 -0.36 -0.09 -1.35 -3.45 0.00 0.00 179.45 174.29 2ck4 h PRO 17 N -0.56 0.00 0.00 1.90 0.11 -1.78 -2.55 132.00 129.12 2ck4 h PRO 17 Ca 0.03 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.13 2ck4 h PRO 17 Cb 0.60 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.71 2ck4 h PRO 17 CO -0.21 0.09 -0.14 0.00 -0.21 0.00 0.00 178.00 177.52 2ck4 h LYS 19 N -1.00 0.00 -0.23 0.00 3.64 0.19 0.49 116.57 119.65 2ck4 h LYS 19 Ca -0.02 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 2ck4 h LYS 19 Cb 0.47 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 2ck4 h LYS 19 CO -0.01 0.24 -0.25 0.22 -2.27 0.00 0.00 179.45 177.38 2ck4 h ASP 20 N 0.00 0.44 0.08 4.20 1.82 -1.58 -3.23 116.42 118.17 2ck4 h ASP 20 Ca -0.00 -0.15 -0.22 0.00 -0.39 0.00 0.00 57.03 56.27 2ck4 h ASP 20 Cb 0.58 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.46 2ck4 h ASP 20 CO 0.03 0.70 -1.14 0.00 -1.61 0.00 0.00 179.24 177.22 2ck4 h ALA 21 N 1.34 0.14 0.00 -0.78 0.00 -1.07 -3.48 119.26 115.41 2ck4 h ALA 21 Ca 0.06 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 53.98 2ck4 h ALA 21 Cb 0.66 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2ck4 h ALA 21 CO 0.05 0.65 0.00 0.41 0.00 0.00 0.00 179.25 180.36 2ck4 n GLY 22 N 1.67 0.00 2.93 0.00 0.00 0.92 -5.06 105.19 105.64 2ck4 n GLY 22 Ca -0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.49 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 0.00 1.37 0.44 1.61 -1.94 0.13 0.10 119.30 121.02 2ck4 s MET 23 Ca 0.00 -1.39 0.20 0.00 -1.71 0.00 0.00 55.69 52.79 2ck4 s MET 23 Cb 0.00 -2.71 1.16 0.00 2.01 0.00 0.00 34.83 35.29 2ck4 s MET 23 CO 0.00 -0.83 1.87 0.07 -0.01 0.00 0.00 175.02 176.12 2ck4 h ARG 24 N 7.84 0.31 -6.08 2.03 0.11 -0.77 -2.23 114.38 115.58 2ck4 h ARG 24 Ca -0.11 -0.02 -0.59 0.00 0.10 0.00 0.00 59.98 59.36 2ck4 h ARG 24 Cb 1.03 -0.07 -0.14 0.00 1.11 0.00 0.00 29.97 31.90 2ck4 h ARG 24 CO 0.47 0.21 -0.74 -0.06 0.10 0.00 0.00 179.97 179.95 2ck4 s PHE 25 N -5.33 2.24 -0.34 4.08 0.08 -0.04 -4.89 117.98 113.77 2ck4 s PHE 25 Ca -0.07 -0.39 0.07 0.00 0.12 0.00 0.00 56.93 56.65 2ck4 s PHE 25 Cb 0.22 -1.03 0.19 0.00 -0.57 0.00 0.00 43.02 41.83 2ck4 s PHE 25 CO 0.78 0.65 0.60 0.20 -0.10 0.00 0.00 175.22 177.35 2ck4 s GLY 26 N -3.50 -1.25 -0.06 4.36 0.00 -1.26 -1.74 107.32 103.86 2ck4 s GLY 26 Ca 0.30 0.69 0.06 0.00 0.00 0.00 0.00 44.72 45.76 2ck4 s GLY 26 CO 0.14 3.67 -0.25 0.54 0.00 0.00 0.00 173.10 177.20 2ck4 s LYS 27 N 2.41 2.61 -0.08 2.90 1.02 0.19 -4.31 119.74 124.48 2ck4 s LYS 27 Ca 0.13 -0.90 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 2ck4 s LYS 27 Cb -0.08 -2.18 -0.03 0.00 -0.52 0.00 0.00 37.83 35.02 2ck4 s LYS 27 CO -0.18 0.36 1.27 0.00 -0.92 0.00 0.00 175.35 175.87 2ck4 s MET 29 N 2.68 1.25 0.00 0.00 -1.94 -0.11 -4.93 119.30 116.25 2ck4 s MET 29 Ca 0.57 -1.74 0.00 0.00 -1.71 0.00 0.00 55.69 52.81 2ck4 s MET 29 Cb -0.25 -2.62 0.00 0.00 2.01 0.00 0.00 34.83 33.97 2ck4 s MET 29 CO 0.21 -1.03 0.00 -1.71 -0.01 0.00 0.00 175.02 172.48 2ck4 n ASN 30 N 4.13 0.00 0.00 3.03 5.15 -1.26 -3.05 115.26 123.27 2ck4 n ASN 30 Ca 0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.01 2ck4 n ASN 30 Cb 0.39 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.64 2ck4 n ASN 30 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ck4 n GLY 31 N 0.00 0.02 3.86 8.20 0.00 -1.26 -5.00 105.19 111.01 2ck4 n GLY 31 Ca 0.00 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.00 2.48 -0.20 1.61 1.02 -1.17 -3.07 119.74 119.41 2ck4 s LYS 32 Ca 0.00 -1.60 -0.15 0.00 0.02 0.00 0.00 55.97 54.23 2ck4 s LYS 32 Cb 0.00 -2.32 -0.04 0.00 -0.52 0.00 0.00 37.83 34.95 2ck4 s LYS 32 CO 0.00 -0.22 0.37 0.00 -0.92 0.00 0.00 175.35 174.58 2ck4 s HIS 34 N 1.18 3.27 -0.26 0.00 3.76 0.84 -2.35 115.29 121.73 2ck4 s HIS 34 Ca 0.18 -1.13 -0.06 0.00 -0.15 0.00 0.00 55.06 53.90 2ck4 s HIS 34 Cb -0.14 -2.61 -0.01 0.00 1.11 0.00 0.00 32.58 30.93 2ck4 s HIS 34 CO 0.07 -0.71 0.05 0.00 -0.85 0.00 0.00 174.74 173.29 2ck4 s THR 36 N 1.54 4.87 0.50 0.00 2.01 -0.71 -1.98 115.64 121.88 2ck4 s THR 36 Ca 0.05 2.01 -0.21 0.00 0.31 0.00 0.00 61.69 63.85 2ck4 s THR 36 Cb -0.16 -4.30 -0.07 0.00 0.01 0.00 0.00 72.50 67.99 2ck4 s THR 36 CO 0.01 0.17 1.15 -2.84 -0.69 0.00 0.00 174.62 172.43 2ck4 s PRO 37 N 0.96 3.56 0.00 4.92 0.02 -1.26 -0.31 135.00 142.89 2ck4 s PRO 37 Ca 0.51 1.72 0.30 0.00 0.02 0.00 0.00 61.00 63.54 2ck4 s PRO 37 Cb -0.21 -2.23 1.39 0.00 0.02 0.00 0.00 34.50 33.48 2ck4 s PRO 37 CO 0.27 -0.70 1.94 1.17 -0.33 0.00 0.00 177.00 179.35