#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 4.87 -0.30 1.61 -7.23 -1.03 -4.99 120.40 113.33 2ck4 s VAL 2 Ca 0.00 -1.51 -0.11 0.00 -1.81 0.00 0.00 61.98 58.55 2ck4 s VAL 2 Cb 0.00 -4.65 -0.03 0.00 0.56 0.00 0.00 36.38 32.25 2ck4 s VAL 2 CO 0.00 -1.34 0.18 -0.63 -0.31 0.00 0.00 175.10 173.01 2ck4 s ILE 3 N 2.34 5.07 0.05 -0.62 1.09 -1.26 -2.01 121.20 125.87 2ck4 s ILE 3 Ca 0.25 -0.07 0.01 0.00 -1.10 0.00 0.00 60.65 59.73 2ck4 s ILE 3 Cb -0.11 -3.49 -0.04 0.00 -1.06 0.00 0.00 42.46 37.76 2ck4 s ILE 3 CO -0.04 0.16 0.16 0.27 -0.10 0.00 0.00 174.94 175.39 2ck4 s ILE 4 N 1.71 5.10 -0.10 2.92 -4.36 -0.95 -4.97 121.20 120.55 2ck4 s ILE 4 Ca 0.06 -0.48 -0.00 0.00 -0.26 0.00 0.00 60.65 59.97 2ck4 s ILE 4 Cb -0.16 -3.46 0.07 0.00 1.25 0.00 0.00 42.46 40.16 2ck4 s ILE 4 CO 0.09 0.17 2.00 -0.46 0.24 0.00 0.00 174.94 176.98 2ck4 n ASN 5 N 0.47 5.69 -4.71 4.36 6.94 -1.26 -3.12 115.26 123.62 2ck4 n ASN 5 Ca -0.07 -2.62 -0.35 0.00 -0.02 0.00 0.00 54.58 51.52 2ck4 n ASN 5 Cb 0.51 -1.10 -0.09 0.00 -2.36 0.00 0.00 39.78 36.75 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 -0.75 4.93 -0.48 3.53 1.01 -1.26 -5.05 120.40 122.34 2ck4 s VAL 6 Ca 0.10 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.80 2ck4 s VAL 6 Cb 0.08 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.30 2ck4 s VAL 6 CO -0.00 0.53 1.24 -0.75 0.00 0.00 0.00 175.10 176.11 2ck4 s LYS 7 N -0.22 3.63 -0.78 2.72 2.36 -1.25 -3.75 119.74 122.45 2ck4 s LYS 7 Ca 0.08 0.63 -0.26 0.00 -2.55 0.00 0.00 55.97 53.87 2ck4 s LYS 7 Cb -0.12 -3.97 0.04 0.00 -1.05 0.00 0.00 37.83 32.73 2ck4 s LYS 7 CO 0.01 -1.50 1.29 0.00 1.55 0.00 0.00 175.35 176.70 2ck4 n LYS 9 N 9.19 0.08 -3.59 0.00 4.01 -1.26 -4.74 118.16 121.85 2ck4 n LYS 9 Ca 0.08 0.41 -0.08 0.00 -0.51 0.00 0.00 58.31 58.21 2ck4 n LYS 9 Cb 0.49 -1.68 -0.02 0.00 -0.51 0.00 0.00 35.03 33.32 2ck4 n LYS 9 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 2ck4 s ILE 10 N -3.18 0.00 0.17 -0.18 -4.36 -1.26 -5.06 121.20 107.34 2ck4 s ILE 10 Ca 0.03 -0.32 -0.09 0.00 -0.26 0.00 0.00 60.65 60.02 2ck4 s ILE 10 Cb 0.07 -1.39 0.04 0.00 1.25 0.00 0.00 42.46 42.43 2ck4 s ILE 10 CO 0.24 0.00 1.60 0.28 0.24 0.00 0.00 174.94 177.30 2ck4 h SER 11 N 2.00 1.03 0.20 4.36 0.02 -1.85 -2.96 113.55 116.35 2ck4 h SER 11 Ca -0.26 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 2ck4 h SER 11 Cb 1.26 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.52 2ck4 h SER 11 CO 0.30 1.14 0.00 0.03 -1.14 0.00 0.00 176.83 177.17 2ck4 h ARG 12 N 0.92 0.00 -0.80 3.45 3.08 -1.98 -1.42 114.38 117.62 2ck4 h ARG 12 Ca 0.14 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.32 2ck4 h ARG 12 Cb 0.68 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.67 2ck4 h ARG 12 CO 0.05 0.00 0.53 1.96 -1.07 0.00 0.00 179.97 181.44 2ck4 h GLN 13 N 0.00 0.59 0.00 0.04 1.08 -1.87 -2.94 115.11 112.01 2ck4 h GLN 13 Ca 0.00 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2ck4 h GLN 13 Cb 0.10 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2ck4 h GLN 13 CO 0.00 0.39 -1.20 0.00 -0.95 0.00 0.00 178.83 177.07 2ck4 h LEU 15 N 0.00 0.43 0.64 0.00 5.85 -1.24 -0.03 115.31 120.95 2ck4 h LEU 15 Ca 0.00 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 2ck4 h LEU 15 Cb 0.30 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2ck4 h LEU 15 CO 0.00 0.70 -0.31 0.50 -0.34 0.00 0.00 178.44 178.98 2ck4 h LYS 16 N 0.37 -0.84 0.00 1.25 1.63 -1.76 0.28 116.57 117.51 2ck4 h LYS 16 Ca 0.05 0.06 -0.04 0.00 -0.85 0.00 0.00 60.65 59.87 2ck4 h LYS 16 Cb 0.68 0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 32.50 2ck4 h LYS 16 CO 0.05 -0.56 -0.18 -1.00 -3.45 0.00 0.00 179.45 174.32 2ck4 h PRO 17 N -0.87 0.00 0.03 1.90 0.13 -1.80 -2.68 132.00 128.71 2ck4 h PRO 17 Ca -0.09 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.04 2ck4 h PRO 17 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 2ck4 h PRO 17 CO 0.14 0.18 -0.01 0.00 -0.23 0.00 0.00 178.00 178.07 2ck4 h LYS 19 N -0.99 0.00 -0.40 0.00 3.64 -0.45 -0.52 116.57 117.85 2ck4 h LYS 19 Ca -0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 2ck4 h LYS 19 Cb 0.38 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 2ck4 h LYS 19 CO 0.01 0.20 -0.06 0.22 -2.27 0.00 0.00 179.45 177.54 2ck4 h ASP 20 N 0.00 0.64 1.22 4.20 3.58 -1.59 -2.09 116.42 122.39 2ck4 h ASP 20 Ca -0.00 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.29 2ck4 h ASP 20 Cb 0.45 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2ck4 h ASP 20 CO 0.03 0.75 -0.11 0.00 -2.88 0.00 0.00 179.24 177.03 2ck4 n ALA 21 N -2.48 2.45 0.00 -0.78 0.00 -0.33 -4.92 120.51 114.45 2ck4 n ALA 21 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2ck4 n ALA 21 Cb 0.31 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 1.37 0.73 2.65 0.00 0.00 -0.49 -4.99 105.19 104.47 2ck4 n GLY 22 Ca 0.06 -0.77 -0.24 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.26 0.08 0.59 1.61 -1.94 -0.86 -0.25 119.30 117.26 2ck4 s MET 23 Ca 0.00 0.02 0.36 0.00 -1.71 0.00 0.00 55.69 54.36 2ck4 s MET 23 Cb 0.00 -1.60 1.78 0.00 2.01 0.00 0.00 34.83 37.02 2ck4 s MET 23 CO 0.00 -0.64 2.15 0.07 -0.01 0.00 0.00 175.02 176.59 2ck4 h ARG 24 N 8.40 0.00 -5.63 2.03 0.11 0.12 -3.21 114.38 116.20 2ck4 h ARG 24 Ca -0.15 0.00 -0.48 0.00 0.10 0.00 0.00 59.98 59.45 2ck4 h ARG 24 Cb 1.15 0.00 -0.23 0.00 1.11 0.00 0.00 29.97 32.00 2ck4 h ARG 24 CO 0.28 0.03 -0.80 -0.06 0.10 0.00 0.00 179.97 179.52 2ck4 s PHE 25 N -3.97 1.43 -0.42 4.08 0.08 0.12 -4.94 117.98 114.36 2ck4 s PHE 25 Ca -0.02 -0.41 0.09 0.00 0.12 0.00 0.00 56.93 56.71 2ck4 s PHE 25 Cb 0.11 -0.82 0.31 0.00 -0.57 0.00 0.00 43.02 42.06 2ck4 s PHE 25 CO 0.51 0.09 0.85 0.41 -0.10 0.00 0.00 175.22 176.98 2ck4 n GLY 26 N 1.49 2.07 3.77 4.36 0.00 -1.26 -1.31 105.19 114.32 2ck4 n GLY 26 Ca -0.19 -0.88 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 2ck4 n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ck4 s LYS 27 N -0.98 4.22 -0.15 1.61 1.02 -0.50 -4.02 119.74 120.95 2ck4 s LYS 27 Ca 0.32 0.55 -0.28 0.00 0.02 0.00 0.00 55.97 56.59 2ck4 s LYS 27 Cb 0.29 -3.34 -0.01 0.00 -0.52 0.00 0.00 37.83 34.25 2ck4 s LYS 27 CO -0.09 0.40 0.93 0.00 -0.92 0.00 0.00 175.35 175.67 2ck4 s MET 29 N 2.19 0.24 -2.09 0.00 -1.94 -0.09 -4.88 119.30 112.73 2ck4 s MET 29 Ca 0.43 -0.35 0.00 0.00 -1.71 0.00 0.00 55.69 54.06 2ck4 s MET 29 Cb -0.17 -1.66 0.00 0.00 2.01 0.00 0.00 34.83 35.01 2ck4 s MET 29 CO 0.14 -0.81 0.00 0.09 -0.01 0.00 0.00 175.02 174.43 2ck4 n ASN 30 N 5.21 -5.31 0.00 3.03 3.02 -1.26 -1.78 115.26 118.16 2ck4 n ASN 30 Ca -0.07 0.45 0.00 0.00 -0.03 0.00 0.00 54.58 54.93 2ck4 n ASN 30 Cb 0.46 -4.68 0.00 0.00 -0.61 0.00 0.00 39.78 34.95 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 -0.43 0.73 3.92 7.41 0.00 -1.26 -5.09 105.19 110.47 2ck4 n GLY 31 Ca -0.20 -0.12 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 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 0.00 3.57 -0.53 1.61 1.02 -0.74 -2.13 119.74 122.55 2ck4 s LYS 32 Ca 0.00 -0.19 -0.19 0.00 0.02 0.00 0.00 55.97 55.60 2ck4 s LYS 32 Cb 0.00 -2.76 0.07 0.00 -0.52 0.00 0.00 37.83 34.61 2ck4 s LYS 32 CO 0.00 0.33 0.67 0.00 -0.92 0.00 0.00 175.35 175.43 2ck4 s HIS 34 N 2.76 2.92 -0.19 0.00 3.76 0.64 -2.25 115.29 122.94 2ck4 s HIS 34 Ca 0.15 -1.03 -0.11 0.00 -0.15 0.00 0.00 55.06 53.92 2ck4 s HIS 34 Cb -0.20 -4.30 -0.05 0.00 1.11 0.00 0.00 32.58 29.15 2ck4 s HIS 34 CO 0.11 -1.56 0.19 0.00 -0.85 0.00 0.00 174.74 172.62 2ck4 s THR 36 N 0.39 4.01 0.78 0.00 2.01 -0.42 -2.48 115.64 119.93 2ck4 s THR 36 Ca 0.11 -0.32 -0.14 0.00 0.31 0.00 0.00 61.69 61.66 2ck4 s THR 36 Cb -0.12 -2.76 0.07 0.00 0.01 0.00 0.00 72.50 69.69 2ck4 s THR 36 CO 0.00 0.49 1.19 -2.84 -0.69 0.00 0.00 174.62 172.77 2ck4 s PRO 37 N 0.37 1.88 0.00 4.92 0.02 -1.26 0.54 135.00 141.47 2ck4 s PRO 37 Ca -0.03 1.68 0.16 0.00 0.02 0.00 0.00 61.00 62.82 2ck4 s PRO 37 Cb -0.14 -1.81 0.95 0.00 0.02 0.00 0.00 34.50 33.52 2ck4 s PRO 37 CO 0.03 -2.01 1.36 1.63 -0.33 0.00 0.00 177.00 177.67