#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 3.71 -0.24 1.61 1.01 -0.85 -4.97 120.40 120.67 2ck4 s VAL 2 Ca 0.00 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.20 2ck4 s VAL 2 Cb 0.00 -4.86 -0.03 0.00 0.00 0.00 0.00 36.38 31.49 2ck4 s VAL 2 CO 0.00 -1.80 0.09 -0.63 0.00 0.00 0.00 175.10 172.76 2ck4 s ILE 3 N 5.93 4.55 -0.07 2.22 -1.09 -1.26 -1.20 121.20 130.28 2ck4 s ILE 3 Ca 0.38 -0.09 -0.02 0.00 -2.23 0.00 0.00 60.65 58.69 2ck4 s ILE 3 Cb -0.08 -3.12 -0.03 0.00 -1.58 0.00 0.00 42.46 37.65 2ck4 s ILE 3 CO 0.13 0.35 0.02 0.27 -1.23 0.00 0.00 174.94 174.48 2ck4 s ILE 4 N 1.42 4.42 0.00 2.92 -4.36 -1.11 -4.99 121.20 119.51 2ck4 s ILE 4 Ca 0.06 -0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.18 2ck4 s ILE 4 Cb -0.15 -2.89 0.00 0.00 1.25 0.00 0.00 42.46 40.67 2ck4 s ILE 4 CO 0.04 0.56 1.09 0.59 0.24 0.00 0.00 174.94 177.47 2ck4 n ASN 5 N 1.96 3.21 -4.81 4.36 4.13 -1.26 -3.24 115.26 119.61 2ck4 n ASN 5 Ca -0.18 -2.02 -0.38 0.00 1.68 0.00 0.00 54.58 53.68 2ck4 n ASN 5 Cb 0.54 -0.56 -0.06 0.00 -1.54 0.00 0.00 39.78 38.16 2ck4 n ASN 5 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2ck4 s VAL 6 N 0.01 4.83 -0.34 2.41 1.01 -1.26 -5.03 120.40 122.02 2ck4 s VAL 6 Ca 0.00 1.13 -0.28 0.00 0.00 0.00 0.00 61.98 62.83 2ck4 s VAL 6 Cb 0.00 -3.86 0.02 0.00 0.00 0.00 0.00 36.38 32.54 2ck4 s VAL 6 CO 0.00 0.54 1.02 -0.75 0.00 0.00 0.00 175.10 175.91 2ck4 s LYS 7 N -0.98 3.98 -1.18 2.72 2.36 -1.26 -3.59 119.74 121.79 2ck4 s LYS 7 Ca 0.28 0.88 -0.20 0.00 -2.55 0.00 0.00 55.97 54.38 2ck4 s LYS 7 Cb -0.19 -3.76 0.06 0.00 -1.05 0.00 0.00 37.83 32.89 2ck4 s LYS 7 CO 0.17 -0.93 1.62 0.00 1.55 0.00 0.00 175.35 177.76 2ck4 n LYS 9 N 8.54 0.07 -3.64 0.00 4.01 -1.26 -4.73 118.16 121.15 2ck4 n LYS 9 Ca 0.42 0.24 -0.08 0.00 -0.51 0.00 0.00 58.31 58.38 2ck4 n LYS 9 Cb 0.48 -1.61 -0.07 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 -3.08 0.00 -0.28 -0.18 -4.36 -1.26 -5.05 121.20 106.98 2ck4 s ILE 10 Ca 0.08 0.00 0.28 0.00 -0.26 0.00 0.00 60.65 60.75 2ck4 s ILE 10 Cb 0.12 -1.00 0.31 0.00 1.25 0.00 0.00 42.46 43.14 2ck4 s ILE 10 CO 0.38 0.00 1.81 0.28 0.24 0.00 0.00 174.94 177.65 2ck4 h SER 11 N 4.17 0.00 0.10 4.36 0.02 -1.85 -2.98 113.55 117.37 2ck4 h SER 11 Ca -0.28 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.56 2ck4 h SER 11 Cb 1.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 2ck4 h SER 11 CO 0.12 0.00 -0.37 0.03 -1.14 0.00 0.00 176.83 175.47 2ck4 h ARG 12 N 0.00 0.37 0.00 3.45 2.47 -1.97 -1.26 114.38 117.44 2ck4 h ARG 12 Ca 0.00 -0.17 -0.01 0.00 -1.26 0.00 0.00 59.98 58.54 2ck4 h ARG 12 Cb 0.51 -0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.82 2ck4 h ARG 12 CO 0.00 0.69 -0.04 -0.56 0.56 0.00 0.00 179.97 180.62 2ck4 h GLN 13 N 0.31 0.00 0.05 0.04 3.07 -1.90 -2.46 115.11 114.22 2ck4 h GLN 13 Ca 0.03 0.00 -0.31 0.00 0.09 0.00 0.00 58.65 58.46 2ck4 h GLN 13 Cb 0.80 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.32 2ck4 h GLN 13 CO 0.06 0.04 -1.73 0.00 0.09 0.00 0.00 178.83 177.29 2ck4 h LEU 15 N 0.03 0.00 -0.24 0.00 6.46 -1.15 -2.73 115.31 117.68 2ck4 h LEU 15 Ca -0.30 0.00 0.04 0.00 -0.12 0.00 0.00 57.88 57.50 2ck4 h LEU 15 Cb 2.01 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.90 2ck4 h LEU 15 CO 0.10 0.54 -0.00 0.50 -0.62 0.00 0.00 178.44 178.95 2ck4 h LYS 16 N 0.00 0.07 -0.02 1.25 1.63 -1.63 0.32 116.57 118.18 2ck4 h LYS 16 Ca -0.06 -0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.57 2ck4 h LYS 16 Cb 1.46 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 33.06 2ck4 h LYS 16 CO 0.06 0.04 -0.72 -1.35 -3.45 0.00 0.00 179.45 174.03 2ck4 h PRO 17 N 0.07 0.14 0.06 1.90 0.11 -1.77 -3.11 132.00 129.39 2ck4 h PRO 17 Ca 0.11 -0.13 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 2ck4 h PRO 17 Cb 0.15 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.29 2ck4 h PRO 17 CO -0.20 0.80 -0.03 0.00 -0.21 0.00 0.00 178.00 178.37 2ck4 h LYS 19 N -0.82 0.63 0.00 0.00 3.11 -0.13 0.23 116.57 119.58 2ck4 h LYS 19 Ca -0.01 -0.08 -0.04 0.00 -2.81 0.00 0.00 60.65 57.71 2ck4 h LYS 19 Cb 0.64 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.75 2ck4 h LYS 19 CO 0.01 0.52 -0.19 0.22 -2.81 0.00 0.00 179.45 177.20 2ck4 h ASP 20 N 0.63 0.00 -0.09 4.20 3.58 -1.58 -1.25 116.42 121.91 2ck4 h ASP 20 Ca 0.15 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.60 2ck4 h ASP 20 Cb 0.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2ck4 h ASP 20 CO -0.02 0.19 0.00 0.00 -2.88 0.00 0.00 179.24 176.53 2ck4 n ALA 21 N -2.41 2.49 -0.45 -0.78 0.00 -0.28 -4.93 120.51 114.15 2ck4 n ALA 21 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.76 2ck4 n ALA 21 Cb 0.27 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 1.31 0.66 2.97 0.00 0.00 -0.47 -4.99 105.19 104.67 2ck4 n GLY 22 Ca 0.16 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.38 1.56 0.38 1.61 -1.94 0.64 0.04 119.30 121.21 2ck4 s MET 23 Ca 0.00 -1.44 0.08 0.00 -1.71 0.00 0.00 55.69 52.62 2ck4 s MET 23 Cb 0.00 -2.82 0.82 0.00 2.01 0.00 0.00 34.83 34.83 2ck4 s MET 23 CO 0.00 -0.79 1.95 -0.09 -0.01 0.00 0.00 175.02 176.08 2ck4 h ARG 24 N 7.79 0.65 -6.15 2.03 9.65 -0.29 -2.85 114.38 125.21 2ck4 h ARG 24 Ca -0.12 -0.04 -0.53 0.00 -1.10 0.00 0.00 59.98 58.19 2ck4 h ARG 24 Cb 1.04 -0.15 -0.07 0.00 -1.39 0.00 0.00 29.97 29.40 2ck4 h ARG 24 CO 0.47 0.43 -0.55 -0.06 2.80 0.00 0.00 179.97 183.07 2ck4 s PHE 25 N -5.61 2.79 -0.39 2.20 0.08 0.18 -4.93 117.98 112.30 2ck4 s PHE 25 Ca -0.09 -0.30 0.05 0.00 0.12 0.00 0.00 56.93 56.71 2ck4 s PHE 25 Cb 0.20 -1.53 0.31 0.00 -0.57 0.00 0.00 43.02 41.42 2ck4 s PHE 25 CO 0.77 0.40 1.24 0.41 -0.10 0.00 0.00 175.22 177.94 2ck4 n GLY 26 N -1.13 -0.15 3.75 4.36 0.00 -1.24 -2.47 105.19 108.31 2ck4 n GLY 26 Ca -0.04 0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.87 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 0.16 4.44 -0.14 1.61 -0.14 -0.71 -4.26 119.74 120.70 2ck4 s LYS 27 Ca 0.20 0.96 -0.29 0.00 -1.36 0.00 0.00 55.97 55.48 2ck4 s LYS 27 Cb 0.28 -3.36 -0.04 0.00 -1.68 0.00 0.00 37.83 33.04 2ck4 s LYS 27 CO -0.10 0.30 1.56 0.00 -0.76 0.00 0.00 175.35 176.35 2ck4 s MET 29 N 4.19 0.36 -2.13 0.00 -1.94 0.57 -4.87 119.30 115.48 2ck4 s MET 29 Ca 0.69 -0.26 0.00 0.00 -1.71 0.00 0.00 55.69 54.41 2ck4 s MET 29 Cb -0.28 -1.97 0.00 0.00 2.01 0.00 0.00 34.83 34.59 2ck4 s MET 29 CO 0.27 -0.66 0.00 0.09 -0.01 0.00 0.00 175.02 174.71 2ck4 n ASN 30 N 5.16 -5.50 0.00 3.03 5.03 -1.26 -1.34 115.26 120.38 2ck4 n ASN 30 Ca -0.08 0.43 0.00 0.00 0.87 0.00 0.00 54.58 55.81 2ck4 n ASN 30 Cb 0.48 -4.81 0.00 0.00 -1.02 0.00 0.00 39.78 34.43 2ck4 n ASN 30 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2ck4 n GLY 31 N -0.47 1.79 3.92 7.41 0.00 -1.26 -5.08 105.19 111.50 2ck4 n GLY 31 Ca -0.21 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.12 3.28 -0.47 1.61 3.01 -0.45 -2.24 119.74 124.36 2ck4 s LYS 32 Ca 0.00 -0.81 -0.20 0.00 -1.01 0.00 0.00 55.97 53.95 2ck4 s LYS 32 Cb 0.00 -2.81 0.04 0.00 -1.01 0.00 0.00 37.83 34.05 2ck4 s LYS 32 CO 0.00 0.44 0.61 0.00 0.51 0.00 0.00 175.35 176.91 2ck4 s HIS 34 N 2.66 2.96 -0.29 0.00 3.76 0.67 -2.73 115.29 122.33 2ck4 s HIS 34 Ca 0.18 -1.04 -0.12 0.00 -0.15 0.00 0.00 55.06 53.93 2ck4 s HIS 34 Cb -0.17 -4.22 -0.04 0.00 1.11 0.00 0.00 32.58 29.26 2ck4 s HIS 34 CO 0.15 -1.49 0.25 0.00 -0.85 0.00 0.00 174.74 172.80 2ck4 s THR 36 N 1.85 5.20 0.47 0.00 2.01 -1.03 -2.01 115.64 122.13 2ck4 s THR 36 Ca 0.09 0.66 -0.23 0.00 0.31 0.00 0.00 61.69 62.52 2ck4 s THR 36 Cb -0.16 -3.71 -0.08 0.00 0.01 0.00 0.00 72.50 68.55 2ck4 s THR 36 CO 0.11 0.24 1.19 -0.81 -0.69 0.00 0.00 174.62 174.66 2ck4 n PRO 37 N 4.57 1.61 0.00 4.92 -0.04 -1.26 0.29 135.00 145.09 2ck4 n PRO 37 Ca -0.09 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 2ck4 n PRO 37 Cb 0.51 -2.32 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 2ck4 n PRO 37 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63