#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 -0.22 1.61 1.01 -0.75 -4.97 120.40 121.96 2ck4 s VAL 2 Ca 0.00 -1.49 -0.16 0.00 0.00 0.00 0.00 61.98 60.34 2ck4 s VAL 2 Cb 0.00 -4.65 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 2ck4 s VAL 2 CO 0.00 -1.33 0.40 -0.63 0.00 0.00 0.00 175.10 173.54 2ck4 s ILE 3 N 2.35 5.19 -0.06 2.22 1.09 -1.26 -2.34 121.20 128.39 2ck4 s ILE 3 Ca 0.24 0.69 -0.03 0.00 -1.10 0.00 0.00 60.65 60.45 2ck4 s ILE 3 Cb -0.11 -3.73 -0.04 0.00 -1.06 0.00 0.00 42.46 37.52 2ck4 s ILE 3 CO -0.04 0.23 0.09 0.27 -0.10 0.00 0.00 174.94 175.39 2ck4 s ILE 4 N 1.49 4.91 -0.51 2.92 -4.36 -0.65 -4.96 121.20 120.04 2ck4 s ILE 4 Ca 0.18 -0.17 0.02 0.00 -0.26 0.00 0.00 60.65 60.43 2ck4 s ILE 4 Cb -0.15 -3.17 0.15 0.00 1.25 0.00 0.00 42.46 40.54 2ck4 s ILE 4 CO 0.08 0.49 0.94 -0.46 0.24 0.00 0.00 174.94 176.24 2ck4 n ASN 5 N 1.64 2.48 -4.74 4.36 6.94 -1.26 -1.23 115.26 123.46 2ck4 n ASN 5 Ca -0.16 -2.25 -0.41 0.00 -0.02 0.00 0.00 54.58 51.74 2ck4 n ASN 5 Cb 0.54 -0.55 -0.04 0.00 -2.36 0.00 0.00 39.78 37.36 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 -1.05 3.94 -0.37 3.53 1.01 -1.26 -4.90 120.40 121.29 2ck4 s VAL 6 Ca 0.11 1.66 -0.27 0.00 0.00 0.00 0.00 61.98 63.48 2ck4 s VAL 6 Cb 0.09 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 2ck4 s VAL 6 CO 0.03 0.28 2.12 -0.75 0.00 0.00 0.00 175.10 176.78 2ck4 s LYS 7 N -0.31 2.83 -1.19 2.72 2.47 -1.25 -3.61 119.74 121.40 2ck4 s LYS 7 Ca 0.49 1.52 -0.20 0.00 -1.56 0.00 0.00 55.97 56.22 2ck4 s LYS 7 Cb -0.29 -4.39 0.05 0.00 -1.46 0.00 0.00 37.83 31.74 2ck4 s LYS 7 CO 0.34 -2.46 1.65 0.00 0.16 0.00 0.00 175.35 175.05 2ck4 h LYS 9 N 8.55 0.00 -1.86 0.00 1.79 -1.92 -3.43 116.57 119.70 2ck4 h LYS 9 Ca 0.34 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.80 2ck4 h LYS 9 Cb 0.93 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.36 2ck4 h LYS 9 CO 1.43 0.00 0.28 0.96 -1.08 0.00 0.00 179.45 181.04 2ck4 s ILE 10 N -3.75 0.00 0.26 1.86 -4.36 -1.26 -5.06 121.20 108.89 2ck4 s ILE 10 Ca -0.01 0.00 0.15 0.00 -0.26 0.00 0.00 60.65 60.53 2ck4 s ILE 10 Cb 0.10 -1.00 0.07 0.00 1.25 0.00 0.00 42.46 42.88 2ck4 s ILE 10 CO 0.43 0.00 1.72 0.28 0.24 0.00 0.00 174.94 177.61 2ck4 h SER 11 N 3.53 0.00 0.26 4.36 0.02 -1.85 -3.04 113.55 116.83 2ck4 h SER 11 Ca -0.26 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.65 2ck4 h SER 11 Cb 1.15 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2ck4 h SER 11 CO 0.26 0.46 -0.22 0.08 -1.14 0.00 0.00 176.83 176.27 2ck4 h ARG 12 N 0.00 0.00 0.00 3.45 0.11 -1.98 0.25 114.38 116.21 2ck4 h ARG 12 Ca -0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.07 2ck4 h ARG 12 Cb 0.90 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.98 2ck4 h ARG 12 CO 0.06 0.22 -0.01 -0.56 0.10 0.00 0.00 179.97 179.78 2ck4 h GLN 13 N 0.00 0.00 0.08 0.08 3.07 -1.92 -2.26 115.11 114.16 2ck4 h GLN 13 Ca -0.00 0.00 -0.36 0.00 0.09 0.00 0.00 58.65 58.38 2ck4 h GLN 13 Cb 0.41 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.94 2ck4 h GLN 13 CO 0.03 0.01 -2.01 0.00 0.09 0.00 0.00 178.83 176.95 2ck4 h LEU 15 N -0.13 0.41 0.35 0.00 5.85 -0.94 -2.65 115.31 118.21 2ck4 h LEU 15 Ca -0.45 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.09 2ck4 h LEU 15 Cb 1.90 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.79 2ck4 h LEU 15 CO -0.00 0.78 -0.37 0.50 -0.34 0.00 0.00 178.44 179.00 2ck4 h LYS 16 N 0.32 -0.72 0.00 1.25 3.11 -1.62 0.29 116.57 119.20 2ck4 h LYS 16 Ca 0.03 0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.91 2ck4 h LYS 16 Cb 0.86 0.16 -0.00 0.00 -1.00 0.00 0.00 32.23 32.25 2ck4 h LYS 16 CO 0.07 -0.48 -0.03 -1.00 -2.81 0.00 0.00 179.45 175.20 2ck4 h PRO 17 N -0.75 0.00 0.01 1.90 0.13 -1.79 -2.96 132.00 128.53 2ck4 h PRO 17 Ca -0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2ck4 h PRO 17 Cb 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2ck4 h PRO 17 CO -0.07 0.03 -0.00 0.00 -0.23 0.00 0.00 178.00 177.72 2ck4 h LYS 19 N -0.91 0.00 0.00 0.00 3.64 -0.13 0.38 116.57 119.55 2ck4 h LYS 19 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2ck4 h LYS 19 Cb 0.85 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2ck4 h LYS 19 CO 0.00 0.04 -0.08 0.22 -2.27 0.00 0.00 179.45 177.36 2ck4 h ASP 20 N 0.00 0.00 0.09 4.20 3.58 -1.53 -3.28 116.42 119.48 2ck4 h ASP 20 Ca -0.00 -0.00 -0.36 0.00 0.42 0.00 0.00 57.03 57.09 2ck4 h ASP 20 Cb 0.32 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.30 2ck4 h ASP 20 CO 0.00 0.00 -2.26 0.00 -2.88 0.00 0.00 179.24 174.11 2ck4 n ALA 21 N -2.10 1.50 0.00 -0.78 0.00 -0.02 -4.98 120.51 114.12 2ck4 n ALA 21 Ca 0.04 -1.22 0.00 0.00 0.00 0.00 0.00 53.44 52.25 2ck4 n ALA 21 Cb 0.53 -0.31 0.00 0.00 0.00 0.00 0.00 19.45 19.67 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 1.72 0.26 2.80 0.00 0.00 0.10 -5.03 105.19 105.04 2ck4 n GLY 22 Ca -0.30 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 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 0.95 0.46 1.61 -1.94 0.45 -0.12 119.30 120.72 2ck4 s MET 23 Ca 0.00 -0.82 0.20 0.00 -1.71 0.00 0.00 55.69 53.37 2ck4 s MET 23 Cb 0.00 -2.23 1.14 0.00 2.01 0.00 0.00 34.83 35.74 2ck4 s MET 23 CO 0.00 -0.75 1.98 0.07 -0.01 0.00 0.00 175.02 176.32 2ck4 h ARG 24 N 8.10 0.00 -6.35 2.03 0.11 -0.11 -2.73 114.38 115.43 2ck4 h ARG 24 Ca -0.15 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 59.31 2ck4 h ARG 24 Cb 1.07 0.00 -0.14 0.00 1.11 0.00 0.00 29.97 32.01 2ck4 h ARG 24 CO 0.40 0.20 -0.75 -0.06 0.10 0.00 0.00 179.97 179.86 2ck4 s PHE 25 N -4.28 2.42 -0.41 4.08 0.08 -0.06 -4.96 117.98 114.84 2ck4 s PHE 25 Ca -0.03 -0.30 0.05 0.00 0.12 0.00 0.00 56.93 56.77 2ck4 s PHE 25 Cb 0.14 -1.11 0.18 0.00 -0.57 0.00 0.00 43.02 41.66 2ck4 s PHE 25 CO 0.65 0.62 0.70 0.20 -0.10 0.00 0.00 175.22 177.29 2ck4 s GLY 26 N -3.23 -1.32 -0.08 4.36 0.00 -1.24 -1.32 107.32 104.50 2ck4 s GLY 26 Ca 0.27 0.29 0.04 0.00 0.00 0.00 0.00 44.72 45.32 2ck4 s GLY 26 CO 0.15 3.76 -0.19 1.25 0.00 0.00 0.00 173.10 178.07 2ck4 s LYS 27 N 1.73 2.80 -0.13 2.90 2.20 -0.02 -4.34 119.74 124.87 2ck4 s LYS 27 Ca 0.18 -0.79 -0.29 0.00 -0.36 0.00 0.00 55.97 54.70 2ck4 s LYS 27 Cb -0.02 -2.35 -0.02 0.00 -1.51 0.00 0.00 37.83 33.92 2ck4 s LYS 27 CO -0.08 0.39 1.31 0.00 -0.36 0.00 0.00 175.35 176.60 2ck4 s MET 29 N 3.36 0.15 -0.39 0.00 -1.94 0.46 -4.86 119.30 116.09 2ck4 s MET 29 Ca 0.57 0.14 0.00 0.00 -1.71 0.00 0.00 55.69 54.70 2ck4 s MET 29 Cb -0.24 -1.07 0.00 0.00 2.01 0.00 0.00 34.83 35.54 2ck4 s MET 29 CO 0.18 -0.44 0.00 0.09 -0.01 0.00 0.00 175.02 174.84 2ck4 n ASN 30 N 5.24 -5.43 0.00 3.03 4.13 -1.26 -1.13 115.26 119.84 2ck4 n ASN 30 Ca -0.05 0.09 0.00 0.00 1.68 0.00 0.00 54.58 56.30 2ck4 n ASN 30 Cb 0.50 -3.26 0.00 0.00 -1.54 0.00 0.00 39.78 35.48 2ck4 n ASN 30 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2ck4 n GLY 31 N 0.11 2.16 3.86 7.41 0.00 -1.26 -5.09 105.19 112.38 2ck4 n GLY 31 Ca -0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.34 3.09 -0.44 1.61 3.01 -0.29 -2.90 119.74 123.49 2ck4 s LYS 32 Ca 0.00 -0.82 -0.20 0.00 -1.01 0.00 0.00 55.97 53.94 2ck4 s LYS 32 Cb 0.00 -2.74 0.02 0.00 -1.01 0.00 0.00 37.83 34.11 2ck4 s LYS 32 CO 0.00 0.47 0.59 0.00 0.51 0.00 0.00 175.35 176.93 2ck4 s HIS 34 N 2.65 2.81 -0.40 0.00 3.76 0.58 -1.63 115.29 123.06 2ck4 s HIS 34 Ca 0.20 -0.85 -0.14 0.00 -0.15 0.00 0.00 55.06 54.11 2ck4 s HIS 34 Cb -0.15 -4.33 0.02 0.00 1.11 0.00 0.00 32.58 29.23 2ck4 s HIS 34 CO 0.18 -1.63 0.29 0.00 -0.85 0.00 0.00 174.74 172.72 2ck4 s THR 36 N 1.67 5.13 0.60 0.00 2.01 -0.43 -1.80 115.64 122.81 2ck4 s THR 36 Ca 0.05 1.13 -0.18 0.00 0.31 0.00 0.00 61.69 62.99 2ck4 s THR 36 Cb -0.19 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.37 2ck4 s THR 36 CO 0.10 0.29 0.91 -2.65 -0.69 0.00 0.00 174.62 172.58 2ck4 n PRO 37 N 3.79 0.84 0.00 4.92 -0.02 -1.26 0.32 135.00 143.59 2ck4 n PRO 37 Ca -0.05 0.33 0.06 0.00 -2.02 0.00 0.00 63.50 61.83 2ck4 n PRO 37 Cb 0.51 -2.11 0.38 0.00 -0.02 0.00 0.00 33.50 32.27 2ck4 n PRO 37 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65