#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 4.25 -0.34 1.61 1.01 -0.79 -4.94 120.40 121.20 2ck4 s VAL 2 Ca 0.00 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 61.42 2ck4 s VAL 2 Cb 0.00 -4.74 0.00 0.00 0.00 0.00 0.00 36.38 31.64 2ck4 s VAL 2 CO 0.00 -1.53 0.68 -0.63 0.00 0.00 0.00 175.10 173.62 2ck4 s ILE 3 N 4.24 4.86 0.04 2.22 -1.09 -1.26 -3.23 121.20 126.97 2ck4 s ILE 3 Ca 0.25 0.80 0.02 0.00 -2.23 0.00 0.00 60.65 59.49 2ck4 s ILE 3 Cb -0.14 -4.09 -0.04 0.00 -1.58 0.00 0.00 42.46 36.61 2ck4 s ILE 3 CO 0.09 -0.28 0.02 0.27 -1.23 0.00 0.00 174.94 173.81 2ck4 s ILE 4 N 2.80 4.25 -0.81 2.92 -4.36 -0.86 -4.99 121.20 120.14 2ck4 s ILE 4 Ca 0.27 -0.72 0.06 0.00 -0.26 0.00 0.00 60.65 60.00 2ck4 s ILE 4 Cb -0.14 -2.97 0.31 0.00 1.25 0.00 0.00 42.46 40.91 2ck4 s ILE 4 CO 0.14 0.25 1.00 -0.46 0.24 0.00 0.00 174.94 176.11 2ck4 n ASN 5 N 0.96 2.71 -4.70 4.36 6.94 -1.26 -2.63 115.26 121.64 2ck4 n ASN 5 Ca -0.12 -2.33 -0.42 0.00 -0.02 0.00 0.00 54.58 51.69 2ck4 n ASN 5 Cb 0.52 -0.54 -0.03 0.00 -2.36 0.00 0.00 39.78 37.37 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 -1.67 4.49 -0.45 3.53 1.01 -1.26 -4.96 120.40 121.09 2ck4 s VAL 6 Ca 0.21 1.79 -0.28 0.00 0.00 0.00 0.00 61.98 63.70 2ck4 s VAL 6 Cb 0.15 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 2ck4 s VAL 6 CO 0.07 0.10 1.68 -0.75 0.00 0.00 0.00 175.10 176.20 2ck4 s LYS 7 N 1.34 3.19 -0.95 2.72 2.36 -1.26 -3.87 119.74 123.28 2ck4 s LYS 7 Ca 0.54 0.97 -0.24 0.00 -2.55 0.00 0.00 55.97 54.70 2ck4 s LYS 7 Cb -0.24 -4.20 0.02 0.00 -1.05 0.00 0.00 37.83 32.36 2ck4 s LYS 7 CO 0.26 -2.04 1.56 0.00 1.55 0.00 0.00 175.35 176.68 2ck4 n LYS 9 N 8.94 0.11 -3.82 0.00 3.00 -1.26 -4.75 118.16 120.39 2ck4 n LYS 9 Ca 0.31 0.45 -0.06 0.00 -0.00 0.00 0.00 58.31 59.01 2ck4 n LYS 9 Cb 0.50 -1.76 -0.02 0.00 0.00 0.00 0.00 35.03 33.75 2ck4 n LYS 9 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 2ck4 s ILE 10 N -3.26 0.00 0.37 3.15 -4.36 -1.26 -5.04 121.20 110.80 2ck4 s ILE 10 Ca 0.03 -0.87 0.21 0.00 -0.26 0.00 0.00 60.65 59.75 2ck4 s ILE 10 Cb 0.07 -2.00 0.21 0.00 1.25 0.00 0.00 42.46 41.99 2ck4 s ILE 10 CO 0.27 0.00 1.95 0.28 0.24 0.00 0.00 174.94 177.67 2ck4 h SER 11 N 2.00 0.00 -0.89 4.36 0.02 -1.90 -1.82 113.55 115.32 2ck4 h SER 11 Ca -0.21 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 60.93 2ck4 h SER 11 Cb 1.24 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 63.67 2ck4 h SER 11 CO 0.24 0.22 0.44 0.03 -1.14 0.00 0.00 176.83 176.62 2ck4 h ARG 12 N 0.00 0.52 0.00 3.45 2.47 -1.96 0.17 114.38 119.02 2ck4 h ARG 12 Ca -0.00 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 2ck4 h ARG 12 Cb 0.50 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 2ck4 h ARG 12 CO 0.03 0.34 0.00 1.04 0.56 0.00 0.00 179.97 181.94 2ck4 n GLN 13 N -4.94 0.11 -0.12 0.04 1.13 -0.68 -1.11 117.38 111.81 2ck4 n GLN 13 Ca 0.20 0.13 -0.23 0.00 -1.94 0.00 0.00 57.00 55.16 2ck4 n GLN 13 Cb 0.56 -1.50 -0.08 0.00 0.11 0.00 0.00 30.24 29.33 2ck4 n GLN 13 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2ck4 h LEU 15 N -1.00 0.74 -0.03 0.00 5.85 -0.89 -2.91 115.31 117.07 2ck4 h LEU 15 Ca -0.48 -0.58 0.03 0.00 0.84 0.00 0.00 57.88 57.69 2ck4 h LEU 15 Cb 1.40 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 2ck4 h LEU 15 CO -0.29 1.37 -0.17 0.50 -0.34 0.00 0.00 178.44 179.51 2ck4 h LYS 16 N 0.33 -0.25 -0.02 1.25 1.63 -1.34 0.43 116.57 118.61 2ck4 h LYS 16 Ca -0.10 0.02 -0.13 0.00 -0.85 0.00 0.00 60.65 59.59 2ck4 h LYS 16 Cb 1.61 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 33.28 2ck4 h LYS 16 CO 0.18 -0.17 -0.57 -1.35 -3.45 0.00 0.00 179.45 174.09 2ck4 h PRO 17 N -0.26 0.07 0.00 1.90 0.11 -1.79 -3.11 132.00 128.92 2ck4 h PRO 17 Ca 0.06 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 2ck4 h PRO 17 Cb 0.35 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 31.46 2ck4 h PRO 17 CO -0.18 0.62 -0.04 0.00 -0.21 0.00 0.00 178.00 178.19 2ck4 h LYS 19 N -1.00 0.28 -0.62 0.00 3.64 -0.13 0.24 116.57 118.98 2ck4 h LYS 19 Ca -0.01 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.32 2ck4 h LYS 19 Cb 0.50 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 2ck4 h LYS 19 CO -0.01 0.26 0.32 0.22 -2.27 0.00 0.00 179.45 177.97 2ck4 h ASP 20 N 0.28 0.77 0.60 4.20 3.58 -1.64 -2.55 116.42 121.66 2ck4 h ASP 20 Ca 0.07 -0.06 -0.28 0.00 0.42 0.00 0.00 57.03 57.17 2ck4 h ASP 20 Cb 0.10 -0.20 -0.00 0.00 1.72 0.00 0.00 39.33 40.95 2ck4 h ASP 20 CO -0.00 0.64 -1.34 0.00 -2.88 0.00 0.00 179.24 175.66 2ck4 h ALA 21 N 1.49 0.19 0.00 -0.78 0.00 -0.98 -3.48 119.26 115.71 2ck4 h ALA 21 Ca 0.22 -0.98 0.00 0.00 0.00 0.00 0.00 54.91 54.15 2ck4 h ALA 21 Cb 0.05 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2ck4 h ALA 21 CO -0.03 1.07 0.00 0.41 0.00 0.00 0.00 179.25 180.70 2ck4 n GLY 22 N 1.56 -0.05 2.70 0.00 0.00 0.68 -5.03 105.19 105.06 2ck4 n GLY 22 Ca -0.11 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 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 0.59 0.56 1.61 -1.94 -0.66 -0.08 119.30 119.38 2ck4 s MET 23 Ca 0.00 -0.64 0.30 0.00 -1.71 0.00 0.00 55.69 53.64 2ck4 s MET 23 Cb 0.00 -1.92 1.65 0.00 2.01 0.00 0.00 34.83 36.57 2ck4 s MET 23 CO 0.00 -0.81 2.16 -0.09 -0.01 0.00 0.00 175.02 176.27 2ck4 h ARG 24 N 8.22 0.00 -5.93 2.03 2.43 -0.88 -3.18 114.38 117.08 2ck4 h ARG 24 Ca -0.16 0.00 -0.52 0.00 -0.81 0.00 0.00 59.98 58.49 2ck4 h ARG 24 Cb 1.07 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 30.43 2ck4 h ARG 24 CO 0.39 0.07 -0.79 -0.06 -1.51 0.00 0.00 179.97 178.07 2ck4 s PHE 25 N -4.34 1.78 -0.33 2.20 0.08 -0.42 -4.98 117.98 111.97 2ck4 s PHE 25 Ca -0.04 -0.47 0.06 0.00 0.12 0.00 0.00 56.93 56.60 2ck4 s PHE 25 Cb 0.14 -0.90 0.19 0.00 -0.57 0.00 0.00 43.02 41.88 2ck4 s PHE 25 CO 0.56 0.29 0.62 0.20 -0.10 0.00 0.00 175.22 176.79 2ck4 s GLY 26 N -2.52 -1.26 -0.12 4.36 0.00 -1.26 -1.03 107.32 105.49 2ck4 s GLY 26 Ca 0.13 0.84 -0.02 0.00 0.00 0.00 0.00 44.72 45.68 2ck4 s GLY 26 CO 0.06 3.71 -0.05 1.25 0.00 0.00 0.00 173.10 178.06 2ck4 s LYS 27 N 2.53 3.29 0.02 2.90 2.20 -1.13 -4.14 119.74 125.40 2ck4 s LYS 27 Ca 0.12 -0.54 -0.30 0.00 -0.36 0.00 0.00 55.97 54.90 2ck4 s LYS 27 Cb -0.08 -2.77 -0.04 0.00 -1.51 0.00 0.00 37.83 33.43 2ck4 s LYS 27 CO -0.20 0.42 1.08 0.00 -0.36 0.00 0.00 175.35 176.29 2ck4 s MET 29 N 1.14 0.92 0.00 0.00 1.00 -0.26 -4.96 119.30 117.13 2ck4 s MET 29 Ca 0.55 -1.35 0.00 0.00 0.00 0.00 0.00 55.69 54.89 2ck4 s MET 29 Cb -0.25 -2.22 0.00 0.00 0.00 0.00 0.00 34.83 32.37 2ck4 s MET 29 CO 0.28 -1.01 0.00 0.09 0.00 0.00 0.00 175.02 174.37 2ck4 n ASN 30 N 4.53 0.00 0.00 3.03 4.13 -1.26 -2.29 115.26 123.40 2ck4 n ASN 30 Ca 0.01 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.27 2ck4 n ASN 30 Cb 0.41 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.65 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 0.00 0.00 3.91 7.41 0.00 -1.26 -4.94 105.19 110.31 2ck4 n GLY 31 Ca 0.00 0.00 -0.29 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 -1.15 3.57 -0.13 1.61 3.01 -0.97 -2.16 119.74 123.52 2ck4 s LYS 32 Ca 0.00 -0.19 -0.17 0.00 -1.01 0.00 0.00 55.97 54.61 2ck4 s LYS 32 Cb 0.00 -2.79 -0.04 0.00 -1.01 0.00 0.00 37.83 33.98 2ck4 s LYS 32 CO 0.00 0.37 0.41 0.00 0.51 0.00 0.00 175.35 176.64 2ck4 s HIS 34 N 0.52 3.41 -0.14 0.00 3.76 -0.69 -2.02 115.29 120.13 2ck4 s HIS 34 Ca 0.23 -3.03 -0.08 0.00 -0.15 0.00 0.00 55.06 52.03 2ck4 s HIS 34 Cb -0.14 -2.99 -0.04 0.00 1.11 0.00 0.00 32.58 30.52 2ck4 s HIS 34 CO 0.08 -0.74 0.13 0.00 -0.85 0.00 0.00 174.74 173.36 2ck4 s THR 36 N -0.59 5.27 0.69 0.00 2.01 -0.19 -1.88 115.64 120.95 2ck4 s THR 36 Ca 0.13 0.57 -0.17 0.00 0.31 0.00 0.00 61.69 62.53 2ck4 s THR 36 Cb -0.12 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.75 2ck4 s THR 36 CO 0.02 0.34 1.23 -2.65 -0.69 0.00 0.00 174.62 172.87 2ck4 n PRO 37 N 3.96 0.86 0.00 4.92 -0.02 -1.26 -0.55 135.00 142.91 2ck4 n PRO 37 Ca -0.11 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2ck4 n PRO 37 Cb 0.52 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 2ck4 n PRO 37 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65