#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ckx s PRO 2 N 0.00 3.45 -1.25 0.03 0.04 -1.26 -3.88 135.00 132.14 1ckx s PRO 2 Ca 0.00 1.21 -0.02 0.00 0.04 0.00 0.00 61.00 62.23 1ckx s PRO 2 Cb 0.00 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 1ckx s PRO 2 CO 0.00 -0.70 0.79 0.41 0.04 0.00 0.00 177.00 177.53 1ckx n GLY 3 N -0.90 -0.44 0.00 0.56 0.00 -1.26 -4.89 105.19 98.26 1ckx n GLY 3 Ca 0.09 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1ckx n GLY 3 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ckx n THR 4 N -4.14 0.00 0.02 2.61 5.66 -1.25 -4.71 114.28 112.48 1ckx n THR 4 Ca -0.26 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.53 1ckx n THR 4 Cb 0.67 -0.62 -0.14 0.00 -1.55 0.00 0.00 70.33 68.68 1ckx n THR 4 CO 0.00 0.00 0.00 0.40 -3.05 0.00 0.00 175.07 172.42 1ckx h ILE 5 N 0.00 1.28 -1.18 1.09 2.04 -1.90 -2.55 117.51 116.29 1ckx h ILE 5 Ca 0.00 -2.46 0.34 0.00 1.00 0.00 0.00 64.86 63.74 1ckx h ILE 5 Cb 0.92 2.95 -0.09 0.00 -0.74 0.00 0.00 36.82 39.86 1ckx h ILE 5 CO 0.00 0.69 0.79 0.50 0.00 0.00 0.00 178.15 180.13 1ckx h LYS 6 N -0.38 0.20 0.18 2.37 1.63 -1.98 0.34 116.57 118.93 1ckx h LYS 6 Ca -0.22 -0.01 -0.35 0.00 -0.85 0.00 0.00 60.65 59.21 1ckx h LYS 6 Cb 1.67 -0.05 0.01 0.00 -0.60 0.00 0.00 32.23 33.26 1ckx h LYS 6 CO 0.09 0.13 -1.79 1.05 -3.45 0.00 0.00 179.45 175.49 1ckx h GLU 7 N 0.21 0.38 0.00 1.90 4.11 -1.84 -3.04 114.58 116.29 1ckx h GLU 7 Ca 0.66 -0.64 0.00 0.00 0.07 0.00 0.00 59.36 59.44 1ckx h GLU 7 Cb 2.04 0.24 0.00 0.00 0.50 0.00 0.00 28.75 31.53 1ckx h GLU 7 CO -0.25 1.30 0.25 -0.97 0.07 0.00 0.00 179.01 179.42 1ckx h ASN 8 N 0.10 0.00 0.14 3.06 -0.73 0.03 2.85 115.58 121.03 1ckx h ASN 8 Ca -0.36 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.81 1ckx h ASN 8 Cb 2.09 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.68 1ckx h ASN 8 CO 0.17 0.00 -1.41 -0.38 -0.37 0.00 0.00 177.43 175.43 1ckx n ILE 9 N -2.56 0.06 0.01 2.57 2.08 -0.10 -4.05 119.36 117.38 1ckx n ILE 9 Ca -0.02 -0.28 0.00 0.00 0.56 0.00 0.00 62.75 63.01 1ckx n ILE 9 Cb 0.29 0.36 0.00 0.00 -0.75 0.00 0.00 39.64 39.54 1ckx n ILE 9 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1ckx n ILE 10 N -1.96 0.26 -0.06 1.39 0.00 0.31 -4.28 119.36 115.02 1ckx n ILE 10 Ca 0.00 0.09 0.25 0.00 0.00 0.00 0.00 62.75 63.08 1ckx n ILE 10 Cb 0.46 -1.42 0.72 0.00 0.00 0.00 0.00 39.64 39.40 1ckx n ILE 10 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 1ckx h PHE 11 N 0.00 0.00 0.21 9.51 3.57 0.43 0.69 116.94 131.36 1ckx h PHE 11 Ca 0.00 0.00 -0.33 0.00 3.53 0.00 0.00 57.97 61.17 1ckx h PHE 11 Cb 0.69 0.00 0.02 0.00 2.79 0.00 0.00 35.95 39.46 1ckx h PHE 11 CO 0.00 0.00 -1.52 0.78 -2.23 0.00 0.00 178.31 175.34 1ckx h GLY 12 N 0.00 0.51 1.79 2.40 0.00 -1.64 -2.95 103.07 103.18 1ckx h GLY 12 Ca 0.32 -1.31 -0.14 0.00 0.00 0.00 0.00 47.33 46.20 1ckx h GLY 12 CO -0.00 1.15 -0.58 -2.08 0.00 0.00 0.00 176.54 175.02 1ckx h VAL 13 N 0.12 1.38 -0.55 4.60 2.07 -0.65 -2.71 116.25 120.51 1ckx h VAL 13 Ca -0.26 -1.94 -0.10 0.00 0.82 0.00 0.00 66.70 65.22 1ckx h VAL 13 Cb 2.12 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 33.85 1ckx h VAL 13 CO 0.24 0.57 -0.05 -1.28 0.02 0.00 0.00 177.57 177.07 1ckx h SER 14 N 0.17 0.97 0.47 0.57 0.87 0.12 -2.67 113.55 114.05 1ckx h SER 14 Ca -0.00 -0.29 -0.02 0.00 -1.23 0.00 0.00 61.79 60.25 1ckx h SER 14 Cb 1.07 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 1ckx h SER 14 CO 0.09 1.05 -0.22 0.22 -0.53 0.00 0.00 176.83 177.43 1ckx h TYR 15 N 0.89 -0.58 -1.30 2.24 3.20 -1.34 1.69 116.97 121.77 1ckx h TYR 15 Ca 0.15 -0.01 0.38 0.00 3.14 0.00 0.00 58.73 62.39 1ckx h TYR 15 Cb 0.58 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.99 1ckx h TYR 15 CO 0.04 -0.31 0.93 -0.44 -1.64 0.00 0.00 178.16 176.74 1ckx h ASP 16 N -0.74 0.05 0.60 -2.11 3.32 -1.40 1.68 116.42 117.82 1ckx h ASP 16 Ca -0.06 0.01 -0.23 0.00 0.02 0.00 0.00 57.03 56.77 1ckx h ASP 16 Cb 0.53 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 1ckx h ASP 16 CO 0.10 -0.00 -1.56 1.21 -1.72 0.00 0.00 179.24 177.27 1ckx n GLU 17 N -4.20 0.63 -0.01 3.56 2.13 -0.49 -2.53 120.64 119.73 1ckx n GLU 17 Ca 0.29 0.26 -0.13 0.00 0.66 0.00 0.00 57.16 58.24 1ckx n GLU 17 Cb 1.34 -1.80 -0.00 0.00 0.27 0.00 0.00 31.44 31.25 1ckx n GLU 17 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1ckx h TYR 18 N 0.00 0.83 0.04 4.31 5.03 1.39 -3.08 116.97 125.50 1ckx h TYR 18 Ca -0.22 -0.33 -0.17 0.00 2.58 0.00 0.00 58.73 60.58 1ckx h TYR 18 Cb 1.80 -0.14 0.02 0.00 1.55 0.00 0.00 36.73 39.95 1ckx h TYR 18 CO 0.00 1.12 -0.69 0.00 -1.32 0.00 0.00 178.16 177.27 1ckx h ARG 19 N 0.46 0.39 -0.66 1.82 3.08 0.18 -3.09 114.38 116.57 1ckx h ARG 19 Ca -0.02 -0.48 0.19 0.00 0.07 0.00 0.00 59.98 59.75 1ckx h ARG 19 Cb 1.25 0.15 -0.03 0.00 0.08 0.00 0.00 29.97 31.42 1ckx h ARG 19 CO 0.13 1.15 0.67 -0.92 -1.07 0.00 0.00 179.97 179.93 1ckx h TYR 20 N -0.16 0.00 0.02 3.04 5.03 -1.52 0.28 116.97 123.66 1ckx h TYR 20 Ca -0.10 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.21 1ckx h TYR 20 Cb 1.43 0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.71 1ckx h TYR 20 CO 0.16 0.00 -0.01 -0.09 -1.32 0.00 0.00 178.16 176.90 1ckx h ARG 21 N 0.00 -0.03 0.00 1.82 2.43 -1.46 -2.70 114.38 114.45 1ckx h ARG 21 Ca 0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 1ckx h ARG 21 Cb 1.65 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.21 1ckx h ARG 21 CO -0.00 0.72 0.00 0.45 -1.51 0.00 0.00 179.97 179.63 1ckx n SER 22 N -4.70 0.41 0.06 -3.80 2.88 0.13 0.19 113.62 108.79 1ckx n SER 22 Ca -0.08 0.62 0.03 0.00 -1.33 0.00 0.00 58.87 58.11 1ckx n SER 22 Cb 0.37 -0.70 -0.05 0.00 -0.75 0.00 0.00 64.21 63.08 1ckx n SER 22 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1ckx h VAL 23 N 0.00 0.40 0.00 2.46 2.07 -0.55 -3.37 116.25 117.26 1ckx h VAL 23 Ca 0.00 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.76 1ckx h VAL 23 Cb 0.24 1.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1ckx h VAL 23 CO 0.00 0.23 0.00 -0.38 0.02 0.00 0.00 177.57 177.44 1ckx n ILE 24 N -2.87 0.00 -3.32 4.57 -0.00 -0.71 -4.82 119.36 112.20 1ckx n ILE 24 Ca -0.06 -0.47 -0.25 0.00 -0.00 0.00 0.00 62.75 61.97 1ckx n ILE 24 Cb 0.76 1.06 -0.08 0.00 -0.00 0.00 0.00 39.64 41.38 1ckx n ILE 24 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 1ckx n LYS 25 N -0.06 1.15 0.00 0.38 0.00 0.51 -5.05 118.16 115.08 1ckx n LYS 25 Ca 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 58.31 54.67 1ckx n LYS 25 Cb 0.02 -1.59 0.00 0.00 0.00 0.00 0.00 35.03 33.45 1ckx n LYS 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40