#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ckx n PRO 2 N 0.00 2.23 -0.12 2.12 -0.04 -1.26 -4.34 135.00 133.59 1ckx n PRO 2 Ca 0.00 -2.27 0.03 0.00 -0.04 0.00 0.00 63.50 61.22 1ckx n PRO 2 Cb 0.00 -3.13 0.04 0.00 -0.04 0.00 0.00 33.50 30.37 1ckx n PRO 2 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ckx n GLY 3 N 4.34 1.92 0.15 0.55 0.00 -1.26 -4.78 105.19 106.12 1ckx n GLY 3 Ca 0.51 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 1ckx n GLY 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ckx h THR 4 N 1.91 1.16 -1.01 2.61 1.03 -1.99 -1.79 112.91 114.83 1ckx h THR 4 Ca 0.00 -0.47 0.26 0.00 -0.01 0.00 0.00 66.41 66.19 1ckx h THR 4 Cb 0.92 0.93 -0.07 0.00 -1.07 0.00 0.00 68.15 68.86 1ckx h THR 4 CO 0.00 0.17 0.68 0.40 -0.01 0.00 0.00 175.52 176.75 1ckx h ILE 5 N 0.33 0.55 0.00 0.00 2.04 -1.97 0.98 117.51 119.44 1ckx h ILE 5 Ca 0.10 -0.10 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 1ckx h ILE 5 Cb 0.14 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 1ckx h ILE 5 CO -0.01 0.05 -0.72 0.11 0.00 0.00 0.00 178.15 177.58 1ckx h LYS 6 N 0.29 0.00 0.05 2.37 1.57 -1.76 -3.26 116.57 115.83 1ckx h LYS 6 Ca 0.54 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 59.11 1ckx h LYS 6 Cb 1.56 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.86 1ckx h LYS 6 CO -0.18 0.37 -1.11 0.93 -0.57 0.00 0.00 179.45 178.89 1ckx h GLU 7 N 0.00 0.11 0.00 3.15 4.39 0.95 -3.10 114.58 120.08 1ckx h GLU 7 Ca -0.04 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.48 1ckx h GLU 7 Cb 1.38 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 30.09 1ckx h GLU 7 CO 0.05 1.09 0.07 -1.71 -1.16 0.00 0.00 179.01 177.35 1ckx n ASN 8 N -4.23 0.43 -0.22 1.42 5.15 0.28 0.25 115.26 118.34 1ckx n ASN 8 Ca -0.25 0.67 0.09 0.00 -0.60 0.00 0.00 54.58 54.49 1ckx n ASN 8 Cb 0.74 -0.71 -0.05 0.00 -0.53 0.00 0.00 39.78 39.24 1ckx n ASN 8 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1ckx n ILE 9 N -2.09 0.00 0.00 -1.44 5.41 -1.23 -4.32 119.36 115.68 1ckx n ILE 9 Ca -0.01 -0.20 0.00 0.00 1.00 0.00 0.00 62.75 63.54 1ckx n ILE 9 Cb 0.10 1.12 0.00 0.00 -0.71 0.00 0.00 39.64 40.14 1ckx n ILE 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ckx n ILE 10 N -0.70 0.00 -0.37 1.39 0.00 0.13 -4.31 119.36 115.50 1ckx n ILE 10 Ca 0.06 0.00 0.29 0.00 0.00 0.00 0.00 62.75 63.10 1ckx n ILE 10 Cb 0.34 -1.05 0.57 0.00 0.00 0.00 0.00 39.64 39.50 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 0.61 -0.00 9.51 3.04 0.30 1.35 116.94 131.74 1ckx h PHE 11 Ca 0.00 0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.95 1ckx h PHE 11 Cb 0.96 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 39.31 1ckx h PHE 11 CO 0.00 -0.07 -0.09 0.78 -2.02 0.00 0.00 178.31 176.91 1ckx h GLY 12 N 0.25 0.08 1.02 2.40 0.00 -1.75 -2.65 103.07 102.42 1ckx h GLY 12 Ca 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 47.33 47.89 1ckx h GLY 12 CO -0.36 0.11 0.57 -2.08 0.00 0.00 0.00 176.54 174.78 1ckx h VAL 13 N -0.65 1.26 0.08 4.60 2.07 -0.63 0.26 116.25 123.23 1ckx h VAL 13 Ca -0.01 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 66.96 1ckx h VAL 13 Cb 0.85 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 1ckx h VAL 13 CO 0.02 0.27 -0.12 -1.28 0.02 0.00 0.00 177.57 176.48 1ckx h SER 14 N 1.30 -0.34 0.45 0.57 0.87 0.15 0.43 113.55 116.98 1ckx h SER 14 Ca 0.34 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.92 1ckx h SER 14 Cb -0.06 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1ckx h SER 14 CO -0.06 -0.18 -0.21 0.22 -0.53 0.00 0.00 176.83 176.06 1ckx h TYR 15 N -0.25 -0.56 -0.29 2.24 3.20 -1.08 2.13 116.97 122.36 1ckx h TYR 15 Ca 0.02 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 61.96 1ckx h TYR 15 Cb 0.26 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 1ckx h TYR 15 CO -0.15 -0.27 0.50 -0.44 -1.64 0.00 0.00 178.16 176.16 1ckx h ASP 16 N -0.76 0.00 0.18 -2.11 5.19 -0.31 0.84 116.42 119.45 1ckx h ASP 16 Ca -0.06 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.27 1ckx h ASP 16 Cb 0.54 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.03 1ckx h ASP 16 CO 0.10 0.00 -1.90 1.21 -3.12 0.00 0.00 179.24 175.53 1ckx n GLU 17 N -3.32 0.66 0.09 3.56 2.13 0.15 -3.17 120.64 120.73 1ckx n GLU 17 Ca 0.05 -0.09 -0.05 0.00 0.66 0.00 0.00 57.16 57.72 1ckx n GLU 17 Cb 0.63 -1.58 0.02 0.00 0.27 0.00 0.00 31.44 30.77 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 0.08 -0.51 4.31 3.20 1.04 -1.15 116.97 123.93 1ckx h TYR 18 Ca -0.11 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.72 1ckx h TYR 18 Cb 1.27 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.53 1ckx h TYR 18 CO 0.00 0.85 0.00 0.54 -1.64 0.00 0.00 178.16 177.91 1ckx n ARG 19 N -3.60 2.88 -0.00 1.82 1.74 -0.17 -4.07 116.66 115.27 1ckx n ARG 19 Ca -0.01 -2.36 -0.00 0.00 -0.77 0.00 0.00 57.85 54.70 1ckx n ARG 19 Cb 0.79 -1.44 -0.00 0.00 -1.02 0.00 0.00 32.46 30.78 1ckx n ARG 19 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1ckx n TYR 20 N 0.93 0.00 0.01 -1.55 9.36 -1.19 -4.63 117.16 120.09 1ckx n TYR 20 Ca 0.18 0.00 -0.18 0.00 3.32 0.00 0.00 57.90 61.22 1ckx n TYR 20 Cb 0.55 -0.02 -0.10 0.00 -0.63 0.00 0.00 39.34 39.14 1ckx n TYR 20 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1ckx h ARG 21 N -0.00 0.57 -0.86 2.98 2.43 -1.44 0.13 114.38 118.20 1ckx h ARG 21 Ca -0.01 -0.56 0.20 0.00 -0.81 0.00 0.00 59.98 58.79 1ckx h ARG 21 Cb 1.02 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 30.66 1ckx h ARG 21 CO -0.00 1.18 0.57 1.03 -1.51 0.00 0.00 179.97 181.25 1ckx h SER 22 N 0.16 0.34 0.08 -3.80 0.87 -1.72 2.09 113.55 111.57 1ckx h SER 22 Ca -0.08 0.03 -0.37 0.00 -1.23 0.00 0.00 61.79 60.14 1ckx h SER 22 Cb 1.42 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.31 1ckx h SER 22 CO 0.15 0.14 -2.08 0.55 -0.53 0.00 0.00 176.83 175.06 1ckx n VAL 23 N -4.47 1.69 0.88 2.23 3.14 -1.19 -4.10 118.33 116.51 1ckx n VAL 23 Ca 0.18 -0.58 0.05 0.00 -2.96 0.00 0.00 64.34 61.03 1ckx n VAL 23 Cb 0.69 -1.69 0.15 0.00 -1.06 0.00 0.00 33.84 31.93 1ckx n VAL 23 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ckx n ILE 24 N -3.52 0.52 -0.22 1.55 0.13 0.46 -4.90 119.36 113.38 1ckx n ILE 24 Ca -0.36 -0.45 -0.00 0.00 -1.10 0.00 0.00 62.75 60.83 1ckx n ILE 24 Cb 1.00 0.14 0.00 0.00 -0.84 0.00 0.00 39.64 39.94 1ckx n ILE 24 CO 0.00 0.00 0.00 1.17 2.80 0.00 0.00 176.55 180.52 1ckx n LYS 25 N 0.42 -1.62 -0.77 9.51 4.81 0.70 -4.93 118.16 126.29 1ckx n LYS 25 Ca 0.11 -0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.53 1ckx n LYS 25 Cb 0.32 -0.03 0.00 0.00 0.02 0.00 0.00 35.03 35.34 1ckx n LYS 25 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57