#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 1.99 -0.66 0.03 -0.04 -1.26 -4.43 135.00 130.62 1ckx n PRO 2 Ca 0.00 -2.24 0.06 0.00 -0.04 0.00 0.00 63.50 61.27 1ckx n PRO 2 Cb 0.00 -3.18 0.11 0.00 -0.04 0.00 0.00 33.50 30.40 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 4.69 3.37 0.10 0.55 0.00 -1.26 -4.82 105.19 107.82 1ckx n GLY 3 Ca 0.49 -0.95 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 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 3.11 0.85 -0.15 2.61 1.03 -2.02 -2.36 112.91 115.98 1ckx h THR 4 Ca -0.05 -0.02 -0.03 0.00 -0.01 0.00 0.00 66.41 66.29 1ckx h THR 4 Cb 1.27 0.79 -0.00 0.00 -1.07 0.00 0.00 68.15 69.14 1ckx h THR 4 CO 0.02 0.01 -0.03 0.40 -0.01 0.00 0.00 175.52 175.91 1ckx h ILE 5 N 0.06 1.28 -1.24 0.00 1.08 -1.98 -2.75 117.51 113.95 1ckx h ILE 5 Ca 0.09 -0.97 0.37 0.00 -0.39 0.00 0.00 64.86 63.96 1ckx h ILE 5 Cb 0.12 1.62 -0.10 0.00 -3.07 0.00 0.00 36.82 35.39 1ckx h ILE 5 CO -0.16 0.29 0.82 0.50 -0.69 0.00 0.00 178.15 178.90 1ckx h LYS 6 N -0.00 0.17 -0.14 2.37 1.63 -1.82 0.74 116.57 119.51 1ckx h LYS 6 Ca 0.04 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.80 1ckx h LYS 6 Cb 0.46 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.04 1ckx h LYS 6 CO 0.01 0.11 -0.02 0.93 -3.45 0.00 0.00 179.45 177.04 1ckx h GLU 7 N 0.18 0.27 0.00 1.90 5.08 -1.13 -1.87 114.58 119.01 1ckx h GLU 7 Ca 0.71 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.98 1ckx h GLU 7 Cb 2.23 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.46 1ckx h GLU 7 CO -0.30 0.54 0.20 -0.97 -1.00 0.00 0.00 179.01 177.48 1ckx h ASN 8 N -0.02 0.00 0.75 1.42 -0.00 0.53 2.64 115.58 120.90 1ckx h ASN 8 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.34 1ckx h ASN 8 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.75 1ckx h ASN 8 CO 0.01 0.00 -0.68 -0.38 -0.00 0.00 0.00 177.43 176.38 1ckx n ILE 9 N -2.55 0.28 -0.03 2.57 2.08 -0.72 -3.67 119.36 117.32 1ckx n ILE 9 Ca -0.02 -0.24 -0.05 0.00 0.56 0.00 0.00 62.75 63.01 1ckx n ILE 9 Cb 0.24 -0.03 -0.03 0.00 -0.75 0.00 0.00 39.64 39.06 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 -2.02 0.39 -0.19 1.39 0.00 0.29 -4.36 119.36 114.86 1ckx n ILE 10 Ca 0.03 -0.16 0.20 0.00 0.00 0.00 0.00 62.75 62.82 1ckx n ILE 10 Cb 0.43 -0.76 0.56 0.00 0.00 0.00 0.00 39.64 39.87 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 0.39 -0.10 9.51 3.57 0.39 0.21 116.94 130.91 1ckx h PHE 11 Ca -0.15 0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.15 1ckx h PHE 11 Cb 1.25 -0.12 0.01 0.00 2.79 0.00 0.00 35.95 39.88 1ckx h PHE 11 CO 0.01 0.12 -0.76 0.78 -2.23 0.00 0.00 178.31 176.23 1ckx h GLY 12 N 0.31 0.77 1.91 2.40 0.00 -1.73 0.14 103.07 106.86 1ckx h GLY 12 Ca 0.42 -1.15 0.00 0.00 0.00 0.00 0.00 47.33 46.60 1ckx h GLY 12 CO -0.12 1.02 0.04 -2.08 0.00 0.00 0.00 176.54 175.40 1ckx h VAL 13 N 0.38 0.00 0.00 4.60 2.07 -0.83 0.32 116.25 122.79 1ckx h VAL 13 Ca -0.07 0.00 -0.34 0.00 0.82 0.00 0.00 66.70 67.12 1ckx h VAL 13 Cb 1.40 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.94 1ckx h VAL 13 CO 0.15 0.00 -2.02 -0.24 0.02 0.00 0.00 177.57 175.48 1ckx n SER 14 N -2.83 1.94 0.15 0.57 2.88 -0.68 -4.04 113.62 111.62 1ckx n SER 14 Ca -0.02 0.36 -0.14 0.00 -1.33 0.00 0.00 58.87 57.74 1ckx n SER 14 Cb 0.10 -0.83 -0.08 0.00 -0.75 0.00 0.00 64.21 62.66 1ckx n SER 14 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1ckx h TYR 15 N -1.00 -0.29 -0.54 0.66 3.20 -0.45 0.11 116.97 118.66 1ckx h TYR 15 Ca -0.51 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 61.51 1ckx h TYR 15 Cb 1.42 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.77 1ckx h TYR 15 CO -0.13 -0.17 0.65 -0.44 -1.64 0.00 0.00 178.16 176.43 1ckx h ASP 16 N -0.34 0.00 1.05 -2.11 5.19 -0.59 2.24 116.42 121.87 1ckx h ASP 16 Ca -0.03 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.30 1ckx h ASP 16 Cb 0.26 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.75 1ckx h ASP 16 CO 0.05 0.00 -0.99 -0.08 -3.12 0.00 0.00 179.24 175.10 1ckx h GLU 17 N 0.00 0.00 0.00 3.56 4.57 -1.06 -2.63 114.58 119.01 1ckx h GLU 17 Ca 0.26 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 58.22 1ckx h GLU 17 Cb 1.55 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 30.10 1ckx h GLU 17 CO -0.00 0.17 -1.47 1.88 -1.18 0.00 0.00 179.01 178.41 1ckx h TYR 18 N 0.00 0.00 -0.01 0.92 0.05 0.57 -3.29 116.97 115.21 1ckx h TYR 18 Ca -0.06 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1ckx h TYR 18 Cb 1.27 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.01 1ckx h TYR 18 CO 0.00 0.78 -0.34 0.54 -1.05 0.00 0.00 178.16 178.09 1ckx n ARG 19 N -3.00 1.16 0.01 4.88 1.74 0.19 -3.90 116.66 117.74 1ckx n ARG 19 Ca -0.12 -0.86 -0.22 0.00 -0.77 0.00 0.00 57.85 55.89 1ckx n ARG 19 Cb 0.93 -1.48 -0.14 0.00 -1.02 0.00 0.00 32.46 30.75 1ckx n ARG 19 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 1ckx h TYR 20 N 2.11 0.48 0.00 -1.55 5.03 -1.57 -3.27 116.97 118.20 1ckx h TYR 20 Ca 0.00 -0.35 -0.08 0.00 2.58 0.00 0.00 58.73 60.88 1ckx h TYR 20 Cb 0.66 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.91 1ckx h TYR 20 CO 0.00 1.77 -0.38 0.00 -1.32 0.00 0.00 178.16 178.23 1ckx h ARG 21 N 0.03 0.00 0.44 1.82 3.08 -1.73 -2.53 114.38 115.48 1ckx h ARG 21 Ca -0.42 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.61 1ckx h ARG 21 Cb 2.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.06 1ckx h ARG 21 CO 0.08 0.38 -0.21 1.03 -1.07 0.00 0.00 179.97 180.18 1ckx h SER 22 N 0.00 -0.50 -0.60 7.04 0.87 -1.70 0.22 113.55 118.88 1ckx h SER 22 Ca -0.00 -0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.56 1ckx h SER 22 Cb 0.88 0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.93 1ckx h SER 22 CO 0.05 -0.07 0.40 0.58 -0.53 0.00 0.00 176.83 177.26 1ckx h VAL 23 N -1.11 1.05 -0.59 2.23 2.07 -1.61 -0.03 116.25 118.27 1ckx h VAL 23 Ca -0.06 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1ckx h VAL 23 Cb 0.51 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1ckx h VAL 23 CO 0.10 0.12 0.00 -0.38 0.02 0.00 0.00 177.57 177.43 1ckx n ILE 24 N -4.47 2.02 -1.83 4.57 -0.00 -0.95 -4.91 119.36 113.78 1ckx n ILE 24 Ca 0.08 -1.17 -0.42 0.00 -0.00 0.00 0.00 62.75 61.24 1ckx n ILE 24 Cb 0.17 -0.05 -0.03 0.00 -0.00 0.00 0.00 39.64 39.73 1ckx n ILE 24 CO 0.00 0.00 0.00 -0.75 -0.00 0.00 0.00 176.55 175.80 1ckx s LYS 25 N -2.12 3.03 0.00 0.38 2.36 0.77 -4.96 119.74 119.20 1ckx s LYS 25 Ca 0.49 1.50 0.00 0.00 -2.55 0.00 0.00 55.97 55.41 1ckx s LYS 25 Cb 0.34 -4.32 0.00 0.00 -1.05 0.00 0.00 37.83 32.80 1ckx s LYS 25 CO 0.20 -2.22 0.00 0.00 1.55 0.00 0.00 175.35 174.89