#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q68 s HIS 8 N 0.00 3.48 1.07 7.33 0.00 -1.26 -5.09 115.29 120.83 1q68 s HIS 8 Ca 0.00 0.84 -0.15 0.00 -3.00 0.00 0.00 55.06 52.75 1q68 s HIS 8 Cb 0.00 -2.28 0.22 0.00 -4.00 0.00 0.00 32.58 26.52 1q68 s HIS 8 CO 0.00 -0.01 1.12 -1.25 -1.00 0.00 0.00 174.74 173.60 1q68 s PRO 9 N -3.85 -0.14 -0.28 -0.38 0.04 -1.26 -4.95 135.00 124.18 1q68 s PRO 9 Ca 0.48 0.18 0.08 0.00 0.04 0.00 0.00 61.00 61.78 1q68 s PRO 9 Cb -0.10 -1.70 0.65 0.00 0.04 0.00 0.00 34.50 33.39 1q68 s PRO 9 CO 0.32 -3.04 1.67 0.39 0.04 0.00 0.00 177.00 176.39 1q68 n GLU 10 N -4.33 3.40 0.00 4.56 -0.58 -1.26 -4.09 120.64 118.34 1q68 n GLU 10 Ca 0.09 -2.67 0.10 0.00 -0.42 0.00 0.00 57.16 54.26 1q68 n GLU 10 Cb 0.59 -2.10 0.07 0.00 -0.57 0.00 0.00 31.44 29.42 1q68 n GLU 10 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1q68 n ASP 11 N -0.08 2.59 0.47 1.62 2.03 -1.26 -4.57 116.55 117.35 1q68 n ASP 11 Ca 0.36 -1.79 -0.20 0.00 0.52 0.00 0.00 54.79 53.67 1q68 n ASP 11 Cb 1.26 0.09 -0.10 0.00 -0.72 0.00 0.00 41.12 41.65 1q68 n ASP 11 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1q68 h ASP 12 N 3.76 -1.23 -1.00 1.67 3.32 -1.98 -1.02 116.42 119.94 1q68 h ASP 12 Ca 0.00 0.06 0.20 0.00 0.02 0.00 0.00 57.03 57.31 1q68 h ASP 12 Cb 0.84 0.34 -0.11 0.00 0.22 0.00 0.00 39.33 40.63 1q68 h ASP 12 CO 0.00 -0.79 0.61 4.11 -1.72 0.00 0.00 179.24 181.45 1q68 h TRP 13 N -1.28 1.03 -0.14 4.55 5.08 -1.92 0.22 115.95 123.51 1q68 h TRP 13 Ca -0.12 0.03 -0.09 0.00 1.08 0.00 0.00 58.89 59.80 1q68 h TRP 13 Cb 1.01 -0.31 -0.01 0.00 -3.00 0.00 0.00 29.16 26.84 1q68 h TRP 13 CO -0.07 0.20 -0.30 -0.07 -1.28 0.00 0.00 178.44 176.92 1q68 h LEU 14 N 0.71 0.26 -0.56 0.11 3.38 -1.76 -2.05 115.31 115.40 1q68 h LEU 14 Ca 0.59 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.46 1q68 h LEU 14 Cb 0.98 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1q68 h LEU 14 CO -0.39 0.56 0.30 -0.08 0.09 0.00 0.00 178.44 178.93 1q68 h GLU 15 N 0.23 0.79 -0.89 1.13 4.81 0.80 -2.55 114.58 118.90 1q68 h GLU 15 Ca 0.03 -0.09 -0.45 0.00 -0.13 0.00 0.00 59.36 58.72 1q68 h GLU 15 Cb 0.66 -0.15 -0.27 0.00 0.63 0.00 0.00 28.75 29.61 1q68 h GLU 15 CO 0.05 0.61 0.53 0.09 -0.73 0.00 0.00 179.01 179.55 1q68 n ASN 16 N -4.60 3.64 -4.77 1.04 4.13 -1.05 -5.00 115.26 108.66 1q68 n ASN 16 Ca 0.03 -3.61 -0.41 0.00 1.68 0.00 0.00 54.58 52.28 1q68 n ASN 16 Cb 0.09 -0.80 -0.03 0.00 -1.54 0.00 0.00 39.78 37.50 1q68 n ASN 16 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 1q68 s ILE 17 N -3.27 2.93 0.02 2.41 2.07 -0.79 -5.03 121.20 119.54 1q68 s ILE 17 Ca 0.55 0.93 0.03 0.00 -1.41 0.00 0.00 60.65 60.75 1q68 s ILE 17 Cb 0.47 -3.59 -0.04 0.00 0.13 0.00 0.00 42.46 39.43 1q68 s ILE 17 CO 0.10 0.22 -0.03 -0.62 -1.91 0.00 0.00 174.94 172.70 1q68 s ASP 18 N -0.57 4.88 -0.19 4.50 -1.08 -1.26 -5.01 116.67 117.93 1q68 s ASP 18 Ca 0.48 -0.10 -0.05 0.00 -0.52 0.00 0.00 52.55 52.36 1q68 s ASP 18 Cb -0.38 -1.19 -0.03 0.00 -1.46 0.00 0.00 42.92 39.87 1q68 s ASP 18 CO 0.50 0.26 -0.00 -0.69 0.52 0.00 0.00 175.17 175.75 1q68 s VAL 19 N -1.09 3.98 0.93 1.11 1.01 -1.26 0.12 120.40 125.21 1q68 s VAL 19 Ca 0.20 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 1q68 s VAL 19 Cb -0.11 -2.79 0.16 0.00 0.00 0.00 0.00 36.38 33.63 1q68 s VAL 19 CO 0.11 0.44 1.13 0.00 0.00 0.00 0.00 175.10 176.77 1q68 n GLU 21 N -4.26 0.92 0.10 0.00 4.71 -1.26 -2.70 120.64 118.15 1q68 n GLU 21 Ca 0.10 -0.03 -0.13 0.00 -0.01 0.00 0.00 57.16 57.09 1q68 n GLU 21 Cb 0.52 -1.48 -0.08 0.00 -1.01 0.00 0.00 31.44 29.39 1q68 n GLU 21 CO 0.00 0.00 0.00 -0.97 0.09 0.00 0.00 177.13 176.25 1q68 h ASN 22 N 0.00 -0.21 -0.01 1.62 -0.73 -1.96 -3.29 115.58 111.01 1q68 h ASN 22 Ca -0.45 -0.21 0.00 0.00 1.87 0.00 0.00 56.30 57.51 1q68 h ASN 22 Cb 2.01 0.05 0.00 0.00 0.27 0.00 0.00 38.32 40.66 1q68 h ASN 22 CO 0.02 0.10 -0.59 0.00 -0.37 0.00 0.00 177.43 176.59 1q68 n HIS 24 N -0.53 0.00 -3.71 0.00 8.25 -1.10 -4.97 115.22 113.16 1q68 n HIS 24 Ca 0.07 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.31 1q68 n HIS 24 Cb 0.38 -2.34 -0.02 0.00 1.12 0.00 0.00 29.99 29.14 1q68 n HIS 24 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1q68 s TYR 25 N -1.91 3.47 -0.39 4.41 1.51 -1.25 -4.73 117.35 118.47 1q68 s TYR 25 Ca 0.00 0.14 -0.28 0.00 -1.01 0.00 0.00 57.07 55.92 1q68 s TYR 25 Cb 0.00 -1.71 -0.03 0.00 -0.11 0.00 0.00 41.96 40.11 1q68 s TYR 25 CO 0.00 0.30 1.92 -2.14 -1.11 0.00 0.00 175.55 174.52 1q68 s PRO 26 N -4.13 3.06 0.61 -1.71 0.02 -1.26 0.11 135.00 131.70 1q68 s PRO 26 Ca 0.37 1.34 -0.15 0.00 0.02 0.00 0.00 61.00 62.58 1q68 s PRO 26 Cb -0.09 -4.29 -0.03 0.00 0.02 0.00 0.00 34.50 30.11 1q68 s PRO 26 CO 0.32 -2.19 1.06 -1.50 -0.33 0.00 0.00 177.00 174.36 1q68 s ILE 27 N 7.99 3.82 -0.04 2.83 2.07 0.32 -4.83 121.20 133.36 1q68 s ILE 27 Ca 0.82 0.82 0.05 0.00 -1.41 0.00 0.00 60.65 60.92 1q68 s ILE 27 Cb -0.21 -3.37 -0.01 0.00 0.13 0.00 0.00 42.46 39.00 1q68 s ILE 27 CO 0.31 -0.55 -0.20 -0.69 -1.91 0.00 0.00 174.94 171.89 1q68 s VAL 28 N -2.55 1.65 0.10 4.00 1.01 -1.26 -4.12 120.40 119.24 1q68 s VAL 28 Ca 0.63 -0.85 -0.31 0.00 0.00 0.00 0.00 61.98 61.45 1q68 s VAL 28 Cb -0.16 -1.40 -0.08 0.00 0.00 0.00 0.00 36.38 34.74 1q68 s VAL 28 CO 0.40 0.47 1.50 -2.16 0.00 0.00 0.00 175.10 175.30 1q68 s PRO 29 N -0.11 4.26 -0.48 2.72 0.04 -1.26 -4.87 135.00 135.29 1q68 s PRO 29 Ca -0.02 2.19 -0.34 0.00 0.04 0.00 0.00 61.00 62.87 1q68 s PRO 29 Cb -0.12 -3.36 -0.13 0.00 0.04 0.00 0.00 34.50 30.94 1q68 s PRO 29 CO 0.02 -0.57 2.30 -0.11 0.04 0.00 0.00 177.00 178.69 1q68 n LEU 30 N 4.56 1.78 -2.76 -3.56 7.94 -1.26 -3.24 117.00 120.46 1q68 n LEU 30 Ca 0.13 0.24 -0.02 0.00 -1.11 0.00 0.00 56.01 55.26 1q68 n LEU 30 Cb 0.41 -1.24 0.00 0.00 0.53 0.00 0.00 43.42 43.13 1q68 n LEU 30 CO 0.60 -0.87 -0.39 0.47 -1.11 0.00 0.00 177.39 176.09 1q68 n ASP 31 N 10.79 -8.02 -4.74 1.96 8.00 -1.26 -5.01 116.55 118.26 1q68 n ASP 31 Ca 0.45 1.25 -0.29 0.00 0.71 0.00 0.00 54.79 56.91 1q68 n ASP 31 Cb 0.23 -5.31 0.11 0.00 -0.02 0.00 0.00 41.12 36.13 1q68 n ASP 31 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1q68 s GLY 32 N -1.83 1.64 0.87 0.44 0.00 -1.20 -5.04 107.32 102.19 1q68 s GLY 32 Ca 0.05 -0.79 -0.11 0.00 0.00 0.00 0.00 44.72 43.87 1q68 s GLY 32 CO 0.78 -0.25 1.10 -1.59 0.00 0.00 0.00 173.10 173.14 1q68 s LYS 33 N -5.62 1.48 -0.23 2.90 0.00 -1.26 -5.00 119.74 112.01 1q68 s LYS 33 Ca 0.64 1.17 0.05 0.00 0.00 0.00 0.00 55.97 57.83 1q68 s LYS 33 Cb -0.09 -1.81 0.18 0.00 0.00 0.00 0.00 37.83 36.10 1q68 s LYS 33 CO 0.49 -2.19 1.05 0.41 0.00 0.00 0.00 175.35 175.12 1q68 n GLY 34 N -0.68 0.19 3.97 0.59 0.00 -1.26 -5.15 105.19 102.85 1q68 n GLY 34 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1q68 n GLY 34 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73