#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kb9 n GLN 3 N -2.11 -0.47 -3.07 0.00 7.27 -1.26 -5.01 117.38 112.74 2kb9 n GLN 3 Ca 0.03 -0.59 -0.41 0.00 0.07 0.00 0.00 57.00 56.10 2kb9 n GLN 3 Cb 0.54 -0.41 -0.06 0.00 2.41 0.00 0.00 30.24 32.73 2kb9 n GLN 3 CO 0.00 0.00 0.00 -0.47 0.07 0.00 0.00 177.06 176.66 2kb9 s TYR 4 N -1.83 3.31 0.00 3.69 5.04 -1.26 -3.97 117.35 122.33 2kb9 s TYR 4 Ca 0.22 0.91 0.00 0.00 -2.44 0.00 0.00 57.07 55.76 2kb9 s TYR 4 Cb -0.01 -2.87 0.00 0.00 0.35 0.00 0.00 41.96 39.43 2kb9 s TYR 4 CO 0.15 -0.30 0.00 0.41 -1.34 0.00 0.00 175.55 174.47 2kb9 n GLY 5 N 3.99 1.59 2.55 8.97 0.00 -1.26 -5.05 105.19 115.98 2kb9 n GLY 5 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 2kb9 n GLY 5 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2kb9 n TRP 6 N -0.78 -2.12 -3.22 1.61 7.02 -1.25 -4.39 117.44 114.30 2kb9 n TRP 6 Ca 0.00 -2.52 -0.21 0.00 -1.02 0.00 0.00 57.50 53.75 2kb9 n TRP 6 Cb 0.00 0.93 0.05 0.00 -2.42 0.00 0.00 31.31 29.87 2kb9 n TRP 6 CO 0.00 0.00 0.00 1.14 -2.02 0.00 0.00 177.69 176.81 2kb9 s GLN 7 N -0.25 2.26 0.00 -0.99 -2.07 -1.22 -4.39 119.66 113.00 2kb9 s GLN 7 Ca 0.31 -1.75 0.00 0.00 -1.82 0.00 0.00 55.36 52.10 2kb9 s GLN 7 Cb 0.25 -2.52 0.00 0.00 -1.09 0.00 0.00 33.01 29.65 2kb9 s GLN 7 CO -0.14 -0.85 0.00 0.41 -1.32 0.00 0.00 175.29 173.39 2kb9 n GLY 8 N -2.17 0.58 3.54 2.60 0.00 -1.26 -3.94 105.19 104.53 2kb9 n GLY 8 Ca 0.12 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 2kb9 n GLY 8 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kb9 s LEU 9 N 0.00 4.47 -1.54 0.99 2.01 -1.26 -4.23 118.68 119.12 2kb9 s LEU 9 Ca 0.00 -0.21 0.00 0.00 0.01 0.00 0.00 54.13 53.93 2kb9 s LEU 9 Cb 0.00 -2.48 0.00 0.00 0.01 0.00 0.00 46.19 43.72 2kb9 s LEU 9 CO 0.00 -0.47 0.00 -1.22 1.01 0.00 0.00 176.35 175.67 2kb9 n TYR 10 N 5.63 -0.84 -3.30 0.29 4.02 -1.26 -2.91 117.16 118.79 2kb9 n TYR 10 Ca -0.06 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.70 2kb9 n TYR 10 Cb 0.49 -3.20 0.01 0.00 -0.02 0.00 0.00 39.34 36.61 2kb9 n TYR 10 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2kb9 n ASP 12 N -1.68 2.74 -3.63 0.00 2.03 -1.15 -4.93 116.55 109.94 2kb9 n ASP 12 Ca -0.09 -2.73 -0.11 0.00 0.52 0.00 0.00 54.79 52.37 2kb9 n ASP 12 Cb 0.57 -0.45 -0.07 0.00 -0.72 0.00 0.00 41.12 40.46 2kb9 n ASP 12 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2kb9 s LYS 13 N -3.63 0.64 -0.28 -0.67 1.02 -1.25 -4.97 119.74 110.60 2kb9 s LYS 13 Ca 0.35 0.68 0.08 0.00 0.02 0.00 0.00 55.97 57.10 2kb9 s LYS 13 Cb 0.37 0.31 0.63 0.00 -0.52 0.00 0.00 37.83 38.62 2kb9 s LYS 13 CO -0.02 -0.09 1.65 0.00 -0.92 0.00 0.00 175.35 175.97 2kb9 n ILE 15 N -0.14 -7.88 0.25 0.00 5.41 -1.26 -3.84 119.36 111.89 2kb9 n ILE 15 Ca 0.36 0.37 0.13 0.00 1.00 0.00 0.00 62.75 64.61 2kb9 n ILE 15 Cb 1.26 -5.60 0.59 0.00 -0.71 0.00 0.00 39.64 35.18 2kb9 n ILE 15 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2kb9 h PRO 16 N 1.55 0.00 -0.09 0.38 0.13 -1.92 -3.29 132.00 128.76 2kb9 h PRO 16 Ca -0.25 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.90 2kb9 h PRO 16 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 2kb9 h PRO 16 CO 0.24 0.13 -0.35 0.45 -0.23 0.00 0.00 178.00 178.24 2kb9 h HIS 17 N 0.00 -1.06 -0.54 1.56 3.86 -1.90 0.24 115.15 117.32 2kb9 h HIS 17 Ca -0.00 0.04 -0.32 0.00 -1.16 0.00 0.00 60.37 58.93 2kb9 h HIS 17 Cb 0.59 0.47 -0.04 0.00 1.06 0.00 0.00 27.41 29.49 2kb9 h HIS 17 CO 0.00 -0.36 0.97 -1.25 0.86 0.00 0.00 177.93 178.15 2kb9 s PRO 18 N -4.76 2.51 0.00 2.45 0.04 -1.24 -3.53 135.00 130.47 2kb9 s PRO 18 Ca -0.10 -0.92 0.00 0.00 0.04 0.00 0.00 61.00 60.02 2kb9 s PRO 18 Cb 0.05 -5.19 0.00 0.00 0.04 0.00 0.00 34.50 29.39 2kb9 s PRO 18 CO 0.40 -3.82 0.00 0.41 0.04 0.00 0.00 177.00 174.03 2kb9 n GLY 19 N 6.10 3.14 1.40 0.56 0.00 -1.24 -5.05 105.19 110.10 2kb9 n GLY 19 Ca 0.43 -0.62 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 2kb9 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kb9 n VAL 21 N -1.41 0.00 -4.01 0.00 0.31 -1.18 -4.35 118.33 107.69 2kb9 n VAL 21 Ca 0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.30 2kb9 n VAL 21 Cb 0.22 -0.58 -0.08 0.00 -0.91 0.00 0.00 33.84 32.48 2kb9 n VAL 21 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 2kb9 s HIS 22 N -1.73 0.47 0.00 3.52 3.76 -1.18 -4.91 115.29 115.21 2kb9 s HIS 22 Ca 0.00 -0.89 0.00 0.00 -0.15 0.00 0.00 55.06 54.02 2kb9 s HIS 22 Cb 0.00 -0.23 0.00 0.00 1.11 0.00 0.00 32.58 33.46 2kb9 s HIS 22 CO 0.00 -0.55 0.00 0.41 -0.85 0.00 0.00 174.74 173.75 2kb9 n GLY 23 N -0.07 -0.09 1.69 -2.22 0.00 -1.26 -4.81 105.19 98.43 2kb9 n GLY 23 Ca -0.11 -2.06 -0.12 0.00 0.00 0.00 0.00 46.02 43.74 2kb9 n GLY 23 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2kb9 n ILE 24 N 0.00 0.00 -3.57 -0.61 -5.35 -0.91 -5.01 119.36 103.91 2kb9 n ILE 24 Ca 0.00 -1.23 -0.11 0.00 -0.27 0.00 0.00 62.75 61.14 2kb9 n ILE 24 Cb 0.00 0.52 -0.05 0.00 -1.74 0.00 0.00 39.64 38.38 2kb9 n ILE 24 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2kb9 n ASN 26 N 0.62 4.11 -4.80 0.00 0.23 -1.26 -4.80 115.26 109.36 2kb9 n ASN 26 Ca -0.10 0.00 -0.22 0.00 -0.53 0.00 0.00 54.58 53.73 2kb9 n ASN 26 Cb 0.58 0.79 -0.05 0.00 -2.08 0.00 0.00 39.78 39.03 2kb9 n ASN 26 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2kb9 s GLU 27 N -2.15 2.82 0.11 -3.83 2.02 -1.26 -5.02 118.70 111.39 2kb9 s GLU 27 Ca -0.02 -1.13 -0.31 0.00 0.02 0.00 0.00 54.97 53.54 2kb9 s GLU 27 Cb 0.02 -2.50 -0.08 0.00 0.10 0.00 0.00 34.13 31.67 2kb9 s GLU 27 CO 0.15 0.37 1.37 -1.25 0.02 0.00 0.00 175.26 175.91 2kb9 s PRO 28 N -3.83 4.33 -1.67 0.39 0.04 -1.26 -2.78 135.00 130.22 2kb9 s PRO 28 Ca 0.33 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.41 2kb9 s PRO 28 Cb -0.07 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.20 2kb9 s PRO 28 CO 0.24 -0.42 0.02 0.91 0.04 0.00 0.00 177.00 177.80 2kb9 n TRP 29 N 3.97 -0.96 -3.50 0.56 5.03 -1.25 -4.99 117.44 116.30 2kb9 n TRP 29 Ca 0.11 0.02 -0.04 0.00 3.03 0.00 0.00 57.50 60.62 2kb9 n TRP 29 Cb 0.43 -3.81 0.00 0.00 -1.03 0.00 0.00 31.31 26.90 2kb9 n TRP 29 CO 0.00 0.00 0.00 0.94 -0.03 0.00 0.00 177.69 178.60 2kb9 n GLN 30 N -2.91 1.34 -3.66 -0.99 0.00 -1.12 -5.11 117.38 104.92 2kb9 n GLN 30 Ca -0.23 -0.49 -0.14 0.00 -0.00 0.00 0.00 57.00 56.14 2kb9 n GLN 30 Cb 0.67 0.05 -0.08 0.00 0.00 0.00 0.00 30.24 30.88 2kb9 n GLN 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2kb9 s LEU 32 N 0.27 0.20 0.19 0.00 1.43 0.33 -4.94 118.68 116.16 2kb9 s LEU 32 Ca -0.00 -0.05 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 2kb9 s LEU 32 Cb -0.04 -0.17 -0.02 0.00 0.03 0.00 0.00 46.19 45.98 2kb9 s LEU 32 CO 0.01 -0.26 0.27 0.00 0.23 0.00 0.00 176.35 176.59 2kb9 s GLU 34 N -4.04 1.46 0.49 0.00 2.02 -1.26 -4.94 118.70 112.43 2kb9 s GLU 34 Ca 0.25 0.31 0.25 0.00 0.02 0.00 0.00 54.97 55.80 2kb9 s GLU 34 Cb 0.04 -1.87 1.27 0.00 0.10 0.00 0.00 34.13 33.67 2kb9 s GLU 34 CO 0.06 -1.98 2.00 1.15 0.02 0.00 0.00 175.26 176.51 2kb9 h THR 35 N -1.34 0.64 -0.15 3.63 2.02 -2.01 -2.97 112.91 112.72 2kb9 h THR 35 Ca -0.49 -0.71 0.01 0.00 0.77 0.00 0.00 66.41 65.99 2kb9 h THR 35 Cb 1.32 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 69.17 2kb9 h THR 35 CO 0.62 0.16 0.05 0.78 0.37 0.00 0.00 175.52 177.51 2kb9 h ASN 36 N 0.00 0.06 0.85 4.18 -0.26 -1.97 -3.16 115.58 115.28 2kb9 h ASN 36 Ca -0.00 0.01 -0.04 0.00 -0.56 0.00 0.00 56.30 55.71 2kb9 h ASN 36 Cb 0.44 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.71 2kb9 h ASN 36 CO 0.02 0.06 -0.46 -0.50 -1.06 0.00 0.00 177.43 175.49 2kb9 h TRP 37 N 0.13 -1.21 -2.56 1.19 4.06 -1.75 -3.50 115.95 112.31 2kb9 h TRP 37 Ca 0.06 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.99 2kb9 h TRP 37 Cb 0.03 0.42 0.00 0.00 -1.00 0.00 0.00 29.16 28.61 2kb9 h TRP 37 CO -0.11 -0.71 -0.42 0.41 -3.56 0.00 0.00 178.44 174.05 2kb9 n GLY 38 N -1.61 -4.37 0.00 1.49 0.00 -1.20 -4.50 105.19 95.01 2kb9 n GLY 38 Ca -0.15 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.37 2kb9 n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kb9 n GLY 39 N 0.82 3.81 0.12 -0.02 0.00 -1.26 -4.62 105.19 104.05 2kb9 n GLY 39 Ca 0.00 -1.74 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 2kb9 n GLY 39 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2kb9 h GLN 40 N 0.00 0.21 0.00 1.61 7.50 -1.99 -3.27 115.11 119.18 2kb9 h GLN 40 Ca 0.00 -0.25 -0.26 0.00 0.50 0.00 0.00 58.65 58.65 2kb9 h GLN 40 Cb 0.00 0.07 -0.04 0.00 0.05 0.00 0.00 27.48 27.56 2kb9 h GLN 40 CO 0.00 0.99 -1.45 -0.07 -1.50 0.00 0.00 178.83 176.80 2kb9 h LEU 41 N 0.11 0.00 -2.48 1.46 3.38 -1.91 -3.44 115.31 112.44 2kb9 h LEU 41 Ca -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2kb9 h LEU 41 Cb 1.56 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.33 2kb9 h LEU 41 CO 0.14 0.97 -0.06 0.00 0.09 0.00 0.00 178.44 179.58 2kb9 n ASP 43 N -1.76 3.63 -0.61 0.00 5.75 -1.26 -3.12 116.55 119.18 2kb9 n ASP 43 Ca -0.00 -0.00 0.08 0.00 -0.01 0.00 0.00 54.79 54.85 2kb9 n ASP 43 Cb 0.51 0.61 0.06 0.00 -1.03 0.00 0.00 41.12 41.27 2kb9 n ASP 43 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38