#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 -3.91 0.06 -2.42 0.00 7.27 -1.24 -5.05 117.38 112.08 2kb9 n GLN 3 Ca -0.02 -0.47 -0.43 0.00 0.07 0.00 0.00 57.00 56.15 2kb9 n GLN 3 Cb 0.07 0.85 -0.02 0.00 2.41 0.00 0.00 30.24 33.55 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 -2.11 2.65 0.00 3.69 5.04 -1.26 -2.91 117.35 122.45 2kb9 s TYR 4 Ca 0.24 0.83 0.00 0.00 -2.44 0.00 0.00 57.07 55.71 2kb9 s TYR 4 Cb -0.00 -4.00 0.00 0.00 0.35 0.00 0.00 41.96 38.30 2kb9 s TYR 4 CO -0.02 -1.72 0.00 0.41 -1.34 0.00 0.00 175.55 172.89 2kb9 n GLY 5 N 4.47 0.76 2.72 8.97 0.00 -1.26 -4.97 105.19 115.88 2kb9 n GLY 5 Ca 0.15 -0.61 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 2kb9 n GLY 5 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2kb9 s TRP 6 N -2.00 -0.19 0.43 1.61 0.52 -1.14 -4.26 118.94 113.90 2kb9 s TRP 6 Ca 0.00 -0.75 0.05 0.00 0.02 0.00 0.00 56.10 55.41 2kb9 s TRP 6 Cb 0.00 -0.50 0.05 0.00 -1.15 0.00 0.00 33.47 31.86 2kb9 s TRP 6 CO 0.00 -0.93 0.38 0.00 0.02 0.00 0.00 176.95 176.41 2kb9 n GLN 7 N 4.54 0.83 0.00 4.98 10.64 -1.25 -3.67 117.38 133.45 2kb9 n GLN 7 Ca 0.07 -2.64 0.00 0.00 -1.83 0.00 0.00 57.00 52.60 2kb9 n GLN 7 Cb 0.44 0.20 0.00 0.00 -0.86 0.00 0.00 30.24 30.02 2kb9 n GLN 7 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2kb9 n GLY 8 N -0.24 2.10 0.27 2.61 0.00 -1.26 -3.78 105.19 104.89 2kb9 n GLY 8 Ca 0.01 -1.65 0.11 0.00 0.00 0.00 0.00 46.02 44.49 2kb9 n GLY 8 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2kb9 h LEU 9 N 0.00 0.00 0.00 0.99 5.85 -2.04 -2.01 115.31 118.10 2kb9 h LEU 9 Ca 0.00 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.52 2kb9 h LEU 9 Cb 0.00 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 2kb9 h LEU 9 CO 0.00 0.03 -1.76 -1.22 -0.34 0.00 0.00 178.44 175.15 2kb9 n TYR 10 N -4.19 0.61 -2.70 1.25 4.02 -1.26 -5.05 117.16 109.83 2kb9 n TYR 10 Ca -0.03 0.20 -0.05 0.00 -0.01 0.00 0.00 57.90 58.02 2kb9 n TYR 10 Cb 0.12 -0.99 0.01 0.00 -0.02 0.00 0.00 39.34 38.45 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 -0.01 -0.97 -3.79 0.00 2.03 -1.26 -5.03 116.55 107.53 2kb9 n ASP 12 Ca 0.08 -1.78 -0.13 0.00 0.52 0.00 0.00 54.79 53.48 2kb9 n ASP 12 Cb 0.29 0.36 -0.10 0.00 -0.72 0.00 0.00 41.12 40.95 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 0.04 0.51 -0.33 -0.67 1.02 -1.26 -5.04 119.74 114.01 2kb9 s LYS 13 Ca 0.03 -0.04 0.10 0.00 0.02 0.00 0.00 55.97 56.08 2kb9 s LYS 13 Cb 0.13 0.23 0.72 0.00 -0.52 0.00 0.00 37.83 38.38 2kb9 s LYS 13 CO -0.04 -0.12 1.78 0.00 -0.92 0.00 0.00 175.35 176.05 2kb9 n ILE 15 N -0.31 -7.97 0.25 0.00 5.41 -1.26 -3.95 119.36 111.53 2kb9 n ILE 15 Ca 0.41 0.39 0.13 0.00 1.00 0.00 0.00 62.75 64.67 2kb9 n ILE 15 Cb 1.37 -5.65 0.58 0.00 -0.71 0.00 0.00 39.64 35.23 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 1.57 0.00 -0.08 0.38 0.13 -1.93 -3.29 132.00 128.77 2kb9 h PRO 16 Ca -0.24 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.91 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 0.15 -0.36 0.45 -0.23 0.00 0.00 178.00 178.25 2kb9 h HIS 17 N 0.00 -1.08 -0.54 1.56 3.86 -1.89 -1.43 115.15 115.63 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 0.60 0.48 -0.04 0.00 1.06 0.00 0.00 27.41 29.51 2kb9 h HIS 17 CO 0.00 -0.36 0.98 -1.25 0.86 0.00 0.00 177.93 178.15 2kb9 s PRO 18 N -4.79 2.51 0.00 2.45 0.04 -1.24 -2.16 135.00 131.80 2kb9 s PRO 18 Ca -0.10 -0.93 0.00 0.00 0.04 0.00 0.00 61.00 60.01 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 6.09 1.87 1.69 0.56 0.00 -1.24 -4.97 105.19 109.19 2kb9 n GLY 19 Ca 0.44 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.47 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 -0.39 0.00 -4.28 0.00 0.31 -0.81 -4.47 118.33 108.70 2kb9 n VAL 21 Ca 0.02 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.15 2kb9 n VAL 21 Cb 0.25 -0.91 -0.08 0.00 -0.91 0.00 0.00 33.84 32.18 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 -1.99 1.77 0.00 3.52 0.09 -1.16 -4.86 115.29 112.66 2kb9 s HIS 22 Ca 0.00 -1.67 0.00 0.00 -0.00 0.00 0.00 55.06 53.39 2kb9 s HIS 22 Cb 0.00 -0.71 0.00 0.00 -0.00 0.00 0.00 32.58 31.87 2kb9 s HIS 22 CO 0.00 -0.89 0.00 0.41 -0.00 0.00 0.00 174.74 174.26 2kb9 n GLY 23 N -0.63 -1.59 1.42 -2.22 0.00 -1.26 -4.75 105.19 96.16 2kb9 n GLY 23 Ca 0.08 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.39 -4.96 119.36 104.48 2kb9 n ILE 24 Ca 0.00 -0.98 -0.09 0.00 -0.27 0.00 0.00 62.75 61.40 2kb9 n ILE 24 Cb 0.00 0.31 -0.05 0.00 -1.74 0.00 0.00 39.64 38.16 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 0.57 4.11 -4.77 0.00 5.15 -1.26 -4.79 115.26 114.27 2kb9 n ASN 26 Ca -0.09 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.67 2kb9 n ASN 26 Cb 0.58 0.82 -0.05 0.00 -0.53 0.00 0.00 39.78 40.60 2kb9 n ASN 26 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2kb9 s GLU 27 N -2.16 2.71 0.03 1.20 2.02 -1.26 -5.02 118.70 116.23 2kb9 s GLU 27 Ca -0.02 -1.19 -0.30 0.00 0.02 0.00 0.00 54.97 53.48 2kb9 s GLU 27 Cb 0.02 -2.43 -0.06 0.00 0.10 0.00 0.00 34.13 31.76 2kb9 s GLU 27 CO 0.15 0.36 1.42 -1.25 0.02 0.00 0.00 175.26 175.96 2kb9 s PRO 28 N -3.80 4.29 -0.50 0.39 0.04 -1.26 -3.98 135.00 130.17 2kb9 s PRO 28 Ca 0.33 2.02 -0.07 0.00 0.04 0.00 0.00 61.00 63.33 2kb9 s PRO 28 Cb -0.07 -3.50 0.01 0.00 0.04 0.00 0.00 34.50 30.98 2kb9 s PRO 28 CO 0.23 -0.55 0.55 0.91 0.04 0.00 0.00 177.00 178.18 2kb9 n TRP 29 N 5.04 -2.74 -3.84 0.56 5.03 -1.25 -5.06 117.44 115.18 2kb9 n TRP 29 Ca 0.13 1.07 -0.06 0.00 3.03 0.00 0.00 57.50 61.67 2kb9 n TRP 29 Cb 0.43 -3.71 0.02 0.00 -1.03 0.00 0.00 31.31 27.02 2kb9 n TRP 29 CO 0.00 0.00 0.00 -0.65 -0.03 0.00 0.00 177.69 177.01 2kb9 s GLN 30 N -2.69 1.78 -0.00 -0.99 -1.52 -1.26 -5.17 119.66 109.81 2kb9 s GLN 30 Ca 0.10 -1.12 0.00 0.00 -1.95 0.00 0.00 55.36 52.39 2kb9 s GLN 30 Cb -0.03 0.51 0.00 0.00 -0.22 0.00 0.00 33.01 33.28 2kb9 s GLN 30 CO 0.64 -0.83 -0.00 0.00 -0.25 0.00 0.00 175.29 174.85 2kb9 s LEU 32 N 0.16 0.36 0.25 0.00 1.43 0.43 -4.97 118.68 116.34 2kb9 s LEU 32 Ca -0.01 -0.91 0.03 0.00 -1.03 0.00 0.00 54.13 52.21 2kb9 s LEU 32 Cb -0.03 -0.19 -0.05 0.00 0.03 0.00 0.00 46.19 45.95 2kb9 s LEU 32 CO -0.00 -0.39 0.03 0.00 0.23 0.00 0.00 176.35 176.21 2kb9 s GLU 34 N -3.91 -0.69 0.39 0.00 2.12 -1.26 -4.92 118.70 110.42 2kb9 s GLU 34 Ca 0.31 0.03 0.19 0.00 0.36 0.00 0.00 54.97 55.86 2kb9 s GLU 34 Cb 0.07 -1.65 0.75 0.00 0.26 0.00 0.00 34.13 33.56 2kb9 s GLU 34 CO 0.10 -3.38 1.77 1.15 -0.54 0.00 0.00 175.26 174.37 2kb9 h THR 35 N -2.34 0.88 -0.82 -1.70 2.02 -2.01 -3.02 112.91 105.92 2kb9 h THR 35 Ca -0.47 -1.41 0.23 0.00 0.77 0.00 0.00 66.41 65.53 2kb9 h THR 35 Cb 1.30 1.85 -0.04 0.00 -1.74 0.00 0.00 68.15 69.53 2kb9 h THR 35 CO 0.40 0.34 0.58 0.78 0.37 0.00 0.00 175.52 177.99 2kb9 h ASN 36 N 0.00 0.08 0.00 4.18 -0.26 -2.03 -3.07 115.58 114.48 2kb9 h ASN 36 Ca -0.00 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 2kb9 h ASN 36 Cb 0.83 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.08 2kb9 h ASN 36 CO 0.05 0.03 -0.01 -0.50 -1.06 0.00 0.00 177.43 175.93 2kb9 h TRP 37 N 0.08 0.00 0.00 1.19 4.06 -1.90 -3.48 115.95 115.90 2kb9 h TRP 37 Ca 0.40 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.35 2kb9 h TRP 37 Cb 1.46 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.62 2kb9 h TRP 37 CO -0.00 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.29 2kb9 n GLY 38 N 1.90 2.05 3.72 1.49 0.00 -1.16 -4.99 105.19 108.19 2kb9 n GLY 38 Ca -0.00 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 2kb9 n GLY 38 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2kb9 s GLY 39 N -0.09 2.26 0.14 -0.02 0.00 -1.26 -4.94 107.32 103.42 2kb9 s GLY 39 Ca 0.00 0.84 -0.13 0.00 0.00 0.00 0.00 44.72 45.43 2kb9 s GLY 39 CO 0.00 1.25 1.60 -1.61 0.00 0.00 0.00 173.10 174.35 2kb9 h GLN 40 N -0.52 0.82 0.00 2.90 4.15 -1.99 -2.72 115.11 117.76 2kb9 h GLN 40 Ca -0.47 -0.25 -0.06 0.00 0.77 0.00 0.00 58.65 58.64 2kb9 h GLN 40 Cb 1.29 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.89 2kb9 h GLN 40 CO 0.49 0.86 -0.28 -0.07 -1.93 0.00 0.00 178.83 177.90 2kb9 h LEU 41 N 0.68 0.00 -2.66 -2.39 3.38 -1.92 -3.46 115.31 108.94 2kb9 h LEU 41 Ca 0.14 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.83 2kb9 h LEU 41 Cb 0.47 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.37 2kb9 h LEU 41 CO 0.02 0.28 -0.80 0.00 0.09 0.00 0.00 178.44 178.03 2kb9 s ASP 43 N -3.36 4.18 0.00 0.00 1.47 -1.26 -3.01 116.67 114.69 2kb9 s ASP 43 Ca 0.41 -1.47 0.00 0.00 1.18 0.00 0.00 52.55 52.67 2kb9 s ASP 43 Cb -0.08 0.19 0.00 0.00 -0.34 0.00 0.00 42.92 42.69 2kb9 s ASP 43 CO 0.77 -0.76 0.48 2.29 0.68 0.00 0.00 175.17 178.62