#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 6.06 0.00 -3.44 0.00 6.02 -1.26 -5.09 117.38 119.67 2kb9 n GLN 3 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.96 2kb9 n GLN 3 Cb 0.44 -0.15 -0.04 0.00 1.02 0.00 0.00 30.24 31.51 2kb9 n GLN 3 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 2kb9 s TYR 4 N -1.68 -1.28 0.00 1.08 5.04 -1.26 -4.93 117.35 114.32 2kb9 s TYR 4 Ca 0.00 1.79 0.00 0.00 -2.44 0.00 0.00 57.07 56.42 2kb9 s TYR 4 Cb 0.00 0.54 0.00 0.00 0.35 0.00 0.00 41.96 42.85 2kb9 s TYR 4 CO 0.00 -0.72 0.00 0.41 -1.34 0.00 0.00 175.55 173.90 2kb9 n GLY 5 N 5.42 1.57 2.85 8.97 0.00 -1.26 -4.96 105.19 117.78 2kb9 n GLY 5 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.72 0.03 1.61 0.52 -1.26 -4.29 118.94 112.82 2kb9 s TRP 6 Ca 0.00 -0.12 0.00 0.00 0.02 0.00 0.00 56.10 56.00 2kb9 s TRP 6 Cb 0.00 -0.27 -0.00 0.00 -1.15 0.00 0.00 33.47 32.05 2kb9 s TRP 6 CO 0.00 -0.98 0.01 0.00 0.02 0.00 0.00 176.95 176.00 2kb9 n GLN 7 N 4.98 1.18 0.00 4.98 10.64 -1.23 -4.79 117.38 133.13 2kb9 n GLN 7 Ca 0.04 -0.26 0.00 0.00 -1.83 0.00 0.00 57.00 54.94 2kb9 n GLN 7 Cb 0.48 0.12 0.00 0.00 -0.86 0.00 0.00 30.24 29.98 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 2.76 0.87 0.38 2.61 0.00 -1.26 -4.40 105.19 106.15 2kb9 n GLY 8 Ca -0.01 -1.47 -0.17 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.89 0.00 0.99 5.85 -1.98 -3.46 115.31 115.81 2kb9 h LEU 9 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2kb9 h LEU 9 Cb 0.00 0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.30 2kb9 h LEU 9 CO 0.00 -0.54 0.00 -1.22 -0.34 0.00 0.00 178.44 176.34 2kb9 n TYR 10 N -5.48 -3.20 -3.15 1.25 4.01 -1.26 -5.13 117.16 104.20 2kb9 n TYR 10 Ca -0.12 0.81 0.05 0.00 -0.16 0.00 0.00 57.90 58.49 2kb9 n TYR 10 Cb 0.38 2.07 -0.01 0.00 -0.31 0.00 0.00 39.34 41.46 2kb9 n TYR 10 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2kb9 n ASP 12 N 5.43 0.00 -4.82 0.00 2.03 -1.26 -5.09 116.55 112.85 2kb9 n ASP 12 Ca -0.05 0.00 -0.37 0.00 0.52 0.00 0.00 54.79 54.88 2kb9 n ASP 12 Cb 0.54 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.88 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 -0.66 3.91 -0.36 -0.67 1.02 -1.26 -4.93 119.74 116.79 2kb9 s LYS 13 Ca 0.00 0.24 0.07 0.00 0.02 0.00 0.00 55.97 56.30 2kb9 s LYS 13 Cb 0.00 -3.27 0.69 0.00 -0.52 0.00 0.00 37.83 34.73 2kb9 s LYS 13 CO 0.00 0.59 1.81 0.00 -0.92 0.00 0.00 175.35 176.83 2kb9 n ILE 15 N -0.51 -8.66 0.25 0.00 5.41 -1.26 -4.16 119.36 110.42 2kb9 n ILE 15 Ca 0.47 0.44 0.13 0.00 1.00 0.00 0.00 62.75 64.79 2kb9 n ILE 15 Cb 1.47 -6.02 0.59 0.00 -0.71 0.00 0.00 39.64 34.96 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 1.59 0.00 -0.09 0.38 0.13 -1.92 -3.29 132.00 128.80 2kb9 h PRO 16 Ca -0.19 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.96 2kb9 h PRO 16 Cb 1.13 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.22 2kb9 h PRO 16 CO 0.24 0.14 -0.36 0.45 -0.23 0.00 0.00 178.00 178.24 2kb9 h HIS 17 N 0.00 -1.06 -0.53 1.56 3.86 -1.87 0.24 115.15 117.35 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 0.47 -0.04 0.00 1.06 0.00 0.00 27.41 29.50 2kb9 h HIS 17 CO 0.00 -0.36 0.98 -1.25 0.86 0.00 0.00 177.93 178.17 2kb9 s PRO 18 N -4.76 2.50 0.00 2.45 0.04 -1.24 -2.24 135.00 131.75 2kb9 s PRO 18 Ca -0.10 -0.95 0.00 0.00 0.04 0.00 0.00 61.00 59.99 2kb9 s PRO 18 Cb 0.05 -5.20 0.00 0.00 0.04 0.00 0.00 34.50 29.39 2kb9 s PRO 18 CO 0.40 -3.84 0.00 0.41 0.04 0.00 0.00 177.00 174.00 2kb9 n GLY 19 N 6.06 1.49 3.55 0.56 0.00 -1.24 -4.96 105.19 110.65 2kb9 n GLY 19 Ca 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.59 0.33 -4.23 0.00 0.31 -0.43 -4.01 118.33 109.71 2kb9 n VAL 21 Ca -0.01 -0.09 -0.18 0.00 -0.01 0.00 0.00 64.34 64.06 2kb9 n VAL 21 Cb 0.61 -1.55 -0.07 0.00 -0.91 0.00 0.00 33.84 31.91 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 -2.11 1.57 0.00 3.52 0.09 -1.25 -4.80 115.29 112.31 2kb9 s HIS 22 Ca -0.08 -1.57 0.00 0.00 -0.00 0.00 0.00 55.06 53.41 2kb9 s HIS 22 Cb 0.03 -0.56 0.00 0.00 -0.00 0.00 0.00 32.58 32.05 2kb9 s HIS 22 CO 0.11 -0.92 0.00 0.41 -0.00 0.00 0.00 174.74 174.33 2kb9 n GLY 23 N -0.59 0.15 2.83 -2.22 0.00 -1.26 -4.74 105.19 99.36 2kb9 n GLY 23 Ca 0.06 -1.96 -0.15 0.00 0.00 0.00 0.00 46.02 43.97 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 -3.59 -0.61 -5.35 0.51 -5.02 119.36 105.30 2kb9 n ILE 24 Ca 0.00 -1.79 -0.09 0.00 -0.27 0.00 0.00 62.75 60.59 2kb9 n ILE 24 Cb 0.00 0.99 -0.05 0.00 -1.74 0.00 0.00 39.64 38.84 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 0.84 1.57 -3.59 0.00 0.23 -1.26 -4.78 115.26 108.27 2kb9 n ASN 26 Ca -0.09 -3.18 -0.11 0.00 -0.53 0.00 0.00 54.58 50.67 2kb9 n ASN 26 Cb 0.58 -0.43 -0.04 0.00 -2.08 0.00 0.00 39.78 37.81 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 -2.25 1.16 -0.15 -3.83 2.02 -1.26 -5.13 118.70 109.27 2kb9 s GLU 27 Ca 0.32 -0.66 -0.29 0.00 0.02 0.00 0.00 54.97 54.36 2kb9 s GLU 27 Cb 0.32 0.51 -0.03 0.00 0.10 0.00 0.00 34.13 35.02 2kb9 s GLU 27 CO -0.06 -0.48 1.56 -1.25 0.02 0.00 0.00 175.26 175.06 2kb9 s PRO 28 N -3.80 4.02 -0.31 0.39 0.04 -1.26 -4.11 135.00 129.97 2kb9 s PRO 28 Ca 0.03 1.85 -0.07 0.00 0.04 0.00 0.00 61.00 62.86 2kb9 s PRO 28 Cb 0.01 -3.97 0.01 0.00 0.04 0.00 0.00 34.50 30.59 2kb9 s PRO 28 CO -0.11 -1.02 0.25 0.91 0.04 0.00 0.00 177.00 177.07 2kb9 n TRP 29 N 7.62 -3.16 -3.76 0.56 5.03 -1.26 -5.07 117.44 117.39 2kb9 n TRP 29 Ca 0.17 1.34 -0.08 0.00 3.03 0.00 0.00 57.50 61.96 2kb9 n TRP 29 Cb 0.44 -3.65 0.03 0.00 -1.03 0.00 0.00 31.31 27.10 2kb9 n TRP 29 CO 0.00 0.00 0.00 1.04 -0.03 0.00 0.00 177.69 178.70 2kb9 n GLN 30 N 0.13 1.08 -3.72 -0.99 6.02 -1.26 -5.16 117.38 113.49 2kb9 n GLN 30 Ca 0.05 -2.12 -0.13 0.00 -0.01 0.00 0.00 57.00 54.79 2kb9 n GLN 30 Cb 0.19 2.65 -0.13 0.00 1.02 0.00 0.00 30.24 33.97 2kb9 n GLN 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kb9 s LEU 32 N 1.52 0.53 0.12 0.00 1.43 -0.86 -5.03 118.68 116.39 2kb9 s LEU 32 Ca -0.07 0.56 -0.19 0.00 -1.03 0.00 0.00 54.13 53.40 2kb9 s LEU 32 Cb -0.11 0.83 0.05 0.00 0.03 0.00 0.00 46.19 46.99 2kb9 s LEU 32 CO -0.08 -0.15 0.47 0.00 0.23 0.00 0.00 176.35 176.83 2kb9 n GLU 34 N -0.12 -0.93 0.22 0.00 2.13 -1.26 -4.86 120.64 115.82 2kb9 n GLU 34 Ca -0.17 -0.24 0.06 0.00 0.66 0.00 0.00 57.16 57.47 2kb9 n GLU 34 Cb 0.63 -1.82 0.51 0.00 0.27 0.00 0.00 31.44 31.03 2kb9 n GLU 34 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2kb9 h THR 35 N -1.83 1.02 -0.91 6.31 2.02 -2.04 -2.65 112.91 114.83 2kb9 h THR 35 Ca -0.48 -0.80 0.20 0.00 0.77 0.00 0.00 66.41 66.09 2kb9 h THR 35 Cb 1.32 1.45 -0.07 0.00 -1.74 0.00 0.00 68.15 69.11 2kb9 h THR 35 CO 0.37 0.22 0.59 0.78 0.37 0.00 0.00 175.52 177.85 2kb9 h ASN 36 N 0.00 0.46 -3.29 4.18 -0.26 -1.97 -3.39 115.58 111.30 2kb9 h ASN 36 Ca -0.00 0.05 -0.55 0.00 -0.56 0.00 0.00 56.30 55.23 2kb9 h ASN 36 Cb 0.43 -0.04 -0.03 0.00 -1.06 0.00 0.00 38.32 37.62 2kb9 h ASN 36 CO 0.03 0.19 0.51 0.26 -1.06 0.00 0.00 177.43 177.36 2kb9 s TRP 37 N -5.48 3.53 -0.08 1.19 0.52 -1.00 -4.92 118.94 112.70 2kb9 s TRP 37 Ca -0.09 1.58 0.09 0.00 0.02 0.00 0.00 56.10 57.71 2kb9 s TRP 37 Cb 0.23 -3.20 -0.13 0.00 -1.15 0.00 0.00 33.47 29.22 2kb9 s TRP 37 CO 0.78 -0.29 0.08 0.41 0.02 0.00 0.00 176.95 177.95 2kb9 n GLY 38 N 3.06 -0.49 3.40 0.98 0.00 -1.08 -4.92 105.19 106.14 2kb9 n GLY 38 Ca 0.08 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 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 2.28 -2.07 0.15 -0.02 0.00 -1.26 -4.89 105.19 99.38 2kb9 n GLY 39 Ca -0.13 -0.75 0.01 0.00 0.00 0.00 0.00 46.02 45.14 2kb9 n GLY 39 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2kb9 h GLN 40 N -1.58 0.00 -0.54 1.61 4.15 -1.98 -3.04 115.11 113.73 2kb9 h GLN 40 Ca -0.44 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 58.78 2kb9 h GLN 40 Cb 1.29 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.86 2kb9 h GLN 40 CO 0.34 0.56 0.15 1.28 -1.93 0.00 0.00 178.83 179.24 2kb9 n LEU 41 N -3.68 5.05 -3.88 -2.39 4.77 -1.26 -4.93 117.00 110.67 2kb9 n LEU 41 Ca -0.01 -3.41 -0.27 0.00 -0.03 0.00 0.00 56.01 52.29 2kb9 n LEU 41 Cb 0.60 -0.68 0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2kb9 n LEU 41 CO 0.41 0.96 -0.02 0.00 -1.33 0.00 0.00 177.39 177.40 2kb9 n ASP 43 N -2.92 2.46 -0.49 0.00 2.03 -1.26 -3.77 116.55 112.60 2kb9 n ASP 43 Ca -0.13 -0.01 0.06 0.00 0.52 0.00 0.00 54.79 55.23 2kb9 n ASP 43 Cb 0.60 0.66 0.05 0.00 -0.72 0.00 0.00 41.12 41.71 2kb9 n ASP 43 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57