#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kb9 h GLN 3 N 0.01 -0.63 -5.22 0.00 -0.00 -2.01 -3.22 115.11 104.04 2kb9 h GLN 3 Ca -0.33 0.04 -0.63 0.00 -0.00 0.00 0.00 58.65 57.73 2kb9 h GLN 3 Cb 2.05 0.14 -0.20 0.00 0.00 0.00 0.00 27.48 29.47 2kb9 h GLN 3 CO 0.07 -0.42 -0.63 -0.47 0.00 0.00 0.00 178.83 177.38 2kb9 s TYR 4 N -5.95 3.10 0.00 3.99 5.04 -1.26 -4.40 117.35 117.87 2kb9 s TYR 4 Ca -0.16 -0.23 0.00 0.00 -2.44 0.00 0.00 57.07 54.24 2kb9 s TYR 4 Cb 0.07 -2.05 0.00 0.00 0.35 0.00 0.00 41.96 40.33 2kb9 s TYR 4 CO 0.63 -0.05 0.00 0.41 -1.34 0.00 0.00 175.55 175.20 2kb9 n GLY 5 N 3.84 3.09 2.72 8.97 0.00 -1.26 -4.87 105.19 117.68 2kb9 n GLY 5 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.73 1.87 1.01 1.61 0.52 -1.21 -4.20 118.94 115.81 2kb9 s TRP 6 Ca 0.00 -2.08 -0.16 0.00 0.02 0.00 0.00 56.10 53.88 2kb9 s TRP 6 Cb 0.00 -1.80 0.21 0.00 -1.15 0.00 0.00 33.47 30.72 2kb9 s TRP 6 CO 0.00 -0.84 1.24 -0.65 0.02 0.00 0.00 176.95 176.72 2kb9 s GLN 7 N 1.03 0.27 0.00 4.98 -0.21 -0.26 -4.63 119.66 120.83 2kb9 s GLN 7 Ca 0.14 -0.22 0.00 0.00 0.02 0.00 0.00 55.36 55.30 2kb9 s GLN 7 Cb -0.21 -1.78 0.00 0.00 1.00 0.00 0.00 33.01 32.02 2kb9 s GLN 7 CO -0.12 -2.69 0.00 0.41 -2.12 0.00 0.00 175.29 170.77 2kb9 n GLY 8 N -2.83 -0.17 0.13 3.09 0.00 -1.26 -1.96 105.19 102.19 2kb9 n GLY 8 Ca 0.13 -1.91 -0.20 0.00 0.00 0.00 0.00 46.02 44.04 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 0.51 -3.34 0.99 5.85 -1.99 -3.36 115.31 113.98 2kb9 h LEU 9 Ca 0.00 -0.78 -0.13 0.00 0.84 0.00 0.00 57.88 57.81 2kb9 h LEU 9 Cb 0.00 -0.17 -0.08 0.00 0.37 0.00 0.00 40.66 40.78 2kb9 h LEU 9 CO 0.00 1.66 -0.03 -1.22 -0.34 0.00 0.00 178.44 178.52 2kb9 n TYR 10 N -3.52 1.08 -2.96 1.25 4.01 -1.26 -5.01 117.16 110.75 2kb9 n TYR 10 Ca -0.22 -1.37 -0.07 0.00 -0.16 0.00 0.00 57.90 56.08 2kb9 n TYR 10 Cb 1.06 -0.44 0.01 0.00 -0.31 0.00 0.00 39.34 39.66 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 0.53 0.97 -3.57 0.00 -0.08 -0.83 -4.97 116.55 108.60 2kb9 n ASP 12 Ca 0.01 -2.39 -0.00 0.00 -1.51 0.00 0.00 54.79 50.90 2kb9 n ASP 12 Cb 0.30 -0.28 -0.06 0.00 2.34 0.00 0.00 41.12 43.43 2kb9 n ASP 12 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2kb9 s LYS 13 N -2.84 0.27 -0.27 -0.67 1.02 -1.25 -4.96 119.74 111.05 2kb9 s LYS 13 Ca 0.25 0.52 0.07 0.00 0.02 0.00 0.00 55.97 56.83 2kb9 s LYS 13 Cb 0.40 0.14 0.59 0.00 -0.52 0.00 0.00 37.83 38.44 2kb9 s LYS 13 CO -0.01 -0.07 1.61 0.00 -0.92 0.00 0.00 175.35 175.96 2kb9 n ILE 15 N -0.17 -7.92 0.25 0.00 5.41 -1.26 -3.96 119.36 111.71 2kb9 n ILE 15 Ca 0.35 0.38 0.13 0.00 1.00 0.00 0.00 62.75 64.60 2kb9 n ILE 15 Cb 1.22 -5.62 0.59 0.00 -0.71 0.00 0.00 39.64 35.12 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 -0.08 0.38 0.13 -1.91 -3.29 132.00 128.77 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 0.14 -0.36 0.45 -0.23 0.00 0.00 178.00 178.24 2kb9 h HIS 17 N 0.00 -1.07 -0.54 1.56 3.86 -1.89 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 0.48 -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 0.00 177.93 178.16 2kb9 s PRO 18 N -4.78 2.51 0.00 2.45 0.04 -1.24 -2.24 135.00 131.74 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 -5.20 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 1.50 3.54 0.56 0.00 -1.24 -4.95 105.19 110.69 2kb9 n GLY 19 Ca 0.44 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.58 0.00 -4.20 0.00 0.31 -0.89 -3.99 118.33 108.98 2kb9 n VAL 21 Ca -0.01 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.15 2kb9 n VAL 21 Cb 0.60 -1.05 -0.07 0.00 -0.91 0.00 0.00 33.84 32.42 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 1.39 0.00 3.52 3.76 -1.25 -4.84 115.29 115.88 2kb9 s HIS 22 Ca 0.00 -1.47 0.00 0.00 -0.15 0.00 0.00 55.06 53.44 2kb9 s HIS 22 Cb 0.00 -0.46 0.00 0.00 1.11 0.00 0.00 32.58 33.23 2kb9 s HIS 22 CO 0.00 -0.91 0.00 0.41 -0.85 0.00 0.00 174.74 173.39 2kb9 n GLY 23 N -0.53 0.34 2.19 -2.22 0.00 -1.26 -4.86 105.19 98.85 2kb9 n GLY 23 Ca 0.04 -1.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.14 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 -0.67 -5.05 119.36 104.09 2kb9 n ILE 24 Ca 0.00 -1.08 -0.08 0.00 -0.27 0.00 0.00 62.75 61.32 2kb9 n ILE 24 Cb 0.00 0.70 -0.04 0.00 -1.74 0.00 0.00 39.64 38.55 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 0.56 4.10 -4.70 0.00 0.23 -1.26 -4.84 115.26 109.34 2kb9 n ASN 26 Ca -0.07 0.00 -0.23 0.00 -0.53 0.00 0.00 54.58 53.76 2kb9 n ASN 26 Cb 0.58 0.84 -0.06 0.00 -2.08 0.00 0.00 39.78 39.06 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 -2.17 2.46 0.12 -3.83 2.02 -1.26 -5.04 118.70 111.00 2kb9 s GLU 27 Ca -0.02 -1.34 -0.31 0.00 0.02 0.00 0.00 54.97 53.33 2kb9 s GLU 27 Cb 0.02 -2.27 -0.08 0.00 0.10 0.00 0.00 34.13 31.90 2kb9 s GLU 27 CO 0.16 0.35 1.36 -1.25 0.02 0.00 0.00 175.26 175.89 2kb9 s PRO 28 N -3.74 4.34 -0.44 0.39 0.04 -1.26 -4.11 135.00 130.22 2kb9 s PRO 28 Ca 0.32 2.04 -0.15 0.00 0.04 0.00 0.00 61.00 63.25 2kb9 s PRO 28 Cb -0.06 -3.25 0.02 0.00 0.04 0.00 0.00 34.50 31.24 2kb9 s PRO 28 CO 0.21 -0.40 0.60 0.91 0.04 0.00 0.00 177.00 178.37 2kb9 n TRP 29 N 3.82 -3.48 -3.83 0.56 5.03 -1.25 -5.06 117.44 113.22 2kb9 n TRP 29 Ca 0.11 1.40 -0.07 0.00 3.03 0.00 0.00 57.50 61.96 2kb9 n TRP 29 Cb 0.43 -4.10 0.00 0.00 -1.03 0.00 0.00 31.31 26.61 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 -2.62 1.91 -0.03 -0.99 -0.21 -1.26 -5.17 119.66 111.29 2kb9 s GLN 30 Ca 0.24 -1.16 -0.00 0.00 0.02 0.00 0.00 55.36 54.46 2kb9 s GLN 30 Cb -0.07 0.59 0.03 0.00 1.00 0.00 0.00 33.01 34.56 2kb9 s GLN 30 CO 0.77 -0.89 0.02 0.00 -2.12 0.00 0.00 175.29 173.07 2kb9 s LEU 32 N 1.38 0.38 0.32 0.00 1.43 -1.05 -5.04 118.68 116.10 2kb9 s LEU 32 Ca -0.05 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.05 2kb9 s LEU 32 Cb -0.13 -0.27 -0.01 0.00 0.03 0.00 0.00 46.19 45.81 2kb9 s LEU 32 CO -0.03 -0.22 0.40 0.00 0.23 0.00 0.00 176.35 176.74 2kb9 s GLU 34 N -3.28 0.33 0.21 0.00 2.12 -1.26 -4.98 118.70 111.84 2kb9 s GLU 34 Ca 0.33 -0.35 0.04 0.00 0.36 0.00 0.00 54.97 55.36 2kb9 s GLU 34 Cb 0.01 -1.80 0.16 0.00 0.26 0.00 0.00 34.13 32.75 2kb9 s GLU 34 CO 0.21 -2.63 1.49 1.15 -0.54 0.00 0.00 175.26 174.94 2kb9 h THR 35 N -1.80 1.43 -0.68 -1.70 2.02 -2.03 -3.12 112.91 107.03 2kb9 h THR 35 Ca -0.44 -2.23 0.10 0.00 0.77 0.00 0.00 66.41 64.61 2kb9 h THR 35 Cb 1.25 2.18 -0.04 0.00 -1.74 0.00 0.00 68.15 69.79 2kb9 h THR 35 CO 0.38 0.65 0.45 0.78 0.37 0.00 0.00 175.52 178.15 2kb9 h ASN 36 N 0.14 0.48 -3.78 4.18 -0.26 -1.94 -3.41 115.58 110.99 2kb9 h ASN 36 Ca -0.02 0.01 -0.50 0.00 -0.56 0.00 0.00 56.30 55.23 2kb9 h ASN 36 Cb 1.25 -0.09 0.01 0.00 -1.06 0.00 0.00 38.32 38.43 2kb9 h ASN 36 CO 0.11 0.29 0.45 0.26 -1.06 0.00 0.00 177.43 177.47 2kb9 s TRP 37 N -5.50 3.68 0.21 1.19 0.52 -1.18 -4.94 118.94 112.92 2kb9 s TRP 37 Ca -0.08 1.75 0.07 0.00 0.02 0.00 0.00 56.10 57.85 2kb9 s TRP 37 Cb 0.20 -3.21 -0.04 0.00 -1.15 0.00 0.00 33.47 29.27 2kb9 s TRP 37 CO 0.76 -0.31 0.09 0.20 0.02 0.00 0.00 176.95 177.71 2kb9 s GLY 38 N -0.91 1.62 0.16 0.98 0.00 -1.19 -4.89 107.32 103.08 2kb9 s GLY 38 Ca 0.44 -1.39 0.00 0.00 0.00 0.00 0.00 44.72 43.77 2kb9 s GLY 38 CO 0.39 -1.42 0.00 0.61 0.00 0.00 0.00 173.10 172.67 2kb9 n GLY 39 N -0.60 -2.03 0.14 0.20 0.00 -1.26 -3.46 105.19 98.18 2kb9 n GLY 39 Ca -0.08 -1.37 -0.16 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.47 0.38 -0.15 1.61 7.50 -1.96 -3.16 115.11 118.86 2kb9 h GLN 40 Ca -0.02 -0.37 0.04 0.00 0.50 0.00 0.00 58.65 58.81 2kb9 h GLN 40 Cb 0.46 0.09 -0.01 0.00 0.05 0.00 0.00 27.48 28.08 2kb9 h GLN 40 CO 0.01 1.03 0.18 -0.07 -1.50 0.00 0.00 178.83 178.48 2kb9 h LEU 41 N -0.13 0.00 -2.55 1.46 3.38 -1.82 -3.46 115.31 112.19 2kb9 h LEU 41 Ca -0.05 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.71 2kb9 h LEU 41 Cb 1.17 0.00 0.13 0.00 0.09 0.00 0.00 40.66 42.05 2kb9 h LEU 41 CO 0.10 0.00 -0.64 0.00 0.09 0.00 0.00 178.44 177.99 2kb9 n ASP 43 N -2.75 1.79 -0.24 0.00 5.75 -1.25 -3.92 116.55 115.93 2kb9 n ASP 43 Ca -0.06 0.00 0.03 0.00 -0.01 0.00 0.00 54.79 54.75 2kb9 n ASP 43 Cb 0.59 0.82 0.02 0.00 -1.03 0.00 0.00 41.12 41.52 2kb9 n ASP 43 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38