#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k7b s PRO 12 N -2.45 -0.76 0.55 0.00 0.02 -1.26 -4.94 135.00 126.15 1k7b s PRO 12 Ca 0.22 0.65 -0.20 0.00 0.02 0.00 0.00 61.00 61.68 1k7b s PRO 12 Cb -0.03 -1.59 -0.05 0.00 0.02 0.00 0.00 34.50 32.85 1k7b s PRO 12 CO 0.16 -3.56 1.19 -1.25 -0.33 0.00 0.00 177.00 173.21 1k7b s PRO 13 N -4.66 3.26 -1.36 5.54 0.04 -1.26 -2.68 135.00 133.89 1k7b s PRO 13 Ca 0.68 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.52 1k7b s PRO 13 Cb -0.22 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.23 1k7b s PRO 13 CO 0.62 -0.97 0.00 0.41 0.04 0.00 0.00 177.00 177.11 1k7b n GLY 14 N 0.43 -0.05 3.07 0.56 0.00 -1.26 -4.99 105.19 102.95 1k7b n GLY 14 Ca 0.11 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 1k7b n GLY 14 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1k7b s GLN 15 N -4.62 0.71 0.17 1.61 -0.21 -1.09 -0.55 119.66 115.68 1k7b s GLN 15 Ca 0.00 -0.58 0.01 0.00 0.02 0.00 0.00 55.36 54.81 1k7b s GLN 15 Cb 0.00 -0.65 -0.05 0.00 1.00 0.00 0.00 33.01 33.31 1k7b s GLN 15 CO 0.00 0.16 0.02 -0.59 -2.12 0.00 0.00 175.29 172.77 1k7b s PHE 16 N -0.74 1.17 0.01 0.91 -0.71 -0.28 -4.60 117.98 113.74 1k7b s PHE 16 Ca -0.01 -1.08 -0.01 0.00 -1.04 0.00 0.00 56.93 54.79 1k7b s PHE 16 Cb -0.07 -0.67 -0.04 0.00 -1.21 0.00 0.00 43.02 41.04 1k7b s PHE 16 CO 0.01 -0.29 0.14 -0.98 -1.34 0.00 0.00 175.22 172.75 1k7b s ARG 17 N -3.96 3.24 0.00 1.99 1.70 -1.26 -0.36 118.95 120.31 1k7b s ARG 17 Ca 0.26 -0.44 0.00 0.00 -0.47 0.00 0.00 55.73 55.08 1k7b s ARG 17 Cb 0.07 -2.96 0.00 0.00 -0.57 0.00 0.00 34.95 31.48 1k7b s ARG 17 CO 0.05 0.64 0.00 0.00 -1.08 0.00 0.00 175.30 174.91 1k7b n SER 19 N 0.00 2.63 -3.72 0.00 3.41 -1.26 -4.86 113.62 109.82 1k7b n SER 19 Ca 0.00 -3.72 -0.17 0.00 -0.26 0.00 0.00 58.87 54.72 1k7b n SER 19 Cb 0.00 -0.64 -0.17 0.00 -0.26 0.00 0.00 64.21 63.14 1k7b n SER 19 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1k7b s GLU 20 N -3.22 -0.04 0.92 4.33 2.12 -1.26 -5.10 118.70 116.44 1k7b s GLU 20 Ca 0.45 0.30 -0.12 0.00 0.36 0.00 0.00 54.97 55.96 1k7b s GLU 20 Cb 0.41 -0.35 0.14 0.00 0.26 0.00 0.00 34.13 34.59 1k7b s GLU 20 CO 0.01 -0.24 1.10 -1.25 -0.54 0.00 0.00 175.26 174.34 1k7b s PRO 21 N 1.58 1.09 1.06 4.30 0.04 -1.26 -4.99 135.00 136.81 1k7b s PRO 21 Ca -0.03 0.62 -0.12 0.00 0.04 0.00 0.00 61.00 61.50 1k7b s PRO 21 Cb -0.12 -1.81 0.22 0.00 0.04 0.00 0.00 34.50 32.83 1k7b s PRO 21 CO -0.03 -2.30 1.07 -1.25 0.04 0.00 0.00 177.00 174.52 1k7b s PRO 22 N -5.03 -0.06 0.00 0.56 0.04 -1.26 -3.43 135.00 125.82 1k7b s PRO 22 Ca 0.64 0.65 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1k7b s PRO 22 Cb -0.17 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.70 1k7b s PRO 22 CO 0.56 -3.09 0.00 0.41 0.04 0.00 0.00 177.00 174.92 1k7b n GLY 23 N -0.38 2.48 2.59 0.56 0.00 -1.26 -4.90 105.19 104.28 1k7b n GLY 23 Ca 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.79 1k7b n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7b n ALA 24 N 0.18 3.14 -0.32 4.61 0.00 -1.22 -5.04 120.51 121.86 1k7b n ALA 24 Ca 0.00 -3.83 0.12 0.00 0.00 0.00 0.00 53.44 49.73 1k7b n ALA 24 Cb 0.00 -0.88 0.33 0.00 0.00 0.00 0.00 19.45 18.90 1k7b n ALA 24 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1k7b h HIS 25 N 5.31 0.97 0.00 0.00 -0.00 -1.90 -3.44 115.15 116.08 1k7b h HIS 25 Ca 0.20 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.60 1k7b h HIS 25 Cb 0.83 -0.30 0.00 0.00 -0.00 0.00 0.00 27.41 27.93 1k7b h HIS 25 CO 0.48 0.31 0.00 0.41 -0.00 0.00 0.00 177.93 179.13 1k7b n GLY 26 N -1.38 2.28 2.84 2.45 0.00 -1.26 -4.61 105.19 105.50 1k7b n GLY 26 Ca 0.20 -0.40 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1k7b n GLY 26 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1k7b s GLU 27 N 0.00 1.10 1.38 1.61 0.41 -1.26 -5.15 118.70 116.79 1k7b s GLU 27 Ca 0.00 -0.23 -0.21 0.00 -0.41 0.00 0.00 54.97 54.12 1k7b s GLU 27 Cb 0.00 -1.57 0.35 0.00 -1.78 0.00 0.00 34.13 31.13 1k7b s GLU 27 CO 0.00 -0.37 0.95 0.00 -0.49 0.00 0.00 175.26 175.35 1k7b s TYR 29 N -2.36 0.43 0.60 0.00 2.02 0.52 -4.96 117.35 113.61 1k7b s TYR 29 Ca 0.69 -0.87 -0.20 0.00 -0.37 0.00 0.00 57.07 56.32 1k7b s TYR 29 Cb -0.14 -0.32 -0.03 0.00 -0.40 0.00 0.00 41.96 41.07 1k7b s TYR 29 CO 0.58 -0.31 1.30 -2.30 -1.57 0.00 0.00 175.55 173.25 1k7b n PRO 30 N 0.65 1.33 0.00 -1.71 -0.02 -1.26 -1.13 135.00 132.86 1k7b n PRO 30 Ca -0.18 0.51 0.13 0.00 -2.02 0.00 0.00 63.50 61.94 1k7b n PRO 30 Cb 0.59 -2.52 0.72 0.00 -0.02 0.00 0.00 33.50 32.27 1k7b n PRO 30 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1k7b n GLN 31 N -1.48 0.60 -0.05 -0.52 6.02 0.28 -1.02 117.38 121.21 1k7b n GLN 31 Ca 0.14 0.02 0.01 0.00 -0.01 0.00 0.00 57.00 57.16 1k7b n GLN 31 Cb 0.47 -1.50 0.32 0.00 1.02 0.00 0.00 30.24 30.54 1k7b n GLN 31 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1k7b h ASP 32 N 0.00 0.58 -0.81 1.08 3.58 -1.91 -2.82 116.42 116.12 1k7b h ASP 32 Ca 0.00 -0.06 -0.46 0.00 0.42 0.00 0.00 57.03 56.93 1k7b h ASP 32 Cb 0.12 -0.15 -0.18 0.00 1.72 0.00 0.00 39.33 40.84 1k7b h ASP 32 CO 0.00 0.52 0.53 0.79 -2.88 0.00 0.00 179.24 178.20 1k7b n TRP 33 N -4.37 1.94 -3.74 0.28 7.02 -0.19 -4.01 117.44 114.38 1k7b n TRP 33 Ca 0.03 -2.18 -0.29 0.00 -1.02 0.00 0.00 57.50 54.05 1k7b n TRP 33 Cb 0.15 -1.17 -0.16 0.00 -2.42 0.00 0.00 31.31 27.71 1k7b n TRP 33 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 1k7b s LEU 34 N -2.40 1.68 -0.91 -0.99 2.96 -1.07 -4.78 118.68 113.17 1k7b s LEU 34 Ca 0.46 -1.21 -0.07 0.00 -0.22 0.00 0.00 54.13 53.08 1k7b s LEU 34 Cb 0.34 -0.73 -0.01 0.00 0.50 0.00 0.00 46.19 46.28 1k7b s LEU 34 CO -0.08 -0.35 0.73 0.00 -1.32 0.00 0.00 176.35 175.32 1k7b n ASP 36 N -2.38 0.49 0.00 0.00 2.03 -1.26 -4.92 116.55 110.51 1k7b n ASP 36 Ca -0.10 0.37 0.00 0.00 0.52 0.00 0.00 54.79 55.57 1k7b n ASP 36 Cb 0.58 -0.40 0.00 0.00 -0.72 0.00 0.00 41.12 40.58 1k7b n ASP 36 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k7b n GLY 37 N 1.40 0.72 3.02 0.27 0.00 -1.26 -5.03 105.19 104.31 1k7b n GLY 37 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1k7b n GLY 37 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1k7b s HIS 38 N -2.56 -0.42 0.59 1.61 5.04 -1.26 -5.17 115.29 113.12 1k7b s HIS 38 Ca 0.00 0.96 -0.17 0.00 -1.54 0.00 0.00 55.06 54.31 1k7b s HIS 38 Cb 0.00 -0.01 -0.04 0.00 0.04 0.00 0.00 32.58 32.57 1k7b s HIS 38 CO 0.00 -0.34 1.09 -1.25 -2.34 0.00 0.00 174.74 171.90 1k7b s PRO 39 N 2.23 3.22 0.00 2.88 0.05 -1.26 -4.81 135.00 137.30 1k7b s PRO 39 Ca -0.01 1.38 0.00 0.00 0.05 0.00 0.00 61.00 62.42 1k7b s PRO 39 Cb -0.12 -2.01 0.00 0.00 0.05 0.00 0.00 34.50 32.43 1k7b s PRO 39 CO -0.09 -0.92 0.11 -3.47 0.05 0.00 0.00 177.00 172.69 1k7b n ASP 40 N -1.85 0.00 0.00 6.66 -0.08 -1.26 -4.91 116.55 115.10 1k7b n ASP 40 Ca 0.10 -1.00 0.00 0.00 -1.51 0.00 0.00 54.79 52.38 1k7b n ASP 40 Cb 0.52 0.00 0.01 0.00 2.34 0.00 0.00 41.12 43.99 1k7b n ASP 40 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1k7b n ASP 42 N -0.51 0.00 0.00 0.00 2.03 -1.26 -4.15 116.55 112.66 1k7b n ASP 42 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1k7b n ASP 42 Cb 0.00 -1.07 0.00 0.00 -0.72 0.00 0.00 41.12 39.34 1k7b n ASP 42 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1k7b n ASP 43 N 0.00 0.25 -0.58 1.67 2.03 -1.26 -5.02 116.55 113.64 1k7b n ASP 43 Ca 0.00 -0.59 -0.08 0.00 0.52 0.00 0.00 54.79 54.65 1k7b n ASP 43 Cb 0.00 0.56 -0.03 0.00 -0.72 0.00 0.00 41.12 40.92 1k7b n ASP 43 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k7b n GLY 44 N 0.56 0.85 0.00 0.27 0.00 -1.26 -4.89 105.19 100.72 1k7b n GLY 44 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.92 1k7b n GLY 44 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1k7b n ARG 45 N -1.40 0.81 0.09 1.61 1.85 -1.26 -1.51 116.66 116.85 1k7b n ARG 45 Ca -0.08 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 56.73 1k7b n ARG 45 Cb 0.42 -1.27 0.01 0.00 -1.05 0.00 0.00 32.46 30.58 1k7b n ARG 45 CO 0.00 0.00 0.00 0.38 -0.01 0.00 0.00 177.63 178.00 1k7b h ASP 46 N 0.00 0.01 0.73 2.89 2.03 -1.90 -3.30 116.42 116.88 1k7b h ASP 46 Ca 0.00 -0.00 -0.23 0.00 -0.73 0.00 0.00 57.03 56.06 1k7b h ASP 46 Cb 0.00 -0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 1k7b h ASP 46 CO 0.00 0.83 -1.06 -0.33 -1.03 0.00 0.00 179.24 177.65 1k7b h GLU 47 N 0.00 0.16 -6.10 4.15 4.39 -1.59 -0.77 114.58 114.84 1k7b h GLU 47 Ca -0.01 -0.25 -0.58 0.00 0.34 0.00 0.00 59.36 58.86 1k7b h GLU 47 Cb 1.46 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.19 1k7b h GLU 47 CO 0.11 1.07 1.41 -1.58 -1.16 0.00 0.00 179.01 178.86 1k7b s TRP 48 N -2.83 1.40 0.00 4.33 0.52 -1.24 -1.49 118.94 119.63 1k7b s TRP 48 Ca -0.02 0.54 0.00 0.00 0.02 0.00 0.00 56.10 56.64 1k7b s TRP 48 Cb 0.09 -4.00 0.00 0.00 -1.15 0.00 0.00 33.47 28.41 1k7b s TRP 48 CO 0.85 -3.74 0.00 0.41 0.02 0.00 0.00 176.95 174.49 1k7b n GLY 49 N 5.59 0.90 1.70 0.98 0.00 -1.26 -4.31 105.19 108.79 1k7b n GLY 49 Ca 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.21 1k7b n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32