#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k7b n PRO 12 N 0.00 -1.39 -2.04 0.00 -0.02 -1.26 -4.93 135.00 125.36 1k7b n PRO 12 Ca 0.00 -0.36 -0.38 0.00 -2.02 0.00 0.00 63.50 60.74 1k7b n PRO 12 Cb 0.00 -2.22 0.01 0.00 -0.02 0.00 0.00 33.50 31.26 1k7b n PRO 12 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1k7b s PRO 13 N -4.42 3.66 -1.56 0.52 0.04 -1.26 -2.45 135.00 129.53 1k7b s PRO 13 Ca 0.67 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.76 1k7b s PRO 13 Cb -0.23 -2.50 0.00 0.00 0.04 0.00 0.00 34.50 31.81 1k7b s PRO 13 CO 0.62 -0.71 0.00 0.41 0.04 0.00 0.00 177.00 177.36 1k7b n GLY 14 N 0.61 1.10 2.98 0.56 0.00 -1.26 -5.02 105.19 104.16 1k7b n GLY 14 Ca 0.07 -0.28 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 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 -3.68 1.03 0.20 1.61 -0.21 -1.03 -0.64 119.66 116.94 1k7b s GLN 15 Ca 0.00 -0.28 0.06 0.00 0.02 0.00 0.00 55.36 55.16 1k7b s GLN 15 Cb 0.00 -0.95 -0.05 0.00 1.00 0.00 0.00 33.01 33.01 1k7b s GLN 15 CO 0.00 0.07 -0.10 -0.59 -2.12 0.00 0.00 175.29 172.54 1k7b s PHE 16 N 0.38 1.56 -0.06 0.91 -0.71 -0.31 -4.31 117.98 115.45 1k7b s PHE 16 Ca -0.06 -0.69 -0.05 0.00 -1.04 0.00 0.00 56.93 55.09 1k7b s PHE 16 Cb -0.11 -0.79 -0.04 0.00 -1.21 0.00 0.00 43.02 40.88 1k7b s PHE 16 CO 0.01 0.21 0.16 -0.98 -1.34 0.00 0.00 175.22 173.28 1k7b s ARG 17 N -3.71 3.44 0.00 1.99 1.70 -1.26 -0.60 118.95 120.51 1k7b s ARG 17 Ca 0.22 -0.23 0.00 0.00 -0.47 0.00 0.00 55.73 55.24 1k7b s ARG 17 Cb 0.02 -3.14 0.00 0.00 -0.57 0.00 0.00 34.95 31.26 1k7b s ARG 17 CO 0.05 0.72 0.00 0.00 -1.08 0.00 0.00 175.30 175.00 1k7b n SER 19 N -0.04 2.23 -3.69 0.00 7.64 -1.26 -4.87 113.62 113.63 1k7b n SER 19 Ca 0.00 -3.84 -0.19 0.00 1.01 0.00 0.00 58.87 55.85 1k7b n SER 19 Cb 0.00 -0.61 -0.18 0.00 -1.01 0.00 0.00 64.21 62.42 1k7b n SER 19 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1k7b s GLU 20 N -3.26 -0.07 0.91 1.43 2.12 -1.26 -5.10 118.70 113.48 1k7b s GLU 20 Ca 0.43 0.35 -0.12 0.00 0.36 0.00 0.00 54.97 55.99 1k7b s GLU 20 Cb 0.40 -0.47 0.14 0.00 0.26 0.00 0.00 34.13 34.45 1k7b s GLU 20 CO -0.03 -0.31 1.11 -1.25 -0.54 0.00 0.00 175.26 174.25 1k7b s PRO 21 N 2.01 1.11 1.06 4.30 0.04 -1.26 -4.98 135.00 137.27 1k7b s PRO 21 Ca 0.03 0.53 -0.12 0.00 0.04 0.00 0.00 61.00 61.48 1k7b s PRO 21 Cb -0.12 -1.82 0.22 0.00 0.04 0.00 0.00 34.50 32.83 1k7b s PRO 21 CO -0.03 -2.27 1.07 -1.25 0.04 0.00 0.00 177.00 174.56 1k7b s PRO 22 N -5.09 -0.08 0.00 0.56 0.04 -1.26 -3.30 135.00 125.87 1k7b s PRO 22 Ca 0.64 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.41 1k7b s PRO 22 Cb -0.17 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1k7b s PRO 22 CO 0.56 -3.13 0.00 0.41 0.04 0.00 0.00 177.00 174.87 1k7b n GLY 23 N -0.20 2.64 2.62 0.56 0.00 -1.26 -4.88 105.19 104.67 1k7b n GLY 23 Ca 0.05 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 0.12 3.32 -0.32 4.61 0.00 -1.21 -5.03 120.51 122.00 1k7b n ALA 24 Ca 0.00 -4.14 0.12 0.00 0.00 0.00 0.00 53.44 49.43 1k7b n ALA 24 Cb 0.00 -0.92 0.34 0.00 0.00 0.00 0.00 19.45 18.87 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 5.07 0.96 0.00 0.00 -0.00 -1.90 -3.44 115.15 115.84 1k7b h HIS 25 Ca 0.18 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.58 1k7b h HIS 25 Cb 0.78 -0.30 0.00 0.00 -0.00 0.00 0.00 27.41 27.90 1k7b h HIS 25 CO 0.56 0.29 0.00 0.41 -0.00 0.00 0.00 177.93 179.19 1k7b n GLY 26 N -1.38 2.58 3.32 2.45 0.00 -1.26 -4.84 105.19 106.06 1k7b n GLY 26 Ca 0.21 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 1k7b n GLY 26 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1k7b s GLU 27 N 0.00 1.21 0.30 1.61 1.03 -1.26 -5.19 118.70 116.39 1k7b s GLU 27 Ca 0.00 -1.34 0.00 0.00 0.03 0.00 0.00 54.97 53.66 1k7b s GLU 27 Cb 0.00 0.35 0.00 0.00 -0.80 0.00 0.00 34.13 33.68 1k7b s GLU 27 CO 0.00 -0.43 0.02 0.00 -1.33 0.00 0.00 175.26 173.52 1k7b s TYR 29 N -2.02 0.30 0.62 0.00 2.02 0.24 -4.97 117.35 113.54 1k7b s TYR 29 Ca 0.02 -0.68 -0.19 0.00 -0.37 0.00 0.00 57.07 55.85 1k7b s TYR 29 Cb -0.00 -0.22 -0.02 0.00 -0.40 0.00 0.00 41.96 41.32 1k7b s TYR 29 CO 0.01 -0.34 1.28 -2.30 -1.57 0.00 0.00 175.55 172.62 1k7b n PRO 30 N 0.70 1.24 0.00 -1.71 -0.02 -1.26 -1.17 135.00 132.78 1k7b n PRO 30 Ca -0.18 0.48 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 1k7b n PRO 30 Cb 0.59 -2.51 0.73 0.00 -0.02 0.00 0.00 33.50 32.29 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 -1.60 0.68 -0.05 -0.52 6.02 0.19 -1.03 117.38 121.08 1k7b n GLN 31 Ca 0.14 0.01 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 30.55 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 -0.77 1.08 3.58 -1.91 -2.80 116.42 116.17 1k7b h ASP 32 Ca 0.00 -0.06 -0.45 0.00 0.42 0.00 0.00 57.03 56.95 1k7b h ASP 32 Cb 0.07 -0.15 -0.18 0.00 1.72 0.00 0.00 39.33 40.79 1k7b h ASP 32 CO 0.00 0.51 0.52 0.79 -2.88 0.00 0.00 179.24 178.19 1k7b n TRP 33 N -4.37 1.92 -3.73 0.28 7.02 -0.20 -3.99 117.44 114.36 1k7b n TRP 33 Ca 0.03 -2.17 -0.29 0.00 -1.02 0.00 0.00 57.50 54.06 1k7b n TRP 33 Cb 0.14 -1.16 -0.16 0.00 -2.42 0.00 0.00 31.31 27.72 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 -2.36 1.69 -0.86 -0.99 2.96 -1.06 -4.79 118.68 113.28 1k7b s LEU 34 Ca 0.44 -1.25 -0.04 0.00 -0.22 0.00 0.00 54.13 53.07 1k7b s LEU 34 Cb 0.33 -0.73 -0.01 0.00 0.50 0.00 0.00 46.19 46.28 1k7b s LEU 34 CO -0.07 -0.36 0.71 0.00 -1.32 0.00 0.00 176.35 175.30 1k7b n ASP 36 N -2.27 0.59 0.00 0.00 2.03 -1.26 -4.93 116.55 110.72 1k7b n ASP 36 Ca -0.11 0.32 0.00 0.00 0.52 0.00 0.00 54.79 55.52 1k7b n ASP 36 Cb 0.58 -0.31 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 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 1.38 0.71 3.04 0.27 0.00 -1.26 -5.03 105.19 104.29 1k7b n GLY 37 Ca 0.05 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 -2.48 -0.41 0.59 1.61 5.04 -1.26 -5.17 115.29 113.21 1k7b s HIS 38 Ca 0.00 0.95 -0.17 0.00 -1.54 0.00 0.00 55.06 54.30 1k7b s HIS 38 Cb 0.00 0.01 -0.03 0.00 0.04 0.00 0.00 32.58 32.59 1k7b s HIS 38 CO 0.00 -0.32 1.09 -1.25 -2.34 0.00 0.00 174.74 171.91 1k7b s PRO 39 N 2.06 3.20 0.00 2.88 0.05 -1.26 -4.81 135.00 137.13 1k7b s PRO 39 Ca -0.02 1.36 0.00 0.00 0.05 0.00 0.00 61.00 62.39 1k7b s PRO 39 Cb -0.11 -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 0.00 177.00 172.67 1k7b n ASP 40 N -1.91 0.00 0.00 6.66 -0.08 -1.26 -4.92 116.55 115.04 1k7b n ASP 40 Ca 0.10 -1.00 0.01 0.00 -1.51 0.00 0.00 54.79 52.39 1k7b n ASP 40 Cb 0.52 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.03 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 -0.53 0.00 0.00 0.00 2.03 -1.26 -4.20 116.55 112.59 1k7b n ASP 42 Ca 0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.32 1k7b n ASP 42 Cb 0.01 -1.20 0.00 0.00 -0.72 0.00 0.00 41.12 39.20 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 0.36 -0.61 1.67 2.03 -1.26 -5.02 116.55 113.73 1k7b n ASP 43 Ca 0.00 -0.68 -0.08 0.00 0.52 0.00 0.00 54.79 54.55 1k7b n ASP 43 Cb 0.00 0.35 -0.03 0.00 -0.72 0.00 0.00 41.12 40.72 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 0.35 0.89 0.00 0.27 0.00 -1.26 -4.88 105.19 100.55 1k7b n GLY 44 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.47 0.81 0.09 1.61 1.85 -1.26 -1.49 116.66 116.80 1k7b n ARG 45 Ca -0.08 0.00 -0.05 0.00 -1.00 0.00 0.00 57.85 56.72 1k7b n ARG 45 Cb 0.42 -1.26 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 0.71 2.89 2.03 -1.90 -3.30 116.42 116.86 1k7b h ASP 46 Ca 0.00 -0.01 -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 0.84 -1.03 -0.33 -1.03 0.00 0.00 179.24 177.69 1k7b h GLU 47 N 0.00 0.17 -6.10 4.15 4.39 -1.58 -0.74 114.58 114.87 1k7b h GLU 47 Ca -0.01 -0.24 -0.58 0.00 0.34 0.00 0.00 59.36 58.87 1k7b h GLU 47 Cb 1.47 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 30.20 1k7b h GLU 47 CO 0.11 1.05 1.40 -1.58 -1.16 0.00 0.00 179.01 178.84 1k7b s TRP 48 N -2.89 1.39 0.00 4.33 0.52 -1.24 -1.56 118.94 119.50 1k7b s TRP 48 Ca -0.02 0.52 0.00 0.00 0.02 0.00 0.00 56.10 56.61 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 0.84 -3.79 0.00 0.41 0.02 0.00 0.00 176.95 174.44 1k7b n GLY 49 N 5.56 0.74 3.31 0.98 0.00 -1.26 -4.27 105.19 110.25 1k7b n GLY 49 Ca 0.27 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.10 1k7b n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32