#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 -2.29 1.16 0.27 0.00 0.02 -1.26 -4.88 135.00 128.02 1k7b s PRO 12 Ca 0.12 1.45 -0.30 0.00 0.02 0.00 0.00 61.00 62.29 1k7b s PRO 12 Cb -0.01 -1.75 -0.14 0.00 0.02 0.00 0.00 34.50 32.62 1k7b s PRO 12 CO 0.09 -2.50 1.24 -2.30 -0.33 0.00 0.00 177.00 173.19 1k7b n PRO 13 N -4.14 1.76 -1.48 5.54 -0.02 -1.26 -1.97 135.00 133.44 1k7b n PRO 13 Ca 0.11 0.62 -0.11 0.00 -2.02 0.00 0.00 63.50 62.10 1k7b n PRO 13 Cb 0.52 -2.16 -0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1k7b n PRO 13 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k7b n GLY 14 N 1.52 0.97 2.95 -1.23 0.00 -1.26 -5.02 105.19 103.12 1k7b n GLY 14 Ca 0.10 -0.52 -0.24 0.00 0.00 0.00 0.00 46.02 45.36 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 -3.21 1.41 0.38 1.61 -0.21 -0.83 -0.52 119.66 118.29 1k7b s GLN 15 Ca 0.00 -0.28 0.07 0.00 0.02 0.00 0.00 55.36 55.18 1k7b s GLN 15 Cb 0.00 -1.32 -0.07 0.00 1.00 0.00 0.00 33.01 32.62 1k7b s GLN 15 CO 0.00 -0.10 -0.01 -0.59 -2.12 0.00 0.00 175.29 172.47 1k7b s PHE 16 N 1.08 2.40 0.13 0.91 -0.71 -0.36 -4.33 117.98 117.11 1k7b s PHE 16 Ca -0.07 -0.66 0.06 0.00 -1.04 0.00 0.00 56.93 55.22 1k7b s PHE 16 Cb -0.14 -1.60 -0.04 0.00 -1.21 0.00 0.00 43.02 40.03 1k7b s PHE 16 CO -0.01 0.43 -0.02 -0.98 -1.34 0.00 0.00 175.22 173.30 1k7b s ARG 17 N -3.71 2.41 0.00 1.99 1.70 -1.26 -0.32 118.95 119.77 1k7b s ARG 17 Ca 0.34 -1.00 0.00 0.00 -0.47 0.00 0.00 55.73 54.61 1k7b s ARG 17 Cb 0.08 -2.42 0.00 0.00 -0.57 0.00 0.00 34.95 32.04 1k7b s ARG 17 CO 0.17 0.49 0.00 0.00 -1.08 0.00 0.00 175.30 174.88 1k7b n SER 19 N 0.00 4.24 -3.68 0.00 3.41 -1.26 -4.82 113.62 111.51 1k7b n SER 19 Ca 0.00 -3.28 -0.18 0.00 -0.26 0.00 0.00 58.87 55.15 1k7b n SER 19 Cb 0.00 -0.69 -0.17 0.00 -0.26 0.00 0.00 64.21 63.09 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 -3.01 -0.03 0.93 4.33 2.12 -1.26 -5.12 118.70 116.65 1k7b s GLU 20 Ca 0.51 0.42 -0.12 0.00 0.36 0.00 0.00 54.97 56.14 1k7b s GLU 20 Cb 0.42 -0.38 0.15 0.00 0.26 0.00 0.00 34.13 34.57 1k7b s GLU 20 CO 0.10 -0.30 1.11 -1.25 -0.54 0.00 0.00 175.26 174.39 1k7b s PRO 21 N 2.03 1.01 1.06 4.30 0.04 -1.26 -4.98 135.00 137.21 1k7b s PRO 21 Ca 0.02 0.49 -0.12 0.00 0.04 0.00 0.00 61.00 61.42 1k7b s PRO 21 Cb -0.12 -1.81 0.23 0.00 0.04 0.00 0.00 34.50 32.84 1k7b s PRO 21 CO -0.04 -2.33 1.06 -1.25 0.04 0.00 0.00 177.00 174.48 1k7b s PRO 22 N -5.10 -0.11 0.00 0.56 0.04 -1.26 -3.35 135.00 125.78 1k7b s PRO 22 Ca 0.64 0.74 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1k7b s PRO 22 Cb -0.17 -1.66 0.00 0.00 0.04 0.00 0.00 34.50 32.72 1k7b s PRO 22 CO 0.55 -3.15 0.00 0.41 0.04 0.00 0.00 177.00 174.85 1k7b n GLY 23 N -0.16 2.69 2.52 0.56 0.00 -1.26 -4.90 105.19 104.64 1k7b n GLY 23 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 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 0.10 3.04 -0.30 4.61 0.00 -1.21 -5.05 120.51 121.70 1k7b n ALA 24 Ca 0.00 -3.60 0.12 0.00 0.00 0.00 0.00 53.44 49.96 1k7b n ALA 24 Cb 0.00 -0.84 0.35 0.00 0.00 0.00 0.00 19.45 18.96 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 5.36 0.91 -0.45 0.00 -0.00 -1.91 -3.44 115.15 115.62 1k7b h HIS 25 Ca 0.22 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 60.61 1k7b h HIS 25 Cb 0.85 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.98 1k7b h HIS 25 CO 0.41 0.30 0.00 0.41 -0.00 0.00 0.00 177.93 179.05 1k7b n GLY 26 N -1.40 0.95 3.15 2.45 0.00 -1.26 -4.60 105.19 104.48 1k7b n GLY 26 Ca 0.19 -0.72 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 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 2.21 1.44 1.61 0.41 -1.26 -5.10 118.70 118.01 1k7b s GLU 27 Ca 0.00 -1.56 -0.24 0.00 -0.41 0.00 0.00 54.97 52.76 1k7b s GLU 27 Cb 0.00 -3.43 0.37 0.00 -1.78 0.00 0.00 34.13 29.29 1k7b s GLU 27 CO 0.00 -0.87 0.93 0.00 -0.49 0.00 0.00 175.26 174.82 1k7b s TYR 29 N -2.28 0.17 0.61 0.00 2.02 0.57 -4.97 117.35 113.47 1k7b s TYR 29 Ca 0.69 -0.52 -0.20 0.00 -0.37 0.00 0.00 57.07 56.68 1k7b s TYR 29 Cb -0.12 -0.10 -0.03 0.00 -0.40 0.00 0.00 41.96 41.31 1k7b s TYR 29 CO 0.57 -0.45 1.32 -2.14 -1.57 0.00 0.00 175.55 173.29 1k7b s PRO 30 N -3.15 2.79 0.00 -1.71 0.02 -1.26 -1.22 135.00 130.47 1k7b s PRO 30 Ca -0.00 2.13 0.25 0.00 0.02 0.00 0.00 61.00 63.40 1k7b s PRO 30 Cb 0.02 -2.01 1.45 0.00 0.02 0.00 0.00 34.50 33.98 1k7b s PRO 30 CO -0.07 -1.43 1.87 1.04 -0.33 0.00 0.00 177.00 178.07 1k7b n GLN 31 N -1.55 0.69 -0.03 5.54 6.02 0.32 -1.03 117.38 127.33 1k7b n GLN 31 Ca 0.14 0.01 0.02 0.00 -0.01 0.00 0.00 57.00 57.16 1k7b n GLN 31 Cb 0.47 -1.50 0.34 0.00 1.02 0.00 0.00 30.24 30.57 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 0.54 -0.90 1.08 3.58 -1.91 -2.80 116.42 116.01 1k7b h ASP 32 Ca 0.00 -0.05 -0.49 0.00 0.42 0.00 0.00 57.03 56.91 1k7b h ASP 32 Cb 0.06 -0.14 -0.19 0.00 1.72 0.00 0.00 39.33 40.77 1k7b h ASP 32 CO 0.00 0.49 0.57 0.79 -2.88 0.00 0.00 179.24 178.21 1k7b n TRP 33 N -4.38 2.07 -3.75 0.28 7.02 -0.20 -4.08 117.44 114.40 1k7b n TRP 33 Ca 0.03 -2.23 -0.29 0.00 -1.02 0.00 0.00 57.50 53.99 1k7b n TRP 33 Cb 0.14 -1.20 -0.16 0.00 -2.42 0.00 0.00 31.31 27.67 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 -2.58 1.71 -0.90 -0.99 2.96 -1.06 -4.79 118.68 113.03 1k7b s LEU 34 Ca 0.48 -1.19 -0.06 0.00 -0.22 0.00 0.00 54.13 53.14 1k7b s LEU 34 Cb 0.36 -0.75 -0.01 0.00 0.50 0.00 0.00 46.19 46.29 1k7b s LEU 34 CO -0.10 -0.34 0.73 0.00 -1.32 0.00 0.00 176.35 175.31 1k7b n ASP 36 N -2.38 0.53 0.00 0.00 2.03 -1.26 -4.92 116.55 110.55 1k7b n ASP 36 Ca -0.10 0.38 0.00 0.00 0.52 0.00 0.00 54.79 55.59 1k7b n ASP 36 Cb 0.58 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.56 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 1.39 0.72 3.04 0.27 0.00 -1.26 -5.03 105.19 104.32 1k7b n GLY 37 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.52 -0.41 0.57 1.61 5.04 -1.26 -5.17 115.29 113.16 1k7b s HIS 38 Ca 0.00 0.93 -0.17 0.00 -1.54 0.00 0.00 55.06 54.28 1k7b s HIS 38 Cb 0.00 0.02 -0.04 0.00 0.04 0.00 0.00 32.58 32.59 1k7b s HIS 38 CO 0.00 -0.31 1.08 -1.25 -2.34 0.00 0.00 174.74 171.92 1k7b s PRO 39 N 1.96 3.31 0.00 2.88 0.04 -1.26 -4.81 135.00 137.12 1k7b s PRO 39 Ca -0.03 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.39 1k7b s PRO 39 Cb -0.11 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.41 1k7b s PRO 39 CO -0.09 -0.84 0.14 -3.47 0.04 0.00 0.00 177.00 172.77 1k7b n ASP 40 N -1.71 0.00 -0.01 6.66 -0.08 -1.26 -4.92 116.55 115.23 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 0.00 0.00 2.34 0.00 0.00 41.12 43.98 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 -0.49 0.00 0.00 0.00 2.03 -1.26 -4.15 116.55 112.68 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 -1.00 0.00 0.00 -0.72 0.00 0.00 41.12 39.40 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 0.26 -0.63 1.67 2.03 -1.26 -5.01 116.55 113.60 1k7b n ASP 43 Ca 0.00 -0.60 -0.08 0.00 0.52 0.00 0.00 54.79 54.63 1k7b n ASP 43 Cb 0.00 0.57 -0.04 0.00 -0.72 0.00 0.00 41.12 40.94 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 0.57 0.91 0.00 0.27 0.00 -1.26 -4.89 105.19 100.80 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 -1.53 0.80 0.10 1.61 1.85 -1.26 -1.49 116.66 116.74 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 0.43 -1.29 0.01 0.00 -1.05 0.00 0.00 32.46 30.56 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 0.00 0.69 2.89 2.03 -1.90 -3.30 116.42 116.83 1k7b h ASP 46 Ca 0.00 0.00 -0.24 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 0.81 -1.08 -0.33 -1.03 0.00 0.00 179.24 177.61 1k7b h GLU 47 N 0.00 0.20 -6.10 4.15 4.39 -1.58 -0.76 114.58 114.89 1k7b h GLU 47 Ca -0.01 -0.30 -0.58 0.00 0.34 0.00 0.00 59.36 58.81 1k7b h GLU 47 Cb 1.48 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 30.22 1k7b h GLU 47 CO 0.11 1.10 1.41 -1.58 -1.16 0.00 0.00 179.01 178.88 1k7b s TRP 48 N -2.83 1.39 0.00 4.33 0.52 -1.23 -1.50 118.94 119.61 1k7b s TRP 48 Ca -0.03 0.53 0.00 0.00 0.02 0.00 0.00 56.10 56.62 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 0.86 -3.77 0.00 0.41 0.02 0.00 0.00 176.95 174.47 1k7b n GLY 49 N 5.59 0.92 2.23 0.98 0.00 -1.26 -4.31 105.19 109.33 1k7b n GLY 49 Ca 0.27 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.23 1k7b n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32