#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r7f n GLY 2 N 0.00 -1.13 3.72 0.23 0.00 -1.26 -4.92 105.19 101.83 1r7f n GLY 2 Ca 0.00 0.26 -0.28 0.00 0.00 0.00 0.00 46.02 46.00 1r7f n GLY 2 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r7f n SER 3 N 0.00 -4.30 -0.27 1.61 7.64 -1.26 -4.89 113.62 112.15 1r7f n SER 3 Ca 0.00 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.23 1r7f n SER 3 Cb 0.00 -3.48 0.00 0.00 -1.01 0.00 0.00 64.21 59.72 1r7f n SER 3 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 1r7f n TRP 4 N -4.37 -0.25 -2.33 1.43 -0.00 -1.26 -4.96 117.44 105.70 1r7f n TRP 4 Ca 0.02 0.00 -0.18 0.00 -0.00 0.00 0.00 57.50 57.34 1r7f n TRP 4 Cb 0.53 0.00 -0.02 0.00 -0.00 0.00 0.00 31.31 31.82 1r7f n TRP 4 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1r7f n LEU 5 N 0.00 -1.64 -0.08 5.87 4.32 -1.26 -4.85 117.00 119.36 1r7f n LEU 5 Ca 0.00 0.09 -0.20 0.00 -0.02 0.00 0.00 56.01 55.89 1r7f n LEU 5 Cb 0.00 -2.66 -0.13 0.00 -1.62 0.00 0.00 43.42 39.02 1r7f n LEU 5 CO 0.00 -0.26 -1.13 -1.14 -1.22 0.00 0.00 177.39 173.64 1r7f n ARG 6 N -2.87 0.69 0.02 3.23 0.63 -1.26 -4.44 116.66 112.65 1r7f n ARG 6 Ca -0.21 0.21 0.11 0.00 -0.92 0.00 0.00 57.85 57.04 1r7f n ARG 6 Cb 0.66 -1.59 -0.11 0.00 0.45 0.00 0.00 32.46 31.86 1r7f n ARG 6 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1r7f n ASP 7 N -3.41 0.31 0.25 6.15 -0.08 -1.26 -4.24 116.55 114.27 1r7f n ASP 7 Ca -0.41 0.00 0.08 0.00 -1.51 0.00 0.00 54.79 52.96 1r7f n ASP 7 Cb 1.00 1.48 0.61 0.00 2.34 0.00 0.00 41.12 46.55 1r7f n ASP 7 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 1r7f h ILE 8 N 0.00 0.96 -0.08 5.18 2.10 -1.96 -2.12 117.51 121.60 1r7f h ILE 8 Ca 0.00 -0.38 -0.21 0.00 1.08 0.00 0.00 64.86 65.35 1r7f h ILE 8 Cb 0.95 1.21 0.01 0.00 -1.09 0.00 0.00 36.82 37.90 1r7f h ILE 8 CO 0.00 0.10 -0.79 -0.50 -1.08 0.00 0.00 178.15 175.88 1r7f h TRP 9 N 0.00 0.94 -0.29 2.19 6.55 -1.78 -2.87 115.95 120.69 1r7f h TRP 9 Ca -0.00 -0.46 -0.02 0.00 0.95 0.00 0.00 58.89 59.36 1r7f h TRP 9 Cb 0.20 -0.13 -0.01 0.00 -0.86 0.00 0.00 29.16 28.36 1r7f h TRP 9 CO 0.00 1.28 0.12 0.22 -1.05 0.00 0.00 178.44 179.01 1r7f h ASP 10 N 0.33 0.40 -0.70 -3.49 3.58 -1.66 -0.95 116.42 113.95 1r7f h ASP 10 Ca -0.08 -0.16 0.02 0.00 0.42 0.00 0.00 57.03 57.23 1r7f h ASP 10 Cb 1.44 -0.10 -0.04 0.00 1.72 0.00 0.00 39.33 42.35 1r7f h ASP 10 CO 0.16 0.45 0.46 4.11 -2.88 0.00 0.00 179.24 181.54 1r7f h TRP 11 N 0.33 0.86 -0.21 0.28 5.08 -1.46 -1.73 115.95 119.09 1r7f h TRP 11 Ca 0.10 0.02 -0.18 0.00 1.08 0.00 0.00 58.89 59.91 1r7f h TRP 11 Cb 0.18 -0.29 -0.00 0.00 -3.00 0.00 0.00 29.16 26.05 1r7f h TRP 11 CO -0.01 0.53 -0.59 0.82 -1.28 0.00 0.00 178.44 177.91 1r7f h ILE 12 N 0.91 1.30 -0.43 0.12 1.08 -1.24 -3.10 117.51 116.15 1r7f h ILE 12 Ca 0.26 -1.83 -0.05 0.00 -0.39 0.00 0.00 64.86 62.85 1r7f h ILE 12 Cb -0.06 1.78 -0.02 0.00 -3.07 0.00 0.00 36.82 35.45 1r7f h ILE 12 CO -0.06 0.58 0.05 0.00 -0.69 0.00 0.00 178.15 178.02 1r7f h GLU 14 N 0.64 1.00 0.00 0.00 4.81 -1.27 -1.97 114.58 117.79 1r7f h GLU 14 Ca 0.14 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 59.13 1r7f h GLU 14 Cb 0.33 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 1r7f h GLU 14 CO 0.01 0.66 -0.96 0.28 -0.73 0.00 0.00 179.01 178.26 1r7f h VAL 15 N 1.03 1.15 -0.73 0.32 2.07 -1.49 -3.32 116.25 115.27 1r7f h VAL 15 Ca 0.31 -2.72 -0.00 0.00 0.82 0.00 0.00 66.70 65.11 1r7f h VAL 15 Cb -0.03 2.54 -0.04 0.00 -1.52 0.00 0.00 31.29 32.24 1r7f h VAL 15 CO -0.10 0.65 0.45 0.25 0.02 0.00 0.00 177.57 178.85 1r7f h LEU 16 N 0.00 0.86 -0.79 2.57 5.85 -0.05 -1.57 115.31 122.17 1r7f h LEU 16 Ca -0.06 -0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.56 1r7f h LEU 16 Cb 1.64 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.42 1r7f h LEU 16 CO 0.09 0.66 0.31 0.77 -0.34 0.00 0.00 178.44 179.93 1r7f h SER 17 N 0.99 1.10 -0.81 1.25 4.64 -1.48 0.20 113.55 119.44 1r7f h SER 17 Ca 0.26 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.39 1r7f h SER 17 Cb -0.06 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 61.71 1r7f h SER 17 CO -0.05 0.97 0.45 -0.78 -0.87 0.00 0.00 176.83 176.55 1r7f h ASP 18 N 1.15 1.02 -0.08 4.97 1.82 -1.54 -1.65 116.42 122.11 1r7f h ASP 18 Ca 0.26 -0.10 -0.15 0.00 -0.39 0.00 0.00 57.03 56.66 1r7f h ASP 18 Cb 0.22 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.97 1r7f h ASP 18 CO -0.02 0.82 -0.47 0.15 -1.61 0.00 0.00 179.24 178.11 1r7f h PHE 19 N 1.13 0.77 -0.63 0.28 3.57 -0.74 -2.85 116.94 118.47 1r7f h PHE 19 Ca 0.29 -0.25 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1r7f h PHE 19 Cb 0.03 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 1r7f h PHE 19 CO 0.00 0.99 0.40 -0.22 -2.23 0.00 0.00 178.31 177.25 1r7f h LYS 20 N 0.51 0.78 -0.59 1.11 1.63 -0.01 0.24 116.57 120.24 1r7f h LYS 20 Ca 0.03 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.77 1r7f h LYS 20 Cb 1.01 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 32.44 1r7f h LYS 20 CO 0.09 0.52 0.33 1.15 -3.45 0.00 0.00 179.45 178.09 1r7f h THR 21 N 0.80 1.19 -0.55 1.00 2.02 -1.23 -0.48 112.91 115.66 1r7f h THR 21 Ca 0.25 -0.46 -0.10 0.00 0.77 0.00 0.00 66.41 66.87 1r7f h THR 21 Cb -0.03 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 1r7f h THR 21 CO -0.08 0.20 -0.04 -0.25 0.37 0.00 0.00 175.52 175.72 1r7f h TRP 22 N 0.79 1.05 -0.50 3.16 7.01 -1.17 -2.71 115.95 123.59 1r7f h TRP 22 Ca 0.21 -0.18 -0.08 0.00 2.11 0.00 0.00 58.89 60.95 1r7f h TRP 22 Cb 0.03 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 26.79 1r7f h TRP 22 CO -0.01 0.96 0.00 -0.07 -2.79 0.00 0.00 178.44 176.52 1r7f h LEU 23 N 0.88 0.81 -0.68 0.65 -0.00 -0.08 -2.43 115.31 114.46 1r7f h LEU 23 Ca 0.15 -0.20 -0.05 0.00 -0.00 0.00 0.00 57.88 57.79 1r7f h LEU 23 Cb 0.57 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.98 1r7f h LEU 23 CO 0.03 0.87 0.24 0.50 -0.00 0.00 0.00 178.44 180.08 1r7f h LYS 24 N 0.78 1.03 -0.46 1.13 1.63 -0.86 0.21 116.57 120.04 1r7f h LYS 24 Ca 0.15 -0.21 -0.07 0.00 -0.85 0.00 0.00 60.65 59.67 1r7f h LYS 24 Cb 0.47 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 1r7f h LYS 24 CO 0.02 0.88 -0.00 0.00 -3.45 0.00 0.00 179.45 176.90 1r7f h ALA 25 N 1.10 1.14 -0.00 5.00 0.00 -1.25 -2.25 119.26 123.01 1r7f h ALA 25 Ca 0.22 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1r7f h ALA 25 Cb 0.26 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1r7f h ALA 25 CO -0.01 0.55 -0.22 1.17 0.00 0.00 0.00 179.25 180.74 1r7f n LYS 26 N -4.22 0.56 -1.34 0.00 4.81 -0.93 -5.03 118.16 112.00 1r7f n LYS 26 Ca 0.02 -0.26 0.00 0.00 -0.87 0.00 0.00 58.31 57.20 1r7f n LYS 26 Cb 0.29 -1.49 0.00 0.00 0.02 0.00 0.00 35.03 33.85 1r7f n LYS 26 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1r7f n LEU 27 N -0.99 -4.07 -4.57 3.14 -0.00 0.70 -4.92 117.00 106.29 1r7f n LEU 27 Ca 0.11 1.60 -0.42 0.00 -0.00 0.00 0.00 56.01 57.30 1r7f n LEU 27 Cb 0.32 -2.08 -0.06 0.00 -0.00 0.00 0.00 43.42 41.60 1r7f n LEU 27 CO 0.27 -0.96 0.43 -0.04 -0.00 0.00 0.00 177.39 177.09 1r7f s MET 28 N -1.75 3.69 0.51 1.96 -1.94 -1.23 -4.94 119.30 115.60 1r7f s MET 28 Ca 0.00 0.11 -0.09 0.00 -1.71 0.00 0.00 55.69 54.01 1r7f s MET 28 Cb 0.00 -3.81 0.12 0.00 2.01 0.00 0.00 34.83 33.15 1r7f s MET 28 CO 0.00 -0.77 0.58 -0.35 -0.01 0.00 0.00 175.02 174.48 1r7f n PRO 29 N 6.13 -1.17 -2.11 2.03 -0.04 -1.26 -4.91 135.00 133.67 1r7f n PRO 29 Ca -0.00 -0.91 -0.42 0.00 -0.04 0.00 0.00 63.50 62.13 1r7f n PRO 29 Cb 0.48 -0.69 -0.03 0.00 -0.04 0.00 0.00 33.50 33.22 1r7f n PRO 29 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1r7f s GLN 30 N -4.29 3.18 0.00 0.54 2.00 -1.26 -5.28 119.66 114.56 1r7f s GLN 30 Ca 0.35 1.03 0.02 0.00 -2.00 0.00 0.00 55.36 54.76 1r7f s GLN 30 Cb -0.02 -4.21 0.01 0.00 0.80 0.00 0.00 33.01 29.59 1r7f s GLN 30 CO 0.25 -2.05 0.56 -0.11 -0.50 0.00 0.00 175.29 173.44