#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 0.53 1.21 0.23 0.00 -1.26 -4.71 105.19 101.19 1r7f n GLY 2 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 3.34 0.78 -1.86 1.61 7.64 -1.26 -5.15 113.62 118.72 1r7f n SER 3 Ca 0.00 0.18 -0.05 0.00 1.01 0.00 0.00 58.87 60.01 1r7f n SER 3 Cb 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 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 -3.38 -1.40 -2.03 1.43 -0.00 -1.26 -4.94 117.44 105.86 1r7f n TRP 4 Ca 0.00 -0.94 -0.19 0.00 -0.00 0.00 0.00 57.50 56.37 1r7f n TRP 4 Cb 0.00 0.37 -0.04 0.00 -0.00 0.00 0.00 31.31 31.64 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 -1.60 -0.04 5.87 4.32 -1.26 -4.87 117.00 119.42 1r7f n LEU 5 Ca -0.03 0.22 -0.15 0.00 -0.02 0.00 0.00 56.01 56.04 1r7f n LEU 5 Cb 0.28 -2.72 -0.08 0.00 -1.62 0.00 0.00 43.42 39.27 1r7f n LEU 5 CO 0.13 -0.55 0.44 -0.09 -1.22 0.00 0.00 177.39 176.10 1r7f h ARG 6 N 0.00 0.44 0.00 3.23 1.12 -1.92 -3.26 114.38 113.99 1r7f h ARG 6 Ca -0.42 -0.33 -0.19 0.00 -1.11 0.00 0.00 59.98 57.92 1r7f h ARG 6 Cb 1.29 0.06 -0.04 0.00 -0.01 0.00 0.00 29.97 31.28 1r7f h ARG 6 CO 0.55 0.95 -1.80 -3.47 -3.11 0.00 0.00 179.97 173.09 1r7f n ASP 7 N -4.35 0.46 -0.24 -3.80 2.03 -1.26 -3.65 116.55 105.73 1r7f n ASP 7 Ca -0.08 0.20 0.05 0.00 0.52 0.00 0.00 54.79 55.49 1r7f n ASP 7 Cb 0.52 0.73 0.30 0.00 -0.72 0.00 0.00 41.12 41.95 1r7f n ASP 7 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 1r7f h ILE 8 N 0.00 1.04 0.10 5.18 -0.00 -1.96 0.77 117.51 122.64 1r7f h ILE 8 Ca -0.24 -0.31 -0.28 0.00 -0.00 0.00 0.00 64.86 64.04 1r7f h ILE 8 Cb 1.67 0.07 -0.01 0.00 -0.00 0.00 0.00 36.82 38.55 1r7f h ILE 8 CO 0.03 0.16 -1.33 -0.50 -0.00 0.00 0.00 178.15 176.51 1r7f h TRP 9 N 0.89 0.38 -0.16 2.19 6.55 -1.73 -3.11 115.95 120.96 1r7f h TRP 9 Ca 0.35 -0.27 -0.05 0.00 0.95 0.00 0.00 58.89 59.87 1r7f h TRP 9 Cb 0.23 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 28.51 1r7f h TRP 9 CO -0.00 1.26 -0.08 0.22 -1.05 0.00 0.00 178.44 178.79 1r7f h ASP 10 N 0.06 0.35 -0.85 -3.49 3.58 -1.40 -1.99 116.42 112.68 1r7f h ASP 10 Ca -0.16 -0.41 0.06 0.00 0.42 0.00 0.00 57.03 56.94 1r7f h ASP 10 Cb 1.96 -0.10 -0.05 0.00 1.72 0.00 0.00 39.33 42.86 1r7f h ASP 10 CO 0.17 0.68 0.55 4.11 -2.88 0.00 0.00 179.24 181.88 1r7f h TRP 11 N 0.01 0.95 -0.37 0.28 5.08 0.41 -0.89 115.95 121.42 1r7f h TRP 11 Ca 0.04 0.02 -0.12 0.00 1.08 0.00 0.00 58.89 59.91 1r7f h TRP 11 Cb 0.55 -0.31 -0.01 0.00 -3.00 0.00 0.00 29.16 26.39 1r7f h TRP 11 CO 0.07 0.50 -0.26 0.82 -1.28 0.00 0.00 178.44 178.28 1r7f h ILE 12 N 0.94 1.27 -0.71 0.12 1.08 -1.45 -2.49 117.51 116.27 1r7f h ILE 12 Ca 0.36 -1.39 -0.06 0.00 -0.39 0.00 0.00 64.86 63.38 1r7f h ILE 12 Cb 0.22 1.27 -0.03 0.00 -3.07 0.00 0.00 36.82 35.21 1r7f h ILE 12 CO -0.13 0.46 0.20 0.00 -0.69 0.00 0.00 178.15 177.99 1r7f h GLU 14 N 1.07 0.03 0.00 0.00 4.57 -1.16 0.12 114.58 119.21 1r7f h GLU 14 Ca 0.23 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.30 1r7f h GLU 14 Cb 0.33 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 1r7f h GLU 14 CO -0.00 0.34 -0.46 -0.24 -1.18 0.00 0.00 179.01 177.46 1r7f h VAL 15 N -0.27 1.19 0.08 0.32 3.04 -1.37 -3.13 116.25 116.10 1r7f h VAL 15 Ca 0.01 -1.65 -0.26 0.00 -1.01 0.00 0.00 66.70 63.78 1r7f h VAL 15 Cb 0.32 1.93 -0.01 0.00 -2.01 0.00 0.00 31.29 31.52 1r7f h VAL 15 CO 0.00 0.45 -1.25 0.25 -1.01 0.00 0.00 177.57 176.01 1r7f h LEU 16 N 0.00 0.27 -0.37 3.16 5.85 -0.60 -3.23 115.31 120.38 1r7f h LEU 16 Ca -0.00 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.43 1r7f h LEU 16 Cb 0.89 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1r7f h LEU 16 CO 0.06 1.25 0.19 0.28 -0.34 0.00 0.00 178.44 179.88 1r7f h SER 17 N 0.05 0.30 -0.53 1.25 0.02 -0.70 0.86 113.55 114.80 1r7f h SER 17 Ca -0.13 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 1r7f h SER 17 Cb 1.92 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 64.39 1r7f h SER 17 CO 0.17 0.22 0.30 -0.78 -1.14 0.00 0.00 176.83 175.59 1r7f h ASP 18 N 0.40 0.65 0.53 3.07 3.58 -1.67 -1.20 116.42 121.78 1r7f h ASP 18 Ca 0.15 -0.08 -0.09 0.00 0.42 0.00 0.00 57.03 57.43 1r7f h ASP 18 Cb 0.05 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 1r7f h ASP 18 CO -0.10 0.54 -0.44 0.15 -2.88 0.00 0.00 179.24 176.52 1r7f h PHE 19 N 0.71 0.00 -0.11 0.28 3.57 -1.44 -2.79 116.94 117.16 1r7f h PHE 19 Ca 0.19 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 1r7f h PHE 19 Cb 0.03 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1r7f h PHE 19 CO -0.02 0.44 -0.08 -0.22 -2.23 0.00 0.00 178.31 176.20 1r7f h LYS 20 N 0.00 0.25 -0.80 1.11 1.63 0.15 -1.27 116.57 117.65 1r7f h LYS 20 Ca -0.00 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.67 1r7f h LYS 20 Cb 0.83 -0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.42 1r7f h LYS 20 CO 0.06 0.64 0.50 1.15 -3.45 0.00 0.00 179.45 178.34 1r7f h THR 21 N -0.12 1.22 -0.34 1.00 2.02 -1.21 0.46 112.91 115.94 1r7f h THR 21 Ca 0.02 -0.45 -0.03 0.00 0.77 0.00 0.00 66.41 66.72 1r7f h THR 21 Cb 0.57 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1r7f h THR 21 CO 0.02 0.22 0.09 -0.25 0.37 0.00 0.00 175.52 175.97 1r7f h TRP 22 N 1.09 0.56 -0.19 3.16 7.01 -1.46 -0.25 115.95 125.87 1r7f h TRP 22 Ca 0.29 -0.06 -0.08 0.00 2.11 0.00 0.00 58.89 61.14 1r7f h TRP 22 Cb -0.07 -0.16 -0.00 0.00 -2.10 0.00 0.00 29.16 26.83 1r7f h TRP 22 CO -0.01 0.57 -0.20 -0.07 -2.79 0.00 0.00 178.44 175.94 1r7f h LEU 23 N 0.39 0.51 -1.04 0.65 3.38 -0.86 -2.70 115.31 115.64 1r7f h LEU 23 Ca 0.11 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 1r7f h LEU 23 Cb 0.28 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1r7f h LEU 23 CO -0.00 0.88 0.39 0.50 0.09 0.00 0.00 178.44 180.30 1r7f h LYS 24 N 0.14 1.07 -0.53 1.13 3.11 -0.05 0.23 116.57 121.67 1r7f h LYS 24 Ca 0.03 -0.13 -0.06 0.00 -2.81 0.00 0.00 60.65 57.68 1r7f h LYS 24 Cb 0.74 -0.21 -0.02 0.00 -1.00 0.00 0.00 32.23 31.74 1r7f h LYS 24 CO 0.05 0.80 0.10 0.00 -2.81 0.00 0.00 179.45 177.59 1r7f h ALA 25 N 1.36 1.17 0.06 5.00 0.00 -1.00 0.18 119.26 126.03 1r7f h ALA 25 Ca 0.27 -0.22 -0.24 0.00 0.00 0.00 0.00 54.91 54.72 1r7f h ALA 25 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1r7f h ALA 25 CO -0.04 0.56 -1.09 -0.22 0.00 0.00 0.00 179.25 178.46 1r7f h LYS 26 N 0.80 0.14 -0.00 0.00 3.11 -1.06 -3.33 116.57 116.23 1r7f h LYS 26 Ca 0.17 -0.22 -0.08 0.00 -2.81 0.00 0.00 60.65 57.70 1r7f h LYS 26 Cb 0.34 0.08 0.01 0.00 -1.00 0.00 0.00 32.23 31.66 1r7f h LYS 26 CO 0.00 1.09 -0.32 -0.07 -2.81 0.00 0.00 179.45 177.34 1r7f h LEU 27 N 0.04 0.29 -0.42 5.20 -0.00 -0.29 -3.50 115.31 116.63 1r7f h LEU 27 Ca -0.07 -0.77 0.27 0.00 -0.00 0.00 0.00 57.88 57.32 1r7f h LEU 27 Cb 1.82 -0.09 -0.13 0.00 -0.00 0.00 0.00 40.66 42.26 1r7f h LEU 27 CO 0.16 1.02 -0.88 0.23 -0.00 0.00 0.00 178.44 178.97 1r7f n MET 28 N -4.45 -2.51 -1.30 1.13 2.81 0.60 -4.95 117.12 108.46 1r7f n MET 28 Ca -0.10 1.99 -0.21 0.00 -1.81 0.00 0.00 57.70 57.57 1r7f n MET 28 Cb 0.54 -2.95 0.15 0.00 -0.71 0.00 0.00 33.22 30.25 1r7f n MET 28 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1r7f n PRO 29 N -3.83 -1.16 -2.16 0.03 -0.04 -1.26 -4.91 135.00 121.66 1r7f n PRO 29 Ca -0.06 -1.47 -0.33 0.00 -0.04 0.00 0.00 63.50 61.61 1r7f n PRO 29 Cb 0.52 -1.02 -0.04 0.00 -0.04 0.00 0.00 33.50 32.92 1r7f n PRO 29 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1r7f s GLN 30 N -5.07 2.78 0.00 0.54 -2.07 -1.26 -5.24 119.66 109.34 1r7f s GLN 30 Ca 0.54 -0.19 0.00 0.00 -1.82 0.00 0.00 55.36 53.89 1r7f s GLN 30 Cb -0.02 -4.87 0.00 0.00 -1.09 0.00 0.00 33.01 27.03 1r7f s GLN 30 CO 0.39 -2.94 0.16 -0.11 -1.32 0.00 0.00 175.29 171.47