#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r7f s GLY 2 N 0.00 1.93 -0.07 0.23 0.00 -1.26 -4.63 107.32 103.52 1r7f s GLY 2 Ca 0.00 -3.08 0.17 0.00 0.00 0.00 0.00 44.72 41.81 1r7f s GLY 2 CO 0.00 2.46 0.29 1.44 0.00 0.00 0.00 173.10 177.29 1r7f n SER 3 N 7.32 0.87 -0.75 1.64 7.64 -1.26 -4.41 113.62 124.67 1r7f n SER 3 Ca 0.44 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.44 1r7f n SER 3 Cb 0.45 1.54 0.24 0.00 -1.01 0.00 0.00 64.21 65.43 1r7f n SER 3 CO 0.00 0.00 0.00 -2.67 -3.01 0.00 0.00 175.04 169.36 1r7f n TRP 4 N -2.28 0.00 0.23 1.43 4.27 -1.26 -4.23 117.44 115.59 1r7f n TRP 4 Ca -0.11 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.58 1r7f n TRP 4 Cb 0.65 -0.00 0.56 0.00 -1.36 0.00 0.00 31.31 31.16 1r7f n TRP 4 CO 0.00 0.00 0.00 -0.07 -2.29 0.00 0.00 177.69 175.33 1r7f h LEU 5 N 3.68 0.00 -2.44 5.67 4.07 -1.94 -2.33 115.31 122.02 1r7f h LEU 5 Ca 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 1r7f h LEU 5 Cb 0.80 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.54 1r7f h LEU 5 CO 0.00 0.21 -0.00 -0.09 -1.08 0.00 0.00 178.44 177.47 1r7f h ARG 6 N 0.00 0.00 0.01 1.13 1.12 -1.88 -2.43 114.38 112.33 1r7f h ARG 6 Ca -0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 59.98 58.50 1r7f h ARG 6 Cb 0.44 0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 30.33 1r7f h ARG 6 CO 0.03 0.00 -2.35 -0.25 -3.11 0.00 0.00 179.97 174.29 1r7f n ASP 7 N -3.87 1.09 0.25 -3.80 9.92 -0.91 -4.33 116.55 114.89 1r7f n ASP 7 Ca -0.03 -0.02 0.09 0.00 -0.53 0.00 0.00 54.79 54.31 1r7f n ASP 7 Cb 0.09 0.17 0.63 0.00 -0.64 0.00 0.00 41.12 41.36 1r7f n ASP 7 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 1r7f h ILE 8 N 0.01 0.85 -0.50 0.53 6.09 -1.21 -2.56 117.51 120.72 1r7f h ILE 8 Ca -0.53 -0.53 -0.09 0.00 -1.37 0.00 0.00 64.86 62.33 1r7f h ILE 8 Cb 2.06 1.31 -0.02 0.00 0.47 0.00 0.00 36.82 40.65 1r7f h ILE 8 CO -0.01 0.14 -0.04 -0.50 -3.07 0.00 0.00 178.15 174.66 1r7f h TRP 9 N 0.00 1.00 -0.14 2.19 6.55 -1.63 -1.89 115.95 122.03 1r7f h TRP 9 Ca -0.00 -0.19 -0.01 0.00 0.95 0.00 0.00 58.89 59.64 1r7f h TRP 9 Cb 0.30 -0.26 -0.01 0.00 -0.86 0.00 0.00 29.16 28.34 1r7f h TRP 9 CO 0.00 0.95 0.05 0.22 -1.05 0.00 0.00 178.44 178.61 1r7f h ASP 10 N 0.77 0.20 -0.80 -3.49 3.58 -1.66 -1.39 116.42 113.63 1r7f h ASP 10 Ca 0.14 -0.19 0.01 0.00 0.42 0.00 0.00 57.03 57.40 1r7f h ASP 10 Cb 0.58 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.54 1r7f h ASP 10 CO 0.03 0.33 0.53 4.11 -2.88 0.00 0.00 179.24 181.37 1r7f h TRP 11 N 0.05 1.01 -0.46 0.28 5.08 -1.47 -1.84 115.95 118.60 1r7f h TRP 11 Ca 0.04 0.02 -0.10 0.00 1.08 0.00 0.00 58.89 59.94 1r7f h TRP 11 Cb 0.21 -0.34 -0.02 0.00 -3.00 0.00 0.00 29.16 26.00 1r7f h TRP 11 CO -0.01 0.64 -0.11 0.82 -1.28 0.00 0.00 178.44 178.51 1r7f h ILE 12 N 1.09 1.26 -0.11 0.12 1.08 -1.07 -2.24 117.51 117.63 1r7f h ILE 12 Ca 0.29 -1.19 -0.06 0.00 -0.39 0.00 0.00 64.86 63.51 1r7f h ILE 12 Cb -0.12 1.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.64 1r7f h ILE 12 CO -0.06 0.41 -0.22 0.00 -0.69 0.00 0.00 178.15 177.59 1r7f h GLU 14 N 0.18 0.27 0.00 0.00 4.81 -0.96 -1.04 114.58 117.83 1r7f h GLU 14 Ca 0.03 -0.18 -0.07 0.00 -0.13 0.00 0.00 59.36 59.01 1r7f h GLU 14 Cb 0.50 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 1r7f h GLU 14 CO 0.03 0.79 -0.32 -0.24 -0.73 0.00 0.00 179.01 178.55 1r7f h VAL 15 N -0.22 0.69 0.20 0.32 3.04 -1.29 -3.10 116.25 115.89 1r7f h VAL 15 Ca -0.00 -1.46 -0.32 0.00 -1.01 0.00 0.00 66.70 63.91 1r7f h VAL 15 Cb 0.80 1.96 0.02 0.00 -2.01 0.00 0.00 31.29 32.05 1r7f h VAL 15 CO 0.04 0.31 -1.49 0.25 -1.01 0.00 0.00 177.57 175.67 1r7f h LEU 16 N 0.00 0.65 -0.10 3.16 7.12 -0.92 -3.22 115.31 121.99 1r7f h LEU 16 Ca -0.00 -0.92 -0.00 0.00 0.13 0.00 0.00 57.88 57.08 1r7f h LEU 16 Cb 0.93 -0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 40.85 1r7f h LEU 16 CO 0.04 1.69 0.06 0.77 -0.13 0.00 0.00 178.44 180.87 1r7f h SER 17 N -0.00 0.12 -0.85 1.25 4.64 -1.23 0.29 113.55 117.77 1r7f h SER 17 Ca -0.28 -0.06 0.07 0.00 -0.47 0.00 0.00 61.79 61.05 1r7f h SER 17 Cb 2.02 -0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 64.02 1r7f h SER 17 CO 0.19 0.14 0.56 -0.78 -0.87 0.00 0.00 176.83 176.07 1r7f h ASP 18 N 0.09 0.81 -0.15 4.97 1.82 -1.69 -1.19 116.42 121.08 1r7f h ASP 18 Ca 0.04 0.01 -0.16 0.00 -0.39 0.00 0.00 57.03 56.53 1r7f h ASP 18 Cb 0.04 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 39.89 1r7f h ASP 18 CO -0.01 0.51 -0.46 0.15 -1.61 0.00 0.00 179.24 177.82 1r7f h PHE 19 N 0.91 0.87 -0.64 0.28 3.57 -1.44 -2.95 116.94 117.53 1r7f h PHE 19 Ca 0.38 -0.28 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 1r7f h PHE 19 Cb 0.28 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 1r7f h PHE 19 CO -0.00 1.04 0.25 -0.22 -2.23 0.00 0.00 178.31 177.14 1r7f h LYS 20 N 0.57 0.97 -0.73 1.11 3.64 0.21 0.40 116.57 122.73 1r7f h LYS 20 Ca 0.03 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1r7f h LYS 20 Cb 1.02 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.65 1r7f h LYS 20 CO 0.10 0.82 0.47 1.15 -2.27 0.00 0.00 179.45 179.72 1r7f h THR 21 N 0.91 1.19 -0.39 1.00 2.02 -1.29 0.33 112.91 116.69 1r7f h THR 21 Ca 0.21 -0.38 -0.13 0.00 0.77 0.00 0.00 66.41 66.89 1r7f h THR 21 Cb 0.22 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.76 1r7f h THR 21 CO -0.02 0.19 -0.26 -0.25 0.37 0.00 0.00 175.52 175.55 1r7f h TRP 22 N 0.99 1.02 -0.46 3.16 7.01 -1.31 -2.78 115.95 123.58 1r7f h TRP 22 Ca 0.27 -0.27 -0.11 0.00 2.11 0.00 0.00 58.89 60.88 1r7f h TRP 22 Cb -0.09 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.73 1r7f h TRP 22 CO -0.02 1.06 -0.15 1.25 -2.79 0.00 0.00 178.44 177.79 1r7f h LEU 23 N 0.68 0.93 -0.40 0.65 6.46 -0.46 -2.61 115.31 120.56 1r7f h LEU 23 Ca 0.08 -0.38 0.01 0.00 -0.12 0.00 0.00 57.88 57.47 1r7f h LEU 23 Cb 0.84 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 40.49 1r7f h LEU 23 CO 0.07 1.10 0.26 0.50 -0.62 0.00 0.00 178.44 179.75 1r7f h LYS 24 N 0.76 0.52 -0.16 1.25 3.64 -0.33 -1.28 116.57 120.96 1r7f h LYS 24 Ca 0.11 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.43 1r7f h LYS 24 Cb 0.71 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.41 1r7f h LYS 24 CO 0.05 0.34 -0.05 0.00 -2.27 0.00 0.00 179.45 177.53 1r7f h ALA 25 N 1.15 1.63 -0.01 5.00 0.00 -1.45 -1.71 119.26 123.87 1r7f h ALA 25 Ca 0.15 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1r7f h ALA 25 Cb -0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1r7f h ALA 25 CO -0.04 0.28 -0.70 -0.22 0.00 0.00 0.00 179.25 178.57 1r7f h LYS 26 N 0.23 0.07 0.00 0.00 3.64 -0.97 -3.32 116.57 116.22 1r7f h LYS 26 Ca 0.05 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1r7f h LYS 26 Cb 0.24 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1r7f h LYS 26 CO 0.01 0.74 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.86 1r7f h LEU 27 N 0.04 -0.01 -9.07 5.20 4.07 -0.63 -3.43 115.31 111.49 1r7f h LEU 27 Ca -0.01 -0.83 -0.61 0.00 0.08 0.00 0.00 57.88 56.51 1r7f h LEU 27 Cb 1.24 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.87 1r7f h LEU 27 CO 0.10 0.85 -0.04 -0.04 -1.08 0.00 0.00 178.44 178.22 1r7f s MET 28 N -2.73 4.14 0.46 1.13 -1.94 -0.70 -4.94 119.30 114.73 1r7f s MET 28 Ca -0.18 0.37 0.30 0.00 -1.71 0.00 0.00 55.69 54.47 1r7f s MET 28 Cb -0.02 -3.59 1.09 0.00 2.01 0.00 0.00 34.83 34.32 1r7f s MET 28 CO 0.66 -0.22 1.86 -1.00 -0.01 0.00 0.00 175.02 176.32 1r7f h PRO 29 N 7.66 0.00 -0.04 2.03 0.13 -1.85 -3.09 132.00 136.84 1r7f h PRO 29 Ca -0.32 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.80 1r7f h PRO 29 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 1r7f h PRO 29 CO 0.73 0.00 -0.07 0.94 -0.23 0.00 0.00 178.00 179.37 1r7f n GLN 30 N -2.90 1.54 0.00 0.86 7.27 -1.26 -5.14 117.38 117.75 1r7f n GLN 30 Ca 0.02 -2.73 0.00 0.00 0.07 0.00 0.00 57.00 54.36 1r7f n GLN 30 Cb 0.34 -1.57 0.00 0.00 2.41 0.00 0.00 30.24 31.42 1r7f n GLN 30 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02