#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 -0.23 0.14 0.23 0.00 -1.26 -5.04 105.19 99.03 1r7f n GLY 2 Ca 0.00 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.10 1r7f n GLY 2 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1r7f h SER 3 N 0.00 0.61 -3.36 1.61 0.87 -2.10 -3.46 113.55 107.72 1r7f h SER 3 Ca 0.00 -0.93 -0.38 0.00 -1.23 0.00 0.00 61.79 59.25 1r7f h SER 3 Cb 0.00 -0.20 -0.37 0.00 -0.44 0.00 0.00 62.40 61.39 1r7f h SER 3 CO 0.00 1.76 -0.75 -1.66 -0.53 0.00 0.00 176.83 175.65 1r7f s TRP 4 N -2.56 0.36 -0.06 2.24 1.48 -1.26 -5.02 118.94 114.12 1r7f s TRP 4 Ca -0.16 0.02 0.02 0.00 -1.06 0.00 0.00 56.10 54.91 1r7f s TRP 4 Cb 0.05 -0.57 -0.05 0.00 -1.16 0.00 0.00 33.47 31.75 1r7f s TRP 4 CO 0.85 -0.21 -0.03 1.28 -4.06 0.00 0.00 176.95 174.77 1r7f n LEU 5 N 4.82 2.11 -0.35 -4.66 4.32 -1.26 -4.56 117.00 117.42 1r7f n LEU 5 Ca -0.13 -0.02 0.08 0.00 -0.02 0.00 0.00 56.01 55.92 1r7f n LEU 5 Cb 0.50 -0.11 0.25 0.00 -1.62 0.00 0.00 43.42 42.43 1r7f n LEU 5 CO 0.14 0.46 1.21 -0.09 -1.22 0.00 0.00 177.39 177.88 1r7f h ARG 6 N 0.00 0.88 0.00 3.23 2.43 -2.00 0.15 114.38 119.07 1r7f h ARG 6 Ca -0.13 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 58.94 1r7f h ARG 6 Cb 1.23 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 1r7f h ARG 6 CO -0.01 0.58 -0.19 0.22 -1.51 0.00 0.00 179.97 179.06 1r7f h ASP 7 N 0.91 0.00 0.81 -3.80 1.82 -2.01 -2.43 116.42 111.72 1r7f h ASP 7 Ca 0.50 0.00 -0.24 0.00 -0.39 0.00 0.00 57.03 56.90 1r7f h ASP 7 Cb 0.57 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.56 1r7f h ASP 7 CO -0.29 0.19 -1.16 0.40 -1.61 0.00 0.00 179.24 176.77 1r7f h ILE 8 N 0.00 1.55 -0.91 2.25 2.04 -1.01 -3.31 117.51 118.13 1r7f h ILE 8 Ca -0.00 -3.22 0.02 0.00 1.00 0.00 0.00 64.86 62.66 1r7f h ILE 8 Cb 0.38 2.84 -0.05 0.00 -0.74 0.00 0.00 36.82 39.25 1r7f h ILE 8 CO 0.03 0.91 0.59 -0.50 0.00 0.00 0.00 178.15 179.18 1r7f h TRP 9 N 0.03 1.12 -0.45 1.37 -0.00 -0.67 -1.96 115.95 115.38 1r7f h TRP 9 Ca -0.08 0.03 -0.05 0.00 -0.00 0.00 0.00 58.89 58.78 1r7f h TRP 9 Cb 1.87 -0.37 -0.02 0.00 -0.00 0.00 0.00 29.16 30.63 1r7f h TRP 9 CO 0.02 0.67 0.06 0.22 -0.00 0.00 0.00 178.44 179.42 1r7f h ASP 10 N 1.18 0.65 -0.41 -3.49 3.58 -1.62 0.24 116.42 116.55 1r7f h ASP 10 Ca 0.35 -0.12 0.04 0.00 0.42 0.00 0.00 57.03 57.71 1r7f h ASP 10 Cb -0.06 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.80 1r7f h ASP 10 CO -0.10 0.68 0.27 -0.25 -2.88 0.00 0.00 179.24 176.97 1r7f h TRP 11 N 0.67 0.40 0.01 0.28 2.91 -1.45 0.31 115.95 119.07 1r7f h TRP 11 Ca 0.15 0.01 -0.33 0.00 1.13 0.00 0.00 58.89 59.85 1r7f h TRP 11 Cb 0.32 -0.13 -0.06 0.00 -0.51 0.00 0.00 29.16 28.78 1r7f h TRP 11 CO 0.02 0.23 -2.01 -0.89 -1.03 0.00 0.00 178.44 174.76 1r7f n ILE 12 N -4.48 1.54 -0.02 2.65 2.08 -0.86 -3.84 119.36 116.43 1r7f n ILE 12 Ca 0.04 -0.80 -0.16 0.00 0.56 0.00 0.00 62.75 62.40 1r7f n ILE 12 Cb 0.18 -0.92 -0.10 0.00 -0.75 0.00 0.00 39.64 38.05 1r7f n ILE 12 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1r7f h GLU 14 N -0.19 -0.18 -0.20 0.00 4.81 -0.61 -1.87 114.58 116.34 1r7f h GLU 14 Ca -0.04 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1r7f h GLU 14 Cb 1.08 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1r7f h GLU 14 CO 0.08 -0.12 0.04 -0.24 -0.73 0.00 0.00 179.01 178.04 1r7f h VAL 15 N -0.19 1.11 -0.41 0.32 3.04 -1.67 -2.15 116.25 116.29 1r7f h VAL 15 Ca -0.00 -0.37 -0.11 0.00 -1.01 0.00 0.00 66.70 65.21 1r7f h VAL 15 Cb 0.18 0.91 -0.02 0.00 -2.01 0.00 0.00 31.29 30.35 1r7f h VAL 15 CO -0.01 0.13 -0.18 0.25 -1.01 0.00 0.00 177.57 176.74 1r7f h LEU 16 N 0.28 0.80 -0.86 3.16 6.46 -1.04 -2.84 115.31 121.27 1r7f h LEU 16 Ca 0.07 -0.27 -0.01 0.00 -0.12 0.00 0.00 57.88 57.55 1r7f h LEU 16 Cb 0.13 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 39.80 1r7f h LEU 16 CO -0.00 0.98 0.51 -1.28 -0.62 0.00 0.00 178.44 178.02 1r7f h SER 17 N 0.70 1.04 -0.71 1.25 0.87 -0.68 -0.67 113.55 115.35 1r7f h SER 17 Ca 0.10 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.60 1r7f h SER 17 Cb 0.69 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 62.35 1r7f h SER 17 CO 0.05 0.81 0.47 -0.78 -0.53 0.00 0.00 176.83 176.84 1r7f h ASP 18 N 1.19 0.82 0.97 6.23 3.58 -1.36 -0.41 116.42 127.45 1r7f h ASP 18 Ca 0.31 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.73 1r7f h ASP 18 Cb -0.04 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 40.81 1r7f h ASP 18 CO -0.06 0.60 -0.04 0.33 -2.88 0.00 0.00 179.24 177.19 1r7f n PHE 19 N -4.42 0.03 0.08 0.28 7.35 -0.64 -3.41 117.46 116.72 1r7f n PHE 19 Ca 0.08 0.01 0.06 0.00 -0.76 0.00 0.00 57.45 56.84 1r7f n PHE 19 Cb 0.04 -0.49 0.13 0.00 0.35 0.00 0.00 39.48 39.50 1r7f n PHE 19 CO 0.00 0.00 0.00 1.17 -0.76 0.00 0.00 176.76 177.17 1r7f n LYS 20 N -1.52 2.04 -0.12 -4.13 4.81 -0.27 -4.57 118.16 114.41 1r7f n LYS 20 Ca 0.07 -1.78 -0.17 0.00 -0.87 0.00 0.00 58.31 55.56 1r7f n LYS 20 Cb 0.34 -1.28 -0.11 0.00 0.02 0.00 0.00 35.03 34.01 1r7f n LYS 20 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1r7f n THR 21 N 0.67 1.35 0.25 3.15 -1.04 -0.56 -4.30 114.28 113.79 1r7f n THR 21 Ca 0.11 -0.51 0.10 0.00 -2.04 0.00 0.00 64.05 61.72 1r7f n THR 21 Cb 0.40 -1.36 0.67 0.00 -1.82 0.00 0.00 70.33 68.22 1r7f n THR 21 CO 0.00 0.00 0.00 4.11 -0.64 0.00 0.00 175.07 178.54 1r7f h TRP 22 N -0.05 0.00 -0.30 -1.42 5.08 -1.81 -2.57 115.95 114.88 1r7f h TRP 22 Ca -0.53 0.00 -0.17 0.00 1.08 0.00 0.00 58.89 59.27 1r7f h TRP 22 Cb 1.80 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.96 1r7f h TRP 22 CO 0.02 0.13 -0.50 -0.07 -1.28 0.00 0.00 178.44 176.74 1r7f h LEU 23 N 0.00 0.91 -2.06 0.11 3.38 -1.80 -0.43 115.31 115.42 1r7f h LEU 23 Ca -0.00 -0.46 0.08 0.00 0.09 0.00 0.00 57.88 57.58 1r7f h LEU 23 Cb 0.30 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1r7f h LEU 23 CO 0.02 1.25 0.22 0.50 0.09 0.00 0.00 178.44 180.51 1r7f h LYS 24 N 0.65 0.00 0.02 1.13 3.11 -1.64 0.28 116.57 120.11 1r7f h LYS 24 Ca 0.03 0.00 -0.35 0.00 -2.81 0.00 0.00 60.65 57.52 1r7f h LYS 24 Cb 1.09 0.00 -0.06 0.00 -1.00 0.00 0.00 32.23 32.26 1r7f h LYS 24 CO 0.11 0.00 -2.13 0.00 -2.81 0.00 0.00 179.45 174.62 1r7f n ALA 25 N -2.54 1.39 0.12 5.00 0.00 -1.11 -3.25 120.51 120.13 1r7f n ALA 25 Ca 0.04 -1.00 -0.01 0.00 0.00 0.00 0.00 53.44 52.46 1r7f n ALA 25 Cb 0.37 -0.46 0.08 0.00 0.00 0.00 0.00 19.45 19.45 1r7f n ALA 25 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1r7f h LYS 26 N 0.01 0.00 0.00 0.00 1.63 -0.51 -3.29 116.57 114.42 1r7f h LYS 26 Ca -0.45 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.23 1r7f h LYS 26 Cb 2.08 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.70 1r7f h LYS 26 CO 0.03 0.69 -0.77 -0.07 -3.45 0.00 0.00 179.45 175.89 1r7f h LEU 27 N 0.00 0.00 -7.54 5.20 4.07 -0.65 -3.43 115.31 112.95 1r7f h LEU 27 Ca -0.01 -0.45 -0.67 0.00 0.08 0.00 0.00 57.88 56.83 1r7f h LEU 27 Cb 1.34 0.00 -0.38 0.00 1.08 0.00 0.00 40.66 42.69 1r7f h LEU 27 CO 0.09 1.17 -0.54 -0.32 -1.08 0.00 0.00 178.44 177.76 1r7f s MET 28 N -2.24 2.12 0.00 1.13 1.75 -1.20 -5.07 119.30 115.78 1r7f s MET 28 Ca -0.22 -2.40 0.00 0.00 -1.25 0.00 0.00 55.69 51.82 1r7f s MET 28 Cb 0.03 -3.48 0.00 0.00 2.84 0.00 0.00 34.83 34.22 1r7f s MET 28 CO 0.49 -1.10 0.00 -0.35 -0.65 0.00 0.00 175.02 173.40 1r7f n PRO 29 N 3.57 3.42 0.00 4.11 -0.04 -1.24 -4.53 135.00 140.29 1r7f n PRO 29 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 1r7f n PRO 29 Cb 0.36 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.82 1r7f n PRO 29 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1r7f n GLN 30 N 0.00 1.25 -0.83 0.54 7.27 -1.26 -5.08 117.38 119.27 1r7f n GLN 30 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1r7f n GLN 30 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1r7f n GLN 30 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02