#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r7d n GLY 2 N 0.00 -1.92 2.79 0.23 0.00 -1.26 -4.86 105.19 100.17 1r7d n GLY 2 Ca 0.00 -1.54 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 1r7d n GLY 2 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1r7d s SER 3 N -4.00 1.03 -0.11 1.61 0.15 -1.26 -4.99 113.70 106.13 1r7d s SER 3 Ca 0.00 -1.47 0.06 0.00 0.70 0.00 0.00 55.95 55.25 1r7d s SER 3 Cb 0.00 0.64 -0.11 0.00 -1.71 0.00 0.00 66.02 64.84 1r7d s SER 3 CO 0.00 -0.26 -0.02 1.87 1.20 0.00 0.00 173.24 176.03 1r7d n TRP 4 N 4.34 0.00 0.09 3.44 -0.00 -1.26 -4.59 117.44 119.46 1r7d n TRP 4 Ca 0.10 0.00 -0.14 0.00 -0.00 0.00 0.00 57.50 57.46 1r7d n TRP 4 Cb 0.46 -0.51 -0.14 0.00 -0.00 0.00 0.00 31.31 31.13 1r7d n TRP 4 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1r7d h LEU 5 N 0.00 0.31 -0.31 5.87 5.85 -2.00 -3.30 115.31 121.74 1r7d h LEU 5 Ca -0.28 -0.34 0.06 0.00 0.84 0.00 0.00 57.88 58.16 1r7d h LEU 5 Cb 1.57 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 42.44 1r7d h LEU 5 CO -0.01 1.27 -0.08 -0.09 -0.34 0.00 0.00 178.44 179.19 1r7d h ARG 6 N 0.05 -0.01 -0.86 1.25 9.65 -1.97 -1.63 114.38 120.86 1r7d h ARG 6 Ca -0.11 0.00 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 1r7d h ARG 6 Cb 1.93 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 30.46 1r7d h ARG 6 CO 0.18 -0.01 0.57 0.22 2.80 0.00 0.00 179.97 183.73 1r7d h ASP 7 N -0.01 0.98 -0.63 -3.80 3.58 -1.81 -2.35 116.42 112.38 1r7d h ASP 7 Ca 0.15 -0.02 0.04 0.00 0.42 0.00 0.00 57.03 57.62 1r7d h ASP 7 Cb 0.24 -0.24 -0.05 0.00 1.72 0.00 0.00 39.33 41.00 1r7d h ASP 7 CO -0.32 0.70 0.37 0.40 -2.88 0.00 0.00 179.24 177.51 1r7d h ILE 8 N 1.15 1.03 -0.81 2.25 2.04 -1.40 0.24 117.51 122.02 1r7d h ILE 8 Ca 0.32 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.96 1r7d h ILE 8 Cb -0.11 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 36.18 1r7d h ILE 8 CO -0.08 0.13 0.52 -0.25 0.00 0.00 0.00 178.15 178.48 1r7d h TRP 9 N 0.72 0.98 -0.24 1.37 -0.00 -0.83 -0.11 115.95 117.85 1r7d h TRP 9 Ca 0.27 0.02 -0.07 0.00 -0.00 0.00 0.00 58.89 59.11 1r7d h TRP 9 Cb 0.08 -0.33 -0.01 0.00 -0.00 0.00 0.00 29.16 28.91 1r7d h TRP 9 CO -0.06 0.58 -0.14 0.22 -0.00 0.00 0.00 178.44 179.03 1r7d h ASP 10 N 1.03 0.54 -0.88 2.65 1.82 -0.95 -3.01 116.42 117.61 1r7d h ASP 10 Ca 0.31 -0.43 0.07 0.00 -0.39 0.00 0.00 57.03 56.60 1r7d h ASP 10 Cb -0.03 -0.15 -0.07 0.00 0.68 0.00 0.00 39.33 39.76 1r7d h ASP 10 CO -0.10 0.85 0.54 -0.25 -1.61 0.00 0.00 179.24 178.67 1r7d h TRP 11 N 0.23 1.00 -0.75 0.28 7.01 -0.04 -0.33 115.95 123.34 1r7d h TRP 11 Ca 0.05 0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.12 1r7d h TRP 11 Cb 0.66 -0.32 -0.04 0.00 -2.10 0.00 0.00 29.16 27.36 1r7d h TRP 11 CO 0.07 0.48 0.49 0.82 -2.79 0.00 0.00 178.44 177.51 1r7d h ILE 12 N 0.96 1.09 -0.24 2.65 2.04 -0.93 -0.74 117.51 122.34 1r7d h ILE 12 Ca 0.40 -0.30 -0.17 0.00 1.00 0.00 0.00 64.86 65.79 1r7d h ILE 12 Cb 0.23 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.45 1r7d h ILE 12 CO -0.20 0.16 -0.52 0.00 0.00 0.00 0.00 178.15 177.59 1r7d h GLU 14 N 0.53 0.89 -0.40 0.00 4.39 -0.32 -2.84 114.58 116.84 1r7d h GLU 14 Ca 0.02 -0.30 -0.11 0.00 0.34 0.00 0.00 59.36 59.31 1r7d h GLU 14 Cb 1.09 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.65 1r7d h GLU 14 CO 0.11 0.94 -0.20 0.28 -1.16 0.00 0.00 179.01 178.98 1r7d h VAL 15 N 0.75 1.27 -0.53 3.13 2.07 -1.15 -0.18 116.25 121.60 1r7d h VAL 15 Ca 0.14 -1.30 0.04 0.00 0.82 0.00 0.00 66.70 66.40 1r7d h VAL 15 Cb 0.56 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 1r7d h VAL 15 CO 0.03 0.44 0.29 0.25 0.02 0.00 0.00 177.57 178.60 1r7d h LEU 16 N 0.68 0.44 -0.22 2.57 5.85 -1.20 0.32 115.31 123.75 1r7d h LEU 16 Ca 0.10 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.62 1r7d h LEU 16 Cb 0.70 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1r7d h LEU 16 CO 0.05 0.30 -0.88 -1.28 -0.34 0.00 0.00 178.44 176.29 1r7d h SER 17 N 0.57 0.56 -0.45 1.25 0.87 -1.38 -3.21 113.55 111.76 1r7d h SER 17 Ca 0.23 -0.42 -0.06 0.00 -1.23 0.00 0.00 61.79 60.30 1r7d h SER 17 Cb 0.10 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 61.87 1r7d h SER 17 CO -0.14 1.21 0.06 -0.78 -0.53 0.00 0.00 176.83 176.64 1r7d h ASP 18 N 0.26 0.78 -0.96 6.23 3.58 -0.43 -2.93 116.42 122.95 1r7d h ASP 18 Ca -0.07 -0.17 0.27 0.00 0.42 0.00 0.00 57.03 57.48 1r7d h ASP 18 Cb 1.51 -0.21 -0.14 0.00 1.72 0.00 0.00 39.33 42.21 1r7d h ASP 18 CO 0.15 0.81 0.48 0.15 -2.88 0.00 0.00 179.24 177.95 1r7d h PHE 19 N 0.78 0.79 -0.19 0.28 3.57 -0.39 1.33 116.94 123.10 1r7d h PHE 19 Ca 0.16 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.66 1r7d h PHE 19 Cb 0.39 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1r7d h PHE 19 CO 0.02 -0.10 -0.05 -0.22 -2.23 0.00 0.00 178.31 175.73 1r7d h LYS 20 N 0.38 0.37 -0.02 1.11 3.64 -1.67 -2.73 116.57 117.64 1r7d h LYS 20 Ca 0.64 -0.14 -0.20 0.00 -1.27 0.00 0.00 60.65 59.68 1r7d h LYS 20 Cb 1.34 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.13 1r7d h LYS 20 CO -0.57 0.63 -0.84 1.79 -2.27 0.00 0.00 179.45 178.19 1r7d h THR 21 N 0.08 1.43 -0.19 1.00 1.35 -1.04 -2.89 112.91 112.66 1r7d h THR 21 Ca 0.05 -2.41 0.04 0.00 -0.55 0.00 0.00 66.41 63.54 1r7d h THR 21 Cb 0.50 2.33 -0.04 0.00 -1.73 0.00 0.00 68.15 69.22 1r7d h THR 21 CO 0.02 0.71 -0.05 -0.25 -0.25 0.00 0.00 175.52 175.70 1r7d h TRP 22 N 0.18 -0.12 -0.68 4.73 7.01 0.16 0.37 115.95 127.61 1r7d h TRP 22 Ca -0.05 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 60.91 1r7d h TRP 22 Cb 1.45 0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 28.56 1r7d h TRP 22 CO 0.04 -0.09 0.18 -0.07 -2.79 0.00 0.00 178.44 175.71 1r7d h LEU 23 N -0.01 1.02 -0.73 0.65 4.07 -1.53 0.89 115.31 119.66 1r7d h LEU 23 Ca 0.09 -0.23 -0.08 0.00 0.08 0.00 0.00 57.88 57.75 1r7d h LEU 23 Cb 0.15 -0.27 -0.03 0.00 1.08 0.00 0.00 40.66 41.60 1r7d h LEU 23 CO -0.20 0.98 0.11 0.11 -1.08 0.00 0.00 178.44 178.36 1r7d h LYS 24 N 1.01 1.08 -0.00 1.13 1.57 -1.18 -1.93 116.57 118.25 1r7d h LYS 24 Ca 0.21 -0.28 -0.15 0.00 -1.87 0.00 0.00 60.65 58.56 1r7d h LYS 24 Cb 0.35 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1r7d h LYS 24 CO -0.00 0.99 -0.70 0.00 -0.57 0.00 0.00 179.45 179.16 1r7d h ALA 25 N 1.10 0.84 -0.26 3.86 0.00 -0.01 -3.25 119.26 121.54 1r7d h ALA 25 Ca 0.20 -0.64 -0.13 0.00 0.00 0.00 0.00 54.91 54.35 1r7d h ALA 25 Cb 0.42 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1r7d h ALA 25 CO 0.01 0.87 -0.33 -0.22 0.00 0.00 0.00 179.25 179.58 1r7d h LYS 26 N 0.01 0.68 -3.54 0.00 3.64 -0.48 -3.45 116.57 113.43 1r7d h LYS 26 Ca -0.01 -0.39 -0.25 0.00 -1.27 0.00 0.00 60.65 58.74 1r7d h LYS 26 Cb 1.24 0.03 -0.30 0.00 -0.41 0.00 0.00 32.23 32.79 1r7d h LYS 26 CO 0.09 1.00 -0.68 -1.17 -2.27 0.00 0.00 179.45 176.43 1r7d s LEU 27 N -8.91 1.45 0.19 5.20 0.20 -0.76 -5.01 118.68 111.04 1r7d s LEU 27 Ca -0.12 0.10 0.00 0.00 0.69 0.00 0.00 54.13 54.80 1r7d s LEU 27 Cb 0.08 0.11 0.00 0.00 -0.43 0.00 0.00 46.19 45.95 1r7d s LEU 27 CO 0.83 -0.07 0.00 0.80 -0.29 0.00 0.00 176.35 177.62 1r7d n MET 28 N 3.56 0.00 -0.77 1.98 1.56 -1.26 -4.49 117.12 117.70 1r7d n MET 28 Ca -0.19 0.00 -0.20 0.00 -0.27 0.00 0.00 57.70 57.04 1r7d n MET 28 Cb 0.56 0.00 0.16 0.00 2.15 0.00 0.00 33.22 36.09 1r7d n MET 28 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1r7d n PRO 29 N -3.06 -2.20 0.13 2.12 -0.04 -1.26 -4.95 135.00 125.74 1r7d n PRO 29 Ca 0.00 -1.19 -0.02 0.00 -0.04 0.00 0.00 63.50 62.26 1r7d n PRO 29 Cb 0.00 -1.06 0.14 0.00 -0.04 0.00 0.00 33.50 32.54 1r7d n PRO 29 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1r7d h GLN 30 N 0.00 0.00 -0.01 0.54 4.20 -2.04 -3.55 115.11 114.25 1r7d h GLN 30 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1r7d h GLN 30 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 1r7d h GLN 30 CO 0.18 0.65 0.00 1.28 -0.67 0.00 0.00 178.83 180.27