#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 1.11 2.90 5.00 0.00 -1.26 -4.96 105.19 107.98 1r7d n GLY 2 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 1r7d n GLY 2 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1r7d n SER 3 N 0.00 6.48 -0.06 1.61 2.88 -1.26 -4.81 113.62 118.46 1r7d n SER 3 Ca 0.00 -3.48 -0.11 0.00 -1.33 0.00 0.00 58.87 53.95 1r7d n SER 3 Cb 0.00 -1.21 -0.05 0.00 -0.75 0.00 0.00 64.21 62.20 1r7d n SER 3 CO 0.00 0.00 0.00 -0.25 -1.23 0.00 0.00 175.04 173.56 1r7d h TRP 4 N 5.07 0.35 -0.89 0.66 7.01 -2.00 -1.28 115.95 124.87 1r7d h TRP 4 Ca 0.27 -0.05 0.02 0.00 2.11 0.00 0.00 58.89 61.24 1r7d h TRP 4 Cb 0.55 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.47 1r7d h TRP 4 CO 1.07 0.48 0.59 -0.07 -2.79 0.00 0.00 178.44 177.71 1r7d h LEU 5 N 0.12 1.00 -0.49 0.65 4.07 -2.00 -2.02 115.31 116.62 1r7d h LEU 5 Ca 0.06 -0.02 -0.13 0.00 0.08 0.00 0.00 57.88 57.87 1r7d h LEU 5 Cb 0.32 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.80 1r7d h LEU 5 CO 0.00 0.71 -0.18 -0.09 -1.08 0.00 0.00 178.44 177.80 1r7d h ARG 6 N 1.17 1.00 -1.00 1.13 2.43 -1.91 -1.34 114.38 115.86 1r7d h ARG 6 Ca 0.34 -0.41 0.09 0.00 -0.81 0.00 0.00 59.98 59.18 1r7d h ARG 6 Cb -0.08 -0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 29.35 1r7d h ARG 6 CO -0.08 1.09 0.64 0.22 -1.51 0.00 0.00 179.97 180.33 1r7d h ASP 7 N 0.86 0.99 0.78 -3.80 1.82 -0.52 -1.81 116.42 114.74 1r7d h ASP 7 Ca 0.12 0.02 -0.22 0.00 -0.39 0.00 0.00 57.03 56.56 1r7d h ASP 7 Cb 0.76 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.57 1r7d h ASP 7 CO 0.06 0.60 -1.04 0.40 -1.61 0.00 0.00 179.24 177.65 1r7d h ILE 8 N 1.11 1.59 -0.20 2.25 2.04 -1.28 -3.29 117.51 119.73 1r7d h ILE 8 Ca 0.46 -3.09 0.05 0.00 1.00 0.00 0.00 64.86 63.28 1r7d h ILE 8 Cb 0.29 2.77 -0.06 0.00 -0.74 0.00 0.00 36.82 39.08 1r7d h ILE 8 CO -0.21 0.89 -0.19 -0.25 0.00 0.00 0.00 178.15 178.39 1r7d h TRP 9 N 0.05 -0.50 -0.96 1.37 2.91 -0.36 0.83 115.95 119.28 1r7d h TRP 9 Ca -0.06 0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.01 1r7d h TRP 9 Cb 1.75 0.25 -0.05 0.00 -0.51 0.00 0.00 29.16 30.61 1r7d h TRP 9 CO 0.03 -0.27 0.64 0.22 -1.03 0.00 0.00 178.44 178.02 1r7d h ASP 10 N -0.21 1.10 -0.74 2.65 3.58 -1.63 -2.04 116.42 119.13 1r7d h ASP 10 Ca 0.12 -0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.50 1r7d h ASP 10 Cb 0.40 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 41.14 1r7d h ASP 10 CO -0.32 0.79 0.29 -0.25 -2.88 0.00 0.00 179.24 176.87 1r7d h TRP 11 N 1.30 1.14 -0.85 0.28 7.01 -1.35 -1.56 115.95 121.91 1r7d h TRP 11 Ca 0.36 -0.08 -0.01 0.00 2.11 0.00 0.00 58.89 61.27 1r7d h TRP 11 Cb -0.14 -0.34 -0.04 0.00 -2.10 0.00 0.00 29.16 26.54 1r7d h TRP 11 CO -0.00 0.86 0.51 0.82 -2.79 0.00 0.00 178.44 177.83 1r7d h ILE 12 N 1.09 1.24 -0.14 2.65 2.04 -0.18 -1.09 117.51 123.12 1r7d h ILE 12 Ca 0.25 -0.53 -0.11 0.00 1.00 0.00 0.00 64.86 65.47 1r7d h ILE 12 Cb 0.21 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1r7d h ILE 12 CO -0.02 0.25 -0.39 0.00 0.00 0.00 0.00 178.15 177.99 1r7d h GLU 14 N 0.25 0.52 -0.80 0.00 5.08 -0.30 -0.18 114.58 119.15 1r7d h GLU 14 Ca 0.03 -0.21 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1r7d h GLU 14 Cb 0.81 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.99 1r7d h GLU 14 CO 0.06 0.75 0.53 0.28 -1.00 0.00 0.00 179.01 179.63 1r7d h VAL 15 N 0.26 1.19 -0.08 3.13 2.07 -1.15 0.52 116.25 122.19 1r7d h VAL 15 Ca 0.06 -0.36 -0.19 0.00 0.82 0.00 0.00 66.70 67.03 1r7d h VAL 15 Cb 0.57 0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1r7d h VAL 15 CO 0.03 0.19 -0.70 0.25 0.02 0.00 0.00 177.57 177.37 1r7d h LEU 16 N 1.06 0.76 -0.41 2.57 7.12 -1.34 -1.84 115.31 123.23 1r7d h LEU 16 Ca 0.30 -0.67 -0.15 0.00 0.13 0.00 0.00 57.88 57.48 1r7d h LEU 16 Cb -0.09 -0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 39.80 1r7d h LEU 16 CO -0.07 1.32 -0.34 -1.28 -0.13 0.00 0.00 178.44 177.94 1r7d h SER 17 N 0.26 1.01 -0.30 1.25 0.87 -0.59 -3.18 113.55 112.87 1r7d h SER 17 Ca -0.06 -0.45 -0.16 0.00 -1.23 0.00 0.00 61.79 59.88 1r7d h SER 17 Cb 1.35 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1r7d h SER 17 CO 0.14 1.25 -0.44 -0.78 -0.53 0.00 0.00 176.83 176.47 1r7d h ASP 18 N 0.78 0.93 -0.91 6.23 1.82 -0.02 -3.06 116.42 122.19 1r7d h ASP 18 Ca 0.07 -0.45 0.16 0.00 -0.39 0.00 0.00 57.03 56.42 1r7d h ASP 18 Cb 0.94 -0.26 -0.07 0.00 0.68 0.00 0.00 39.33 40.61 1r7d h ASP 18 CO 0.09 1.23 0.58 -0.26 -1.61 0.00 0.00 179.24 179.27 1r7d h PHE 19 N 0.69 0.82 -0.70 0.28 -1.00 -1.31 0.90 116.94 116.63 1r7d h PHE 19 Ca 0.05 0.02 -0.07 0.00 2.81 0.00 0.00 57.97 60.77 1r7d h PHE 19 Cb 1.02 -0.26 -0.03 0.00 3.61 0.00 0.00 35.95 40.30 1r7d h PHE 19 CO 0.06 0.28 0.14 -0.22 -1.61 0.00 0.00 178.31 176.96 1r7d h LYS 20 N 0.67 1.13 0.00 1.51 3.64 -1.54 -2.62 116.57 119.36 1r7d h LYS 20 Ca 0.47 -0.29 -0.19 0.00 -1.27 0.00 0.00 60.65 59.37 1r7d h LYS 20 Cb 0.79 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.44 1r7d h LYS 20 CO -0.22 1.01 -1.31 0.00 -2.27 0.00 0.00 179.45 176.66 1r7d h THR 21 N 1.07 0.75 0.17 1.00 1.03 -1.17 -3.22 112.91 112.53 1r7d h THR 21 Ca 0.22 -2.33 -0.01 0.00 -0.01 0.00 0.00 66.41 64.28 1r7d h THR 21 Cb 0.41 2.26 0.00 0.00 -1.07 0.00 0.00 68.15 69.75 1r7d h THR 21 CO 0.01 0.43 -0.08 -0.25 -0.01 0.00 0.00 175.52 175.61 1r7d h TRP 22 N 0.00 -0.21 -0.77 0.00 7.01 0.86 0.78 115.95 123.61 1r7d h TRP 22 Ca -0.15 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 60.82 1r7d h TRP 22 Cb 1.67 0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 28.77 1r7d h TRP 22 CO 0.00 -0.13 0.38 -0.07 -2.79 0.00 0.00 178.44 175.84 1r7d h LEU 23 N -0.24 0.99 -0.68 0.65 4.07 -1.62 -2.36 115.31 116.13 1r7d h LEU 23 Ca -0.02 -0.10 -0.06 0.00 0.08 0.00 0.00 57.88 57.77 1r7d h LEU 23 Cb 0.18 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 41.64 1r7d h LEU 23 CO 0.04 0.83 0.18 0.11 -1.08 0.00 0.00 178.44 178.52 1r7d h LYS 24 N 1.09 1.07 -0.19 1.13 1.57 -1.47 -2.06 116.57 117.71 1r7d h LYS 24 Ca 0.27 -0.25 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 1r7d h LYS 24 Cb 0.09 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1r7d h LYS 24 CO -0.04 0.95 -0.07 0.00 -0.57 0.00 0.00 179.45 179.72 1r7d h ALA 25 N 1.08 1.54 -0.14 3.86 0.00 -0.41 -2.67 119.26 122.52 1r7d h ALA 25 Ca 0.21 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.74 1r7d h ALA 25 Cb 0.34 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.04 1r7d h ALA 25 CO -0.00 0.33 -0.75 -0.22 0.00 0.00 0.00 179.25 178.61 1r7d h LYS 26 N 0.28 0.68 -3.22 0.00 3.11 -0.96 -3.45 116.57 113.01 1r7d h LYS 26 Ca 0.06 -0.55 -0.24 0.00 -2.81 0.00 0.00 60.65 57.12 1r7d h LYS 26 Cb 0.30 0.11 -0.32 0.00 -1.00 0.00 0.00 32.23 31.33 1r7d h LYS 26 CO 0.01 1.16 -0.58 -0.48 -2.81 0.00 0.00 179.45 176.75 1r7d s LEU 27 N -8.29 0.66 -0.40 5.20 0.05 -0.82 -5.10 118.68 109.98 1r7d s LEU 27 Ca -0.09 0.33 0.03 0.00 0.05 0.00 0.00 54.13 54.45 1r7d s LEU 27 Cb 0.09 0.41 0.16 0.00 -2.05 0.00 0.00 46.19 44.81 1r7d s LEU 27 CO 0.88 -0.15 0.34 -0.04 -0.55 0.00 0.00 176.35 176.83 1r7d s MET 28 N 1.21 0.82 0.75 1.48 -1.94 -1.24 -4.40 119.30 115.97 1r7d s MET 28 Ca -0.09 -1.80 -0.13 0.00 -1.71 0.00 0.00 55.69 51.96 1r7d s MET 28 Cb -0.11 -1.26 0.18 0.00 2.01 0.00 0.00 34.83 35.64 1r7d s MET 28 CO -0.06 -1.34 0.78 -0.35 -0.01 0.00 0.00 175.02 174.05 1r7d n PRO 29 N 3.19 -1.80 -2.48 2.03 -0.04 -1.26 -5.07 135.00 129.57 1r7d n PRO 29 Ca 0.24 -1.24 -0.24 0.00 -0.04 0.00 0.00 63.50 62.22 1r7d n PRO 29 Cb 0.46 -1.01 0.11 0.00 -0.04 0.00 0.00 33.50 33.02 1r7d n PRO 29 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1r7d s GLN 30 N -4.75 1.61 0.00 0.54 0.74 -1.26 -5.28 119.66 111.27 1r7d s GLN 30 Ca 0.48 -0.95 0.00 0.00 0.05 0.00 0.00 55.36 54.94 1r7d s GLN 30 Cb -0.03 -2.26 0.00 0.00 1.10 0.00 0.00 33.01 31.81 1r7d s GLN 30 CO 0.36 -1.53 0.00 -0.11 -0.55 0.00 0.00 175.29 173.46