#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 2.23 3.94 0.46 0.00 -1.26 -5.17 105.19 105.39 1r7d n GLY 2 Ca 0.00 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.31 1r7d n GLY 2 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1r7d s SER 3 N 0.00 4.62 0.06 1.61 1.04 -1.26 -5.06 113.70 114.72 1r7d s SER 3 Ca 0.00 0.32 -0.02 0.00 0.48 0.00 0.00 55.95 56.73 1r7d s SER 3 Cb 0.00 -0.89 -0.01 0.00 0.10 0.00 0.00 66.02 65.22 1r7d s SER 3 CO 0.00 -1.71 -0.04 1.87 0.98 0.00 0.00 173.24 174.34 1r7d n TRP 4 N -2.96 0.00 0.18 5.02 -0.00 -1.26 -4.37 117.44 114.05 1r7d n TRP 4 Ca 0.09 0.00 -0.14 0.00 -0.00 0.00 0.00 57.50 57.46 1r7d n TRP 4 Cb 0.60 -0.05 -0.08 0.00 -0.00 0.00 0.00 31.31 31.78 1r7d n TRP 4 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1r7d h LEU 5 N -0.10 -0.40 -1.47 5.87 3.38 -2.00 -2.02 115.31 118.58 1r7d h LEU 5 Ca -0.01 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1r7d h LEU 5 Cb 0.19 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1r7d h LEU 5 CO -0.00 -0.08 0.37 -0.09 0.09 0.00 0.00 178.44 178.73 1r7d h ARG 6 N -0.73 0.70 -0.56 1.13 2.43 -1.99 -2.02 114.38 113.34 1r7d h ARG 6 Ca -0.05 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.06 1r7d h ARG 6 Cb 0.50 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.86 1r7d h ARG 6 CO 0.08 0.47 0.27 0.22 -1.51 0.00 0.00 179.97 179.50 1r7d h ASP 7 N 0.73 0.74 0.06 -3.80 3.58 -1.73 0.68 116.42 116.68 1r7d h ASP 7 Ca 0.21 -0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 1r7d h ASP 7 Cb -0.03 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.83 1r7d h ASP 7 CO -0.05 0.66 -0.03 0.40 -2.88 0.00 0.00 179.24 177.34 1r7d h ILE 8 N 0.76 1.19 -0.30 2.25 2.04 -0.77 -0.71 117.51 121.97 1r7d h ILE 8 Ca 0.19 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1r7d h ILE 8 Cb 0.12 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1r7d h ILE 8 CO -0.02 0.21 0.19 -0.50 0.00 0.00 0.00 178.15 178.03 1r7d h TRP 9 N -0.46 0.38 -0.52 1.37 -0.00 -1.33 -1.17 115.95 114.22 1r7d h TRP 9 Ca -0.01 0.01 -0.03 0.00 -0.00 0.00 0.00 58.89 58.85 1r7d h TRP 9 Cb 0.41 -0.13 -0.02 0.00 -0.00 0.00 0.00 29.16 29.42 1r7d h TRP 9 CO 0.05 0.26 0.19 0.22 -0.00 0.00 0.00 178.44 179.16 1r7d h ASP 10 N 0.39 0.73 -0.77 -3.49 3.58 -0.89 -2.65 116.42 113.32 1r7d h ASP 10 Ca 0.11 -0.19 -0.03 0.00 0.42 0.00 0.00 57.03 57.34 1r7d h ASP 10 Cb -0.02 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.80 1r7d h ASP 10 CO -0.02 0.72 0.38 -0.25 -2.88 0.00 0.00 179.24 177.18 1r7d h TRP 11 N 0.70 1.12 -0.77 0.28 7.01 -0.89 -1.50 115.95 121.89 1r7d h TRP 11 Ca 0.17 -0.05 0.01 0.00 2.11 0.00 0.00 58.89 61.13 1r7d h TRP 11 Cb 0.23 -0.35 -0.04 0.00 -2.10 0.00 0.00 29.16 26.90 1r7d h TRP 11 CO 0.01 0.81 0.50 0.82 -2.79 0.00 0.00 178.44 177.79 1r7d h ILE 12 N 1.11 1.20 -0.14 2.65 2.04 -0.93 -0.31 117.51 123.13 1r7d h ILE 12 Ca 0.27 -0.37 -0.14 0.00 1.00 0.00 0.00 64.86 65.62 1r7d h ILE 12 Cb 0.11 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.25 1r7d h ILE 12 CO -0.04 0.19 -0.51 0.00 0.00 0.00 0.00 178.15 177.80 1r7d h GLU 14 N 0.30 0.73 -0.57 0.00 4.81 -0.30 -2.70 114.58 116.85 1r7d h GLU 14 Ca 0.01 -0.38 -0.03 0.00 -0.13 0.00 0.00 59.36 58.83 1r7d h GLU 14 Cb 1.00 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.36 1r7d h GLU 14 CO 0.09 1.00 0.22 0.28 -0.73 0.00 0.00 179.01 179.86 1r7d h VAL 15 N 0.49 1.21 -0.12 0.32 2.07 -1.05 0.38 116.25 119.55 1r7d h VAL 15 Ca 0.05 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 1r7d h VAL 15 Cb 0.85 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1r7d h VAL 15 CO 0.07 0.26 0.01 0.25 0.02 0.00 0.00 177.57 178.18 1r7d h LEU 16 N 0.82 0.21 -0.47 2.57 6.46 -1.38 0.17 115.31 123.69 1r7d h LEU 16 Ca 0.19 -0.30 -0.12 0.00 -0.12 0.00 0.00 57.88 57.54 1r7d h LEU 16 Cb 0.18 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 1r7d h LEU 16 CO -0.02 0.45 -0.17 -1.28 -0.62 0.00 0.00 178.44 176.80 1r7d h SER 17 N -0.05 0.97 -0.09 1.25 0.87 -1.29 -3.00 113.55 112.22 1r7d h SER 17 Ca 0.04 -0.38 -0.11 0.00 -1.23 0.00 0.00 61.79 60.10 1r7d h SER 17 Cb 0.34 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1r7d h SER 17 CO 0.01 1.14 -0.30 -0.78 -0.53 0.00 0.00 176.83 176.37 1r7d h ASP 18 N 0.80 0.57 -0.62 6.23 1.82 -0.88 -3.12 116.42 121.23 1r7d h ASP 18 Ca 0.11 -0.22 0.13 0.00 -0.39 0.00 0.00 57.03 56.67 1r7d h ASP 18 Cb 0.74 -0.16 -0.11 0.00 0.68 0.00 0.00 39.33 40.49 1r7d h ASP 18 CO 0.06 0.84 -0.04 0.15 -1.61 0.00 0.00 179.24 178.64 1r7d h PHE 19 N 0.48 -0.11 -0.41 0.28 3.04 -0.50 1.20 116.94 120.93 1r7d h PHE 19 Ca 0.06 0.05 -0.03 0.00 3.98 0.00 0.00 57.97 62.03 1r7d h PHE 19 Cb 0.76 0.15 -0.02 0.00 2.56 0.00 0.00 35.95 39.40 1r7d h PHE 19 CO 0.03 -0.20 0.15 -0.22 -2.02 0.00 0.00 178.31 176.05 1r7d h LYS 20 N 0.08 0.62 -0.28 1.11 3.64 -1.59 -2.63 116.57 117.51 1r7d h LYS 20 Ca 0.32 -0.12 -0.15 0.00 -1.27 0.00 0.00 60.65 59.43 1r7d h LYS 20 Cb 0.52 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1r7d h LYS 20 CO -0.56 0.59 -0.45 1.15 -2.27 0.00 0.00 179.45 177.92 1r7d h THR 21 N 0.51 1.29 -0.24 1.00 2.02 -1.13 -2.41 112.91 113.95 1r7d h THR 21 Ca 0.13 -1.64 0.05 0.00 0.77 0.00 0.00 66.41 65.73 1r7d h THR 21 Cb 0.22 1.55 -0.05 0.00 -1.74 0.00 0.00 68.15 68.13 1r7d h THR 21 CO -0.01 0.53 -0.07 -0.25 0.37 0.00 0.00 175.52 176.09 1r7d h TRP 22 N 0.58 -0.16 -0.58 3.16 7.01 0.16 0.63 115.95 126.75 1r7d h TRP 22 Ca 0.04 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.00 1r7d h TRP 22 Cb 1.00 0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 28.15 1r7d h TRP 22 CO 0.05 -0.12 0.12 -0.07 -2.79 0.00 0.00 178.44 175.63 1r7d h LEU 23 N -0.02 0.91 -0.28 0.65 4.07 -1.45 0.06 115.31 119.24 1r7d h LEU 23 Ca 0.12 -0.25 -0.05 0.00 0.08 0.00 0.00 57.88 57.78 1r7d h LEU 23 Cb 0.20 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.69 1r7d h LEU 23 CO -0.26 0.92 -0.02 0.11 -1.08 0.00 0.00 178.44 178.11 1r7d h LYS 24 N 0.85 0.51 -0.14 1.13 1.57 -0.86 -2.99 116.57 116.65 1r7d h LYS 24 Ca 0.18 -0.17 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1r7d h LYS 24 Cb 0.38 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1r7d h LYS 24 CO 0.01 0.68 -0.33 0.00 -0.57 0.00 0.00 179.45 179.23 1r7d h ALA 25 N 0.81 1.18 -0.60 3.86 0.00 0.33 0.30 119.26 125.14 1r7d h ALA 25 Ca 0.08 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.65 1r7d h ALA 25 Cb 0.46 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1r7d h ALA 25 CO 0.02 0.54 0.37 0.87 0.00 0.00 0.00 179.25 181.05 1r7d h LYS 26 N 0.24 0.71 0.00 0.00 1.79 -0.83 -1.38 116.57 117.10 1r7d h LYS 26 Ca 0.03 -0.04 -0.15 0.00 -2.18 0.00 0.00 60.65 58.30 1r7d h LYS 26 Cb 0.71 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 1r7d h LYS 26 CO 0.05 0.47 -1.61 1.47 -1.08 0.00 0.00 179.45 178.75 1r7d n LEU 27 N -4.73 0.59 -3.43 2.94 -0.00 -1.16 -4.66 117.00 106.55 1r7d n LEU 27 Ca 0.05 0.25 -0.27 0.00 -0.00 0.00 0.00 56.01 56.05 1r7d n LEU 27 Cb 0.08 0.11 -0.10 0.00 -0.00 0.00 0.00 43.42 43.51 1r7d n LEU 27 CO 0.33 0.14 -0.29 0.23 -0.00 0.00 0.00 177.39 177.80 1r7d n MET 28 N -2.74 0.36 -1.25 1.47 2.81 0.11 -5.12 117.12 112.75 1r7d n MET 28 Ca -0.11 -3.29 -0.30 0.00 -1.81 0.00 0.00 57.70 52.18 1r7d n MET 28 Cb 0.81 -1.71 0.24 0.00 -0.71 0.00 0.00 33.22 31.86 1r7d n MET 28 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1r7d s PRO 29 N -0.14 -1.12 -0.35 0.03 0.04 -0.53 -4.08 135.00 128.85 1r7d s PRO 29 Ca 0.32 -0.24 0.15 0.00 0.04 0.00 0.00 61.00 61.27 1r7d s PRO 29 Cb 0.04 -1.62 0.43 0.00 0.04 0.00 0.00 34.50 33.39 1r7d s PRO 29 CO -0.19 -3.61 1.09 0.00 0.04 0.00 0.00 177.00 174.33 1r7d n GLN 30 N -4.65 1.16 0.00 4.56 10.64 -1.26 -5.03 117.38 122.80 1r7d n GLN 30 Ca 0.15 -2.74 0.10 0.00 -1.83 0.00 0.00 57.00 52.69 1r7d n GLN 30 Cb 0.60 -0.82 0.09 0.00 -0.86 0.00 0.00 30.24 29.24 1r7d n GLN 30 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.06 175.12