#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r5d h MET 2 N 0.00 0.87 -0.41 5.56 2.86 -2.06 -2.21 114.93 119.54 2r5d h MET 2 Ca 0.00 -0.27 0.01 0.00 -2.06 0.00 0.00 59.70 57.38 2r5d h MET 2 Cb 0.00 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 2r5d h MET 2 CO 0.00 0.90 0.25 -0.22 1.06 0.00 0.00 176.91 178.90 2r5d h LYS 3 N 0.73 0.49 -0.70 1.72 1.63 -2.06 -1.66 116.57 116.73 2r5d h LYS 3 Ca 0.14 -0.03 0.06 0.00 -0.85 0.00 0.00 60.65 59.97 2r5d h LYS 3 Cb 0.50 -0.11 -0.06 0.00 -0.60 0.00 0.00 32.23 31.96 2r5d h LYS 3 CO 0.02 0.33 0.39 1.96 -3.45 0.00 0.00 179.45 178.70 2r5d h GLN 4 N 0.51 0.70 -0.14 1.90 1.08 -1.99 -1.09 115.11 116.07 2r5d h GLN 4 Ca 0.16 -0.04 0.01 0.00 -1.45 0.00 0.00 58.65 57.32 2r5d h GLN 4 Cb -0.02 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.25 2r5d h GLN 4 CO -0.06 0.46 0.08 0.82 -0.95 0.00 0.00 178.83 179.18 2r5d h ILE 5 N 0.72 1.01 -0.68 2.54 2.04 -1.12 -2.36 117.51 119.66 2r5d h ILE 5 Ca 0.32 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 66.10 2r5d h ILE 5 Cb 0.20 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 2r5d h ILE 5 CO -0.19 0.03 0.36 -0.33 0.00 0.00 0.00 178.15 178.02 2r5d h GLU 6 N 0.17 0.94 -0.32 2.37 5.08 -0.86 -0.36 114.58 121.61 2r5d h GLU 6 Ca 0.06 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.24 2r5d h GLU 6 Cb -0.00 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.05 2r5d h GLU 6 CO -0.03 0.71 -0.05 -0.44 -1.00 0.00 0.00 179.01 178.20 2r5d h ASP 7 N 0.95 0.60 -0.71 1.42 3.45 -1.11 -2.06 116.42 118.96 2r5d h ASP 7 Ca 0.24 -0.35 -0.06 0.00 0.43 0.00 0.00 57.03 57.29 2r5d h ASP 7 Cb 0.05 -0.16 -0.03 0.00 -0.56 0.00 0.00 39.33 38.62 2r5d h ASP 7 CO -0.04 0.81 0.22 0.11 -1.57 0.00 0.00 179.24 178.77 2r5d h LYS 8 N 0.38 1.11 -0.32 3.56 1.57 -1.11 -1.92 116.57 119.84 2r5d h LYS 8 Ca 0.08 -0.23 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2r5d h LYS 8 Cb 0.53 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 2r5d h LYS 8 CO 0.03 0.94 0.21 0.82 -0.57 0.00 0.00 179.45 180.88 2r5d h ILE 9 N 1.07 1.07 -0.59 1.86 2.04 -0.96 0.08 117.51 122.08 2r5d h ILE 9 Ca 0.23 -0.15 0.07 0.00 1.00 0.00 0.00 64.86 66.02 2r5d h ILE 9 Cb 0.30 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 36.92 2r5d h ILE 9 CO -0.01 0.08 0.26 -0.33 0.00 0.00 0.00 178.15 178.15 2r5d h GLU 10 N 0.42 0.46 -0.25 2.37 5.08 -1.18 -0.50 114.58 120.99 2r5d h GLU 10 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2r5d h GLU 10 Cb -0.03 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2r5d h GLU 10 CO -0.04 0.31 0.17 1.49 -1.00 0.00 0.00 179.01 179.94 2r5d h GLU 11 N 0.48 0.33 -0.44 2.33 4.81 -0.88 -1.17 114.58 120.04 2r5d h GLU 11 Ca 0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2r5d h GLU 11 Cb 0.28 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2r5d h GLU 11 CO -0.24 0.22 0.29 0.82 -0.73 0.00 0.00 179.01 179.37 2r5d h ILE 12 N 0.34 1.11 -0.60 2.32 2.04 -0.69 -1.76 117.51 120.27 2r5d h ILE 12 Ca 0.09 -0.20 0.03 0.00 1.00 0.00 0.00 64.86 65.78 2r5d h ILE 12 Cb -0.04 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 2r5d h ILE 12 CO -0.02 0.11 0.36 -0.33 0.00 0.00 0.00 178.15 178.27 2r5d h GLU 13 N 0.59 0.69 -0.85 2.37 5.08 -0.85 -0.83 114.58 120.77 2r5d h GLU 13 Ca 0.16 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.49 2r5d h GLU 13 Cb -0.07 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 28.98 2r5d h GLU 13 CO -0.04 0.46 0.56 1.03 -1.00 0.00 0.00 179.01 180.03 2r5d h SER 14 N 0.71 0.97 -0.25 1.42 0.87 -0.96 -1.93 113.55 114.38 2r5d h SER 14 Ca 0.25 -0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.65 2r5d h SER 14 Cb 0.04 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2r5d h SER 14 CO -0.11 0.70 -0.32 0.50 -0.53 0.00 0.00 176.83 177.07 2r5d h LYS 15 N 1.15 0.76 -0.68 2.24 1.63 -0.88 -2.06 116.57 118.73 2r5d h LYS 15 Ca 0.32 -0.35 -0.04 0.00 -0.85 0.00 0.00 60.65 59.73 2r5d h LYS 15 Cb -0.11 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.47 2r5d h LYS 15 CO -0.07 0.97 0.29 1.96 -3.45 0.00 0.00 179.45 179.14 2r5d h GLN 16 N 0.64 1.01 -0.61 1.90 4.20 -0.81 0.74 115.11 122.19 2r5d h GLN 16 Ca 0.07 -0.17 -0.00 0.00 0.06 0.00 0.00 58.65 58.60 2r5d h GLN 16 Cb 0.85 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 28.43 2r5d h GLN 16 CO 0.07 0.83 0.36 0.87 -0.67 0.00 0.00 178.83 180.29 2r5d h LYS 17 N 0.96 0.83 -0.68 1.46 1.57 -1.21 -0.64 116.57 118.86 2r5d h LYS 17 Ca 0.23 -0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.96 2r5d h LYS 17 Cb 0.18 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 2r5d h LYS 17 CO -0.02 0.60 0.43 -0.22 -0.57 0.00 0.00 179.45 179.66 2r5d h LYS 18 N 0.82 0.82 -0.46 3.15 3.64 -0.77 -1.97 116.57 121.81 2r5d h LYS 18 Ca 0.22 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.50 2r5d h LYS 18 Cb -0.01 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 2r5d h LYS 18 CO -0.04 0.54 0.11 0.82 -2.27 0.00 0.00 179.45 178.61 2r5d h ILE 19 N 0.84 1.24 -0.69 2.00 2.04 -0.58 -0.61 117.51 121.75 2r5d h ILE 19 Ca 0.27 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 2r5d h ILE 19 Cb -0.00 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 36.95 2r5d h ILE 19 CO -0.10 0.30 0.38 -0.33 0.00 0.00 0.00 178.15 178.40 2r5d h GLU 20 N 0.61 0.94 -0.31 2.37 4.39 -0.92 0.19 114.58 121.85 2r5d h GLU 20 Ca 0.14 -0.10 -0.13 0.00 0.34 0.00 0.00 59.36 59.61 2r5d h GLU 20 Cb 0.33 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2r5d h GLU 20 CO 0.00 0.69 -0.34 -0.91 -1.16 0.00 0.00 179.01 177.29 2r5d h ASN 21 N 0.95 0.72 -0.69 1.42 4.21 -1.01 -1.60 115.58 119.59 2r5d h ASN 21 Ca 0.24 -0.30 -0.03 0.00 1.21 0.00 0.00 56.30 57.42 2r5d h ASN 21 Cb 0.01 -0.20 -0.03 0.00 -1.12 0.00 0.00 38.32 36.98 2r5d h ASN 21 CO -0.04 1.00 0.31 -0.33 -1.29 0.00 0.00 177.43 177.08 2r5d h GLU 22 N 0.58 1.02 -0.48 0.81 5.08 -0.51 -2.67 114.58 118.42 2r5d h GLU 22 Ca 0.06 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 2r5d h GLU 22 Cb 0.86 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2r5d h GLU 22 CO 0.07 0.82 -0.00 0.82 -1.00 0.00 0.00 179.01 179.72 2r5d h ILE 23 N 0.98 1.26 -0.53 3.13 2.04 -0.77 -0.36 117.51 123.25 2r5d h ILE 23 Ca 0.24 -1.07 0.09 0.00 1.00 0.00 0.00 64.86 65.12 2r5d h ILE 23 Cb 0.16 1.01 -0.07 0.00 -0.74 0.00 0.00 36.82 37.17 2r5d h ILE 23 CO -0.03 0.37 0.12 0.00 0.00 0.00 0.00 178.15 178.62 2r5d h ALA 24 N 0.92 0.62 -0.55 1.87 0.00 -1.27 -0.21 119.26 120.64 2r5d h ALA 24 Ca 0.13 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 2r5d h ALA 24 Cb 0.51 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2r5d h ALA 24 CO 0.02 -0.29 -0.05 0.00 0.00 0.00 0.00 179.25 178.93 2r5d h ARG 25 N 0.27 1.01 -0.40 0.00 3.08 -1.10 -2.47 114.38 114.76 2r5d h ARG 25 Ca 0.27 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 2r5d h ARG 25 Cb 0.36 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 2r5d h ARG 25 CO -0.34 1.03 0.21 0.82 -1.07 0.00 0.00 179.97 180.63 2r5d h ILE 26 N 0.88 1.16 -0.66 2.04 2.04 -0.69 -2.46 117.51 119.82 2r5d h ILE 26 Ca 0.15 -0.42 0.03 0.00 1.00 0.00 0.00 64.86 65.62 2r5d h ILE 26 Cb 0.61 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 2r5d h ILE 26 CO 0.04 0.16 0.41 0.11 0.00 0.00 0.00 178.15 178.87 2r5d h LYS 27 N 0.51 0.78 -0.34 2.37 1.57 -0.90 0.65 116.57 121.21 2r5d h LYS 27 Ca 0.14 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2r5d h LYS 27 Cb 0.07 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2r5d h LYS 27 CO -0.02 0.52 0.19 0.87 -0.57 0.00 0.00 179.45 180.44 2r5d h LYS 28 N 0.80 0.46 -0.33 3.15 1.57 -1.26 -0.51 116.57 120.46 2r5d h LYS 28 Ca 0.26 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.85 2r5d h LYS 28 Cb 0.02 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 2r5d h LYS 28 CO -0.10 0.38 -0.34 1.25 -0.57 0.00 0.00 179.45 180.06 2r5d h LEU 29 N 0.42 0.87 -0.88 2.94 5.85 -1.11 -2.41 115.31 121.00 2r5d h LEU 29 Ca 0.12 -0.47 0.04 0.00 0.84 0.00 0.00 57.88 58.40 2r5d h LEU 29 Cb 0.04 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.77 2r5d h LEU 29 CO -0.02 1.17 0.56 0.25 -0.34 0.00 0.00 178.44 180.06 2r5d h LEU 30 N 0.59 0.93 -1.41 2.25 5.85 -0.81 -0.98 115.31 121.75 2r5d h LEU 30 Ca 0.05 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2r5d h LEU 30 Cb 0.93 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 2r5d h LEU 30 CO 0.08 0.63 0.24 1.56 -0.34 0.00 0.00 178.44 180.62 2r5d h GLN 31 N 1.08 0.64 -0.61 1.25 1.08 -0.81 -1.62 115.11 116.13 2r5d h GLN 31 Ca 0.35 -0.07 -0.10 0.00 -1.45 0.00 0.00 58.65 57.39 2r5d h GLN 31 Cb 0.03 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.31 2r5d h GLN 31 CO -0.13 0.49 0.01 -0.07 -0.95 0.00 0.00 178.83 178.18 2r5d h LEU 32 N 0.65 1.05 -0.59 1.46 3.38 -0.87 -2.30 115.31 118.08 2r5d h LEU 32 Ca 0.17 -0.30 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2r5d h LEU 32 Cb 0.04 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2r5d h LEU 32 CO -0.03 1.10 -0.02 0.71 0.09 0.00 0.00 178.44 180.29 2r5d h THR 33 N 0.97 1.27 -0.17 0.22 1.35 -0.61 -0.48 112.91 115.45 2r5d h THR 33 Ca 0.17 -1.17 0.03 0.00 -0.55 0.00 0.00 66.41 64.89 2r5d h THR 33 Cb 0.56 0.84 -0.03 0.00 -1.73 0.00 0.00 68.15 67.78 2r5d h THR 33 CO 0.03 0.42 -0.03 0.58 -0.25 0.00 0.00 175.52 176.27 2r5d h VAL 34 N 0.95 0.84 -0.35 6.82 2.07 -1.23 -0.90 116.25 124.45 2r5d h VAL 34 Ca 0.17 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.71 2r5d h VAL 34 Cb 0.58 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2r5d h VAL 34 CO 0.03 0.00 0.15 -0.25 0.02 0.00 0.00 177.57 177.52 2r5d h TRP 35 N 0.02 0.26 -0.92 1.57 7.01 -1.16 -1.32 115.95 121.41 2r5d h TRP 35 Ca 0.08 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.10 2r5d h TRP 35 Cb 0.12 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.07 2r5d h TRP 35 CO -0.19 0.13 0.57 0.78 -2.79 0.00 0.00 178.44 176.94 2r5d h GLY 36 N 0.31 1.32 0.84 2.65 0.00 -0.74 0.13 103.07 107.57 2r5d h GLY 36 Ca 0.16 -0.53 -0.04 0.00 0.00 0.00 0.00 47.33 46.92 2r5d h GLY 36 CO -0.14 0.52 0.00 -2.22 0.00 0.00 0.00 176.54 174.70 2r5d h ILE 37 N 1.26 1.25 -0.62 2.60 2.04 -0.99 -0.92 117.51 122.12 2r5d h ILE 37 Ca 0.33 -0.89 0.10 0.00 1.00 0.00 0.00 64.86 65.41 2r5d h ILE 37 Cb -0.08 1.39 -0.08 0.00 -0.74 0.00 0.00 36.82 37.31 2r5d h ILE 37 CO -0.07 0.27 0.22 0.50 0.00 0.00 0.00 178.15 179.08 2r5d h LYS 38 N 0.17 0.38 0.06 2.37 3.64 -0.96 -1.23 116.57 121.00 2r5d h LYS 38 Ca 0.06 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2r5d h LYS 38 Cb 0.40 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 2r5d h LYS 38 CO 0.01 0.25 -0.03 0.37 -2.27 0.00 0.00 179.45 177.79 2r5d h GLN 39 N 0.39 -0.08 -0.59 1.90 5.75 -0.46 -1.08 115.11 120.94 2r5d h GLN 39 Ca 0.32 0.01 0.04 0.00 -0.15 0.00 0.00 58.65 58.86 2r5d h GLN 39 Cb 0.41 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.93 2r5d h GLN 39 CO -0.33 0.13 0.34 -0.07 -2.65 0.00 0.00 178.83 176.25 2r5d h LEU 40 N -0.27 0.53 -0.10 -2.39 3.38 -0.89 0.62 115.31 116.18 2r5d h LEU 40 Ca -0.01 0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2r5d h LEU 40 Cb 0.24 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2r5d h LEU 40 CO 0.01 0.36 0.01 -0.61 0.09 0.00 0.00 178.44 178.31 2r5d h GLN 41 N 0.66 0.05 -0.37 1.13 4.15 -1.12 -2.46 115.11 117.15 2r5d h GLN 41 Ca 0.25 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.64 2r5d h GLN 41 Cb 0.09 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 2r5d h GLN 41 CO -0.13 0.03 0.14 0.00 -1.93 0.00 0.00 178.83 176.94 2r5d h ALA 42 N 1.08 0.48 -0.15 3.38 0.00 -0.74 0.14 119.26 123.45 2r5d h ALA 42 Ca 0.05 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 2r5d h ALA 42 Cb 0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2r5d h ALA 42 CO -0.07 0.09 -0.41 0.00 0.00 0.00 0.00 179.25 178.86 2r5d h ARG 43 N 0.44 0.33 0.00 0.00 2.47 -0.85 -3.37 114.38 113.41 2r5d h ARG 43 Ca 0.12 -0.16 -0.31 0.00 -1.26 0.00 0.00 59.98 58.36 2r5d h ARG 43 Cb 0.21 -0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.48 2r5d h ARG 43 CO -0.01 0.70 -2.06 -0.89 0.56 0.00 0.00 179.97 178.26 2r5d n ILE 44 N -4.02 1.05 1.35 2.04 2.08 -0.93 -5.11 119.36 115.82 2r5d n ILE 44 Ca -0.02 -0.30 0.13 0.00 0.56 0.00 0.00 62.75 63.13 2r5d n ILE 44 Cb 0.49 -1.63 0.40 0.00 -0.75 0.00 0.00 39.64 38.15 2r5d n ILE 44 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29