#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 0.60 -0.34 -0.14 4.05 -2.05 -2.45 114.93 114.60 2r5d h MET 2 Ca 0.00 -0.25 0.06 0.00 -0.28 0.00 0.00 59.70 59.23 2r5d h MET 2 Cb 0.00 -0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 30.72 2r5d h MET 2 CO 0.00 0.82 0.03 -0.22 0.23 0.00 0.00 176.91 177.77 2r5d h LYS 3 N 0.52 0.13 -0.63 0.39 1.63 -2.05 -1.08 116.57 115.49 2r5d h LYS 3 Ca 0.07 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2r5d h LYS 3 Cb 0.74 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.31 2r5d h LYS 3 CO 0.06 0.08 0.41 0.37 -3.45 0.00 0.00 179.45 176.92 2r5d h GLN 4 N 0.13 0.83 -0.29 1.90 4.15 -1.92 0.95 115.11 120.86 2r5d h GLN 4 Ca 0.16 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.55 2r5d h GLN 4 Cb 0.21 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 2r5d h GLN 4 CO -0.25 0.56 0.14 0.82 -1.93 0.00 0.00 178.83 178.17 2r5d h ILE 5 N 0.85 0.99 -0.27 2.39 2.04 -1.20 0.69 117.51 122.99 2r5d h ILE 5 Ca 0.23 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 2r5d h ILE 5 Cb -0.09 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2r5d h ILE 5 CO -0.05 0.06 0.11 -0.33 0.00 0.00 0.00 178.15 177.94 2r5d h GLU 6 N 0.30 0.40 -0.27 2.37 5.08 -0.78 -1.12 114.58 120.57 2r5d h GLU 6 Ca 0.12 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2r5d h GLU 6 Cb 0.04 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2r5d h GLU 6 CO -0.08 0.42 0.13 -0.44 -1.00 0.00 0.00 179.01 178.05 2r5d h ASP 7 N 0.29 0.20 -0.14 1.42 3.45 -0.69 -1.94 116.42 119.01 2r5d h ASP 7 Ca 0.09 0.01 -0.08 0.00 0.43 0.00 0.00 57.03 57.49 2r5d h ASP 7 Cb 0.17 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 38.90 2r5d h ASP 7 CO -0.01 0.15 -0.14 0.11 -1.57 0.00 0.00 179.24 177.78 2r5d h LYS 8 N 0.28 0.51 -0.26 3.56 1.57 -0.73 -1.01 116.57 120.49 2r5d h LYS 8 Ca 0.11 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 2r5d h LYS 8 Cb 0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 2r5d h LYS 8 CO -0.08 0.64 0.07 0.82 -0.57 0.00 0.00 179.45 180.34 2r5d h ILE 9 N 0.47 1.20 -0.87 1.86 2.04 -1.01 -1.12 117.51 120.07 2r5d h ILE 9 Ca 0.08 -0.66 0.07 0.00 1.00 0.00 0.00 64.86 65.35 2r5d h ILE 9 Cb 0.52 1.15 -0.06 0.00 -0.74 0.00 0.00 36.82 37.69 2r5d h ILE 9 CO 0.03 0.21 0.54 -0.33 0.00 0.00 0.00 178.15 178.61 2r5d h GLU 10 N 0.25 0.94 -0.65 2.37 5.08 -0.73 -1.13 114.58 120.71 2r5d h GLU 10 Ca 0.08 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.33 2r5d h GLU 10 Cb 0.26 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2r5d h GLU 10 CO -0.00 0.62 0.18 0.93 -1.00 0.00 0.00 179.01 179.75 2r5d h GLU 11 N 0.97 1.03 -0.27 2.33 5.08 -0.97 -1.92 114.58 120.82 2r5d h GLU 11 Ca 0.39 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.50 2r5d h GLU 11 Cb 0.20 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2r5d h GLU 11 CO -0.18 0.91 0.10 0.82 -1.00 0.00 0.00 179.01 179.66 2r5d h ILE 12 N 0.95 1.18 -0.77 3.13 2.04 -0.83 -0.23 117.51 122.98 2r5d h ILE 12 Ca 0.21 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 2r5d h ILE 12 Cb 0.33 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.41 2r5d h ILE 12 CO -0.00 0.19 0.40 -0.33 0.00 0.00 0.00 178.15 178.41 2r5d h GLU 13 N 0.28 1.09 -0.34 2.37 5.08 -1.09 0.25 114.58 122.23 2r5d h GLU 13 Ca 0.09 -0.14 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2r5d h GLU 13 Cb 0.20 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2r5d h GLU 13 CO -0.01 0.82 0.08 0.77 -1.00 0.00 0.00 179.01 179.68 2r5d h SER 14 N 1.08 0.53 -0.07 1.42 0.02 -1.22 -2.28 113.55 113.02 2r5d h SER 14 Ca 0.27 -0.24 -0.05 0.00 -0.84 0.00 0.00 61.79 60.93 2r5d h SER 14 Cb 0.07 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 2r5d h SER 14 CO -0.04 0.63 -0.08 0.50 -1.14 0.00 0.00 176.83 176.69 2r5d h LYS 15 N 0.40 0.34 -0.45 3.45 1.63 -0.66 -1.64 116.57 119.65 2r5d h LYS 15 Ca 0.11 -0.08 -0.12 0.00 -0.85 0.00 0.00 60.65 59.71 2r5d h LYS 15 Cb 0.31 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.88 2r5d h LYS 15 CO 0.00 0.44 -0.20 0.37 -3.45 0.00 0.00 179.45 176.61 2r5d h GLN 16 N 0.33 0.89 -0.51 1.90 4.15 -0.73 -0.52 115.11 120.62 2r5d h GLN 16 Ca 0.07 -0.36 -0.09 0.00 0.77 0.00 0.00 58.65 59.04 2r5d h GLN 16 Cb 0.36 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.99 2r5d h GLN 16 CO 0.02 1.01 -0.03 0.87 -1.93 0.00 0.00 178.83 178.77 2r5d h LYS 17 N 0.78 0.93 -0.22 1.69 1.57 -1.10 -0.59 116.57 119.62 2r5d h LYS 17 Ca 0.11 -0.31 0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2r5d h LYS 17 Cb 0.75 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2r5d h LYS 17 CO 0.06 0.96 -0.04 -0.22 -0.57 0.00 0.00 179.45 179.64 2r5d h LYS 18 N 0.79 0.02 -0.33 3.15 3.64 -1.03 -0.88 116.57 121.93 2r5d h LYS 18 Ca 0.14 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2r5d h LYS 18 Cb 0.56 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 2r5d h LYS 18 CO 0.03 0.01 0.17 0.82 -2.27 0.00 0.00 179.45 178.22 2r5d h ILE 19 N 0.02 1.14 -0.99 2.00 2.04 -0.93 -1.60 117.51 119.19 2r5d h ILE 19 Ca 0.11 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.61 2r5d h ILE 19 Cb 0.15 0.80 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 2r5d h ILE 19 CO -0.21 0.15 0.65 -0.33 0.00 0.00 0.00 178.15 178.41 2r5d h GLU 20 N 0.41 1.24 -0.32 2.37 5.08 -0.90 0.30 114.58 122.75 2r5d h GLU 20 Ca 0.12 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2r5d h GLU 20 Cb 0.08 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 2r5d h GLU 20 CO -0.02 0.82 0.15 -0.91 -1.00 0.00 0.00 179.01 178.06 2r5d h ASN 21 N 1.28 0.43 -0.63 1.42 2.35 -0.89 -0.87 115.58 118.67 2r5d h ASN 21 Ca 0.39 -0.13 0.02 0.00 -0.55 0.00 0.00 56.30 56.03 2r5d h ASN 21 Cb -0.04 -0.11 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 2r5d h ASN 21 CO -0.11 0.44 0.40 -0.33 -1.65 0.00 0.00 177.43 176.17 2r5d h GLU 22 N 0.39 0.77 -0.20 0.81 5.08 -0.84 -2.50 114.58 118.10 2r5d h GLU 22 Ca 0.11 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2r5d h GLU 22 Cb 0.13 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2r5d h GLU 22 CO -0.01 0.51 0.12 0.82 -1.00 0.00 0.00 179.01 179.45 2r5d h ILE 23 N 0.80 1.04 -0.65 3.13 2.04 -0.76 -0.69 117.51 122.41 2r5d h ILE 23 Ca 0.24 -0.09 0.14 0.00 1.00 0.00 0.00 64.86 66.15 2r5d h ILE 23 Cb -0.02 0.76 -0.10 0.00 -0.74 0.00 0.00 36.82 36.72 2r5d h ILE 23 CO -0.08 0.05 0.07 0.00 0.00 0.00 0.00 178.15 178.19 2r5d h ALA 24 N 1.08 0.73 -0.21 1.87 0.00 -0.95 0.06 119.26 121.83 2r5d h ALA 24 Ca 0.07 0.18 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 2r5d h ALA 24 Cb -0.02 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2r5d h ALA 24 CO -0.02 -0.37 -0.34 0.00 0.00 0.00 0.00 179.25 178.53 2r5d h ARG 25 N 0.18 0.61 -0.59 0.00 3.08 -1.19 -2.46 114.38 114.00 2r5d h ARG 25 Ca 0.35 -0.37 0.05 0.00 0.07 0.00 0.00 59.98 60.09 2r5d h ARG 25 Cb 0.58 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.61 2r5d h ARG 25 CO -0.51 0.97 0.31 0.82 -1.07 0.00 0.00 179.97 180.49 2r5d h ILE 26 N 0.29 0.95 -0.77 2.04 2.04 -0.76 -2.15 117.51 119.16 2r5d h ILE 26 Ca 0.02 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 2r5d h ILE 26 Cb 0.92 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 2r5d h ILE 26 CO 0.08 0.11 0.26 0.11 0.00 0.00 0.00 178.15 178.70 2r5d h LYS 27 N 0.58 1.18 -0.32 2.37 1.57 -0.82 -0.47 116.57 120.66 2r5d h LYS 27 Ca 0.26 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2r5d h LYS 27 Cb 0.17 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 2r5d h LYS 27 CO -0.18 0.99 0.11 0.87 -0.57 0.00 0.00 179.45 180.67 2r5d h LYS 28 N 1.14 0.50 -0.59 3.15 1.57 -1.17 -0.92 116.57 120.24 2r5d h LYS 28 Ca 0.25 -0.10 -0.10 0.00 -1.87 0.00 0.00 60.65 58.83 2r5d h LYS 28 Cb 0.28 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2r5d h LYS 28 CO -0.01 0.53 -0.01 1.25 -0.57 0.00 0.00 179.45 180.63 2r5d h LEU 29 N 0.37 1.03 -0.74 2.94 5.85 -1.07 -2.08 115.31 121.60 2r5d h LEU 29 Ca 0.10 -0.31 0.02 0.00 0.84 0.00 0.00 57.88 58.53 2r5d h LEU 29 Cb 0.23 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 2r5d h LEU 29 CO -0.00 1.09 0.48 0.25 -0.34 0.00 0.00 178.44 179.92 2r5d h LEU 30 N 0.95 0.82 -1.03 2.25 5.85 -0.97 -0.57 115.31 122.61 2r5d h LEU 30 Ca 0.17 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2r5d h LEU 30 Cb 0.57 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 2r5d h LEU 30 CO 0.03 0.58 0.44 1.56 -0.34 0.00 0.00 178.44 180.71 2r5d h GLN 31 N 0.97 1.12 -0.34 1.25 1.08 -0.84 -1.52 115.11 116.83 2r5d h GLN 31 Ca 0.28 -0.13 0.02 0.00 -1.45 0.00 0.00 58.65 57.38 2r5d h GLN 31 Cb -0.06 -0.22 -0.03 0.00 -0.05 0.00 0.00 27.48 27.12 2r5d h GLN 31 CO -0.08 0.82 0.17 -0.07 -0.95 0.00 0.00 178.83 178.72 2r5d h LEU 32 N 1.13 0.24 -0.80 1.46 3.38 -0.64 -1.99 115.31 118.09 2r5d h LEU 32 Ca 0.28 0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.19 2r5d h LEU 32 Cb 0.03 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2r5d h LEU 32 CO -0.05 0.18 0.04 0.71 0.09 0.00 0.00 178.44 179.42 2r5d h THR 33 N 0.34 1.25 -0.32 0.22 1.35 -0.73 0.13 112.91 115.16 2r5d h THR 33 Ca 0.14 -1.03 0.04 0.00 -0.55 0.00 0.00 66.41 65.01 2r5d h THR 33 Cb 0.06 0.77 -0.04 0.00 -1.73 0.00 0.00 68.15 67.20 2r5d h THR 33 CO -0.10 0.38 0.10 0.58 -0.25 0.00 0.00 175.52 176.23 2r5d h VAL 34 N 0.89 0.90 -0.51 6.82 2.07 -1.17 -0.34 116.25 124.91 2r5d h VAL 34 Ca 0.17 -0.08 0.01 0.00 0.82 0.00 0.00 66.70 67.62 2r5d h VAL 34 Cb 0.46 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 2r5d h VAL 34 CO 0.02 0.04 0.34 -0.25 0.02 0.00 0.00 177.57 177.74 2r5d h TRP 35 N 0.24 0.64 -0.68 1.57 7.01 -0.82 -1.68 115.95 122.23 2r5d h TRP 35 Ca 0.15 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.12 2r5d h TRP 35 Cb 0.12 -0.22 -0.03 0.00 -2.10 0.00 0.00 29.16 26.94 2r5d h TRP 35 CO -0.14 0.40 0.28 0.78 -2.79 0.00 0.00 178.44 176.97 2r5d h GLY 36 N 0.69 1.09 0.99 2.65 0.00 -0.63 -1.00 103.07 106.86 2r5d h GLY 36 Ca 0.19 -0.59 -0.04 0.00 0.00 0.00 0.00 47.33 46.90 2r5d h GLY 36 CO -0.04 0.55 0.22 -2.22 0.00 0.00 0.00 176.54 175.05 2r5d h ILE 37 N 0.96 1.23 -0.37 2.60 2.04 -0.84 -0.48 117.51 122.66 2r5d h ILE 37 Ca 0.23 -0.73 0.03 0.00 1.00 0.00 0.00 64.86 65.39 2r5d h ILE 37 Cb 0.20 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2r5d h ILE 37 CO -0.02 0.28 0.16 0.50 0.00 0.00 0.00 178.15 179.07 2r5d h LYS 38 N 0.80 0.33 0.01 2.37 3.64 -0.94 -0.55 116.57 122.23 2r5d h LYS 38 Ca 0.19 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 2r5d h LYS 38 Cb 0.22 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2r5d h LYS 38 CO -0.01 0.22 -0.10 1.96 -2.27 0.00 0.00 179.45 179.24 2r5d h GLN 39 N 0.34 -0.18 -0.70 1.90 1.08 -0.85 -2.64 115.11 114.07 2r5d h GLN 39 Ca 0.16 0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.32 2r5d h GLN 39 Cb 0.09 0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.53 2r5d h GLN 39 CO -0.13 -0.12 0.22 -0.07 -0.95 0.00 0.00 178.83 177.78 2r5d h LEU 40 N -0.18 1.00 -0.22 1.46 3.38 -0.70 0.22 115.31 120.26 2r5d h LEU 40 Ca 0.03 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.86 2r5d h LEU 40 Cb 0.23 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2r5d h LEU 40 CO -0.10 0.92 0.05 -0.61 0.09 0.00 0.00 178.44 178.80 2r5d h GLN 41 N 1.03 0.13 -0.13 1.13 4.15 -1.03 0.74 115.11 121.13 2r5d h GLN 41 Ca 0.23 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.62 2r5d h GLN 41 Cb 0.28 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2r5d h GLN 41 CO -0.01 0.09 0.02 0.00 -1.93 0.00 0.00 178.83 177.00 2r5d h ALA 42 N 1.15 0.17 0.07 3.38 0.00 -1.04 -1.78 119.26 121.22 2r5d h ALA 42 Ca 0.10 -0.15 -0.25 0.00 0.00 0.00 0.00 54.91 54.61 2r5d h ALA 42 Cb 0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2r5d h ALA 42 CO -0.13 -0.18 -1.16 0.00 0.00 0.00 0.00 179.25 177.78 2r5d h ARG 43 N -0.00 0.14 0.00 0.00 -0.00 -0.43 -3.36 114.38 110.73 2r5d h ARG 43 Ca 0.04 -0.25 -0.08 0.00 -0.50 0.00 0.00 59.98 59.19 2r5d h ARG 43 Cb 0.28 0.09 -0.01 0.00 0.00 0.00 0.00 29.97 30.33 2r5d h ARG 43 CO 0.00 1.10 -0.63 0.82 0.00 0.00 0.00 179.97 181.26 2r5d h ILE 44 N 0.04 0.53 -0.01 2.04 2.04 -0.97 -3.50 117.51 117.68 2r5d h ILE 44 Ca -0.09 -1.57 0.00 0.00 1.00 0.00 0.00 64.86 64.20 2r5d h ILE 44 Cb 1.89 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 39.14 2r5d h ILE 44 CO 0.17 0.18 0.00 0.18 0.00 0.00 0.00 178.15 178.68