#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1czq h MET 2 N 0.00 0.00 -1.00 -0.14 -0.00 -2.07 -2.84 114.93 108.88 1czq h MET 2 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 59.70 59.77 1czq h MET 2 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 31.60 31.53 1czq h MET 2 CO 0.00 0.33 0.65 -0.22 -0.00 0.00 0.00 176.91 177.67 1czq h LYS 3 N 0.00 1.14 -0.72 -0.10 3.11 -2.06 0.42 116.57 118.37 1czq h LYS 3 Ca -0.00 -0.07 0.01 0.00 -2.81 0.00 0.00 60.65 57.77 1czq h LYS 3 Cb 0.95 -0.26 -0.04 0.00 -1.00 0.00 0.00 32.23 31.89 1czq h LYS 3 CO 0.04 0.76 0.47 0.37 -2.81 0.00 0.00 179.45 178.28 1czq h GLN 4 N 1.18 0.95 -0.36 1.90 -0.00 -1.95 -1.33 115.11 115.50 1czq h GLN 4 Ca 0.43 -0.06 0.01 0.00 -0.00 0.00 0.00 58.65 59.03 1czq h GLN 4 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 27.48 27.41 1czq h GLN 4 CO -0.17 0.64 0.24 0.82 0.00 0.00 0.00 178.83 180.36 1czq h ILE 5 N 0.98 1.09 -0.14 2.39 2.04 -0.19 -0.62 117.51 123.06 1czq h ILE 5 Ca 0.26 -0.17 -0.18 0.00 1.00 0.00 0.00 64.86 65.78 1czq h ILE 5 Cb -0.10 0.56 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1czq h ILE 5 CO -0.06 0.09 -0.66 -0.33 0.00 0.00 0.00 178.15 177.19 1czq h GLU 6 N 0.49 0.55 -0.13 2.37 5.08 -0.60 -2.05 114.58 120.29 1czq h GLU 6 Ca 0.13 -0.41 -0.11 0.00 -1.00 0.00 0.00 59.36 57.97 1czq h GLU 6 Cb -0.04 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1czq h GLU 6 CO -0.03 1.03 -0.36 -0.44 -1.00 0.00 0.00 179.01 178.20 1czq h ASP 7 N 0.40 0.54 -0.40 1.42 3.32 -1.04 -1.30 116.42 119.36 1czq h ASP 7 Ca -0.02 -0.59 0.00 0.00 0.02 0.00 0.00 57.03 56.44 1czq h ASP 7 Cb 1.24 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 1czq h ASP 7 CO 0.12 1.04 0.26 0.07 -1.72 0.00 0.00 179.24 179.01 1czq h LYS 8 N 0.07 0.55 -0.34 3.56 2.10 -1.18 0.35 116.57 121.69 1czq h LYS 8 Ca -0.01 -0.04 -0.07 0.00 -2.00 0.00 0.00 60.65 58.53 1czq h LYS 8 Cb 0.98 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 32.18 1czq h LYS 8 CO 0.08 0.38 -0.07 0.82 -2.00 0.00 0.00 179.45 178.65 1czq h ILE 9 N 0.56 1.28 -0.10 0.07 2.04 -1.22 0.13 117.51 120.27 1czq h ILE 9 Ca 0.15 -1.12 -0.03 0.00 1.00 0.00 0.00 64.86 64.86 1czq h ILE 9 Cb -0.04 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 1czq h ILE 9 CO -0.03 0.37 -0.07 -0.08 0.00 0.00 0.00 178.15 178.33 1czq h GLU 10 N 0.44 0.15 -0.14 2.37 4.81 -0.23 0.20 114.58 122.17 1czq h GLU 10 Ca 0.09 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.23 1czq h GLU 10 Cb 0.57 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 1czq h GLU 10 CO 0.03 0.24 -0.14 1.49 -0.73 0.00 0.00 179.01 179.90 1czq h GLU 11 N 0.15 0.34 -0.93 1.92 4.57 -0.36 -1.44 114.58 118.83 1czq h GLU 11 Ca 0.03 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.02 1czq h GLU 11 Cb 0.23 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.78 1czq h GLU 11 CO 0.01 0.73 0.53 0.82 -1.18 0.00 0.00 179.01 179.92 1czq h ILE 12 N -0.03 1.26 -0.59 2.32 2.04 0.12 -0.97 117.51 121.66 1czq h ILE 12 Ca 0.02 -0.61 -0.05 0.00 1.00 0.00 0.00 64.86 65.22 1czq h ILE 12 Cb 0.67 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 1czq h ILE 12 CO 0.04 0.29 0.17 -0.33 0.00 0.00 0.00 178.15 178.31 1czq h GLU 13 N 1.29 0.90 -0.26 2.37 5.08 -0.91 -0.25 114.58 122.79 1czq h GLU 13 Ca 0.33 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.47 1czq h GLU 13 Cb -0.01 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1czq h GLU 13 CO -0.06 0.79 -0.00 1.03 -1.00 0.00 0.00 179.01 179.77 1czq h SER 14 N 0.87 0.46 -0.10 1.42 0.87 -0.44 -1.27 113.55 115.35 1czq h SER 14 Ca 0.19 -0.31 -0.06 0.00 -1.23 0.00 0.00 61.79 60.38 1czq h SER 14 Cb 0.28 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 1czq h SER 14 CO -0.01 0.65 -0.10 0.11 -0.53 0.00 0.00 176.83 176.96 1czq h LYS 15 N 0.25 0.42 -0.50 2.24 1.57 -0.90 -1.96 116.57 117.69 1czq h LYS 15 Ca 0.07 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1czq h LYS 15 Cb 0.42 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1czq h LYS 15 CO 0.01 0.53 0.15 0.37 -0.57 0.00 0.00 179.45 179.94 1czq h GLN 16 N 0.39 0.78 -0.74 3.15 4.15 -0.70 -0.69 115.11 121.46 1czq h GLN 16 Ca 0.08 -0.17 -0.05 0.00 0.77 0.00 0.00 58.65 59.28 1czq h GLN 16 Cb 0.42 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.97 1czq h GLN 16 CO 0.02 0.74 0.27 -0.22 -1.93 0.00 0.00 178.83 177.71 1czq h LYS 17 N 0.68 1.12 -0.65 1.69 1.63 -0.93 0.28 116.57 120.39 1czq h LYS 17 Ca 0.16 -0.22 -0.05 0.00 -0.85 0.00 0.00 60.65 59.70 1czq h LYS 17 Cb 0.29 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 1czq h LYS 17 CO -0.00 0.93 0.22 0.87 -3.45 0.00 0.00 179.45 178.01 1czq h LYS 18 N 1.07 0.98 -0.46 1.90 1.57 -1.05 -0.91 116.57 119.67 1czq h LYS 18 Ca 0.24 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 1czq h LYS 18 Cb 0.25 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1czq h LYS 18 CO -0.02 0.83 -0.06 0.82 -0.57 0.00 0.00 179.45 180.45 1czq h ILE 19 N 0.95 1.27 -0.51 1.86 2.04 -0.51 -1.21 117.51 121.40 1czq h ILE 19 Ca 0.21 -1.16 -0.07 0.00 1.00 0.00 0.00 64.86 64.85 1czq h ILE 19 Cb 0.25 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1czq h ILE 19 CO -0.01 0.40 0.03 -0.33 0.00 0.00 0.00 178.15 178.24 1czq h GLU 20 N 0.70 0.83 -0.34 2.37 5.08 -0.55 0.56 114.58 123.23 1czq h GLU 20 Ca 0.12 -0.22 -0.13 0.00 -1.00 0.00 0.00 59.36 58.13 1czq h GLU 20 Cb 0.59 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1czq h GLU 20 CO 0.04 0.82 -0.32 -0.91 -1.00 0.00 0.00 179.01 177.63 1czq h ASN 21 N 0.78 0.77 -0.42 1.42 2.35 -0.92 -1.35 115.58 118.22 1czq h ASN 21 Ca 0.16 -0.32 -0.07 0.00 -0.55 0.00 0.00 56.30 55.52 1czq h ASN 21 Cb 0.43 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1czq h ASN 21 CO 0.02 1.03 -0.01 -0.08 -1.65 0.00 0.00 177.43 176.74 1czq h GLU 22 N 0.63 0.75 -0.80 0.81 4.57 -0.78 -2.04 114.58 117.73 1czq h GLU 22 Ca 0.07 -0.25 -0.00 0.00 -1.18 0.00 0.00 59.36 58.00 1czq h GLU 22 Cb 0.85 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.34 1czq h GLU 22 CO 0.07 0.84 0.48 0.82 -1.18 0.00 0.00 179.01 180.05 1czq h ILE 23 N 0.59 1.22 -0.48 2.32 2.04 -0.69 -0.07 117.51 122.43 1czq h ILE 23 Ca 0.12 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.44 1czq h ILE 23 Cb 0.50 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1czq h ILE 23 CO 0.02 0.23 0.05 0.00 0.00 0.00 0.00 178.15 178.45 1czq h ALA 24 N 1.44 1.18 -0.32 1.87 0.00 -0.92 -0.72 119.26 121.78 1czq h ALA 24 Ca 0.29 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1czq h ALA 24 Cb -0.05 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1czq h ALA 24 CO -0.05 0.54 -0.12 0.00 0.00 0.00 0.00 179.25 179.62 1czq h ARG 25 N 0.73 0.65 -0.54 0.00 3.08 -0.57 -2.50 114.38 115.23 1czq h ARG 25 Ca 0.15 -0.27 0.01 0.00 0.07 0.00 0.00 59.98 59.94 1czq h ARG 25 Cb 0.38 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.37 1czq h ARG 25 CO 0.01 0.85 0.35 0.82 -1.07 0.00 0.00 179.97 180.93 1czq h ILE 26 N 0.43 1.11 -0.68 2.04 2.04 -0.69 -1.93 117.51 119.83 1czq h ILE 26 Ca 0.08 -0.24 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1czq h ILE 26 Cb 0.64 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1czq h ILE 26 CO 0.04 0.13 0.31 0.11 0.00 0.00 0.00 178.15 178.74 1czq h LYS 27 N 0.70 0.96 -0.51 2.37 1.57 -1.03 0.12 116.57 120.75 1czq h LYS 27 Ca 0.21 -0.13 -0.12 0.00 -1.87 0.00 0.00 60.65 58.73 1czq h LYS 27 Cb -0.04 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 1czq h LYS 27 CO -0.06 0.75 -0.16 0.87 -0.57 0.00 0.00 179.45 180.28 1czq h LYS 28 N 0.96 1.00 -0.25 3.15 1.57 -1.00 -0.72 116.57 121.29 1czq h LYS 28 Ca 0.23 -0.40 -0.18 0.00 -1.87 0.00 0.00 60.65 58.43 1czq h LYS 28 Cb 0.11 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.37 1czq h LYS 28 CO -0.03 1.08 -0.55 1.25 -0.57 0.00 0.00 179.45 180.63 1czq h LEU 29 N 0.87 0.84 -0.96 2.94 5.85 -1.02 -2.33 115.31 121.49 1czq h LEU 29 Ca 0.12 -0.45 -0.05 0.00 0.84 0.00 0.00 57.88 58.35 1czq h LEU 29 Cb 0.74 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.50 1czq h LEU 29 CO 0.06 1.22 0.22 0.25 -0.34 0.00 0.00 178.44 179.84 1czq h LEU 30 N 0.58 0.90 -1.19 2.25 5.85 -0.60 -0.96 115.31 122.13 1czq h LEU 30 Ca 0.01 -0.15 -0.06 0.00 0.84 0.00 0.00 57.88 58.53 1czq h LEU 30 Cb 1.14 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 1czq h LEU 30 CO 0.12 0.83 -0.03 1.56 -0.34 0.00 0.00 178.44 180.57 1czq h GLN 31 N 0.95 0.51 -0.56 1.25 1.08 -0.89 -1.18 115.11 116.28 1czq h GLN 31 Ca 0.21 -0.12 -0.10 0.00 -1.45 0.00 0.00 58.65 57.20 1czq h GLN 31 Cb 0.24 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 1czq h GLN 31 CO -0.01 0.57 -0.05 -0.07 -0.95 0.00 0.00 178.83 178.32 1czq h LEU 32 N 0.49 0.98 -0.77 1.46 3.38 -0.74 -1.76 115.31 118.35 1czq h LEU 32 Ca 0.10 -0.29 -0.12 0.00 0.09 0.00 0.00 57.88 57.66 1czq h LEU 32 Cb 0.37 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1czq h LEU 32 CO 0.02 1.06 -0.34 0.71 0.09 0.00 0.00 178.44 179.98 1czq h THR 33 N 0.90 1.29 -0.42 0.22 1.35 -0.57 0.14 112.91 115.82 1czq h THR 33 Ca 0.15 -1.45 -0.01 0.00 -0.55 0.00 0.00 66.41 64.56 1czq h THR 33 Cb 0.59 1.46 -0.02 0.00 -1.73 0.00 0.00 68.15 68.45 1czq h THR 33 CO 0.04 0.46 0.23 0.58 -0.25 0.00 0.00 175.52 176.57 1czq h VAL 34 N 0.47 1.16 -0.69 6.82 2.07 -1.03 -0.72 116.25 124.32 1czq h VAL 34 Ca 0.05 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.13 1czq h VAL 34 Cb 0.81 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1czq h VAL 34 CO 0.07 0.17 0.33 -0.25 0.02 0.00 0.00 177.57 177.90 1czq h TRP 35 N 0.54 1.00 -0.50 1.57 7.01 -1.02 -1.39 115.95 123.15 1czq h TRP 35 Ca 0.15 -0.05 -0.04 0.00 2.11 0.00 0.00 58.89 61.06 1czq h TRP 35 Cb 0.06 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.79 1czq h TRP 35 CO -0.02 0.75 0.17 0.78 -2.79 0.00 0.00 178.44 177.32 1czq h GLY 36 N 0.96 0.83 1.00 2.65 0.00 -0.57 -0.67 103.07 107.28 1czq h GLY 36 Ca 0.24 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1czq h GLY 36 CO -0.03 0.45 0.37 -2.22 0.00 0.00 0.00 176.54 175.11 1czq h ILE 37 N 0.68 1.22 -0.80 2.60 2.04 -0.95 -1.45 117.51 120.85 1czq h ILE 37 Ca 0.16 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.50 1czq h ILE 37 Cb 0.25 0.32 -0.05 0.00 -0.74 0.00 0.00 36.82 36.61 1czq h ILE 37 CO -0.01 0.24 0.50 0.50 0.00 0.00 0.00 178.15 179.39 1czq h LYS 38 N 0.95 0.93 -0.54 2.37 3.64 -0.77 0.41 116.57 123.57 1czq h LYS 38 Ca 0.24 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 1czq h LYS 38 Cb 0.06 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1czq h LYS 38 CO -0.04 0.62 -0.06 1.96 -2.27 0.00 0.00 179.45 179.65 1czq h GLN 39 N 0.96 0.99 -0.45 1.90 1.08 -0.67 -1.78 115.11 117.14 1czq h GLN 39 Ca 0.33 -0.35 -0.14 0.00 -1.45 0.00 0.00 58.65 57.05 1czq h GLN 39 Cb 0.07 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1czq h GLN 39 CO -0.13 1.02 -0.26 -0.07 -0.95 0.00 0.00 178.83 178.44 1czq h LEU 40 N 0.86 0.98 -0.82 1.46 3.38 -0.80 -2.02 115.31 118.35 1czq h LEU 40 Ca 0.14 -0.39 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 1czq h LEU 40 Cb 0.62 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1czq h LEU 40 CO 0.04 1.18 0.20 -0.61 0.09 0.00 0.00 178.44 179.34 1czq h GLN 41 N 0.81 1.08 -0.60 1.13 4.15 -0.85 -1.42 115.11 119.41 1czq h GLN 41 Ca 0.10 -0.23 -0.06 0.00 0.77 0.00 0.00 58.65 59.23 1czq h GLN 41 Cb 0.83 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 28.34 1czq h GLN 41 CO 0.07 0.93 0.15 0.00 -1.93 0.00 0.00 178.83 178.06 1czq h ALA 42 N 1.18 1.14 -0.47 3.38 0.00 -1.09 -0.43 119.26 122.97 1czq h ALA 42 Ca 0.22 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1czq h ALA 42 Cb 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1czq h ALA 42 CO -0.01 0.59 0.16 -0.09 0.00 0.00 0.00 179.25 179.90 1czq h ARG 43 N 0.90 0.72 -0.36 0.00 9.65 -0.92 -3.05 114.38 121.31 1czq h ARG 43 Ca 0.19 -0.14 -0.10 0.00 -1.10 0.00 0.00 59.98 58.84 1czq h ARG 43 Cb 0.31 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 1czq h ARG 43 CO -0.00 0.67 -0.17 0.82 2.80 0.00 0.00 179.97 184.08 1czq h ILE 44 N 0.62 1.26 -0.01 1.20 2.04 -0.71 -3.52 117.51 118.40 1czq h ILE 44 Ca 0.15 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1czq h ILE 44 Cb 0.24 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1czq h ILE 44 CO -0.01 0.40 0.00 0.18 0.00 0.00 0.00 178.15 178.72