#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ij1 h MET 2 N 0.00 0.71 -0.43 -0.14 4.05 -2.05 -0.90 114.93 116.17 1ij1 h MET 2 Ca 0.00 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1ij1 h MET 2 Cb 0.00 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.63 1ij1 h MET 2 CO 0.00 0.52 0.27 -0.22 0.23 0.00 0.00 176.91 177.71 1ij1 h LYS 3 N 0.70 0.58 -0.11 0.39 1.63 -2.05 0.33 116.57 118.03 1ij1 h LYS 3 Ca 0.19 -0.05 -0.08 0.00 -0.85 0.00 0.00 60.65 59.87 1ij1 h LYS 3 Cb -0.01 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.49 1ij1 h LYS 3 CO -0.03 0.41 -0.28 1.96 -3.45 0.00 0.00 179.45 178.06 1ij1 h GLN 4 N 0.58 0.20 -0.48 1.90 4.20 -1.96 -0.80 115.11 118.74 1ij1 h GLN 4 Ca 0.16 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.69 1ij1 h GLN 4 Cb -0.03 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1ij1 h GLN 4 CO -0.03 0.47 -0.10 -0.07 -0.67 0.00 0.00 178.83 178.43 1ij1 h LEU 5 N 0.18 0.92 -1.05 1.46 3.38 -0.05 -1.30 115.31 118.86 1ij1 h LEU 5 Ca 0.03 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1ij1 h LEU 5 Cb 0.60 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1ij1 h LEU 5 CO 0.04 1.06 0.30 -0.33 0.09 0.00 0.00 178.44 179.61 1ij1 h GLU 6 N 0.77 0.97 -0.68 1.13 5.08 0.25 -0.76 114.58 121.34 1ij1 h GLU 6 Ca 0.12 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1ij1 h GLU 6 Cb 0.65 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 1ij1 h GLU 6 CO 0.04 0.77 0.18 -0.44 -1.00 0.00 0.00 179.01 178.56 1ij1 h ASP 7 N 0.96 1.03 0.02 1.42 3.32 -0.79 0.03 116.42 122.41 1ij1 h ASP 7 Ca 0.23 -0.23 -0.17 0.00 0.02 0.00 0.00 57.03 56.88 1ij1 h ASP 7 Cb 0.14 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 1ij1 h ASP 7 CO -0.03 0.99 -0.60 0.50 -1.72 0.00 0.00 179.24 178.38 1ij1 h LYS 8 N 1.02 0.58 -0.23 3.56 3.64 -0.90 -0.71 116.57 123.53 1ij1 h LYS 8 Ca 0.22 -0.39 -0.03 0.00 -1.27 0.00 0.00 60.65 59.17 1ij1 h LYS 8 Cb 0.35 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1ij1 h LYS 8 CO -0.00 1.01 0.01 0.28 -2.27 0.00 0.00 179.45 178.48 1ij1 h VAL 9 N 0.44 1.24 -0.75 2.00 2.07 -0.83 -0.67 116.25 119.76 1ij1 h VAL 9 Ca -0.00 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.67 1ij1 h VAL 9 Cb 1.16 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 32.25 1ij1 h VAL 9 CO 0.11 0.26 0.43 -0.33 0.02 0.00 0.00 177.57 178.06 1ij1 h GLU 10 N 0.17 1.03 -0.69 1.57 4.39 -0.90 0.09 114.58 120.24 1ij1 h GLU 10 Ca 0.07 -0.11 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1ij1 h GLU 10 Cb 0.37 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.78 1ij1 h GLU 10 CO 0.01 0.75 0.22 0.93 -1.16 0.00 0.00 179.01 179.76 1ij1 h GLU 11 N 1.03 1.06 -0.62 2.33 4.39 -1.05 -1.37 114.58 120.36 1ij1 h GLU 11 Ca 0.27 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.66 1ij1 h GLU 11 Cb 0.01 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.47 1ij1 h GLU 11 CO -0.05 0.91 0.02 1.15 -1.16 0.00 0.00 179.01 179.88 1ij1 h THR 12 N 1.03 1.27 -0.07 1.13 2.02 -0.44 -2.53 112.91 115.32 1ij1 h THR 12 Ca 0.23 -1.13 -0.13 0.00 0.77 0.00 0.00 66.41 66.15 1ij1 h THR 12 Cb 0.28 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 1ij1 h THR 12 CO -0.01 0.41 -0.53 0.25 0.37 0.00 0.00 175.52 176.02 1ij1 h LEU 13 N 0.99 0.20 -0.55 2.58 5.85 -0.68 -1.89 115.31 121.81 1ij1 h LEU 13 Ca 0.18 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.76 1ij1 h LEU 13 Cb 0.54 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1ij1 h LEU 13 CO 0.03 0.69 0.20 -1.28 -0.34 0.00 0.00 178.44 177.74 1ij1 h SER 14 N 0.14 0.77 -0.70 1.25 0.87 -1.09 -1.52 113.55 113.26 1ij1 h SER 14 Ca 0.00 -0.18 -0.05 0.00 -1.23 0.00 0.00 61.79 60.33 1ij1 h SER 14 Cb 0.98 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.70 1ij1 h SER 14 CO 0.08 0.75 0.26 0.11 -0.53 0.00 0.00 176.83 177.49 1ij1 h LYS 15 N 0.75 1.09 0.03 2.24 1.57 -1.21 -2.03 116.57 119.01 1ij1 h LYS 15 Ca 0.18 -0.21 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1ij1 h LYS 15 Cb 0.23 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.37 1ij1 h LYS 15 CO -0.01 0.90 -0.01 0.28 -0.57 0.00 0.00 179.45 180.04 1ij1 h VAL 16 N 1.06 1.04 -0.99 0.50 2.07 -1.08 0.80 116.25 119.65 1ij1 h VAL 16 Ca 0.24 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.56 1ij1 h VAL 16 Cb 0.25 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 1ij1 h VAL 16 CO -0.01 0.05 0.65 1.88 0.02 0.00 0.00 177.57 180.16 1ij1 h TYR 17 N -0.13 1.23 -0.00 1.57 0.05 -1.17 0.10 116.97 118.62 1ij1 h TYR 17 Ca -0.00 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 1ij1 h TYR 17 Cb 0.12 -0.41 -0.00 0.00 1.01 0.00 0.00 36.73 37.45 1ij1 h TYR 17 CO -0.04 0.75 0.00 1.25 -1.05 0.00 0.00 178.16 179.07 1ij1 h HIS 18 N 1.31 0.00 -0.87 4.88 2.76 -1.11 -2.24 115.15 119.88 1ij1 h HIS 18 Ca 0.37 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.64 1ij1 h HIS 18 Cb -0.09 -0.00 -0.06 0.00 1.55 0.00 0.00 27.41 28.80 1ij1 h HIS 18 CO -0.00 0.12 0.56 -0.07 -1.30 0.00 0.00 177.93 177.24 1ij1 h LEU 19 N -0.12 0.78 -0.97 0.26 3.38 0.20 -0.40 115.31 118.45 1ij1 h LEU 19 Ca 0.00 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1ij1 h LEU 19 Cb 0.12 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1ij1 h LEU 19 CO -0.00 0.47 0.51 -0.33 0.09 0.00 0.00 178.44 179.18 1ij1 h GLU 20 N 0.87 1.23 -0.56 1.13 5.08 -0.46 0.80 114.58 122.66 1ij1 h GLU 20 Ca 0.40 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.54 1ij1 h GLU 20 Cb 0.38 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1ij1 h GLU 20 CO -0.16 0.88 -0.00 -0.91 -1.00 0.00 0.00 179.01 177.81 1ij1 h ASN 21 N 1.24 0.95 -0.40 1.42 2.35 -0.52 -1.21 115.58 119.41 1ij1 h ASN 21 Ca 0.32 -0.26 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 1ij1 h ASN 21 Cb -0.01 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 1ij1 h ASN 21 CO -0.05 1.00 0.11 -0.33 -1.65 0.00 0.00 177.43 176.51 1ij1 h GLU 22 N 0.89 0.63 -0.77 0.81 4.39 -0.40 -1.85 114.58 118.29 1ij1 h GLU 22 Ca 0.16 -0.15 0.03 0.00 0.34 0.00 0.00 59.36 59.75 1ij1 h GLU 22 Cb 0.53 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.04 1ij1 h GLU 22 CO 0.03 0.65 0.49 0.28 -1.16 0.00 0.00 179.01 179.30 1ij1 h VAL 23 N 0.50 1.11 -0.69 3.13 2.07 -0.64 0.12 116.25 121.86 1ij1 h VAL 23 Ca 0.13 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 1ij1 h VAL 23 Cb 0.29 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 1ij1 h VAL 23 CO -0.00 0.17 0.20 0.00 0.02 0.00 0.00 177.57 177.97 1ij1 h ALA 24 N 1.33 1.05 -0.11 1.67 0.00 -0.93 -0.19 119.26 122.07 1ij1 h ALA 24 Ca 0.31 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1ij1 h ALA 24 Cb 0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1ij1 h ALA 24 CO -0.11 0.64 -0.50 -0.09 0.00 0.00 0.00 179.25 179.19 1ij1 h ARG 25 N 1.03 0.30 -0.09 0.00 1.12 -0.71 -2.47 114.38 113.56 1ij1 h ARG 25 Ca 0.22 -0.17 -0.04 0.00 -1.11 0.00 0.00 59.98 58.88 1ij1 h ARG 25 Cb 0.31 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 30.28 1ij1 h ARG 25 CO -0.01 0.73 -0.12 -0.07 -3.11 0.00 0.00 179.97 177.40 1ij1 h LEU 26 N 0.24 0.25 -0.93 3.80 3.38 -0.26 -2.81 115.31 118.98 1ij1 h LEU 26 Ca 0.01 -0.52 0.17 0.00 0.09 0.00 0.00 57.88 57.63 1ij1 h LEU 26 Cb 0.96 -0.07 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 1ij1 h LEU 26 CO 0.08 0.72 0.52 0.11 0.09 0.00 0.00 178.44 179.96 1ij1 h LYS 27 N -0.21 0.68 0.00 1.13 1.57 -1.00 0.42 116.57 119.15 1ij1 h LYS 27 Ca 0.01 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1ij1 h LYS 27 Cb 0.66 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1ij1 h LYS 27 CO 0.03 0.45 -0.14 0.87 -0.57 0.00 0.00 179.45 180.09 1ij1 h LYS 28 N 0.70 0.00 0.00 3.15 1.57 -1.38 -2.70 116.57 117.91 1ij1 h LYS 28 Ca 0.52 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.25 1ij1 h LYS 28 Cb 0.76 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 1ij1 h LYS 28 CO -0.37 0.14 -0.83 1.25 -0.57 0.00 0.00 179.45 179.07 1ij1 h LEU 29 N 0.00 0.00 0.00 2.94 5.85 -0.02 -3.42 115.31 120.66 1ij1 h LEU 29 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ij1 h LEU 29 Cb 0.60 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.63 1ij1 h LEU 29 CO 0.02 0.18 0.00 0.52 -0.34 0.00 0.00 178.44 178.82 1ij1 n VAL 30 N -2.87 0.00 -1.82 1.05 0.31 0.13 -5.10 118.33 110.02 1ij1 n VAL 30 Ca -0.01 0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.66 1ij1 n VAL 30 Cb 0.63 -1.29 0.00 0.00 -0.91 0.00 0.00 33.84 32.27 1ij1 n VAL 30 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12