#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w5k h MET 2 N 0.00 0.86 -0.11 -0.14 4.05 -2.05 -0.93 114.93 116.60 1w5k h MET 2 Ca 0.00 -0.47 -0.07 0.00 -0.28 0.00 0.00 59.70 58.89 1w5k h MET 2 Cb 0.00 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 1w5k h MET 2 CO 0.00 1.11 -0.23 0.00 0.23 0.00 0.00 176.91 178.02 1w5k h ARG 3 N 0.69 0.20 -0.31 0.39 -0.00 -2.05 -0.73 114.38 112.57 1w5k h ARG 3 Ca 0.05 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.98 59.30 1w5k h ARG 3 Cb 1.00 -0.02 -0.00 0.00 0.00 0.00 0.00 29.97 30.95 1w5k h ARG 3 CO 0.10 0.42 -0.46 1.96 0.00 0.00 0.00 179.97 181.99 1w5k h GLN 4 N 0.18 0.87 -0.72 0.04 4.20 -1.93 -1.56 115.11 116.19 1w5k h GLN 4 Ca 0.03 -0.51 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 1w5k h GLN 4 Cb 0.51 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.30 1w5k h GLN 4 CO 0.03 1.15 0.27 0.82 -0.67 0.00 0.00 178.83 180.43 1w5k h ILE 5 N 0.65 1.25 -0.78 2.54 2.04 -0.82 -1.09 117.51 121.29 1w5k h ILE 5 Ca 0.03 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1w5k h ILE 5 Cb 1.06 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 1w5k h ILE 5 CO 0.11 0.32 0.45 -0.33 0.00 0.00 0.00 178.15 178.69 1w5k h GLU 6 N 1.04 1.08 -0.47 2.37 5.08 -1.05 -1.17 114.58 121.47 1w5k h GLU 6 Ca 0.24 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.38 1w5k h GLU 6 Cb 0.22 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1w5k h GLU 6 CO -0.02 0.79 -0.12 -0.44 -1.00 0.00 0.00 179.01 178.22 1w5k h ASP 7 N 1.08 0.85 -0.50 1.42 3.32 -0.84 -2.06 116.42 119.69 1w5k h ASP 7 Ca 0.28 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 1w5k h ASP 7 Cb 0.01 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 1w5k h ASP 7 CO -0.05 0.98 -0.13 -0.09 -1.72 0.00 0.00 179.24 178.23 1w5k h ARG 8 N 0.77 0.98 -0.43 3.56 9.65 -0.85 -1.60 114.38 126.45 1w5k h ARG 8 Ca 0.12 -0.38 -0.04 0.00 -1.10 0.00 0.00 59.98 58.59 1w5k h ARG 8 Cb 0.63 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.14 1w5k h ARG 8 CO 0.04 1.05 0.10 -0.07 2.80 0.00 0.00 179.97 183.90 1w5k h LEU 9 N 0.84 0.59 -0.69 3.80 3.38 -1.10 -0.14 115.31 121.99 1w5k h LEU 9 Ca 0.13 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 1w5k h LEU 9 Cb 0.70 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1w5k h LEU 9 CO 0.05 0.59 -0.09 -0.08 0.09 0.00 0.00 178.44 179.01 1w5k h GLU 10 N 0.63 0.92 -0.51 1.13 4.57 -1.07 -0.04 114.58 120.21 1w5k h GLU 10 Ca 0.14 -0.31 -0.12 0.00 -1.18 0.00 0.00 59.36 57.89 1w5k h GLU 10 Cb 0.24 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1w5k h GLU 10 CO -0.00 0.97 -0.14 0.93 -1.18 0.00 0.00 179.01 179.58 1w5k h GLU 11 N 0.83 0.99 -0.23 1.92 5.08 -0.72 -0.87 114.58 121.58 1w5k h GLU 11 Ca 0.14 -0.38 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 1w5k h GLU 11 Cb 0.61 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1w5k h GLU 11 CO 0.04 1.05 0.07 0.82 -1.00 0.00 0.00 179.01 179.99 1w5k h ILE 12 N 0.87 1.19 -0.55 3.13 2.04 -0.92 -2.23 117.51 121.04 1w5k h ILE 12 Ca 0.13 -0.62 0.07 0.00 1.00 0.00 0.00 64.86 65.44 1w5k h ILE 12 Cb 0.70 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.90 1w5k h ILE 12 CO 0.05 0.20 0.24 -0.07 0.00 0.00 0.00 178.15 178.58 1w5k h LEU 13 N 0.20 0.31 -0.25 1.44 3.38 -0.89 0.15 115.31 119.65 1w5k h LEU 13 Ca 0.07 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.15 1w5k h LEU 13 Cb 0.24 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1w5k h LEU 13 CO -0.00 0.20 -0.12 -1.28 0.09 0.00 0.00 178.44 177.33 1w5k h SER 14 N 0.46 -0.40 -0.11 -0.43 0.87 -1.04 -0.83 113.55 112.07 1w5k h SER 14 Ca 0.26 0.10 -0.15 0.00 -1.23 0.00 0.00 61.79 60.76 1w5k h SER 14 Cb 0.24 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1w5k h SER 14 CO -0.22 -0.15 -0.47 0.50 -0.53 0.00 0.00 176.83 175.96 1w5k h LYS 15 N -0.08 0.67 -0.67 2.24 1.63 -0.89 -2.29 116.57 117.18 1w5k h LYS 15 Ca 0.13 -0.38 -0.05 0.00 -0.85 0.00 0.00 60.65 59.50 1w5k h LYS 15 Cb 0.28 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.91 1w5k h LYS 15 CO -0.30 1.00 0.22 -0.07 -3.45 0.00 0.00 179.45 176.84 1w5k h LEU 16 N 0.53 0.97 -0.87 5.20 3.38 -0.42 -0.68 115.31 123.43 1w5k h LEU 16 Ca 0.03 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 1w5k h LEU 16 Cb 1.02 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1w5k h LEU 16 CO 0.10 0.92 0.12 0.45 0.09 0.00 0.00 178.44 180.11 1w5k h HIS 17 N 0.98 1.00 -0.67 1.13 3.86 -1.04 -0.44 115.15 119.97 1w5k h HIS 17 Ca 0.22 -0.12 -0.03 0.00 -1.16 0.00 0.00 60.37 59.28 1w5k h HIS 17 Cb 0.29 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.44 1w5k h HIS 17 CO 0.02 0.84 0.31 0.45 0.86 0.00 0.00 177.93 180.41 1w5k h HIS 18 N 0.91 0.98 -0.68 2.45 3.86 -1.03 -1.85 115.15 119.80 1w5k h HIS 18 Ca 0.19 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.33 1w5k h HIS 18 Cb 0.37 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 1w5k h HIS 18 CO 0.02 0.74 0.36 0.82 0.86 0.00 0.00 177.93 180.74 1w5k h ILE 19 N 0.93 1.21 -0.67 2.45 2.04 -0.63 -1.04 117.51 121.80 1w5k h ILE 19 Ca 0.23 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.60 1w5k h ILE 19 Cb 0.14 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.51 1w5k h ILE 19 CO -0.03 0.24 0.38 0.00 0.00 0.00 0.00 178.15 178.74 1w5k h ASN 21 N 0.69 1.00 -0.20 0.00 2.35 -0.79 0.73 115.58 119.37 1w5k h ASN 21 Ca 0.30 -0.23 -0.16 0.00 -0.55 0.00 0.00 56.30 55.66 1w5k h ASN 21 Cb 0.18 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.28 1w5k h ASN 21 CO -0.18 0.99 -0.47 -0.33 -1.65 0.00 0.00 177.43 175.79 1w5k h GLU 22 N 0.99 0.77 -0.27 0.81 3.07 -0.83 -1.82 114.58 117.30 1w5k h GLU 22 Ca 0.20 -0.44 -0.12 0.00 -0.50 0.00 0.00 59.36 58.49 1w5k h GLU 22 Cb 0.41 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.35 1w5k h GLU 22 CO 0.01 1.07 -0.34 -0.07 -1.40 0.00 0.00 179.01 178.28 1w5k h LEU 23 N 0.61 0.61 -0.59 1.33 3.38 -0.77 -0.88 115.31 119.01 1w5k h LEU 23 Ca 0.03 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1w5k h LEU 23 Cb 1.04 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1w5k h LEU 23 CO 0.10 0.91 0.25 0.00 0.09 0.00 0.00 178.44 179.79 1w5k h ALA 24 N 1.13 0.76 -0.76 1.53 0.00 -0.81 0.06 119.26 121.18 1w5k h ALA 24 Ca 0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1w5k h ALA 24 Cb 0.83 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1w5k h ALA 24 CO 0.07 0.36 0.40 -0.09 0.00 0.00 0.00 179.25 179.98 1w5k h ARG 25 N 0.81 1.07 0.11 0.00 2.43 -1.09 -1.27 114.38 116.44 1w5k h ARG 25 Ca 0.20 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1w5k h ARG 25 Cb 0.17 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1w5k h ARG 25 CO -0.02 0.81 -0.05 0.82 -1.51 0.00 0.00 179.97 180.01 1w5k h ILE 26 N 1.05 1.02 -0.79 1.20 2.04 -0.79 -0.51 117.51 120.73 1w5k h ILE 26 Ca 0.26 -0.52 0.19 0.00 1.00 0.00 0.00 64.86 65.79 1w5k h ILE 26 Cb 0.06 1.35 -0.13 0.00 -0.74 0.00 0.00 36.82 37.37 1w5k h ILE 26 CO -0.04 0.13 0.06 -0.09 0.00 0.00 0.00 178.15 178.21 1w5k h ARG 27 N -0.39 0.13 -0.27 2.37 9.65 -0.87 -0.02 114.38 124.98 1w5k h ARG 27 Ca -0.02 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.84 1w5k h ARG 27 Cb 0.32 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.86 1w5k h ARG 27 CO 0.03 0.08 0.10 0.00 2.80 0.00 0.00 179.97 182.97 1w5k h ARG 28 N 0.13 0.40 -0.76 0.20 3.08 -0.81 -2.37 114.38 114.26 1w5k h ARG 28 Ca 0.45 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.41 1w5k h ARG 28 Cb 0.82 -0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.77 1w5k h ARG 28 CO -0.66 0.45 0.45 -0.07 -1.07 0.00 0.00 179.97 179.07 1w5k h LEU 29 N 0.27 0.91 -1.34 3.04 3.38 -0.28 -2.23 115.31 119.07 1w5k h LEU 29 Ca 0.09 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1w5k h LEU 29 Cb 0.21 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1w5k h LEU 29 CO -0.01 0.71 0.30 -0.07 0.09 0.00 0.00 178.44 179.46 1w5k h LEU 30 N 1.04 0.66 -1.65 1.67 3.38 -0.91 -2.17 115.31 117.33 1w5k h LEU 30 Ca 0.27 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.17 1w5k h LEU 30 Cb -0.03 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1w5k h LEU 30 CO -0.05 0.54 -0.14 1.23 0.09 0.00 0.00 178.44 180.11 1w5k h GLY 31 N 0.83 0.00 0.69 0.83 0.00 -0.86 -2.67 103.07 101.88 1w5k h GLY 31 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 1w5k h GLY 31 CO -0.03 0.00 -0.09 1.18 0.00 0.00 0.00 176.54 177.60 1w5k n GLU 32 N -3.45 0.87 0.00 4.80 4.71 -0.82 -5.11 120.64 121.64 1w5k n GLU 32 Ca -0.01 -0.32 0.15 0.00 -0.01 0.00 0.00 57.16 56.98 1w5k n GLU 32 Cb 0.30 -1.49 0.79 0.00 -1.01 0.00 0.00 31.44 30.03 1w5k n GLU 32 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76