#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mqs n ALA -3 N 0.00 -3.54 -0.86 4.61 0.00 -1.26 -4.92 120.51 114.54 1mqs n ALA -3 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.18 1mqs n ALA -3 Cb 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 19.45 16.10 1mqs n ALA -3 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1mqs n MET -2 N 0.96 -1.38 0.00 0.00 2.00 -1.26 -4.68 117.12 112.77 1mqs n MET -2 Ca -0.04 0.34 0.11 0.00 0.00 0.00 0.00 57.70 58.12 1mqs n MET -2 Cb 0.74 -4.79 0.04 0.00 0.00 0.00 0.00 33.22 29.21 1mqs n MET -2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1mqs n ALA -1 N 1.00 3.90 -0.08 3.04 0.00 -1.26 -4.07 120.51 123.04 1mqs n ALA -1 Ca 0.00 -0.56 -0.08 0.00 0.00 0.00 0.00 53.44 52.80 1mqs n ALA -1 Cb 0.34 -0.87 0.09 0.00 0.00 0.00 0.00 19.45 19.02 1mqs n ALA -1 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1mqs h GLY 0 N 4.93 0.82 0.49 0.00 0.00 -1.96 -1.95 103.07 105.39 1mqs h GLY 0 Ca 0.00 -0.70 0.20 0.00 0.00 0.00 0.00 47.33 46.83 1mqs h GLY 0 CO 0.00 0.64 0.55 -0.33 0.00 0.00 0.00 176.54 177.39 1mqs h MET 1 N 0.66 0.15 -0.03 4.80 2.07 -1.97 0.16 114.93 120.76 1mqs h MET 1 Ca 0.09 -0.01 -0.01 0.00 -2.07 0.00 0.00 59.70 57.70 1mqs h MET 1 Cb 0.74 -0.03 -0.00 0.00 -1.87 0.00 0.00 31.60 30.44 1mqs h MET 1 CO 0.06 0.10 -0.01 -0.91 1.07 0.00 0.00 176.91 177.21 1mqs h ASN 2 N 0.15 0.06 0.58 1.22 2.35 -1.61 -2.93 115.58 115.41 1mqs h ASN 2 Ca 0.38 -0.41 -0.08 0.00 -0.55 0.00 0.00 56.30 55.64 1mqs h ASN 2 Cb 1.28 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.63 1mqs h ASN 2 CO -0.06 0.46 -0.37 0.40 -1.65 0.00 0.00 177.43 176.20 1mqs h ILE 3 N -0.34 1.05 -0.16 2.81 5.03 -1.05 -3.27 117.51 121.58 1mqs h ILE 3 Ca 0.01 -1.38 -0.22 0.00 -0.12 0.00 0.00 64.86 63.15 1mqs h ILE 3 Cb 0.43 1.79 0.01 0.00 -3.03 0.00 0.00 36.82 36.03 1mqs h ILE 3 CO 0.00 0.36 -0.74 0.11 -0.68 0.00 0.00 178.15 177.20 1mqs h LYS 4 N 0.00 0.78 -6.22 2.37 1.57 -0.74 -3.43 116.57 110.90 1mqs h LYS 4 Ca -0.00 -0.63 -0.58 0.00 -1.87 0.00 0.00 60.65 57.57 1mqs h LYS 4 Cb 0.76 0.13 -0.06 0.00 0.08 0.00 0.00 32.23 33.14 1mqs h LYS 4 CO 0.05 1.24 0.81 0.34 -0.57 0.00 0.00 179.45 181.32 1mqs s ASP 5 N -7.07 6.96 0.00 0.86 -1.08 -1.11 -4.88 116.67 110.36 1mqs s ASP 5 Ca -0.11 1.11 0.03 0.00 -0.52 0.00 0.00 52.55 53.06 1mqs s ASP 5 Cb 0.08 -2.54 0.06 0.00 -1.46 0.00 0.00 42.92 39.07 1mqs s ASP 5 CO 0.90 -0.81 0.98 0.54 0.52 0.00 0.00 175.17 177.30 1mqs n ARG 6 N 6.70 2.36 -0.01 4.34 1.74 -1.26 -4.80 116.66 125.73 1mqs n ARG 6 Ca 0.12 -1.47 -0.15 0.00 -0.77 0.00 0.00 57.85 55.58 1mqs n ARG 6 Cb 0.47 -1.06 -0.10 0.00 -1.02 0.00 0.00 32.46 30.75 1mqs n ARG 6 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1mqs h THR 7 N 0.49 0.00 0.03 0.55 2.02 -1.99 0.35 112.91 114.36 1mqs h THR 7 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1mqs h THR 7 Cb 0.48 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 1mqs h THR 7 CO 0.00 0.00 -0.19 0.28 0.37 0.00 0.00 175.52 175.98 1mqs h SER 8 N -0.56 -0.55 -0.65 4.18 0.02 -1.99 0.67 113.55 114.67 1mqs h SER 8 Ca 0.03 0.07 0.13 0.00 -0.84 0.00 0.00 61.79 61.18 1mqs h SER 8 Cb 0.65 0.22 -0.13 0.00 0.14 0.00 0.00 62.40 63.29 1mqs h SER 8 CO -0.42 -0.26 -0.20 -0.08 -1.14 0.00 0.00 176.83 174.72 1mqs h GLU 9 N -0.33 -0.04 0.07 3.45 4.81 -1.83 0.19 114.58 120.91 1mqs h GLU 9 Ca 0.05 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1mqs h GLU 9 Cb 0.38 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1mqs h GLU 9 CO -0.16 -0.02 -0.10 0.35 -0.73 0.00 0.00 179.01 178.35 1mqs h PHE 10 N -0.04 -0.29 -0.86 0.92 3.57 -0.01 -2.35 116.94 117.89 1mqs h PHE 10 Ca 0.30 0.00 0.22 0.00 3.53 0.00 0.00 57.97 62.03 1mqs h PHE 10 Cb 0.51 0.12 -0.14 0.00 2.79 0.00 0.00 35.95 39.22 1mqs h PHE 10 CO -0.56 -0.13 0.19 1.96 -2.23 0.00 0.00 178.31 177.54 1mqs h GLN 11 N -0.18 0.18 0.00 1.11 4.20 -0.30 1.65 115.11 121.77 1mqs h GLN 11 Ca -0.01 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1mqs h GLN 11 Cb 0.16 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1mqs h GLN 11 CO -0.03 0.12 0.00 1.04 -0.67 0.00 0.00 178.83 179.29 1mqs n GLN 12 N -5.26 0.15 -0.05 1.46 1.13 0.62 -0.53 117.38 114.91 1mqs n GLN 12 Ca 0.20 0.53 -0.22 0.00 -1.94 0.00 0.00 57.00 55.58 1mqs n GLN 12 Cb 0.65 -1.88 -0.13 0.00 0.11 0.00 0.00 30.24 28.99 1mqs n GLN 12 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1mqs h SER 13 N 0.00 0.20 -0.87 1.08 0.87 0.29 -3.04 113.55 112.08 1mqs h SER 13 Ca 0.00 -0.72 0.18 0.00 -1.23 0.00 0.00 61.79 60.03 1mqs h SER 13 Cb 0.15 -0.07 -0.11 0.00 -0.44 0.00 0.00 62.40 61.93 1mqs h SER 13 CO 0.00 1.67 0.42 0.58 -0.53 0.00 0.00 176.83 178.96 1mqs h VAL 14 N -0.49 0.60 0.07 2.23 2.07 0.08 0.97 116.25 121.78 1mqs h VAL 14 Ca -0.39 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 1mqs h VAL 14 Cb 1.65 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1mqs h VAL 14 CO -0.07 0.09 -0.03 -0.07 0.02 0.00 0.00 177.57 177.51 1mqs h LEU 15 N 0.51 -0.07 -0.93 2.57 3.38 -0.91 -1.41 115.31 118.45 1mqs h LEU 15 Ca 0.51 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.41 1mqs h LEU 15 Cb 0.86 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.59 1mqs h LEU 15 CO -0.45 0.01 0.52 0.77 0.09 0.00 0.00 178.44 179.39 1mqs h SER 16 N -0.16 1.13 0.47 -0.43 4.64 -1.08 -0.55 113.55 117.58 1mqs h SER 16 Ca -0.01 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.21 1mqs h SER 16 Cb 0.13 -0.29 -0.00 0.00 -0.31 0.00 0.00 62.40 61.93 1mqs h SER 16 CO 0.01 0.89 -0.05 1.88 -0.87 0.00 0.00 176.83 178.70 1mqs h TYR 17 N 1.28 0.00 0.05 4.77 -1.99 -0.56 -2.39 116.97 118.12 1mqs h TYR 17 Ca 0.33 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.94 1mqs h TYR 17 Cb -0.00 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.74 1mqs h TYR 17 CO 0.01 0.05 -0.47 0.87 -0.00 0.00 0.00 178.16 178.61 1mqs h LYS 18 N 0.00 0.24 -0.67 4.88 1.57 -0.01 -2.86 116.57 119.71 1mqs h LYS 18 Ca -0.00 -0.32 0.06 0.00 -1.87 0.00 0.00 60.65 58.52 1mqs h LYS 18 Cb 0.30 0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.67 1mqs h LYS 18 CO 0.01 1.08 0.45 0.87 -0.57 0.00 0.00 179.45 181.28 1mqs h LYS 19 N -0.46 0.69 0.29 3.15 1.57 -0.97 -3.13 116.57 117.72 1mqs h LYS 19 Ca -0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1mqs h LYS 19 Cb 1.28 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1mqs h LYS 19 CO 0.09 0.46 -0.14 0.00 -0.57 0.00 0.00 179.45 179.29 1mqs h ARG 20 N 0.71 -0.38 0.00 3.15 3.08 -1.53 -3.52 114.38 115.90 1mqs h ARG 20 Ca 0.29 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.36 1mqs h ARG 20 Cb 0.23 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.37 1mqs h ARG 20 CO -0.09 -0.25 0.00 0.09 -1.07 0.00 0.00 179.97 178.65