#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gqe n HIS 1 N 0.00 0.00 -3.31 1.61 -0.00 -1.26 -5.08 115.22 107.17 2gqe n HIS 1 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.75 2gqe n HIS 1 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 29.96 2gqe n HIS 1 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2gqe s MET 2 N -1.57 0.25 0.31 1.57 0.00 -1.26 -5.15 119.30 113.46 2gqe s MET 2 Ca 0.00 0.59 -0.29 0.00 0.00 0.00 0.00 55.69 55.99 2gqe s MET 2 Cb 0.00 0.35 -0.13 0.00 0.00 0.00 0.00 34.83 35.05 2gqe s MET 2 CO 0.00 -0.13 1.27 1.55 0.00 0.00 0.00 175.02 177.71 2gqe n VAL 3 N 5.05 1.76 -2.65 5.16 3.14 -1.26 -4.94 118.33 124.61 2gqe n VAL 3 Ca -0.08 -0.44 -0.24 0.00 -2.96 0.00 0.00 64.34 60.62 2gqe n VAL 3 Cb 0.53 -1.45 -0.01 0.00 -1.06 0.00 0.00 33.84 31.85 2gqe n VAL 3 CO 0.00 0.00 0.00 2.30 -6.46 0.00 0.00 176.83 172.67 2gqe n ILE 4 N 0.66 2.15 0.38 1.55 -5.35 -1.26 -4.80 119.36 112.69 2gqe n ILE 4 Ca 0.07 -4.75 0.12 0.00 -0.27 0.00 0.00 62.75 57.92 2gqe n ILE 4 Cb 0.34 -0.93 0.23 0.00 -1.74 0.00 0.00 39.64 37.55 2gqe n ILE 4 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2gqe h GLY 5 N 2.75 0.00 -5.60 3.28 0.00 -1.95 -3.47 103.07 98.08 2gqe h GLY 5 Ca 0.19 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.79 2gqe h GLY 5 CO 0.77 0.00 0.10 -1.30 0.00 0.00 0.00 176.54 176.11 2gqe n THR 6 N -2.69 0.00 -3.88 4.70 -2.24 -1.26 -4.43 114.28 104.48 2gqe n THR 6 Ca 0.04 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.46 2gqe n THR 6 Cb 0.49 -0.04 -0.07 0.00 -2.10 0.00 0.00 70.33 68.62 2gqe n THR 6 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 2gqe s TRP 7 N 0.23 3.54 0.14 4.78 1.48 0.79 -4.80 118.94 125.11 2gqe s TRP 7 Ca 0.85 0.47 -0.14 0.00 -1.06 0.00 0.00 56.10 56.22 2gqe s TRP 7 Cb -1.19 -1.97 -0.07 0.00 -1.16 0.00 0.00 33.47 29.09 2gqe s TRP 7 CO 0.54 0.64 0.54 -0.51 -4.06 0.00 0.00 176.95 174.11 2gqe s ASP 8 N -0.78 6.82 0.64 -2.66 1.01 -1.26 -0.71 116.67 119.73 2gqe s ASP 8 Ca 0.14 1.07 -0.11 0.00 0.71 0.00 0.00 52.55 54.35 2gqe s ASP 8 Cb -0.12 -2.28 -0.02 0.00 1.01 0.00 0.00 42.92 41.50 2gqe s ASP 8 CO 0.03 0.11 1.04 0.00 0.21 0.00 0.00 175.17 176.56 2gqe n ASP 10 N -2.80 1.61 0.00 0.00 2.03 -1.26 -4.23 116.55 111.89 2gqe n ASP 10 Ca 0.07 -2.26 0.00 0.00 0.52 0.00 0.00 54.79 53.12 2gqe n ASP 10 Cb 0.54 -0.18 0.00 0.00 -0.72 0.00 0.00 41.12 40.76 2gqe n ASP 10 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2gqe n THR 11 N -0.71 0.00 0.39 5.18 -1.04 -1.26 -4.84 114.28 112.00 2gqe n THR 11 Ca 0.06 0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.11 2gqe n THR 11 Cb 0.48 -0.83 0.02 0.00 -1.82 0.00 0.00 70.33 68.18 2gqe n THR 11 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2gqe n LEU 13 N 0.20 -6.75 -3.64 0.00 4.77 -1.26 -5.04 117.00 105.28 2gqe n LEU 13 Ca 0.05 1.74 -0.03 0.00 -0.03 0.00 0.00 56.01 57.73 2gqe n LEU 13 Cb 0.21 -3.11 -0.07 0.00 -2.33 0.00 0.00 43.42 38.12 2gqe n LEU 13 CO 0.08 -3.47 0.91 -0.69 -1.33 0.00 0.00 177.39 172.88 2gqe s VAL 14 N -1.08 0.00 0.22 4.08 1.01 -1.26 -4.90 120.40 118.47 2gqe s VAL 14 Ca -0.13 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.67 2gqe s VAL 14 Cb 0.01 -1.00 -0.08 0.00 0.00 0.00 0.00 36.38 35.31 2gqe s VAL 14 CO 0.70 0.00 0.69 -1.10 0.00 0.00 0.00 175.10 175.39 2gqe s GLN 15 N 0.58 4.17 0.01 2.72 -0.21 -1.26 -0.23 119.66 125.44 2gqe s GLN 15 Ca -0.01 0.77 -0.04 0.00 0.02 0.00 0.00 55.36 56.11 2gqe s GLN 15 Cb -0.04 -2.85 -0.01 0.00 1.00 0.00 0.00 33.01 31.11 2gqe s GLN 15 CO -0.12 0.39 0.06 -0.80 -2.12 0.00 0.00 175.29 172.70 2gqe s ASN 16 N -1.73 0.12 0.50 5.90 0.01 0.11 -4.86 114.94 115.00 2gqe s ASN 16 Ca 0.43 -0.31 -0.23 0.00 -0.71 0.00 0.00 52.86 52.04 2gqe s ASN 16 Cb -0.16 0.15 -0.06 0.00 0.41 0.00 0.00 41.25 41.60 2gqe s ASN 16 CO 0.20 -0.31 1.36 -1.59 -1.51 0.00 0.00 177.10 175.25 2gqe s LYS 17 N -1.31 3.39 0.00 -0.60 -2.85 -1.26 -0.15 119.74 116.96 2gqe s LYS 17 Ca -0.14 2.24 0.14 0.00 -1.00 0.00 0.00 55.97 57.21 2gqe s LYS 17 Cb -0.08 -2.41 0.62 0.00 -2.06 0.00 0.00 37.83 33.90 2gqe s LYS 17 CO 0.00 -0.99 1.44 -0.35 0.10 0.00 0.00 175.35 175.55 2gqe n PRO 18 N -0.69 0.03 0.00 1.78 -0.04 -1.26 -2.01 135.00 132.81 2gqe n PRO 18 Ca 0.08 0.24 0.13 0.00 -0.04 0.00 0.00 63.50 63.92 2gqe n PRO 18 Cb 0.44 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.82 2gqe n PRO 18 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2gqe n GLU 19 N -1.47 0.36 -2.14 0.54 -0.58 -1.26 -4.89 120.64 111.19 2gqe n GLU 19 Ca 0.04 -0.17 -0.27 0.00 -0.42 0.00 0.00 57.16 56.34 2gqe n GLU 19 Cb 0.16 -1.50 0.10 0.00 -0.57 0.00 0.00 31.44 29.63 2gqe n GLU 19 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2gqe s ALA 20 N -2.76 2.96 -0.16 0.62 0.00 -0.85 -5.02 121.76 116.55 2gqe s ALA 20 Ca 0.19 -1.01 0.10 0.00 0.00 0.00 0.00 51.96 51.24 2gqe s ALA 20 Cb 0.19 -2.63 -0.14 0.00 0.00 0.00 0.00 23.12 20.53 2gqe s ALA 20 CO 0.58 -1.58 0.29 1.51 0.00 0.00 0.00 175.76 176.56 2gqe n ILE 21 N -3.13 0.00 -3.89 0.00 0.13 -1.26 -4.96 119.36 106.24 2gqe n ILE 21 Ca 0.10 -0.24 -0.08 0.00 -1.10 0.00 0.00 62.75 61.43 2gqe n ILE 21 Cb 0.60 0.50 -0.03 0.00 -0.84 0.00 0.00 39.64 39.88 2gqe n ILE 21 CO 0.00 0.00 0.00 -1.59 2.80 0.00 0.00 176.55 177.76 2gqe s LYS 22 N -2.46 1.69 0.97 9.51 0.00 -1.26 -0.46 119.74 127.73 2gqe s LYS 22 Ca -0.01 -1.06 -0.12 0.00 0.00 0.00 0.00 55.97 54.78 2gqe s LYS 22 Cb 0.07 0.56 0.13 0.00 0.00 0.00 0.00 37.83 38.60 2gqe s LYS 22 CO 0.42 -0.75 0.86 0.00 0.00 0.00 0.00 175.35 175.88 2gqe n VAL 24 N -4.19 2.20 0.00 0.00 3.14 -1.26 -3.61 118.33 114.61 2gqe n VAL 24 Ca 0.09 -1.81 0.00 0.00 -2.96 0.00 0.00 64.34 59.65 2gqe n VAL 24 Cb 0.53 -0.20 0.00 0.00 -1.06 0.00 0.00 33.84 33.11 2gqe n VAL 24 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2gqe n ALA 25 N -0.43 2.25 0.16 1.55 0.00 -1.26 -4.89 120.51 117.89 2gqe n ALA 25 Ca 0.21 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.69 2gqe n ALA 25 Cb 0.86 0.09 -0.06 0.00 0.00 0.00 0.00 19.45 20.35 2gqe n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gqe n GLU 27 N -1.54 -2.48 -2.57 0.00 1.02 -1.24 -4.98 120.64 108.86 2gqe n GLU 27 Ca -0.00 0.26 -0.36 0.00 -0.02 0.00 0.00 57.16 57.04 2gqe n GLU 27 Cb 0.18 -3.56 -0.04 0.00 -0.02 0.00 0.00 31.44 28.00 2gqe n GLU 27 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2gqe s THR 28 N -3.10 3.78 -0.22 2.62 2.01 -1.26 -4.60 115.64 114.86 2gqe s THR 28 Ca 0.17 1.34 -0.29 0.00 0.31 0.00 0.00 61.69 63.23 2gqe s THR 28 Cb -0.08 -3.68 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2gqe s THR 28 CO 0.23 -0.01 1.61 -2.16 -0.69 0.00 0.00 174.62 173.60 2gqe s PRO 29 N -2.54 3.80 0.39 4.92 0.04 -1.26 -0.74 135.00 139.61 2gqe s PRO 29 Ca 0.58 1.66 -0.25 0.00 0.04 0.00 0.00 61.00 63.03 2gqe s PRO 29 Cb -0.21 -4.03 -0.11 0.00 0.04 0.00 0.00 34.50 30.18 2gqe s PRO 29 CO 0.26 -1.29 1.01 1.17 0.04 0.00 0.00 177.00 178.19 2gqe n LYS 30 N 7.65 1.37 0.00 4.56 4.81 0.39 -4.94 118.16 132.00 2gqe n LYS 30 Ca 0.19 0.49 0.08 0.00 -0.87 0.00 0.00 58.31 58.19 2gqe n LYS 30 Cb 0.45 -2.01 0.46 0.00 0.02 0.00 0.00 35.03 33.96 2gqe n LYS 30 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22