#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gqe s HIS 1 N 0.00 0.18 -0.19 1.61 0.09 -1.26 -5.14 115.29 110.58 2gqe s HIS 1 Ca 0.00 0.06 -0.04 0.00 -0.00 0.00 0.00 55.06 55.08 2gqe s HIS 1 Cb 0.00 -0.33 -0.02 0.00 -0.00 0.00 0.00 32.58 32.23 2gqe s HIS 1 CO 0.00 -0.11 -0.02 -1.64 -0.00 0.00 0.00 174.74 172.97 2gqe s MET 2 N 1.05 3.60 -0.87 1.40 1.00 -1.26 -5.01 119.30 119.21 2gqe s MET 2 Ca -0.09 -0.54 -0.27 0.00 0.00 0.00 0.00 55.69 54.78 2gqe s MET 2 Cb -0.13 -3.01 -0.19 0.00 0.00 0.00 0.00 34.83 31.50 2gqe s MET 2 CO -0.02 0.06 2.35 1.33 0.00 0.00 0.00 175.02 178.74 2gqe n VAL 3 N 4.09 0.00 -3.70 -6.03 0.24 -1.26 -4.84 118.33 106.83 2gqe n VAL 3 Ca -0.17 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.75 2gqe n VAL 3 Cb 0.52 -0.44 -0.10 0.00 -1.47 0.00 0.00 33.84 32.35 2gqe n VAL 3 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 2gqe s ILE 4 N 7.83 3.62 0.00 1.34 2.07 -1.26 -4.96 121.20 129.84 2gqe s ILE 4 Ca 1.19 -2.06 0.00 0.00 -1.41 0.00 0.00 60.65 58.37 2gqe s ILE 4 Cb -1.10 -3.44 0.00 0.00 0.13 0.00 0.00 42.46 38.05 2gqe s ILE 4 CO 0.43 -0.74 0.00 0.61 -1.91 0.00 0.00 174.94 173.33 2gqe n GLY 5 N 4.59 2.33 0.00 1.50 0.00 -1.26 -5.12 105.19 107.23 2gqe n GLY 5 Ca -0.03 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.18 2gqe n GLY 5 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2gqe n THR 6 N 0.00 0.00 -5.06 2.61 -2.24 -1.26 -4.25 114.28 104.08 2gqe n THR 6 Ca 0.00 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 2gqe n THR 6 Cb 0.00 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.07 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 -1.64 1.98 0.09 4.78 1.48 -0.36 -4.94 118.94 120.33 2gqe s TRP 7 Ca 0.00 -0.38 -0.01 0.00 -1.06 0.00 0.00 56.10 54.66 2gqe s TRP 7 Cb 0.00 -1.27 -0.04 0.00 -1.16 0.00 0.00 33.47 31.00 2gqe s TRP 7 CO 0.00 -0.02 0.25 -0.51 -4.06 0.00 0.00 176.95 172.61 2gqe s ASP 8 N -0.58 6.38 1.03 -2.66 1.11 -1.26 -0.61 116.67 120.09 2gqe s ASP 8 Ca 0.09 0.33 -0.15 0.00 0.18 0.00 0.00 52.55 52.99 2gqe s ASP 8 Cb -0.09 -1.98 0.21 0.00 1.07 0.00 0.00 42.92 42.13 2gqe s ASP 8 CO -0.01 0.13 1.15 0.00 1.18 0.00 0.00 175.17 177.62 2gqe n ASP 10 N -4.17 0.43 0.01 0.00 -0.08 -1.26 -4.50 116.55 106.99 2gqe n ASP 10 Ca 0.09 -0.95 -0.02 0.00 -1.51 0.00 0.00 54.79 52.41 2gqe n ASP 10 Cb 0.59 0.03 -0.01 0.00 2.34 0.00 0.00 41.12 44.07 2gqe n ASP 10 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2gqe n THR 11 N -0.03 0.76 0.30 5.18 -1.04 -1.26 -4.80 114.28 113.39 2gqe n THR 11 Ca 0.00 0.20 0.11 0.00 -2.04 0.00 0.00 64.05 62.32 2gqe n THR 11 Cb 0.13 -1.60 -0.02 0.00 -1.82 0.00 0.00 70.33 67.01 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 -2.27 -5.39 -3.71 0.00 4.77 -1.26 -5.05 117.00 104.09 2gqe n LEU 13 Ca 0.00 0.29 -0.13 0.00 -0.03 0.00 0.00 56.01 56.15 2gqe n LEU 13 Cb 0.50 -2.38 -0.10 0.00 -2.33 0.00 0.00 43.42 39.12 2gqe n LEU 13 CO 0.41 -1.32 0.14 -0.69 -1.33 0.00 0.00 177.39 174.60 2gqe s VAL 14 N -1.98 -0.00 0.38 4.08 1.01 -1.26 -4.88 120.40 117.75 2gqe s VAL 14 Ca 0.14 0.02 -0.18 0.00 0.00 0.00 0.00 61.98 61.95 2gqe s VAL 14 Cb -0.04 -0.67 -0.10 0.00 0.00 0.00 0.00 36.38 35.57 2gqe s VAL 14 CO 0.44 0.01 0.84 -1.10 0.00 0.00 0.00 175.10 175.29 2gqe s GLN 15 N 0.52 4.11 0.03 2.72 -0.21 -1.26 -0.36 119.66 125.21 2gqe s GLN 15 Ca -0.02 0.89 -0.11 0.00 0.02 0.00 0.00 55.36 56.13 2gqe s GLN 15 Cb -0.04 -2.31 0.01 0.00 1.00 0.00 0.00 33.01 31.67 2gqe s GLN 15 CO -0.03 0.06 0.24 -0.80 -2.12 0.00 0.00 175.29 172.65 2gqe s ASN 16 N -2.24 -0.05 0.51 5.90 0.01 0.22 -4.77 114.94 114.53 2gqe s ASN 16 Ca 0.58 -0.23 -0.20 0.00 -0.71 0.00 0.00 52.86 52.30 2gqe s ASN 16 Cb -0.10 0.30 -0.07 0.00 0.41 0.00 0.00 41.25 41.80 2gqe s ASN 16 CO 0.15 -0.54 1.12 -1.59 -1.51 0.00 0.00 177.10 174.74 2gqe s LYS 17 N -2.26 3.51 0.08 -0.60 -2.85 -1.26 -1.22 119.74 115.14 2gqe s LYS 17 Ca -0.07 1.62 0.17 0.00 -1.00 0.00 0.00 55.97 56.68 2gqe s LYS 17 Cb -0.02 -2.12 0.71 0.00 -2.06 0.00 0.00 37.83 34.34 2gqe s LYS 17 CO -0.02 -0.72 1.53 -0.35 0.10 0.00 0.00 175.35 175.89 2gqe n PRO 18 N -1.05 0.06 0.00 1.78 -0.04 -1.26 -2.01 135.00 132.48 2gqe n PRO 18 Ca 0.10 0.31 0.13 0.00 -0.04 0.00 0.00 63.50 64.00 2gqe n PRO 18 Cb 0.50 -1.61 0.46 0.00 -0.04 0.00 0.00 33.50 32.81 2gqe n PRO 18 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2gqe n GLU 19 N -1.72 0.51 -2.33 0.54 2.13 -1.26 -4.89 120.64 113.62 2gqe n GLU 19 Ca 0.03 -0.24 -0.24 0.00 0.66 0.00 0.00 57.16 57.37 2gqe n GLU 19 Cb 0.18 -1.50 0.06 0.00 0.27 0.00 0.00 31.44 30.46 2gqe n GLU 19 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2gqe s ALA 20 N -2.65 3.37 -0.03 4.31 0.00 -0.85 -5.03 121.76 120.88 2gqe s ALA 20 Ca 0.22 -1.08 0.08 0.00 0.00 0.00 0.00 51.96 51.19 2gqe s ALA 20 Cb 0.19 -2.43 -0.13 0.00 0.00 0.00 0.00 23.12 20.75 2gqe s ALA 20 CO 0.55 -1.18 0.16 -0.89 0.00 0.00 0.00 175.76 174.40 2gqe n ILE 21 N -2.77 0.11 -4.14 0.00 -0.00 -1.26 -4.99 119.36 106.31 2gqe n ILE 21 Ca 0.08 -0.23 -0.15 0.00 -0.00 0.00 0.00 62.75 62.46 2gqe n ILE 21 Cb 0.60 0.08 -0.06 0.00 -0.00 0.00 0.00 39.64 40.26 2gqe n ILE 21 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.55 174.96 2gqe s LYS 22 N -2.52 1.75 0.73 0.38 -2.85 -1.26 -0.81 119.74 115.16 2gqe s LYS 22 Ca -0.03 -1.75 -0.13 0.00 -1.00 0.00 0.00 55.97 53.06 2gqe s LYS 22 Cb 0.05 0.40 0.04 0.00 -2.06 0.00 0.00 37.83 36.25 2gqe s LYS 22 CO 0.35 -0.70 1.13 0.00 0.10 0.00 0.00 175.35 176.24 2gqe n VAL 24 N -2.93 2.05 0.00 0.00 3.14 -1.26 -3.32 118.33 116.01 2gqe n VAL 24 Ca 0.11 -1.46 0.00 0.00 -2.96 0.00 0.00 64.34 60.03 2gqe n VAL 24 Cb 0.52 -0.03 0.00 0.00 -1.06 0.00 0.00 33.84 33.27 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 0.33 2.60 0.35 1.55 0.00 -1.26 -4.88 120.51 119.21 2gqe n ALA 25 Ca 0.22 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.71 2gqe n ALA 25 Cb 0.88 0.17 -0.07 0.00 0.00 0.00 0.00 19.45 20.43 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 -1.43 -3.87 -3.24 0.00 -0.58 -1.21 -4.97 120.64 105.34 2gqe n GLU 27 Ca 0.01 0.47 -0.35 0.00 -0.42 0.00 0.00 57.16 56.86 2gqe n GLU 27 Cb 0.20 -4.36 -0.06 0.00 -0.57 0.00 0.00 31.44 26.65 2gqe n GLU 27 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2gqe s THR 28 N -3.19 4.74 -0.21 2.62 2.01 -1.26 -4.63 115.64 115.71 2gqe s THR 28 Ca 0.09 0.98 -0.29 0.00 0.31 0.00 0.00 61.69 62.78 2gqe s THR 28 Cb -0.04 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.69 2gqe s THR 28 CO 0.40 0.15 1.61 -2.16 -0.69 0.00 0.00 174.62 173.93 2gqe s PRO 29 N -2.17 3.83 0.45 4.92 0.04 -1.26 -0.30 135.00 140.51 2gqe s PRO 29 Ca 0.43 1.69 -0.25 0.00 0.04 0.00 0.00 61.00 62.90 2gqe s PRO 29 Cb -0.15 -4.02 -0.09 0.00 0.04 0.00 0.00 34.50 30.28 2gqe s PRO 29 CO 0.20 -1.25 1.36 1.17 0.04 0.00 0.00 177.00 178.51 2gqe n LYS 30 N 7.60 2.06 0.00 4.56 4.81 0.01 -4.95 118.16 132.24 2gqe n LYS 30 Ca 0.19 0.74 0.08 0.00 -0.87 0.00 0.00 58.31 58.44 2gqe n LYS 30 Cb 0.45 -2.52 0.47 0.00 0.02 0.00 0.00 35.03 33.45 2gqe n LYS 30 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22