#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 0.25 -0.28 1.61 4.02 -1.26 -5.07 115.29 114.56 2gqe s HIS 1 Ca 0.00 -0.64 0.14 0.00 1.02 0.00 0.00 55.06 55.57 2gqe s HIS 1 Cb 0.00 -0.16 0.48 0.00 -1.02 0.00 0.00 32.58 31.88 2gqe s HIS 1 CO 0.00 -0.44 1.15 -1.33 1.02 0.00 0.00 174.74 175.15 2gqe n MET 2 N 0.33 2.81 -2.44 1.40 2.81 -1.26 -4.82 117.12 115.94 2gqe n MET 2 Ca -0.16 -3.89 -0.21 0.00 -1.81 0.00 0.00 57.70 51.62 2gqe n MET 2 Cb 0.60 -1.99 0.01 0.00 -0.71 0.00 0.00 33.22 31.14 2gqe n MET 2 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2gqe n VAL 3 N -0.65 2.09 -3.18 2.03 0.24 -1.26 -4.93 118.33 112.66 2gqe n VAL 3 Ca 0.28 -4.31 -0.38 0.00 -2.04 0.00 0.00 64.34 57.89 2gqe n VAL 3 Cb 0.89 -0.73 -0.02 0.00 -1.47 0.00 0.00 33.84 32.52 2gqe n VAL 3 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 2gqe n ILE 4 N -0.47 4.28 -2.21 1.34 -0.00 -1.26 -4.85 119.36 116.19 2gqe n ILE 4 Ca 0.33 -5.65 0.00 0.00 -0.00 0.00 0.00 62.75 57.42 2gqe n ILE 4 Cb 0.77 -2.12 0.00 0.00 -0.00 0.00 0.00 39.64 38.28 2gqe n ILE 4 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2gqe n GLY 5 N 1.30 4.96 3.65 7.39 0.00 -1.26 -5.13 105.19 116.09 2gqe n GLY 5 Ca 0.27 -1.13 -0.02 0.00 0.00 0.00 0.00 46.02 45.14 2gqe n GLY 5 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2gqe s THR 6 N -0.15 0.00 -0.05 2.61 -4.23 -1.26 -4.24 115.64 108.32 2gqe s THR 6 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.57 2gqe s THR 6 Cb 0.00 -1.00 -0.01 0.00 1.34 0.00 0.00 72.50 72.83 2gqe s THR 6 CO 0.00 0.00 -0.22 -1.66 -0.54 0.00 0.00 174.62 172.20 2gqe s TRP 7 N -0.80 2.19 -0.01 3.99 1.48 -0.44 -4.94 118.94 120.42 2gqe s TRP 7 Ca 0.09 -0.64 -0.10 0.00 -1.06 0.00 0.00 56.10 54.40 2gqe s TRP 7 Cb -0.02 -1.45 -0.05 0.00 -1.16 0.00 0.00 33.47 30.79 2gqe s TRP 7 CO -0.10 -0.19 0.31 -0.51 -4.06 0.00 0.00 176.95 172.39 2gqe s ASP 8 N -0.11 6.60 1.10 -2.66 1.11 -1.26 -0.84 116.67 120.60 2gqe s ASP 8 Ca -0.03 0.71 -0.14 0.00 0.18 0.00 0.00 52.55 53.27 2gqe s ASP 8 Cb -0.13 -2.15 0.24 0.00 1.07 0.00 0.00 42.92 41.95 2gqe s ASP 8 CO 0.03 0.29 1.07 0.00 1.18 0.00 0.00 175.17 177.74 2gqe n ASP 10 N -4.54 0.63 0.01 0.00 2.03 -1.26 -4.43 116.55 109.00 2gqe n ASP 10 Ca 0.05 -1.10 0.00 0.00 0.52 0.00 0.00 54.79 54.27 2gqe n ASP 10 Cb 0.57 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 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 -0.05 0.22 1.00 5.18 -1.04 -1.26 -4.79 114.28 113.54 2gqe n THR 11 Ca 0.00 0.07 0.10 0.00 -2.04 0.00 0.00 64.05 62.18 2gqe n THR 11 Cb 0.16 -1.51 -0.08 0.00 -1.82 0.00 0.00 70.33 67.08 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 -1.32 -7.91 -3.68 0.00 4.32 -1.26 -5.04 117.00 102.11 2gqe n LEU 13 Ca 0.05 0.65 -0.12 0.00 -0.02 0.00 0.00 56.01 56.57 2gqe n LEU 13 Cb 0.35 -3.38 -0.09 0.00 -1.62 0.00 0.00 43.42 38.68 2gqe n LEU 13 CO 0.41 -2.45 0.22 -0.69 -1.22 0.00 0.00 177.39 173.65 2gqe s VAL 14 N -2.47 -0.01 0.28 4.08 1.01 -1.26 -4.88 120.40 117.16 2gqe s VAL 14 Ca 0.22 0.02 -0.21 0.00 0.00 0.00 0.00 61.98 62.01 2gqe s VAL 14 Cb -0.06 -0.78 -0.09 0.00 0.00 0.00 0.00 36.38 35.45 2gqe s VAL 14 CO 0.76 0.01 0.80 -1.10 0.00 0.00 0.00 175.10 175.57 2gqe s GLN 15 N 0.81 4.30 0.01 2.72 -0.21 -1.26 -0.22 119.66 125.80 2gqe s GLN 15 Ca -0.04 0.98 -0.06 0.00 0.02 0.00 0.00 55.36 56.26 2gqe s GLN 15 Cb -0.05 -2.74 -0.00 0.00 1.00 0.00 0.00 33.01 31.21 2gqe s GLN 15 CO -0.06 0.30 0.10 -0.80 -2.12 0.00 0.00 175.29 172.71 2gqe s ASN 16 N -1.77 0.08 0.51 5.90 0.01 -0.02 -4.81 114.94 114.85 2gqe s ASN 16 Ca 0.48 -0.30 -0.22 0.00 -0.71 0.00 0.00 52.86 52.11 2gqe s ASN 16 Cb -0.16 0.19 -0.06 0.00 0.41 0.00 0.00 41.25 41.63 2gqe s ASN 16 CO 0.21 -0.38 1.24 -1.59 -1.51 0.00 0.00 177.10 175.07 2gqe s LYS 17 N -1.55 3.41 0.00 -0.60 -2.85 -1.26 -1.33 119.74 115.57 2gqe s LYS 17 Ca -0.14 1.94 0.14 0.00 -1.00 0.00 0.00 55.97 56.91 2gqe s LYS 17 Cb -0.07 -2.27 0.62 0.00 -2.06 0.00 0.00 37.83 34.05 2gqe s LYS 17 CO 0.00 -0.88 1.45 -0.35 0.10 0.00 0.00 175.35 175.67 2gqe n PRO 18 N -0.87 0.02 0.00 1.78 -0.04 -1.26 -2.01 135.00 132.63 2gqe n PRO 18 Ca 0.09 0.24 0.13 0.00 -0.04 0.00 0.00 63.50 63.93 2gqe n PRO 18 Cb 0.47 -1.50 0.43 0.00 -0.04 0.00 0.00 33.50 32.86 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 0.46 -2.33 0.54 1.02 -1.26 -4.89 120.64 112.70 2gqe n GLU 19 Ca 0.04 -0.22 -0.25 0.00 -0.02 0.00 0.00 57.16 56.71 2gqe n GLU 19 Cb 0.16 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.16 2gqe n GLU 19 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gqe s ALA 20 N -2.69 3.34 -0.18 0.62 0.00 -0.85 -5.03 121.76 116.97 2gqe s ALA 20 Ca 0.20 -1.12 0.08 0.00 0.00 0.00 0.00 51.96 51.13 2gqe s ALA 20 Cb 0.19 -2.43 -0.10 0.00 0.00 0.00 0.00 23.12 20.78 2gqe s ALA 20 CO 0.56 -1.25 0.25 1.51 0.00 0.00 0.00 175.76 176.83 2gqe n ILE 21 N -2.82 0.00 -4.00 0.00 0.13 -1.26 -4.97 119.36 106.43 2gqe n ILE 21 Ca 0.09 -0.25 -0.14 0.00 -1.10 0.00 0.00 62.75 61.36 2gqe n ILE 21 Cb 0.60 0.64 -0.02 0.00 -0.84 0.00 0.00 39.64 40.02 2gqe n ILE 21 CO 0.00 0.00 0.00 2.29 2.80 0.00 0.00 176.55 181.64 2gqe n LYS 22 N -1.50 0.78 -1.63 9.51 2.85 -1.26 -0.67 118.16 126.25 2gqe n LYS 22 Ca -0.00 -2.68 -0.32 0.00 -1.05 0.00 0.00 58.31 54.26 2gqe n LYS 22 Cb 0.17 2.70 0.05 0.00 -0.65 0.00 0.00 35.03 37.30 2gqe n LYS 22 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2gqe n VAL 24 N -2.88 2.31 0.00 0.00 3.14 -1.26 -3.31 118.33 116.33 2gqe n VAL 24 Ca 0.09 -1.66 0.00 0.00 -2.96 0.00 0.00 64.34 59.80 2gqe n VAL 24 Cb 0.53 -0.19 0.00 0.00 -1.06 0.00 0.00 33.84 33.12 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 -0.05 1.97 0.10 1.55 0.00 -1.26 -4.89 120.51 117.94 2gqe n ALA 25 Ca 0.23 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.68 2gqe n ALA 25 Cb 0.95 0.08 -0.02 0.00 0.00 0.00 0.00 19.45 20.46 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 -1.19 -2.67 -2.48 0.00 1.02 -1.21 -4.96 120.64 109.15 2gqe n GLU 27 Ca 0.00 0.40 -0.37 0.00 -0.02 0.00 0.00 57.16 57.17 2gqe n GLU 27 Cb 0.05 -4.16 -0.03 0.00 -0.02 0.00 0.00 31.44 27.27 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 -2.93 3.58 -0.39 2.62 2.01 -1.26 -4.52 115.64 114.76 2gqe s THR 28 Ca 0.18 1.24 -0.28 0.00 0.31 0.00 0.00 61.69 63.14 2gqe s THR 28 Cb -0.08 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 2gqe s THR 28 CO 0.22 0.03 1.72 -2.16 -0.69 0.00 0.00 174.62 173.74 2gqe s PRO 29 N -2.44 3.30 0.31 4.92 0.04 -1.26 -0.22 135.00 139.64 2gqe s PRO 29 Ca 0.58 1.20 -0.25 0.00 0.04 0.00 0.00 61.00 62.57 2gqe s PRO 29 Cb -0.24 -4.18 -0.15 0.00 0.04 0.00 0.00 34.50 29.96 2gqe s PRO 29 CO 0.30 -1.91 0.50 1.17 0.04 0.00 0.00 177.00 177.10 2gqe n LYS 30 N 8.45 0.33 0.00 4.56 4.81 0.15 -4.96 118.16 131.51 2gqe n LYS 30 Ca 0.21 0.12 0.08 0.00 -0.87 0.00 0.00 58.31 57.85 2gqe n LYS 30 Cb 0.48 -1.24 0.46 0.00 0.02 0.00 0.00 35.03 34.75 2gqe n LYS 30 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22