#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 -1.18 -4.23 1.61 -0.00 -1.26 -5.03 115.22 105.13 2gqe n HIS 1 Ca 0.00 0.01 -0.25 0.00 -0.00 0.00 0.00 57.72 57.48 2gqe n HIS 1 Cb 0.00 -1.68 -0.07 0.00 -0.00 0.00 0.00 29.99 28.23 2gqe n HIS 1 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2gqe s MET 2 N -4.03 2.38 -0.08 -1.40 1.00 -1.26 -5.11 119.30 110.81 2gqe s MET 2 Ca 0.63 -1.21 -0.24 0.00 0.00 0.00 0.00 55.69 54.87 2gqe s MET 2 Cb -0.20 -2.30 -0.03 0.00 0.00 0.00 0.00 34.83 32.30 2gqe s MET 2 CO 0.65 0.42 0.74 0.08 0.00 0.00 0.00 175.02 176.91 2gqe s VAL 3 N -1.95 5.01 -0.02 -6.03 1.01 -1.26 -4.93 120.40 112.24 2gqe s VAL 3 Ca 0.29 1.52 0.08 0.00 0.00 0.00 0.00 61.98 63.87 2gqe s VAL 3 Cb -0.08 -4.08 -0.13 0.00 0.00 0.00 0.00 36.38 32.09 2gqe s VAL 3 CO 0.19 0.21 0.17 -0.38 0.00 0.00 0.00 175.10 175.29 2gqe n ILE 4 N 3.94 0.05 0.22 2.22 2.08 -1.26 -4.55 119.36 122.06 2gqe n ILE 4 Ca 0.00 -0.21 0.18 0.00 0.56 0.00 0.00 62.75 63.28 2gqe n ILE 4 Cb 0.51 0.21 0.86 0.00 -0.75 0.00 0.00 39.64 40.47 2gqe n ILE 4 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2gqe h GLY 5 N 1.56 0.00 -4.00 7.39 0.00 -1.95 -3.44 103.07 102.63 2gqe h GLY 5 Ca -0.02 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.77 2gqe h GLY 5 CO 0.00 0.00 -0.49 -1.30 0.00 0.00 0.00 176.54 174.75 2gqe n THR 6 N -3.67 1.46 -3.99 4.70 -2.24 -1.26 -4.62 114.28 104.66 2gqe n THR 6 Ca 0.01 -0.41 -0.36 0.00 -2.27 0.00 0.00 64.05 61.02 2gqe n THR 6 Cb 0.32 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.47 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 -0.90 3.45 -0.14 4.78 1.48 0.93 -4.81 118.94 123.73 2gqe s TRP 7 Ca 0.52 0.40 -0.16 0.00 -1.06 0.00 0.00 56.10 55.79 2gqe s TRP 7 Cb -0.72 -1.93 -0.04 0.00 -1.16 0.00 0.00 33.47 29.61 2gqe s TRP 7 CO 0.47 0.59 0.40 -0.51 -4.06 0.00 0.00 176.95 173.84 2gqe s ASP 8 N -0.77 6.57 1.29 -2.66 1.11 -1.26 -0.76 116.67 120.18 2gqe s ASP 8 Ca 0.13 0.67 -0.17 0.00 0.18 0.00 0.00 52.55 53.37 2gqe s ASP 8 Cb -0.12 -2.24 0.33 0.00 1.07 0.00 0.00 42.92 41.96 2gqe s ASP 8 CO 0.03 0.03 0.94 0.00 1.18 0.00 0.00 175.17 177.35 2gqe n ASP 10 N -5.18 0.29 0.00 0.00 2.03 -1.26 -4.50 116.55 107.93 2gqe n ASP 10 Ca 0.05 -1.52 0.00 0.00 0.52 0.00 0.00 54.79 53.84 2gqe n ASP 10 Cb 0.56 -0.09 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 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 -0.12 0.00 0.19 5.18 -1.04 -1.26 -4.85 114.28 112.38 2gqe n THR 11 Ca 0.01 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.04 2gqe n THR 11 Cb 0.55 -0.27 -0.01 0.00 -1.82 0.00 0.00 70.33 68.78 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 -0.77 -7.36 -3.68 0.00 4.32 -1.26 -5.05 117.00 103.19 2gqe n LEU 13 Ca 0.01 0.34 -0.10 0.00 -0.02 0.00 0.00 56.01 56.24 2gqe n LEU 13 Cb 0.07 -3.28 -0.09 0.00 -1.62 0.00 0.00 43.42 38.50 2gqe n LEU 13 CO 0.07 -1.90 0.17 -0.69 -1.22 0.00 0.00 177.39 173.81 2gqe s VAL 14 N -2.68 -0.01 0.31 4.08 1.01 -1.26 -4.91 120.40 116.94 2gqe s VAL 14 Ca 0.17 0.05 -0.20 0.00 0.00 0.00 0.00 61.98 62.00 2gqe s VAL 14 Cb -0.05 -0.75 -0.09 0.00 0.00 0.00 0.00 36.38 35.49 2gqe s VAL 14 CO 0.73 0.02 0.83 -1.10 0.00 0.00 0.00 175.10 175.58 2gqe s GLN 15 N 1.37 4.26 0.05 2.72 1.11 -1.26 -0.76 119.66 127.15 2gqe s GLN 15 Ca -0.09 0.98 -0.04 0.00 0.01 0.00 0.00 55.36 56.22 2gqe s GLN 15 Cb -0.07 -2.60 -0.02 0.00 -1.01 0.00 0.00 33.01 29.31 2gqe s GLN 15 CO -0.14 0.22 0.07 -0.80 0.01 0.00 0.00 175.29 174.65 2gqe s ASN 16 N -1.91 0.27 0.46 5.90 0.01 0.06 -4.84 114.94 114.90 2gqe s ASN 16 Ca 0.51 -0.71 -0.22 0.00 -0.71 0.00 0.00 52.86 51.73 2gqe s ASN 16 Cb -0.14 0.24 -0.08 0.00 0.41 0.00 0.00 41.25 41.68 2gqe s ASN 16 CO 0.19 -0.58 1.12 -1.59 -1.51 0.00 0.00 177.10 174.74 2gqe s LYS 17 N -3.26 3.78 0.00 -0.60 -2.85 -1.26 -0.05 119.74 115.50 2gqe s LYS 17 Ca 0.01 1.65 0.14 0.00 -1.00 0.00 0.00 55.97 56.77 2gqe s LYS 17 Cb 0.03 -2.33 0.61 0.00 -2.06 0.00 0.00 37.83 34.07 2gqe s LYS 17 CO -0.08 -0.51 1.46 -0.35 0.10 0.00 0.00 175.35 175.98 2gqe n PRO 18 N -0.59 0.00 0.00 1.78 -0.04 -1.26 -2.01 135.00 132.88 2gqe n PRO 18 Ca 0.08 0.25 0.13 0.00 -0.04 0.00 0.00 63.50 63.92 2gqe n PRO 18 Cb 0.49 -1.50 0.43 0.00 -0.04 0.00 0.00 33.50 32.89 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 -1.50 0.45 -2.30 0.54 1.02 -1.26 -4.89 120.64 112.70 2gqe n GLU 19 Ca 0.03 -0.21 -0.25 0.00 -0.02 0.00 0.00 57.16 56.71 2gqe n GLU 19 Cb 0.17 -1.50 0.09 0.00 -0.02 0.00 0.00 31.44 30.18 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 -2.70 3.25 -0.18 0.62 0.00 -0.85 -5.03 121.76 116.88 2gqe s ALA 20 Ca 0.20 -1.17 0.06 0.00 0.00 0.00 0.00 51.96 51.05 2gqe s ALA 20 Cb 0.19 -2.43 -0.07 0.00 0.00 0.00 0.00 23.12 20.80 2gqe s ALA 20 CO 0.56 -1.39 0.21 -0.89 0.00 0.00 0.00 175.76 174.25 2gqe n ILE 21 N -2.93 0.00 -3.92 0.00 5.41 -1.26 -4.98 119.36 111.69 2gqe n ILE 21 Ca 0.10 -0.28 -0.12 0.00 1.00 0.00 0.00 62.75 63.45 2gqe n ILE 21 Cb 0.60 0.77 -0.01 0.00 -0.71 0.00 0.00 39.64 40.30 2gqe n ILE 21 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 2gqe n LYS 22 N -1.34 0.82 -2.44 0.38 2.85 -1.26 -0.68 118.16 116.49 2gqe n LYS 22 Ca 0.00 -2.45 -0.33 0.00 -1.05 0.00 0.00 58.31 54.48 2gqe n LYS 22 Cb 0.11 2.59 -0.03 0.00 -0.65 0.00 0.00 35.03 37.05 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 -1.22 2.77 0.00 0.00 3.14 -1.26 -2.91 118.33 118.84 2gqe n VAL 24 Ca 0.09 -1.44 0.00 0.00 -2.96 0.00 0.00 64.34 60.03 2gqe n VAL 24 Cb 0.53 -0.28 0.00 0.00 -1.06 0.00 0.00 33.84 33.03 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 0.55 2.65 0.39 1.55 0.00 -1.26 -4.89 120.51 119.50 2gqe n ALA 25 Ca 0.28 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.77 2gqe n ALA 25 Cb 1.20 0.08 -0.06 0.00 0.00 0.00 0.00 19.45 20.67 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 -1.35 -2.98 -2.46 0.00 4.71 -1.15 -4.95 120.64 112.46 2gqe n GLU 27 Ca 0.01 0.44 -0.38 0.00 -0.01 0.00 0.00 57.16 57.23 2gqe n GLU 27 Cb 0.18 -4.31 -0.03 0.00 -1.01 0.00 0.00 31.44 26.26 2gqe n GLU 27 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 2gqe s THR 28 N -2.96 3.52 -0.29 2.62 2.01 -1.26 -4.53 115.64 114.75 2gqe s THR 28 Ca 0.20 1.24 -0.29 0.00 0.31 0.00 0.00 61.69 63.15 2gqe s THR 28 Cb -0.09 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 2gqe s THR 28 CO 0.25 0.08 1.66 -2.16 -0.69 0.00 0.00 174.62 173.76 2gqe s PRO 29 N -2.29 3.57 0.37 4.92 0.04 -1.26 -0.47 135.00 139.87 2gqe s PRO 29 Ca 0.56 1.46 -0.25 0.00 0.04 0.00 0.00 61.00 62.81 2gqe s PRO 29 Cb -0.26 -4.10 -0.13 0.00 0.04 0.00 0.00 34.50 30.05 2gqe s PRO 29 CO 0.33 -1.57 0.81 1.17 0.04 0.00 0.00 177.00 177.78 2gqe n LYS 30 N 8.05 0.98 0.00 4.56 4.81 0.15 -4.96 118.16 131.74 2gqe n LYS 30 Ca 0.20 0.35 0.08 0.00 -0.87 0.00 0.00 58.31 58.07 2gqe n LYS 30 Cb 0.46 -1.72 0.47 0.00 0.02 0.00 0.00 35.03 34.26 2gqe n LYS 30 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22