#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 2.11 0.15 1.61 0.00 -1.26 -5.14 115.29 112.76 2gqe s HIS 1 Ca 0.00 -0.40 -0.16 0.00 -3.00 0.00 0.00 55.06 51.50 2gqe s HIS 1 Cb 0.00 -1.23 0.03 0.00 -4.00 0.00 0.00 32.58 27.38 2gqe s HIS 1 CO 0.00 0.16 0.44 1.41 -1.00 0.00 0.00 174.74 175.75 2gqe s MET 2 N -1.43 1.19 0.01 -0.38 1.75 -1.26 -5.16 119.30 114.02 2gqe s MET 2 Ca 0.10 -0.79 -0.12 0.00 -1.25 0.00 0.00 55.69 53.63 2gqe s MET 2 Cb -0.10 0.48 -0.05 0.00 2.84 0.00 0.00 34.83 38.00 2gqe s MET 2 CO 0.03 -0.48 0.37 0.54 -0.65 0.00 0.00 175.02 174.83 2gqe s VAL 3 N -3.84 5.11 0.17 10.11 0.11 -1.26 -5.10 120.40 125.71 2gqe s VAL 3 Ca 0.06 0.65 0.10 0.00 -2.93 0.00 0.00 61.98 59.86 2gqe s VAL 3 Cb 0.01 -3.65 -0.04 0.00 -1.53 0.00 0.00 36.38 31.16 2gqe s VAL 3 CO -0.08 0.50 -0.19 -0.51 -3.33 0.00 0.00 175.10 171.49 2gqe s ILE 4 N -1.16 2.65 0.00 7.04 2.07 -1.26 -4.74 121.20 125.80 2gqe s ILE 4 Ca 0.25 -1.83 0.00 0.00 -1.41 0.00 0.00 60.65 57.67 2gqe s ILE 4 Cb -0.15 -2.27 0.00 0.00 0.13 0.00 0.00 42.46 40.17 2gqe s ILE 4 CO 0.14 -0.07 0.00 0.61 -1.91 0.00 0.00 174.94 173.71 2gqe n GLY 5 N 0.33 1.31 3.48 1.50 0.00 -1.26 -4.86 105.19 105.70 2gqe n GLY 5 Ca -0.13 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.16 1.14 -4.09 2.61 -2.24 -1.26 -4.45 114.28 105.83 2gqe n THR 6 Ca 0.00 -0.28 -0.36 0.00 -2.27 0.00 0.00 64.05 61.14 2gqe n THR 6 Cb 0.00 -0.25 -0.07 0.00 -2.10 0.00 0.00 70.33 67.90 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 -0.51 3.41 -0.15 4.78 1.48 0.10 -4.83 118.94 123.21 2gqe s TRP 7 Ca 0.74 0.37 -0.11 0.00 -1.06 0.00 0.00 56.10 56.05 2gqe s TRP 7 Cb -1.00 -1.87 -0.05 0.00 -1.16 0.00 0.00 33.47 29.40 2gqe s TRP 7 CO 0.56 0.62 0.20 -0.51 -4.06 0.00 0.00 176.95 173.76 2gqe s ASP 8 N -1.03 6.38 1.25 -2.66 1.11 -1.26 -0.62 116.67 119.83 2gqe s ASP 8 Ca 0.15 0.44 -0.15 0.00 0.18 0.00 0.00 52.55 53.17 2gqe s ASP 8 Cb -0.12 -2.13 0.32 0.00 1.07 0.00 0.00 42.92 42.07 2gqe s ASP 8 CO 0.04 0.23 0.99 0.00 1.18 0.00 0.00 175.17 177.62 2gqe n ASP 10 N -5.19 0.83 0.09 0.00 8.00 -1.26 -4.56 116.55 114.46 2gqe n ASP 10 Ca 0.04 -1.38 0.00 0.00 0.71 0.00 0.00 54.79 54.15 2gqe n ASP 10 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.65 2gqe n ASP 10 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2gqe n THR 11 N -0.19 0.69 0.33 -3.53 -1.04 -1.26 -4.85 114.28 104.44 2gqe n THR 11 Ca 0.00 0.23 0.12 0.00 -2.04 0.00 0.00 64.05 62.36 2gqe n THR 11 Cb 0.36 -1.14 0.11 0.00 -1.82 0.00 0.00 70.33 67.83 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 -2.49 -4.89 -3.70 0.00 4.77 -1.26 -5.07 117.00 104.36 2gqe n LEU 13 Ca 0.02 0.13 -0.11 0.00 -0.03 0.00 0.00 56.01 56.03 2gqe n LEU 13 Cb 0.50 -2.26 -0.11 0.00 -2.33 0.00 0.00 43.42 39.22 2gqe n LEU 13 CO 0.37 -0.95 0.06 -0.69 -1.33 0.00 0.00 177.39 174.86 2gqe s VAL 14 N -2.40 -0.02 0.38 4.08 1.01 -1.26 -4.91 120.40 117.27 2gqe s VAL 14 Ca 0.07 0.08 -0.19 0.00 0.00 0.00 0.00 61.98 61.94 2gqe s VAL 14 Cb -0.02 -0.61 -0.10 0.00 0.00 0.00 0.00 36.38 35.65 2gqe s VAL 14 CO 0.41 0.03 0.86 -1.10 0.00 0.00 0.00 175.10 175.30 2gqe s GLN 15 N 1.20 4.15 0.09 2.72 -0.21 -1.26 -0.97 119.66 125.39 2gqe s GLN 15 Ca -0.08 0.95 -0.09 0.00 0.02 0.00 0.00 55.36 56.16 2gqe s GLN 15 Cb -0.07 -2.31 0.00 0.00 1.00 0.00 0.00 33.01 31.63 2gqe s GLN 15 CO -0.11 0.06 0.20 -0.80 -2.12 0.00 0.00 175.29 172.52 2gqe s ASN 16 N -2.19 0.10 0.45 5.90 0.01 0.21 -4.77 114.94 114.65 2gqe s ASN 16 Ca 0.58 -0.64 -0.21 0.00 -0.71 0.00 0.00 52.86 51.89 2gqe s ASN 16 Cb -0.10 0.35 -0.10 0.00 0.41 0.00 0.00 41.25 41.81 2gqe s ASN 16 CO 0.15 -0.74 0.99 -1.59 -1.51 0.00 0.00 177.10 174.41 2gqe s LYS 17 N -3.86 4.06 0.00 -0.60 -2.85 -1.26 0.01 119.74 115.24 2gqe s LYS 17 Ca 0.05 1.25 0.14 0.00 -1.00 0.00 0.00 55.97 56.41 2gqe s LYS 17 Cb 0.05 -2.19 0.60 0.00 -2.06 0.00 0.00 37.83 34.24 2gqe s LYS 17 CO -0.11 -0.19 1.45 -0.35 0.10 0.00 0.00 175.35 176.25 2gqe n PRO 18 N -0.70 0.00 0.00 1.78 -0.04 -1.26 -2.01 135.00 132.76 2gqe n PRO 18 Ca 0.08 0.26 0.13 0.00 -0.04 0.00 0.00 63.50 63.92 2gqe n PRO 18 Cb 0.53 -1.50 0.44 0.00 -0.04 0.00 0.00 33.50 32.93 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 -1.50 0.45 -2.28 0.54 4.07 -1.26 -4.89 120.64 115.77 2gqe n GLU 19 Ca 0.03 -0.22 -0.25 0.00 -0.06 0.00 0.00 57.16 56.67 2gqe n GLU 19 Cb 0.17 -1.50 0.06 0.00 -0.06 0.00 0.00 31.44 30.11 2gqe n GLU 19 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2gqe s ALA 20 N -2.69 3.27 -0.07 4.31 0.00 -0.85 -5.02 121.76 120.69 2gqe s ALA 20 Ca 0.21 -0.95 0.14 0.00 0.00 0.00 0.00 51.96 51.36 2gqe s ALA 20 Cb 0.19 -2.54 -0.21 0.00 0.00 0.00 0.00 23.12 20.57 2gqe s ALA 20 CO 0.56 -1.17 0.32 -0.89 0.00 0.00 0.00 175.76 174.58 2gqe n ILE 21 N -2.81 0.00 -3.86 0.00 -0.00 -1.26 -4.96 119.36 106.47 2gqe n ILE 21 Ca 0.08 -0.30 -0.08 0.00 -0.00 0.00 0.00 62.75 62.44 2gqe n ILE 21 Cb 0.60 0.26 -0.04 0.00 -0.00 0.00 0.00 39.64 40.47 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 -2.88 1.59 1.00 0.38 -2.85 -1.26 -0.75 119.74 114.97 2gqe s LYS 22 Ca -0.04 -1.02 -0.14 0.00 -1.00 0.00 0.00 55.97 53.77 2gqe s LYS 22 Cb 0.09 0.54 0.07 0.00 -2.06 0.00 0.00 37.83 36.47 2gqe s LYS 22 CO 0.56 -0.69 0.38 0.00 0.10 0.00 0.00 175.35 175.70 2gqe n VAL 24 N -3.89 2.31 0.00 0.00 3.14 -1.26 -3.77 118.33 114.86 2gqe n VAL 24 Ca 0.05 -2.05 0.00 0.00 -2.96 0.00 0.00 64.34 59.38 2gqe n VAL 24 Cb 0.56 -0.27 0.00 0.00 -1.06 0.00 0.00 33.84 33.07 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 -0.69 2.45 0.33 1.55 0.00 -1.26 -4.90 120.51 117.99 2gqe n ALA 25 Ca 0.23 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.73 2gqe n ALA 25 Cb 0.90 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.28 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 -1.55 -3.00 -2.72 0.00 -0.58 -1.25 -4.98 120.64 106.56 2gqe n GLU 27 Ca 0.00 0.35 -0.36 0.00 -0.42 0.00 0.00 57.16 56.73 2gqe n GLU 27 Cb 0.24 -3.89 -0.06 0.00 -0.57 0.00 0.00 31.44 27.16 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 -3.14 4.10 -0.24 2.62 2.01 -1.26 -4.62 115.64 115.11 2gqe s THR 28 Ca 0.12 1.63 -0.29 0.00 0.31 0.00 0.00 61.69 63.46 2gqe s THR 28 Cb -0.05 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.58 2gqe s THR 28 CO 0.30 0.03 1.62 -2.16 -0.69 0.00 0.00 174.62 173.72 2gqe s PRO 29 N -2.36 3.75 0.39 4.92 0.04 -1.26 -0.71 135.00 139.78 2gqe s PRO 29 Ca 0.54 1.62 -0.25 0.00 0.04 0.00 0.00 61.00 62.95 2gqe s PRO 29 Cb -0.18 -4.05 -0.11 0.00 0.04 0.00 0.00 34.50 30.20 2gqe s PRO 29 CO 0.23 -1.35 1.02 1.17 0.04 0.00 0.00 177.00 178.12 2gqe n LYS 30 N 7.74 1.40 0.00 4.56 4.81 0.07 -4.95 118.16 131.79 2gqe n LYS 30 Ca 0.19 0.50 0.08 0.00 -0.87 0.00 0.00 58.31 58.21 2gqe n LYS 30 Cb 0.45 -2.03 0.46 0.00 0.02 0.00 0.00 35.03 33.94 2gqe n LYS 30 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22