#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kq6 n VAL 2 N 0.00 2.26 -3.42 -2.13 3.14 -1.26 -4.95 118.33 111.97 3kq6 n VAL 2 Ca 0.00 -0.50 -0.27 0.00 -2.96 0.00 0.00 64.34 60.61 3kq6 n VAL 2 Cb 0.00 -0.81 -0.08 0.00 -1.06 0.00 0.00 33.84 31.89 3kq6 n VAL 2 CO 0.00 0.00 0.00 -0.46 -6.46 0.00 0.00 176.83 169.91 3kq6 n ASN 3 N 0.68 2.97 -4.15 6.55 0.23 -1.26 -5.05 115.26 115.23 3kq6 n ASN 3 Ca 0.11 -3.27 -0.10 0.00 -0.53 0.00 0.00 54.58 50.79 3kq6 n ASN 3 Cb 0.42 -0.67 -0.10 0.00 -2.08 0.00 0.00 39.78 37.35 3kq6 n ASN 3 CO 0.00 0.00 0.00 -1.10 -0.93 0.00 0.00 177.26 175.23 3kq6 s GLN 4 N -2.10 0.98 0.19 -3.83 -1.52 -1.26 -5.12 119.66 107.00 3kq6 s GLN 4 Ca 0.38 -1.46 -0.31 0.00 -1.95 0.00 0.00 55.36 52.02 3kq6 s GLN 4 Cb 0.13 0.25 -0.09 0.00 -0.22 0.00 0.00 33.01 33.08 3kq6 s GLN 4 CO -0.05 -0.29 1.45 -1.01 -0.25 0.00 0.00 175.29 175.14 3kq6 s HIS 5 N -4.06 3.11 -0.27 0.91 3.76 -1.26 -4.98 115.29 112.49 3kq6 s HIS 5 Ca 0.26 0.92 -0.04 0.00 -0.15 0.00 0.00 55.06 56.05 3kq6 s HIS 5 Cb 0.07 -3.79 0.02 0.00 1.11 0.00 0.00 32.58 29.99 3kq6 s HIS 5 CO 0.03 -2.73 0.01 -0.51 -0.85 0.00 0.00 174.74 170.69 3kq6 s LEU 6 N 0.43 3.55 0.21 0.89 1.43 -1.26 -5.05 118.68 118.88 3kq6 s LEU 6 Ca 0.63 -0.85 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 3kq6 s LEU 6 Cb -0.41 -1.76 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 3kq6 s LEU 6 CO 0.36 -0.17 -0.12 0.00 0.23 0.00 0.00 176.35 176.65 3kq6 n GLY 8 N -0.39 2.54 0.20 0.00 0.00 -1.26 -1.27 105.19 105.01 3kq6 n GLY 8 Ca -0.08 -0.31 0.14 0.00 0.00 0.00 0.00 46.02 45.77 3kq6 n GLY 8 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3kq6 h SER 9 N 6.09 0.00 0.48 1.61 4.64 -2.00 -2.00 113.55 122.37 3kq6 h SER 9 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3kq6 h SER 9 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3kq6 h SER 9 CO 0.00 0.00 -0.63 0.45 -0.87 0.00 0.00 176.83 175.78 3kq6 h HIS 10 N 0.00 0.18 -0.02 4.77 -0.00 -1.56 -1.34 115.15 117.17 3kq6 h HIS 10 Ca 0.00 -0.07 -0.16 0.00 -0.00 0.00 0.00 60.37 60.14 3kq6 h HIS 10 Cb 0.12 -0.03 -0.02 0.00 -0.00 0.00 0.00 27.41 27.49 3kq6 h HIS 10 CO 0.00 0.72 -0.71 1.25 -0.00 0.00 0.00 177.93 179.20 3kq6 h LEU 11 N 0.10 0.16 -0.29 2.43 5.85 -1.28 -2.49 115.31 119.78 3kq6 h LEU 11 Ca -0.01 -0.11 -0.20 0.00 0.84 0.00 0.00 57.88 58.40 3kq6 h LEU 11 Cb 1.13 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.11 3kq6 h LEU 11 CO 0.09 0.81 -0.73 0.58 -0.34 0.00 0.00 178.44 178.85 3kq6 h VAL 12 N 0.09 1.32 -0.05 1.05 2.07 -1.48 -1.97 116.25 117.28 3kq6 h VAL 12 Ca -0.02 -2.01 -0.13 0.00 0.82 0.00 0.00 66.70 65.36 3kq6 h VAL 12 Cb 1.25 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 33.01 3kq6 h VAL 12 CO 0.10 0.62 -0.54 -0.08 0.02 0.00 0.00 177.57 177.70 3kq6 h GLU 13 N 0.43 0.15 -0.40 1.57 4.57 -1.24 -0.75 114.58 118.91 3kq6 h GLU 13 Ca -0.04 -0.09 -0.09 0.00 -1.18 0.00 0.00 59.36 57.96 3kq6 h GLU 13 Cb 1.33 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.92 3kq6 h GLU 13 CO 0.14 0.65 -0.12 0.00 -1.18 0.00 0.00 179.01 178.50 3kq6 h ALA 14 N 1.33 0.55 -0.56 2.92 0.00 -1.33 -1.41 119.26 120.77 3kq6 h ALA 14 Ca -0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 3kq6 h ALA 14 Cb 0.99 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3kq6 h ALA 14 CO 0.08 0.44 0.15 -0.07 0.00 0.00 0.00 179.25 179.85 3kq6 h LEU 15 N 0.60 0.84 -0.32 0.00 3.38 -1.16 0.13 115.31 118.77 3kq6 h LEU 15 Ca 0.10 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.89 3kq6 h LEU 15 Cb 0.65 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 3kq6 h LEU 15 CO 0.04 0.84 0.04 0.22 0.09 0.00 0.00 178.44 179.68 3kq6 h TYR 16 N 0.79 0.07 0.65 1.13 3.20 -0.93 0.18 116.97 122.05 3kq6 h TYR 16 Ca 0.18 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.04 3kq6 h TYR 16 Cb 0.32 0.02 0.01 0.00 1.54 0.00 0.00 36.73 38.61 3kq6 h TYR 16 CO 0.02 -0.00 -0.31 1.25 -1.64 0.00 0.00 178.16 177.48 3kq6 h LEU 17 N 0.15 -0.73 -0.88 2.82 5.85 -1.03 -2.82 115.31 118.67 3kq6 h LEU 17 Ca 0.15 0.03 0.12 0.00 0.84 0.00 0.00 57.88 59.02 3kq6 h LEU 17 Cb 0.18 0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.32 3kq6 h LEU 17 CO -0.22 -0.39 0.51 0.58 -0.34 0.00 0.00 178.44 178.58 3kq6 h VAL 18 N -1.13 0.85 0.00 1.05 2.07 -0.68 -2.83 116.25 115.57 3kq6 h VAL 18 Ca -0.09 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 3kq6 h VAL 18 Cb 0.67 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3kq6 h VAL 18 CO 0.15 0.14 -0.47 0.00 0.02 0.00 0.00 177.57 177.41 3kq6 n GLY 20 N 1.20 2.55 0.31 0.00 0.00 -1.06 -1.20 105.19 106.99 3kq6 n GLY 20 Ca 0.01 -0.20 0.21 0.00 0.00 0.00 0.00 46.02 46.04 3kq6 n GLY 20 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3kq6 h GLU 21 N 0.00 0.00 0.00 1.61 5.08 -1.92 -2.02 114.58 117.33 3kq6 h GLU 21 Ca 0.00 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 3kq6 h GLU 21 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3kq6 h GLU 21 CO 0.00 0.00 -0.24 0.00 -1.00 0.00 0.00 179.01 177.77 3kq6 h ARG 22 N 0.00 0.00 -0.00 2.33 3.08 -1.56 -3.49 114.38 114.74 3kq6 h ARG 22 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3kq6 h ARG 22 Cb 0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 3kq6 h ARG 22 CO 0.00 0.24 -0.00 0.41 -1.07 0.00 0.00 179.97 179.55 3kq6 n GLY 23 N -0.78 -1.67 3.63 0.04 0.00 -0.76 -5.06 105.19 100.59 3kq6 n GLY 23 Ca -0.02 -1.52 -0.10 0.00 0.00 0.00 0.00 46.02 44.38 3kq6 n GLY 23 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3kq6 s PHE 24 N -1.59 0.40 -0.08 1.61 -0.12 -1.26 -4.83 117.98 112.11 3kq6 s PHE 24 Ca 0.00 -0.79 0.01 0.00 -0.05 0.00 0.00 56.93 56.10 3kq6 s PHE 24 Cb 0.00 0.29 0.02 0.00 -0.63 0.00 0.00 43.02 42.70 3kq6 s PHE 24 CO 0.00 -1.13 -0.10 -0.59 -0.05 0.00 0.00 175.22 173.35 3kq6 s PHE 25 N -3.58 1.36 -0.37 3.49 -0.12 -1.26 -5.10 117.98 112.41 3kq6 s PHE 25 Ca 0.22 -0.54 -0.01 0.00 -0.05 0.00 0.00 56.93 56.54 3kq6 s PHE 25 Cb -0.02 -1.06 0.10 0.00 -0.63 0.00 0.00 43.02 41.41 3kq6 s PHE 25 CO 0.11 -0.33 0.12 -0.47 -0.05 0.00 0.00 175.22 174.60 3kq6 s TYR 26 N 0.99 3.57 -0.44 3.49 5.04 -1.26 -5.02 117.35 123.72 3kq6 s TYR 26 Ca -0.09 -2.47 0.02 0.00 -2.44 0.00 0.00 57.07 52.10 3kq6 s TYR 26 Cb -0.15 -2.91 0.14 0.00 0.35 0.00 0.00 41.96 39.40 3kq6 s TYR 26 CO -0.00 -0.93 0.26 0.95 -1.34 0.00 0.00 175.55 174.49 3kq6 s THR 27 N 1.10 1.15 -0.01 4.34 -4.23 -1.26 -5.05 115.64 111.68 3kq6 s THR 27 Ca 0.06 -2.51 -0.23 0.00 -1.18 0.00 0.00 61.69 57.83 3kq6 s THR 27 Cb -0.21 -1.81 -0.14 0.00 1.34 0.00 0.00 72.50 71.68 3kq6 s THR 27 CO -0.05 -0.95 1.01 1.55 -0.54 0.00 0.00 174.62 175.64 3kq6 h PRO 28 N 6.59 -0.49 -0.47 3.99 0.13 -2.06 -3.17 132.00 136.52 3kq6 h PRO 28 Ca 0.04 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3kq6 h PRO 28 Cb 0.92 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3kq6 h PRO 28 CO 0.44 -0.18 0.00 1.17 -0.23 0.00 0.00 178.00 179.21 3kq6 n LYS 29 N -5.14 1.40 0.00 0.86 4.81 -1.26 -5.32 118.16 113.51 3kq6 n LYS 29 Ca -0.09 -0.43 0.00 0.00 -0.87 0.00 0.00 58.31 56.92 3kq6 n LYS 29 Cb 0.28 -1.32 0.00 0.00 0.02 0.00 0.00 35.03 34.01 3kq6 n LYS 29 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82