#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1liq h VAL 2 N 0.00 0.90 0.00 6.31 3.04 -1.89 0.59 116.25 125.20 1liq h VAL 2 Ca 0.00 -0.13 -0.04 0.00 -1.01 0.00 0.00 66.70 65.52 1liq h VAL 2 Cb 0.00 0.49 -0.01 0.00 -2.01 0.00 0.00 31.29 29.77 1liq h VAL 2 CO 0.00 0.07 -0.17 -0.09 -1.01 0.00 0.00 177.57 176.37 1liq h ARG 3 N 0.38 0.00 -0.21 4.17 9.65 -1.94 -1.95 114.38 124.49 1liq h ARG 3 Ca 0.26 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.14 1liq h ARG 3 Cb 0.51 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1liq h ARG 3 CO -0.07 0.17 0.00 0.00 2.80 0.00 0.00 179.97 182.87 1liq n ALA 4 N -2.37 2.44 -1.58 2.80 0.00 0.13 -4.98 120.51 116.96 1liq n ALA 4 Ca -0.02 -0.84 -0.31 0.00 0.00 0.00 0.00 53.44 52.27 1liq n ALA 4 Cb 0.26 -0.82 0.05 0.00 0.00 0.00 0.00 19.45 18.94 1liq n ALA 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1liq n SER 6 N -3.13 2.63 -4.75 0.00 3.41 -1.26 -5.02 113.62 105.50 1liq n SER 6 Ca 0.07 -2.83 -0.33 0.00 -0.26 0.00 0.00 58.87 55.52 1liq n SER 6 Cb 0.54 -0.37 -0.08 0.00 -0.26 0.00 0.00 64.21 64.04 1liq n SER 6 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1liq s LEU 7 N -2.45 3.78 0.00 1.04 1.43 -1.26 -5.00 118.68 116.22 1liq s LEU 7 Ca 0.28 0.12 0.29 0.00 -1.03 0.00 0.00 54.13 53.80 1liq s LEU 7 Cb 0.24 -2.14 1.46 0.00 0.03 0.00 0.00 46.19 45.78 1liq s LEU 7 CO 0.04 0.30 2.02 -0.81 0.23 0.00 0.00 176.35 178.13 1liq n PRO 8 N 1.41 0.37 -0.06 1.29 -0.04 -1.26 -3.05 135.00 133.66 1liq n PRO 8 Ca -0.15 0.01 -0.18 0.00 -0.04 0.00 0.00 63.50 63.14 1liq n PRO 8 Cb 0.53 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.36 1liq n PRO 8 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1liq h HIS 9 N 0.00 0.12 -0.00 0.54 2.76 -2.02 -3.35 115.15 113.19 1liq h HIS 9 Ca 0.00 -0.09 -0.12 0.00 -2.20 0.00 0.00 60.37 57.97 1liq h HIS 9 Cb 0.30 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 1liq h HIS 9 CO 0.00 1.24 -0.55 0.00 -1.30 0.00 0.00 177.93 177.31 1liq s ARG 11 N -3.77 3.08 0.00 0.00 3.00 -1.17 -4.48 118.95 115.61 1liq s ARG 11 Ca -0.02 -1.11 0.00 0.00 -1.00 0.00 0.00 55.73 53.61 1liq s ARG 11 Cb 0.13 -5.29 0.00 0.00 0.00 0.00 0.00 34.95 29.80 1liq s ARG 11 CO 0.75 -3.06 0.00 2.41 0.00 0.00 0.00 175.30 175.40 1liq n THR 12 N 7.32 0.00 0.04 4.11 -1.04 -1.26 -4.93 114.28 118.51 1liq n THR 12 Ca 0.42 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.46 1liq n THR 12 Cb 0.47 -0.18 0.06 0.00 -1.82 0.00 0.00 70.33 68.86 1liq n THR 12 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 1liq n MET 13 N -0.91 1.74 -0.97 -2.82 2.81 -1.26 -4.97 117.12 110.74 1liq n MET 13 Ca 0.00 -1.44 0.00 0.00 -1.81 0.00 0.00 57.70 54.45 1liq n MET 13 Cb 0.00 -1.14 0.00 0.00 -0.71 0.00 0.00 33.22 31.37 1liq n MET 13 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1liq n LYS 14 N 0.17 0.00 -1.47 0.03 2.85 -1.26 -4.94 118.16 113.55 1liq n LYS 14 Ca 0.05 0.46 -0.33 0.00 -1.05 0.00 0.00 58.31 57.44 1liq n LYS 14 Cb 0.27 -3.76 -0.08 0.00 -0.65 0.00 0.00 35.03 30.82 1liq n LYS 14 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 1liq n ASN 15 N 1.89 2.30 -0.27 -5.58 0.23 -1.26 -4.71 115.26 107.86 1liq n ASN 15 Ca 0.00 -2.63 0.24 0.00 -0.53 0.00 0.00 54.58 51.66 1liq n ASN 15 Cb 0.02 -1.36 0.58 0.00 -2.08 0.00 0.00 39.78 36.94 1liq n ASN 15 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1liq h VAL 16 N 5.56 0.57 -0.64 3.53 2.07 -1.93 0.29 116.25 125.70 1liq h VAL 16 Ca 0.25 -0.09 0.05 0.00 0.82 0.00 0.00 66.70 67.73 1liq h VAL 16 Cb 0.83 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1liq h VAL 16 CO 1.54 0.05 0.42 -0.07 0.02 0.00 0.00 177.57 179.53 1liq h LEU 17 N 0.27 0.58 -0.11 2.57 3.38 -1.96 0.75 115.31 120.79 1liq h LEU 17 Ca 0.51 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.24 1liq h LEU 17 Cb 1.52 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 42.15 1liq h LEU 17 CO -0.16 0.38 -0.98 -1.13 0.09 0.00 0.00 178.44 176.65 1liq h ASN 18 N 0.66 0.67 1.53 -0.43 -0.73 -0.83 -3.18 115.58 113.28 1liq h ASN 18 Ca 0.27 -0.54 -0.04 0.00 1.87 0.00 0.00 56.30 57.87 1liq h ASN 18 Cb 0.22 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.60 1liq h ASN 18 CO -0.08 1.34 -0.17 -0.74 -0.37 0.00 0.00 177.43 177.41 1liq h HIS 19 N 0.29 0.00 -0.27 0.67 2.76 -0.84 -3.07 115.15 114.70 1liq h HIS 19 Ca -0.10 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.07 1liq h HIS 19 Cb 1.62 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.58 1liq h HIS 19 CO 0.08 0.17 0.00 -0.12 -1.30 0.00 0.00 177.93 176.75 1liq n MET 20 N -3.18 2.41 0.00 5.26 1.56 0.25 -1.81 117.12 121.60 1liq n MET 20 Ca 0.02 -1.29 0.01 0.00 -0.27 0.00 0.00 57.70 56.17 1liq n MET 20 Cb 0.53 -1.67 -0.00 0.00 2.15 0.00 0.00 33.22 34.23 1liq n MET 20 CO 0.00 0.00 0.00 2.41 -0.73 0.00 0.00 175.97 177.65 1liq n THR 21 N 0.31 0.00 -0.01 1.12 -1.04 -1.16 -4.79 114.28 108.72 1liq n THR 21 Ca 0.11 -0.48 0.00 0.00 -2.04 0.00 0.00 64.05 61.65 1liq n THR 21 Cb 0.55 1.02 0.00 0.00 -1.82 0.00 0.00 70.33 70.07 1liq n THR 21 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1liq n HIS 22 N -0.52 0.00 -3.91 -1.42 1.44 -1.23 -5.12 115.22 104.46 1liq n HIS 22 Ca 0.01 0.00 -0.22 0.00 -2.01 0.00 0.00 57.72 55.50 1liq n HIS 22 Cb 0.03 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.10 1liq n HIS 22 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1liq s GLN 24 N -3.94 4.78 -0.30 0.00 -2.07 -1.26 -4.72 119.66 112.14 1liq s GLN 24 Ca 0.39 1.40 -0.17 0.00 -1.82 0.00 0.00 55.36 55.16 1liq s GLN 24 Cb -0.05 -3.28 0.18 0.00 -1.09 0.00 0.00 33.01 28.77 1liq s GLN 24 CO 0.25 0.53 1.12 0.00 -1.32 0.00 0.00 175.29 175.87 1liq s ALA 25 N -1.14 -3.01 -0.39 2.60 0.00 -1.26 -4.37 121.76 114.19 1liq s ALA 25 Ca 0.40 1.89 0.06 0.00 0.00 0.00 0.00 51.96 54.31 1liq s ALA 25 Cb -0.25 -2.19 0.62 0.00 0.00 0.00 0.00 23.12 21.30 1liq s ALA 25 CO 0.30 -1.00 1.77 0.41 0.00 0.00 0.00 175.76 177.24 1liq n GLY 26 N 4.84 4.56 0.00 0.00 0.00 -1.26 -4.94 105.19 108.39 1liq n GLY 26 Ca -0.08 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1liq n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60