#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 1.08 0.00 2.62 3.04 -1.89 -1.29 116.25 119.82 1liq h VAL 2 Ca 0.00 -0.22 -0.02 0.00 -1.01 0.00 0.00 66.70 65.45 1liq h VAL 2 Cb 0.00 0.75 -0.00 0.00 -2.01 0.00 0.00 31.29 30.03 1liq h VAL 2 CO 0.00 0.09 -0.11 -0.09 -1.01 0.00 0.00 177.57 176.46 1liq h ARG 3 N 0.35 0.00 -0.11 4.17 2.43 -1.93 -1.12 114.38 118.17 1liq h ARG 3 Ca 0.09 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1liq h ARG 3 Cb 0.02 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1liq h ARG 3 CO -0.01 0.11 0.00 0.00 -1.51 0.00 0.00 179.97 178.55 1liq n ALA 4 N -2.48 2.49 -1.58 2.80 0.00 -0.52 -4.95 120.51 116.27 1liq n ALA 4 Ca -0.03 -0.66 -0.31 0.00 0.00 0.00 0.00 53.44 52.45 1liq n ALA 4 Cb 0.18 -0.96 0.06 0.00 0.00 0.00 0.00 19.45 18.73 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 -3.17 2.69 -4.76 0.00 3.41 -1.26 -5.02 113.62 105.52 1liq n SER 6 Ca 0.07 -2.91 -0.33 0.00 -0.26 0.00 0.00 58.87 55.45 1liq n SER 6 Cb 0.54 -0.40 -0.07 0.00 -0.26 0.00 0.00 64.21 64.02 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 -2.58 3.80 0.00 1.04 1.43 -1.26 -5.00 118.68 116.11 1liq s LEU 7 Ca 0.30 0.11 0.28 0.00 -1.03 0.00 0.00 54.13 53.80 1liq s LEU 7 Cb 0.26 -2.19 1.25 0.00 0.03 0.00 0.00 46.19 45.53 1liq s LEU 7 CO 0.05 0.28 1.92 -0.81 0.23 0.00 0.00 176.35 178.02 1liq n PRO 8 N 1.27 0.06 -0.07 1.29 -0.04 -1.26 -3.27 135.00 132.99 1liq n PRO 8 Ca -0.14 0.01 -0.10 0.00 -0.04 0.00 0.00 63.50 63.24 1liq n PRO 8 Cb 0.53 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.00 0.00 0.54 2.76 -2.02 -3.33 115.15 113.10 1liq h HIS 9 Ca 0.00 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 1liq h HIS 9 Cb 0.45 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.41 1liq h HIS 9 CO 0.00 0.68 -0.12 0.00 -1.30 0.00 0.00 177.93 177.18 1liq s ARG 11 N -4.62 2.71 0.00 0.00 3.52 -1.20 -4.54 118.95 114.82 1liq s ARG 11 Ca -0.04 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 54.69 1liq s ARG 11 Cb 0.15 -5.20 0.00 0.00 -1.56 0.00 0.00 34.95 28.34 1liq s ARG 11 CO 0.65 -3.48 0.00 2.41 -0.81 0.00 0.00 175.30 174.07 1liq n THR 12 N 7.66 0.00 -1.21 4.11 -1.04 -1.26 -4.97 114.28 117.57 1liq n THR 12 Ca 0.42 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.47 1liq n THR 12 Cb 0.47 -0.39 0.04 0.00 -1.82 0.00 0.00 70.33 68.64 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 -0.98 0.88 -0.91 -2.82 2.81 -1.26 -4.97 117.12 109.87 1liq n MET 13 Ca 0.00 -1.50 0.00 0.00 -1.81 0.00 0.00 57.70 54.39 1liq n MET 13 Cb 0.00 -0.90 0.00 0.00 -0.71 0.00 0.00 33.22 31.61 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 -0.54 0.00 -1.46 0.03 2.85 -1.26 -4.94 118.16 112.84 1liq n LYS 14 Ca 0.05 0.40 -0.34 0.00 -1.05 0.00 0.00 58.31 57.38 1liq n LYS 14 Cb 0.57 -3.53 -0.08 0.00 -0.65 0.00 0.00 35.03 31.35 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 1.62 2.35 -0.18 -5.58 0.23 -1.26 -4.70 115.26 107.73 1liq n ASN 15 Ca 0.00 -2.64 0.25 0.00 -0.53 0.00 0.00 54.58 51.66 1liq n ASN 15 Cb 0.00 -1.34 0.66 0.00 -2.08 0.00 0.00 39.78 37.01 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 5.48 0.60 -0.63 3.53 2.07 -1.94 0.21 116.25 125.58 1liq h VAL 16 Ca 0.27 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.79 1liq h VAL 16 Cb 0.82 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1liq h VAL 16 CO 1.57 0.02 0.42 -0.07 0.02 0.00 0.00 177.57 179.53 1liq h LEU 17 N 0.13 0.59 -0.05 2.57 3.38 -1.95 0.77 115.31 120.75 1liq h LEU 17 Ca 0.43 -0.00 -0.26 0.00 0.09 0.00 0.00 57.88 58.14 1liq h LEU 17 Cb 1.49 -0.13 0.02 0.00 0.09 0.00 0.00 40.66 42.13 1liq h LEU 17 CO -0.06 0.39 -1.01 -1.13 0.09 0.00 0.00 178.44 176.72 1liq h ASN 18 N 0.68 0.84 1.51 -0.43 -0.73 -0.98 -3.18 115.58 113.29 1liq h ASN 18 Ca 0.26 -0.67 -0.01 0.00 1.87 0.00 0.00 56.30 57.75 1liq h ASN 18 Cb 0.19 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.52 1liq h ASN 18 CO -0.08 1.47 -0.06 -0.74 -0.37 0.00 0.00 177.43 177.65 1liq h HIS 19 N 0.37 0.00 -0.31 0.67 2.76 -0.99 -3.00 115.15 114.65 1liq h HIS 19 Ca -0.12 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 1liq h HIS 19 Cb 1.66 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.62 1liq h HIS 19 CO 0.09 0.06 0.00 -1.33 -1.30 0.00 0.00 177.93 175.46 1liq n MET 20 N -3.14 2.88 0.00 5.26 2.81 0.26 -1.95 117.12 123.24 1liq n MET 20 Ca 0.02 -1.61 0.01 0.00 -1.81 0.00 0.00 57.70 54.31 1liq n MET 20 Cb 0.46 -1.82 -0.00 0.00 -0.71 0.00 0.00 33.22 31.15 1liq n MET 20 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 1liq n THR 21 N 0.37 0.00 0.00 2.03 -1.04 -1.13 -4.80 114.28 109.71 1liq n THR 21 Ca 0.14 -0.49 0.00 0.00 -2.04 0.00 0.00 64.05 61.67 1liq n THR 21 Cb 0.69 1.01 0.00 0.00 -1.82 0.00 0.00 70.33 70.21 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 -0.55 0.00 -3.32 -1.42 1.44 -1.24 -5.13 115.22 105.00 1liq n HIS 22 Ca 0.00 0.00 -0.16 0.00 -2.01 0.00 0.00 57.72 55.55 1liq n HIS 22 Cb 0.02 0.00 0.03 0.00 0.12 0.00 0.00 29.99 30.16 1liq n HIS 22 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1liq n GLN 24 N -1.74 0.67 -1.18 0.00 10.64 -1.26 -4.79 117.38 119.73 1liq n GLN 24 Ca 0.07 -1.91 0.00 0.00 -1.83 0.00 0.00 57.00 53.33 1liq n GLN 24 Cb 0.45 2.05 0.00 0.00 -0.86 0.00 0.00 30.24 31.88 1liq n GLN 24 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1liq n ALA 25 N -1.23 -2.18 0.00 2.61 0.00 -1.26 -4.81 120.51 113.64 1liq n ALA 25 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1liq n ALA 25 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 1liq n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1liq n GLY 26 N -0.45 0.00 3.95 0.00 0.00 -1.26 -4.26 105.19 103.17 1liq n GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1liq n GLY 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49