#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 0.96 0.00 2.62 3.04 -1.89 -0.46 116.25 120.52 1liq h VAL 2 Ca 0.00 -0.02 -0.04 0.00 -1.01 0.00 0.00 66.70 65.63 1liq h VAL 2 Cb 0.00 0.89 -0.01 0.00 -2.01 0.00 0.00 31.29 30.16 1liq h VAL 2 CO 0.00 0.01 -0.19 -0.09 -1.01 0.00 0.00 177.57 176.29 1liq h ARG 3 N 0.07 0.00 -0.02 4.17 9.65 -1.94 -2.03 114.38 124.27 1liq h ARG 3 Ca 0.07 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 1liq h ARG 3 Cb 0.20 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.78 1liq h ARG 3 CO -0.01 0.19 -0.10 0.00 2.80 0.00 0.00 179.97 182.85 1liq n ALA 4 N -2.39 2.72 -1.58 2.80 0.00 -0.22 -4.96 120.51 116.88 1liq n ALA 4 Ca -0.02 -0.62 -0.31 0.00 0.00 0.00 0.00 53.44 52.49 1liq n ALA 4 Cb 0.28 -0.88 0.06 0.00 0.00 0.00 0.00 19.45 18.90 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 2.28 -4.54 0.00 2.88 -1.26 -5.01 113.62 104.80 1liq n SER 6 Ca 0.07 -3.11 -0.35 0.00 -1.33 0.00 0.00 58.87 54.15 1liq n SER 6 Cb 0.54 -0.43 -0.11 0.00 -0.75 0.00 0.00 64.21 63.46 1liq n SER 6 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1liq s LEU 7 N -2.85 3.60 0.48 2.46 1.43 -1.26 -4.98 118.68 117.57 1liq s LEU 7 Ca 0.32 -0.06 0.33 0.00 -1.03 0.00 0.00 54.13 53.68 1liq s LEU 7 Cb 0.28 -1.93 1.75 0.00 0.03 0.00 0.00 46.19 46.32 1liq s LEU 7 CO 0.02 0.09 2.00 -0.65 0.23 0.00 0.00 176.35 178.04 1liq h PRO 8 N 7.34 0.00 0.25 1.29 0.11 -1.95 -2.77 132.00 136.27 1liq h PRO 8 Ca -0.36 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.73 1liq h PRO 8 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1liq h PRO 8 CO 0.64 0.00 -0.12 1.25 -0.21 0.00 0.00 178.00 179.56 1liq h HIS 9 N 0.00 -0.31 0.00 0.65 2.76 -2.02 -3.19 115.15 113.05 1liq h HIS 9 Ca 0.00 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1liq h HIS 9 Cb 0.04 0.10 -0.00 0.00 1.55 0.00 0.00 27.41 29.10 1liq h HIS 9 CO 0.00 0.03 -0.00 0.00 -1.30 0.00 0.00 177.93 176.66 1liq s ARG 11 N -4.41 3.67 0.00 0.00 3.52 -1.08 -4.45 118.95 116.20 1liq s ARG 11 Ca -0.05 -1.49 0.00 0.00 -0.13 0.00 0.00 55.73 54.06 1liq s ARG 11 Cb 0.14 -5.42 0.00 0.00 -1.56 0.00 0.00 34.95 28.11 1liq s ARG 11 CO 0.48 -2.38 0.00 2.41 -0.81 0.00 0.00 175.30 175.00 1liq n THR 12 N 6.76 0.00 -0.05 4.11 -1.04 -1.26 -4.96 114.28 117.84 1liq n THR 12 Ca 0.41 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.45 1liq n THR 12 Cb 0.48 -0.11 0.08 0.00 -1.82 0.00 0.00 70.33 68.96 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 -0.79 2.54 -1.55 -2.82 2.81 -1.26 -4.97 117.12 111.09 1liq n MET 13 Ca 0.00 -1.68 -0.05 0.00 -1.81 0.00 0.00 57.70 54.16 1liq n MET 13 Cb 0.00 -1.14 -0.01 0.00 -0.71 0.00 0.00 33.22 31.35 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 0.09 -0.35 -1.49 0.03 -0.00 -1.26 -4.91 118.16 110.27 1liq n LYS 14 Ca 0.06 0.48 -0.33 0.00 -0.00 0.00 0.00 58.31 58.52 1liq n LYS 14 Cb 0.32 -4.21 -0.08 0.00 -0.00 0.00 0.00 35.03 31.06 1liq n LYS 14 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1liq n ASN 15 N 1.17 2.31 -0.34 -5.58 0.23 -1.26 -4.72 115.26 107.06 1liq n ASN 15 Ca -0.05 -2.63 0.20 0.00 -0.53 0.00 0.00 54.58 51.57 1liq n ASN 15 Cb 0.32 -1.37 0.43 0.00 -2.08 0.00 0.00 39.78 37.08 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 5.59 0.46 -0.55 3.53 2.07 -1.94 0.50 116.25 125.92 1liq h VAL 16 Ca 0.25 -0.17 0.01 0.00 0.82 0.00 0.00 66.70 67.61 1liq h VAL 16 Cb 0.83 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1liq h VAL 16 CO 1.52 0.09 0.36 -0.07 0.02 0.00 0.00 177.57 179.49 1liq h LEU 17 N 0.48 0.60 -0.39 2.57 3.38 -1.99 0.34 115.31 120.30 1liq h LEU 17 Ca 0.67 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 58.45 1liq h LEU 17 Cb 1.41 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 1liq h LEU 17 CO -0.49 0.43 -0.81 -1.13 0.09 0.00 0.00 178.44 176.54 1liq h ASN 18 N 0.71 0.10 0.07 -0.43 -0.73 -0.42 -2.90 115.58 111.99 1liq h ASN 18 Ca 0.21 -0.08 -0.00 0.00 1.87 0.00 0.00 56.30 58.29 1liq h ASN 18 Cb -0.03 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 38.53 1liq h ASN 18 CO -0.05 0.86 -0.04 -0.74 -0.37 0.00 0.00 177.43 177.10 1liq h HIS 19 N 0.05 -0.09 -0.14 0.67 2.76 -0.31 -3.31 115.15 114.77 1liq h HIS 19 Ca -0.02 -0.00 0.04 0.00 -2.20 0.00 0.00 60.37 58.19 1liq h HIS 19 Cb 1.42 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 30.40 1liq h HIS 19 CO 0.01 0.01 0.29 1.98 -1.30 0.00 0.00 177.93 178.92 1liq h MET 20 N -1.02 0.00 0.00 5.26 1.85 -0.53 0.80 114.93 121.29 1liq h MET 20 Ca -0.01 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.08 1liq h MET 20 Cb 0.14 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.17 1liq h MET 20 CO 0.02 0.00 0.00 1.15 -0.40 0.00 0.00 176.91 177.68 1liq h THR 21 N 0.00 0.00 0.00 -0.77 2.02 -1.59 -3.29 112.91 109.28 1liq h THR 21 Ca 0.07 -0.45 0.00 0.00 0.77 0.00 0.00 66.41 66.80 1liq h THR 21 Cb 0.65 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 1liq h THR 21 CO -0.00 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.89 1liq n HIS 22 N -2.98 0.00 -4.38 3.16 1.44 0.79 -5.09 115.22 108.16 1liq n HIS 22 Ca 0.01 0.00 -0.25 0.00 -2.01 0.00 0.00 57.72 55.47 1liq n HIS 22 Cb 0.28 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.30 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 -3.69 2.14 0.00 0.00 -0.21 -1.26 -4.52 119.66 112.13 1liq s GLN 24 Ca 0.34 -2.35 0.00 0.00 0.02 0.00 0.00 55.36 53.37 1liq s GLN 24 Cb -0.00 -1.43 0.00 0.00 1.00 0.00 0.00 33.01 32.58 1liq s GLN 24 CO 0.19 -0.35 0.00 0.00 -2.12 0.00 0.00 175.29 173.01 1liq n ALA 25 N -1.20 -2.35 0.00 6.09 0.00 -1.26 -4.79 120.51 117.00 1liq n ALA 25 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1liq n ALA 25 Cb 0.67 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.99 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 0.65 -0.20 0.00 0.00 0.00 -1.26 -3.51 105.19 100.86 1liq n GLY 26 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1liq n GLY 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49