#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 1.19 0.00 2.62 3.04 -1.89 -2.13 116.25 119.09 1liq h VAL 2 Ca 0.00 -0.87 -0.06 0.00 -1.01 0.00 0.00 66.70 64.76 1liq h VAL 2 Cb 0.00 1.36 -0.01 0.00 -2.01 0.00 0.00 31.29 30.63 1liq h VAL 2 CO 0.00 0.26 -0.27 -0.09 -1.01 0.00 0.00 177.57 176.46 1liq h ARG 3 N 0.12 0.00 -0.26 4.17 2.43 -1.93 -2.28 114.38 116.63 1liq h ARG 3 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1liq h ARG 3 Cb 0.44 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1liq h ARG 3 CO 0.03 0.27 0.00 0.00 -1.51 0.00 0.00 179.97 178.76 1liq n ALA 4 N -2.38 2.46 -1.57 2.80 0.00 -0.83 -4.96 120.51 116.03 1liq n ALA 4 Ca -0.02 -0.80 -0.31 0.00 0.00 0.00 0.00 53.44 52.32 1liq n ALA 4 Cb 0.36 -0.94 0.06 0.00 0.00 0.00 0.00 19.45 18.93 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 -3.19 2.47 -4.75 0.00 2.88 -1.26 -5.03 113.62 104.74 1liq n SER 6 Ca 0.07 -3.00 -0.34 0.00 -1.33 0.00 0.00 58.87 54.27 1liq n SER 6 Cb 0.54 -0.41 -0.08 0.00 -0.75 0.00 0.00 64.21 63.51 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 -2.73 3.81 -0.25 2.46 1.43 -1.26 -5.01 118.68 117.12 1liq s LEU 7 Ca 0.31 0.16 -0.03 0.00 -1.03 0.00 0.00 54.13 53.54 1liq s LEU 7 Cb 0.27 -2.09 0.05 0.00 0.03 0.00 0.00 46.19 44.44 1liq s LEU 7 CO 0.03 0.32 2.54 -0.81 0.23 0.00 0.00 176.35 178.66 1liq n PRO 8 N 1.56 1.90 0.00 1.29 -0.04 -1.26 -3.88 135.00 134.58 1liq n PRO 8 Ca -0.16 -1.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.84 1liq n PRO 8 Cb 0.53 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 1liq n PRO 8 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1liq n HIS 9 N 1.08 0.00 0.21 0.54 -0.00 -1.26 -4.85 115.22 110.94 1liq n HIS 9 Ca 0.34 0.00 0.05 0.00 0.46 0.00 0.00 57.72 58.57 1liq n HIS 9 Cb 0.62 0.35 0.46 0.00 -0.12 0.00 0.00 29.99 31.30 1liq n HIS 9 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1liq s ARG 11 N -4.34 2.56 0.00 0.00 6.06 -1.26 -4.52 118.95 117.45 1liq s ARG 11 Ca -0.03 -0.77 0.00 0.00 -2.50 0.00 0.00 55.73 52.43 1liq s ARG 11 Cb 0.15 -5.16 0.00 0.00 0.06 0.00 0.00 34.95 29.99 1liq s ARG 11 CO 0.70 -3.66 0.00 2.41 -2.50 0.00 0.00 175.30 172.25 1liq n THR 12 N 7.81 0.00 -0.43 4.11 -1.04 -1.26 -4.96 114.28 118.51 1liq n THR 12 Ca 0.43 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.46 1liq n THR 12 Cb 0.47 -0.31 0.04 0.00 -1.82 0.00 0.00 70.33 68.71 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 -0.85 2.23 -0.95 -2.82 2.81 -1.26 -4.96 117.12 111.31 1liq n MET 13 Ca 0.00 -1.72 0.00 0.00 -1.81 0.00 0.00 57.70 54.17 1liq n MET 13 Cb 0.00 -1.09 0.00 0.00 -0.71 0.00 0.00 33.22 31.42 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 -0.71 0.00 -1.46 0.03 2.85 -1.26 -4.94 118.16 112.67 1liq n LYS 14 Ca 0.04 0.47 -0.33 0.00 -1.05 0.00 0.00 58.31 57.44 1liq n LYS 14 Cb 0.39 -3.77 -0.08 0.00 -0.65 0.00 0.00 35.03 30.92 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 2.29 -0.28 -5.58 0.23 -1.26 -4.71 115.26 107.83 1liq n ASN 15 Ca 0.00 -2.63 0.21 0.00 -0.53 0.00 0.00 54.58 51.63 1liq n ASN 15 Cb 0.00 -1.35 0.50 0.00 -2.08 0.00 0.00 39.78 36.86 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 5.54 0.62 -0.52 3.53 2.07 -1.94 0.25 116.25 125.80 1liq h VAL 16 Ca 0.25 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1liq h VAL 16 Cb 0.83 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 1liq h VAL 16 CO 1.55 0.08 0.33 -0.07 0.02 0.00 0.00 177.57 179.47 1liq h LEU 17 N 0.41 0.61 -0.36 2.57 3.38 -1.98 0.37 115.31 120.31 1liq h LEU 17 Ca 0.53 -0.02 -0.18 0.00 0.09 0.00 0.00 57.88 58.29 1liq h LEU 17 Cb 1.31 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1liq h LEU 17 CO -0.23 0.45 -0.83 0.78 0.09 0.00 0.00 178.44 178.71 1liq h ASN 18 N 0.71 0.16 0.07 -0.43 -0.26 -0.90 -2.89 115.58 112.05 1liq h ASN 18 Ca 0.19 -0.13 -0.00 0.00 -0.56 0.00 0.00 56.30 55.80 1liq h ASN 18 Cb -0.06 -0.05 0.00 0.00 -1.06 0.00 0.00 38.32 37.15 1liq h ASN 18 CO -0.04 0.91 -0.04 -0.74 -1.06 0.00 0.00 177.43 176.47 1liq h HIS 19 N 0.07 -0.09 -0.11 1.19 2.76 -0.70 -3.31 115.15 114.96 1liq h HIS 19 Ca -0.03 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.17 1liq h HIS 19 Cb 1.44 0.03 -0.00 0.00 1.55 0.00 0.00 27.41 30.42 1liq h HIS 19 CO 0.02 0.04 0.27 1.98 -1.30 0.00 0.00 177.93 178.94 1liq h MET 20 N -1.02 0.00 0.00 5.26 1.85 -0.45 0.83 114.93 121.40 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 0.18 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.21 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 0.05 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1liq h THR 21 Cb 0.59 1.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 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 -2.96 0.00 -4.01 3.16 1.44 0.71 -5.10 115.22 108.47 1liq n HIS 22 Ca 0.01 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.63 1liq n HIS 22 Cb 0.29 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.39 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 -2.56 1.95 0.00 0.00 -0.21 -1.26 -4.66 119.66 112.92 1liq s GLN 24 Ca 0.03 -2.19 0.00 0.00 0.02 0.00 0.00 55.36 53.22 1liq s GLN 24 Cb -0.00 -0.33 0.00 0.00 1.00 0.00 0.00 33.01 33.67 1liq s GLN 24 CO 0.02 -0.58 0.00 0.00 -2.12 0.00 0.00 175.29 172.61 1liq n ALA 25 N -0.89 -0.75 -1.19 6.09 0.00 -1.26 -4.52 120.51 117.99 1liq n ALA 25 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1liq n ALA 25 Cb 0.64 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.70 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 -0.56 1.02 3.98 0.00 0.00 -1.26 -2.62 105.19 105.74 1liq n GLY 26 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1liq n GLY 26 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60