#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1big s THR 3 N 0.00 0.82 -0.13 4.37 -4.23 -0.86 -4.95 115.64 110.66 1big s THR 3 Ca 0.00 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.66 1big s THR 3 Cb 0.00 -2.62 0.38 0.00 1.34 0.00 0.00 72.50 71.61 1big s THR 3 CO 0.00 0.00 1.19 -0.67 -0.54 0.00 0.00 174.62 174.60 1big n ASP 4 N -0.83 1.51 -4.54 3.99 2.03 -1.26 -4.60 116.55 112.85 1big n ASP 4 Ca -0.03 -3.21 -0.26 0.00 0.52 0.00 0.00 54.79 51.81 1big n ASP 4 Cb 0.66 -0.44 -0.10 0.00 -0.72 0.00 0.00 41.12 40.52 1big n ASP 4 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1big s VAL 5 N -2.18 2.99 0.14 5.18 0.11 -1.26 -5.08 120.40 120.30 1big s VAL 5 Ca 0.34 -1.80 -0.31 0.00 -2.93 0.00 0.00 61.98 57.29 1big s VAL 5 Cb 0.34 -2.49 -0.08 0.00 -1.53 0.00 0.00 36.38 32.63 1big s VAL 5 CO -0.08 -0.15 1.30 -0.54 -3.33 0.00 0.00 175.10 172.30 1big s LYS 6 N -2.90 4.39 0.24 1.54 1.02 -1.25 -3.85 119.74 118.93 1big s LYS 6 Ca 0.25 1.98 0.10 0.00 0.02 0.00 0.00 55.97 58.31 1big s LYS 6 Cb -0.08 -3.25 -0.05 0.00 -0.52 0.00 0.00 37.83 33.93 1big s LYS 6 CO 0.14 -0.30 -0.16 0.00 -0.92 0.00 0.00 175.35 174.11 1big n THR 8 N -0.50 1.72 0.00 0.00 -2.24 -1.26 -4.58 114.28 107.42 1big n THR 8 Ca -0.07 -3.39 0.00 0.00 -2.27 0.00 0.00 64.05 58.32 1big n THR 8 Cb 0.60 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 1big n THR 8 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1big n GLY 9 N -0.64 2.78 0.30 3.38 0.00 -1.26 -4.73 105.19 105.02 1big n GLY 9 Ca 0.20 -2.01 0.03 0.00 0.00 0.00 0.00 46.02 44.24 1big n GLY 9 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1big h SER 10 N 0.00 -0.75 -0.70 1.61 4.64 -1.86 -1.90 113.55 114.60 1big h SER 10 Ca 0.00 0.24 0.14 0.00 -0.47 0.00 0.00 61.79 61.70 1big h SER 10 Cb 0.00 0.50 -0.13 0.00 -0.31 0.00 0.00 62.40 62.46 1big h SER 10 CO 0.00 -0.27 -0.18 0.07 -0.87 0.00 0.00 176.83 175.58 1big h LYS 11 N 0.00 -0.00 0.00 4.77 2.10 -1.88 0.19 116.57 121.75 1big h LYS 11 Ca 0.39 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.94 1big h LYS 11 Cb 0.61 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.92 1big h LYS 11 CO -0.84 -0.00 -0.51 0.37 -2.00 0.00 0.00 179.45 176.47 1big h GLN 12 N -0.00 0.00 0.00 0.07 4.15 -1.64 -3.02 115.11 114.66 1big h GLN 12 Ca 0.33 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.71 1big h GLN 12 Cb 0.51 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 1big h GLN 12 CO -0.72 0.51 -0.22 0.00 -1.93 0.00 0.00 178.83 176.47 1big h TRP 14 N 0.00 -0.96 -0.65 0.00 4.06 -0.85 -0.29 115.95 117.26 1big h TRP 14 Ca -0.00 -0.02 -0.05 0.00 2.06 0.00 0.00 58.89 60.87 1big h TRP 14 Cb 0.87 0.32 -0.03 0.00 -1.00 0.00 0.00 29.16 29.32 1big h TRP 14 CO 0.00 -0.58 0.20 -1.00 -3.56 0.00 0.00 178.44 173.50 1big h PRO 15 N -1.18 1.01 -0.55 0.49 0.13 -1.72 -1.00 132.00 129.18 1big h PRO 15 Ca -0.11 -0.22 0.06 0.00 -0.87 0.00 0.00 66.00 64.87 1big h PRO 15 Cb 0.81 -0.15 -0.05 0.00 0.13 0.00 0.00 31.00 31.74 1big h PRO 15 CO 0.17 0.88 0.25 0.28 -0.23 0.00 0.00 178.00 179.36 1big h VAL 16 N 0.94 0.90 -0.23 1.56 2.07 -1.53 0.30 116.25 120.25 1big h VAL 16 Ca 0.21 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.46 1big h VAL 16 Cb 0.29 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1big h VAL 16 CO -0.01 0.09 -0.25 0.00 0.02 0.00 0.00 177.57 177.42 1big h LYS 18 N 0.28 0.37 0.12 0.00 3.64 -0.48 0.16 116.57 120.67 1big h LYS 18 Ca 0.03 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1big h LYS 18 Cb 0.82 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 1big h LYS 18 CO 0.06 0.24 -0.06 0.37 -2.27 0.00 0.00 179.45 177.79 1big h GLN 19 N 0.38 -0.16 0.47 1.90 5.75 -0.76 -2.91 115.11 119.77 1big h GLN 19 Ca 0.52 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 59.01 1big h GLN 19 Cb 0.96 0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.55 1big h GLN 19 CO -0.52 0.29 -0.23 0.52 -2.65 0.00 0.00 178.83 176.25 1big h MET 20 N -0.71 -0.61 0.00 1.69 2.86 -0.55 -3.42 114.93 114.19 1big h MET 20 Ca -0.02 0.04 -0.07 0.00 -2.06 0.00 0.00 59.70 57.60 1big h MET 20 Cb 0.53 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.31 1big h MET 20 CO 0.03 -0.31 -0.90 1.19 1.06 0.00 0.00 176.91 177.98 1big n PHE 21 N -5.27 0.00 0.00 -0.22 3.01 0.42 -5.07 117.46 110.33 1big n PHE 21 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.35 1big n PHE 21 Cb 0.30 -0.35 0.00 0.00 -0.01 0.00 0.00 39.48 39.42 1big n PHE 21 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1big n GLY 22 N 2.27 1.14 2.90 1.37 0.00 -0.29 -4.97 105.19 107.61 1big n GLY 22 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1big n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1big s LYS 23 N 0.00 1.78 0.00 1.61 3.01 -1.25 -4.88 119.74 120.01 1big s LYS 23 Ca 0.00 -2.42 0.08 0.00 -1.01 0.00 0.00 55.97 52.62 1big s LYS 23 Cb 0.00 -3.08 0.43 0.00 -1.01 0.00 0.00 37.83 34.17 1big s LYS 23 CO 0.00 -1.11 1.04 -0.35 0.51 0.00 0.00 175.35 175.45 1big n PRO 24 N 3.30 0.17 -2.58 -1.68 -0.04 -1.26 -3.89 135.00 129.02 1big n PRO 24 Ca 0.06 0.13 -0.14 0.00 -0.04 0.00 0.00 63.50 63.51 1big n PRO 24 Cb 0.33 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.31 1big n PRO 24 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1big n ASN 25 N -1.17 1.70 0.00 3.54 3.02 -1.26 -4.21 115.26 116.87 1big n ASN 25 Ca 0.05 -2.05 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 1big n ASN 25 Cb 0.05 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.08 1big n ASN 25 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1big n GLY 26 N 0.81 1.01 3.18 7.41 0.00 -1.26 -4.05 105.19 112.29 1big n GLY 26 Ca 0.04 -1.97 -0.11 0.00 0.00 0.00 0.00 46.02 43.98 1big n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1big s LYS 27 N -1.11 1.07 0.05 1.61 -2.85 0.10 -4.67 119.74 113.95 1big s LYS 27 Ca 0.00 -1.54 0.04 0.00 -1.00 0.00 0.00 55.97 53.47 1big s LYS 27 Cb 0.00 0.22 -0.04 0.00 -2.06 0.00 0.00 37.83 35.95 1big s LYS 27 CO 0.00 -0.32 -0.00 0.00 0.10 0.00 0.00 175.35 175.13 1big s MET 29 N -1.99 0.43 -0.94 0.00 0.23 0.40 -4.81 119.30 112.62 1big s MET 29 Ca 0.23 -0.37 -0.05 0.00 -1.03 0.00 0.00 55.69 54.47 1big s MET 29 Cb -0.12 -1.94 0.05 0.00 -1.53 0.00 0.00 34.83 31.30 1big s MET 29 CO 0.15 -0.71 0.13 -1.71 -2.03 0.00 0.00 175.02 170.85 1big n ASN 30 N 5.12 -0.07 0.00 -1.18 5.15 -1.26 -1.17 115.26 121.85 1big n ASN 30 Ca -0.08 -0.71 0.00 0.00 -0.60 0.00 0.00 54.58 53.19 1big n ASN 30 Cb 0.47 -0.89 0.00 0.00 -0.53 0.00 0.00 39.78 38.83 1big n ASN 30 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1big n GLY 31 N -1.47 0.73 3.41 8.20 0.00 -1.26 -5.06 105.19 109.73 1big n GLY 31 Ca -0.09 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1big n GLY 31 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1big s LYS 32 N 0.00 1.78 0.65 1.61 -0.14 -0.32 -0.28 119.74 123.05 1big s LYS 32 Ca 0.00 -1.14 -0.14 0.00 -1.36 0.00 0.00 55.97 53.33 1big s LYS 32 Cb 0.00 -2.05 -0.01 0.00 -1.68 0.00 0.00 37.83 34.10 1big s LYS 32 CO 0.00 0.50 1.08 0.00 -0.76 0.00 0.00 175.35 176.17 1big s ARG 34 N -4.37 0.72 0.36 0.00 6.06 0.22 -2.03 118.95 119.91 1big s ARG 34 Ca 0.63 -0.47 0.08 0.00 -2.50 0.00 0.00 55.73 53.47 1big s ARG 34 Cb -0.17 -0.67 -0.03 0.00 0.06 0.00 0.00 34.95 34.13 1big s ARG 34 CO 0.44 0.17 0.23 0.00 -2.50 0.00 0.00 175.30 173.64 1big n TYR 36 N -1.29 0.78 0.10 0.00 4.01 -1.26 -4.82 117.16 114.68 1big n TYR 36 Ca -0.01 -2.21 0.01 0.00 -0.16 0.00 0.00 57.90 55.53 1big n TYR 36 Cb 0.61 -0.32 0.01 0.00 -0.31 0.00 0.00 39.34 39.34 1big n TYR 36 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27