#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1big n THR 3 N 0.00 0.00 0.18 1.97 -2.24 -0.87 -4.73 114.28 108.59 1big n THR 3 Ca 0.00 -2.49 0.02 0.00 -2.27 0.00 0.00 64.05 59.31 1big n THR 3 Cb 0.00 0.91 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 1big n THR 3 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1big n ASP 4 N -1.51 0.84 -4.55 3.42 5.68 -1.26 -4.80 116.55 114.38 1big n ASP 4 Ca -0.05 -0.92 -0.33 0.00 -0.50 0.00 0.00 54.79 52.99 1big n ASP 4 Cb 0.64 0.44 -0.12 0.00 -1.14 0.00 0.00 41.12 40.94 1big n ASP 4 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1big s VAL 5 N -0.80 3.44 0.93 2.12 1.01 -1.26 -5.06 120.40 120.77 1big s VAL 5 Ca 0.03 -0.70 -0.12 0.00 0.00 0.00 0.00 61.98 61.19 1big s VAL 5 Cb 0.03 -2.42 0.15 0.00 0.00 0.00 0.00 36.38 34.14 1big s VAL 5 CO 0.10 0.51 1.10 -0.54 0.00 0.00 0.00 175.10 176.27 1big s LYS 6 N -1.04 1.02 0.31 2.72 1.02 -1.26 -2.43 119.74 120.08 1big s LYS 6 Ca 0.14 0.61 0.06 0.00 0.02 0.00 0.00 55.97 56.79 1big s LYS 6 Cb -0.11 -1.80 -0.03 0.00 -0.52 0.00 0.00 37.83 35.37 1big s LYS 6 CO 0.03 -2.35 0.24 0.00 -0.92 0.00 0.00 175.35 172.36 1big n THR 8 N -0.58 0.01 -3.91 0.00 -1.04 -1.26 -4.37 114.28 103.13 1big n THR 8 Ca 0.05 0.00 -0.09 0.00 -2.04 0.00 0.00 64.05 61.98 1big n THR 8 Cb 0.63 -1.34 -0.05 0.00 -1.82 0.00 0.00 70.33 67.75 1big n THR 8 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1big s GLY 9 N -4.99 0.30 0.16 3.41 0.00 -1.26 -4.90 107.32 100.04 1big s GLY 9 Ca 0.00 -0.64 -0.26 0.00 0.00 0.00 0.00 44.72 43.82 1big s GLY 9 CO 0.00 -0.50 1.57 1.76 0.00 0.00 0.00 173.10 175.93 1big h SER 10 N 2.26 -1.40 -1.01 1.64 0.02 -1.86 -0.59 113.55 112.61 1big h SER 10 Ca -0.27 0.22 0.24 0.00 -0.84 0.00 0.00 61.79 61.15 1big h SER 10 Cb 1.25 0.63 -0.12 0.00 0.14 0.00 0.00 62.40 64.29 1big h SER 10 CO 0.37 -0.35 0.60 0.07 -1.14 0.00 0.00 176.83 176.37 1big h LYS 11 N -0.28 0.57 -0.17 3.45 2.10 -1.94 0.14 116.57 120.44 1big h LYS 11 Ca 0.16 -0.03 -0.15 0.00 -2.00 0.00 0.00 60.65 58.63 1big h LYS 11 Cb 0.57 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 31.77 1big h LYS 11 CO -0.61 0.38 -0.51 0.37 -2.00 0.00 0.00 179.45 177.08 1big h GLN 12 N 0.59 0.48 0.00 0.07 -0.00 -1.55 -2.96 115.11 111.73 1big h GLN 12 Ca 0.64 -0.28 0.00 0.00 -0.00 0.00 0.00 58.65 59.01 1big h GLN 12 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 27.48 28.72 1big h GLN 12 CO -0.46 0.87 0.00 0.00 0.00 0.00 0.00 178.83 179.24 1big h TRP 14 N 0.00 -0.78 -0.66 0.00 4.06 -1.19 0.29 115.95 117.67 1big h TRP 14 Ca 0.00 -0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.92 1big h TRP 14 Cb 0.45 0.26 -0.03 0.00 -1.00 0.00 0.00 29.16 28.83 1big h TRP 14 CO 0.00 -0.45 0.38 -1.00 -3.56 0.00 0.00 178.44 173.81 1big h PRO 15 N -1.14 0.91 -0.70 0.49 0.13 -1.72 -0.85 132.00 129.13 1big h PRO 15 Ca -0.09 -0.10 0.09 0.00 -0.87 0.00 0.00 66.00 65.03 1big h PRO 15 Cb 0.68 -0.18 -0.07 0.00 0.13 0.00 0.00 31.00 31.56 1big h PRO 15 CO 0.14 0.67 0.35 0.28 -0.23 0.00 0.00 178.00 179.22 1big h VAL 16 N 0.90 0.87 -0.30 1.56 2.07 -1.52 -0.38 116.25 119.45 1big h VAL 16 Ca 0.23 -0.21 -0.14 0.00 0.82 0.00 0.00 66.70 67.40 1big h VAL 16 Cb 0.01 0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 29.98 1big h VAL 16 CO -0.04 0.11 -0.38 0.00 0.02 0.00 0.00 177.57 177.29 1big h LYS 18 N 0.55 0.41 0.14 0.00 3.64 -0.16 0.01 116.57 121.16 1big h LYS 18 Ca 0.04 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1big h LYS 18 Cb 0.96 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1big h LYS 18 CO 0.09 0.27 -0.07 0.37 -2.27 0.00 0.00 179.45 177.84 1big h GLN 19 N 0.42 -0.18 0.24 1.90 5.75 -0.92 -2.77 115.11 119.54 1big h GLN 19 Ca 0.46 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.98 1big h GLN 19 Cb 0.76 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.32 1big h GLN 19 CO -0.45 0.26 -0.32 1.98 -2.65 0.00 0.00 178.83 177.64 1big h MET 20 N -0.73 -0.60 0.00 1.69 4.05 -0.69 -3.41 114.93 115.24 1big h MET 20 Ca -0.02 0.04 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 1big h MET 20 Cb 0.52 0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 31.46 1big h MET 20 CO 0.03 -0.40 -0.54 0.34 0.23 0.00 0.00 176.91 176.57 1big n PHE 21 N -5.43 0.00 0.00 1.39 -0.00 -0.08 -5.07 117.46 108.27 1big n PHE 21 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 1big n PHE 21 Cb 0.33 -0.13 0.00 0.00 -0.00 0.00 0.00 39.48 39.69 1big n PHE 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1big n GLY 22 N 2.97 0.52 2.73 7.13 0.00 -0.78 -5.00 105.19 112.76 1big n GLY 22 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 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 1.25 0.00 1.61 3.01 -1.24 -4.91 119.74 119.46 1big s LYS 23 Ca 0.00 -1.92 0.05 0.00 -1.01 0.00 0.00 55.97 53.09 1big s LYS 23 Cb 0.00 -2.36 0.28 0.00 -1.01 0.00 0.00 37.83 34.74 1big s LYS 23 CO 0.00 -1.13 0.66 -0.35 0.51 0.00 0.00 175.35 175.04 1big n PRO 24 N 3.70 0.23 -3.57 -1.68 -0.04 -1.26 -3.64 135.00 128.74 1big n PRO 24 Ca 0.07 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.30 1big n PRO 24 Cb 0.35 -1.32 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 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 -0.82 2.59 0.00 3.54 3.02 -1.26 -4.16 115.26 118.16 1big n ASN 25 Ca 0.04 -2.62 0.00 0.00 -0.03 0.00 0.00 54.58 51.96 1big n ASN 25 Cb 0.02 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 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 -0.42 0.24 3.46 7.41 0.00 -1.26 -4.00 105.19 110.62 1big n GLY 26 Ca -0.05 -1.79 -0.24 0.00 0.00 0.00 0.00 46.02 43.95 1big n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1big s LYS 27 N -1.54 1.85 0.16 1.61 1.02 0.10 -4.64 119.74 118.31 1big s LYS 27 Ca 0.00 -2.11 0.11 0.00 0.02 0.00 0.00 55.97 53.99 1big s LYS 27 Cb 0.00 -0.46 -0.04 0.00 -0.52 0.00 0.00 37.83 36.80 1big s LYS 27 CO 0.00 -0.47 -0.24 0.00 -0.92 0.00 0.00 175.35 173.72 1big s MET 29 N -2.41 1.55 -0.64 0.00 1.00 0.19 -4.86 119.30 114.13 1big s MET 29 Ca 0.18 -2.62 -0.04 0.00 0.00 0.00 0.00 55.69 53.21 1big s MET 29 Cb -0.09 -2.24 0.01 0.00 0.00 0.00 0.00 34.83 32.50 1big s MET 29 CO 0.09 -1.35 0.07 -1.71 0.00 0.00 0.00 175.02 172.12 1big n ASN 30 N 2.48 -0.12 0.00 3.03 5.15 -1.26 -1.23 115.26 123.31 1big n ASN 30 Ca 0.26 -0.56 0.00 0.00 -0.60 0.00 0.00 54.58 53.67 1big n ASN 30 Cb 0.43 -0.69 0.00 0.00 -0.53 0.00 0.00 39.78 38.98 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 -1.63 1.11 3.44 8.20 0.00 -1.26 -5.05 105.19 109.99 1big n GLY 31 Ca -0.12 -0.15 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 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 2.32 0.76 1.61 1.02 -0.37 -0.08 119.74 124.99 1big s LYS 32 Ca 0.00 -0.81 -0.11 0.00 0.02 0.00 0.00 55.97 55.07 1big s LYS 32 Cb 0.00 -2.26 0.05 0.00 -0.52 0.00 0.00 37.83 35.10 1big s LYS 32 CO 0.00 0.59 1.08 0.00 -0.92 0.00 0.00 175.35 176.10 1big s ARG 34 N -4.97 0.66 0.34 0.00 6.06 0.22 -2.04 118.95 119.22 1big s ARG 34 Ca 0.60 -0.67 0.09 0.00 -2.50 0.00 0.00 55.73 53.26 1big s ARG 34 Cb -0.16 -0.57 -0.06 0.00 0.06 0.00 0.00 34.95 34.22 1big s ARG 34 CO 0.56 0.13 -0.03 0.00 -2.50 0.00 0.00 175.30 173.46 1big n TYR 36 N -0.89 0.58 0.17 0.00 4.01 -1.26 -4.74 117.16 115.04 1big n TYR 36 Ca -0.04 -2.05 0.02 0.00 -0.16 0.00 0.00 57.90 55.66 1big n TYR 36 Cb 0.63 -0.30 0.02 0.00 -0.31 0.00 0.00 39.34 39.37 1big n TYR 36 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27