#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 0.98 -0.53 -2.13 -4.23 -0.63 -4.95 115.64 104.15 1big s THR 3 Ca 0.00 -2.02 0.04 0.00 -1.18 0.00 0.00 61.69 58.53 1big s THR 3 Cb 0.00 -1.84 0.40 0.00 1.34 0.00 0.00 72.50 72.40 1big s THR 3 CO 0.00 -0.75 1.28 -0.67 -0.54 0.00 0.00 174.62 173.95 1big n ASP 4 N -0.16 5.26 -4.68 3.99 2.03 -1.26 -3.65 116.55 118.07 1big n ASP 4 Ca -0.10 -3.74 -0.32 0.00 0.52 0.00 0.00 54.79 51.15 1big n ASP 4 Cb 0.61 -0.58 -0.09 0.00 -0.72 0.00 0.00 41.12 40.34 1big n ASP 4 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1big s VAL 5 N -5.41 4.10 0.22 5.18 1.01 -1.26 -4.96 120.40 119.28 1big s VAL 5 Ca 0.49 -0.69 -0.30 0.00 0.00 0.00 0.00 61.98 61.48 1big s VAL 5 Cb 0.40 -2.86 -0.09 0.00 0.00 0.00 0.00 36.38 33.84 1big s VAL 5 CO -0.23 0.32 1.27 -1.59 0.00 0.00 0.00 175.10 174.87 1big s LYS 6 N -1.71 4.42 0.16 2.72 -2.85 -1.26 -2.47 119.74 118.75 1big s LYS 6 Ca 0.21 2.02 0.05 0.00 -1.00 0.00 0.00 55.97 57.26 1big s LYS 6 Cb -0.12 -3.19 -0.04 0.00 -2.06 0.00 0.00 37.83 32.42 1big s LYS 6 CO 0.12 -0.18 -0.11 0.00 0.10 0.00 0.00 175.35 175.28 1big n THR 8 N -0.25 1.38 0.00 0.00 5.66 -1.26 -4.52 114.28 115.29 1big n THR 8 Ca -0.10 -3.23 0.00 0.00 -3.05 0.00 0.00 64.05 57.67 1big n THR 8 Cb 0.61 0.67 0.00 0.00 -1.55 0.00 0.00 70.33 70.05 1big n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1big n GLY 9 N -0.42 2.82 0.33 1.09 0.00 -1.26 -4.84 105.19 102.92 1big n GLY 9 Ca 0.14 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 1big n GLY 9 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1big h SER 10 N 0.00 -1.31 -1.79 1.61 0.87 -1.89 -2.58 113.55 108.47 1big h SER 10 Ca 0.00 0.16 0.52 0.00 -1.23 0.00 0.00 61.79 61.24 1big h SER 10 Cb 0.00 0.52 -0.07 0.00 -0.44 0.00 0.00 62.40 62.41 1big h SER 10 CO 0.00 -0.32 1.37 2.29 -0.53 0.00 0.00 176.83 179.64 1big n LYS 11 N -4.64 0.00 -0.10 2.24 -0.00 -1.26 -0.14 118.16 114.27 1big n LYS 11 Ca -0.03 1.05 -0.14 0.00 -0.00 0.00 0.00 58.31 59.18 1big n LYS 11 Cb 0.26 -2.46 -0.03 0.00 -0.00 0.00 0.00 35.03 32.80 1big n LYS 11 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.40 177.77 1big h GLN 12 N 0.00 0.90 0.00 -1.58 -0.00 -1.78 -3.13 115.11 109.52 1big h GLN 12 Ca 0.85 -0.53 0.00 0.00 -0.00 0.00 0.00 58.65 58.97 1big h GLN 12 Cb 3.58 0.04 0.00 0.00 0.00 0.00 0.00 27.48 31.10 1big h GLN 12 CO -0.01 1.17 0.00 0.00 0.00 0.00 0.00 178.83 179.99 1big h TRP 14 N 0.00 -0.50 -0.34 0.00 4.06 -1.47 0.06 115.95 117.75 1big h TRP 14 Ca 0.00 -0.01 -0.03 0.00 2.06 0.00 0.00 58.89 60.91 1big h TRP 14 Cb 0.35 0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.66 1big h TRP 14 CO 0.00 -0.20 0.09 -1.00 -3.56 0.00 0.00 178.44 173.77 1big h PRO 15 N -1.04 0.55 -0.52 0.49 0.13 -1.73 -0.80 132.00 129.07 1big h PRO 15 Ca -0.05 -0.13 0.06 0.00 -0.87 0.00 0.00 66.00 65.01 1big h PRO 15 Cb 0.51 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 31.52 1big h PRO 15 CO 0.09 0.59 0.22 0.28 -0.23 0.00 0.00 178.00 178.96 1big h VAL 16 N 0.40 0.87 -0.32 1.56 2.07 -1.62 -0.43 116.25 118.79 1big h VAL 16 Ca 0.11 -0.15 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 1big h VAL 16 Cb 0.29 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1big h VAL 16 CO -0.00 0.08 -0.17 0.00 0.02 0.00 0.00 177.57 177.50 1big h LYS 18 N 0.43 0.53 -0.02 0.00 3.64 -0.47 0.11 116.57 120.78 1big h LYS 18 Ca 0.07 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1big h LYS 18 Cb 0.70 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1big h LYS 18 CO 0.05 0.35 -0.04 1.96 -2.27 0.00 0.00 179.45 179.50 1big h GLN 19 N 0.54 0.07 0.57 1.90 4.20 -0.84 -2.66 115.11 118.89 1big h GLN 19 Ca 0.51 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 59.15 1big h GLN 19 Cb 0.85 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.64 1big h GLN 19 CO -0.43 0.59 -0.27 0.52 -0.67 0.00 0.00 178.83 178.57 1big h MET 20 N -0.44 -0.73 0.00 1.46 2.86 -0.41 -3.42 114.93 114.24 1big h MET 20 Ca 0.00 0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1big h MET 20 Cb 0.59 0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 1big h MET 20 CO 0.01 -0.44 -0.49 1.19 1.06 0.00 0.00 176.91 178.25 1big n PHE 21 N -5.36 0.00 0.00 -0.22 3.01 0.29 -5.06 117.46 110.12 1big n PHE 21 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.34 1big n PHE 21 Cb 0.33 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 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 2.56 0.97 2.66 1.37 0.00 -0.69 -4.98 105.19 107.08 1big n GLY 22 Ca -0.07 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 1big n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1big n LYS 23 N 0.00 1.40 0.00 1.61 5.02 -1.25 -4.91 118.16 120.03 1big n LYS 23 Ca 0.00 -4.08 0.02 0.00 -2.02 0.00 0.00 58.31 52.23 1big n LYS 23 Cb 0.00 -2.05 0.09 0.00 -0.02 0.00 0.00 35.03 33.05 1big n LYS 23 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1big n PRO 24 N 2.03 0.07 -3.84 1.97 -0.04 -1.26 -4.24 135.00 129.68 1big n PRO 24 Ca 0.24 0.16 -0.36 0.00 -0.04 0.00 0.00 63.50 63.50 1big n PRO 24 Cb 0.40 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.24 1big n PRO 24 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1big s ASN 25 N -2.35 5.01 0.10 3.54 0.01 -1.26 -4.24 114.94 115.74 1big s ASN 25 Ca 0.04 -0.21 -0.06 0.00 -0.71 0.00 0.00 52.86 51.92 1big s ASN 25 Cb 0.02 -1.89 -0.02 0.00 0.41 0.00 0.00 41.25 39.78 1big s ASN 25 CO 0.05 -0.01 0.13 -0.83 -1.51 0.00 0.00 177.10 174.93 1big s GLY 26 N 1.44 0.39 0.41 0.66 0.00 -1.26 -1.31 107.32 107.65 1big s GLY 26 Ca 0.05 -0.95 0.03 0.00 0.00 0.00 0.00 44.72 43.86 1big s GLY 26 CO 0.02 -1.03 0.09 -1.59 0.00 0.00 0.00 173.10 170.60 1big s LYS 27 N -3.92 1.93 0.28 2.90 0.00 0.26 -4.32 119.74 116.88 1big s LYS 27 Ca 0.10 -2.17 0.08 0.00 0.00 0.00 0.00 55.97 53.98 1big s LYS 27 Cb 0.06 -0.83 -0.04 0.00 0.00 0.00 0.00 37.83 37.02 1big s LYS 27 CO -0.07 -0.40 0.12 0.00 0.00 0.00 0.00 175.35 175.00 1big s MET 29 N -3.80 0.88 -0.88 0.00 -1.94 0.26 -4.86 119.30 108.97 1big s MET 29 Ca 0.34 -1.71 -0.02 0.00 -1.71 0.00 0.00 55.69 52.59 1big s MET 29 Cb -0.06 -1.70 0.02 0.00 2.01 0.00 0.00 34.83 35.10 1big s MET 29 CO 0.23 -1.22 0.04 0.27 -0.01 0.00 0.00 175.02 174.33 1big n ASN 30 N 3.65 0.32 0.00 3.03 0.23 -1.26 -1.18 115.26 120.05 1big n ASN 30 Ca 0.14 -0.70 0.00 0.00 -0.53 0.00 0.00 54.58 53.49 1big n ASN 30 Cb 0.38 -0.87 0.00 0.00 -2.08 0.00 0.00 39.78 37.20 1big n ASN 30 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1big n GLY 31 N -1.73 2.24 3.49 4.83 0.00 -1.26 -5.07 105.19 107.69 1big n GLY 31 Ca -0.15 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 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 1.97 0.62 1.61 3.01 -0.32 -0.09 119.74 126.53 1big s LYS 32 Ca 0.00 -1.06 -0.16 0.00 -1.01 0.00 0.00 55.97 53.74 1big s LYS 32 Cb 0.00 -2.18 -0.02 0.00 -1.01 0.00 0.00 37.83 34.62 1big s LYS 32 CO 0.00 0.51 1.08 0.00 0.51 0.00 0.00 175.35 177.46 1big s ARG 34 N -4.04 0.55 0.24 0.00 6.06 0.44 -1.60 118.95 120.59 1big s ARG 34 Ca 0.66 -0.91 0.11 0.00 -2.50 0.00 0.00 55.73 53.08 1big s ARG 34 Cb -0.18 -0.09 -0.05 0.00 0.06 0.00 0.00 34.95 34.69 1big s ARG 34 CO 0.38 -0.01 -0.18 0.00 -2.50 0.00 0.00 175.30 172.98 1big n TYR 36 N -0.25 -0.91 0.17 0.00 4.01 -0.43 -4.85 117.16 114.90 1big n TYR 36 Ca -0.09 -1.41 0.02 0.00 -0.16 0.00 0.00 57.90 56.27 1big n TYR 36 Cb 0.58 -0.27 0.02 0.00 -0.31 0.00 0.00 39.34 39.36 1big n TYR 36 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85