#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zaq n PRO 2 N 0.00 0.86 -2.70 5.31 -0.04 -1.26 -4.82 135.00 132.36 1zaq n PRO 2 Ca 0.00 0.31 -0.06 0.00 -0.04 0.00 0.00 63.50 63.71 1zaq n PRO 2 Cb 0.00 -1.99 0.07 0.00 -0.04 0.00 0.00 33.50 31.54 1zaq n PRO 2 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1zaq n VAL 3 N 4.84 0.00 -5.25 0.52 3.14 -1.26 -5.14 118.33 115.18 1zaq n VAL 3 Ca 0.30 -0.98 -0.32 0.00 -2.96 0.00 0.00 64.34 60.39 1zaq n VAL 3 Cb 0.09 1.24 -0.17 0.00 -1.06 0.00 0.00 33.84 33.94 1zaq n VAL 3 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1zaq s ASP 4 N -0.80 3.09 0.24 6.55 1.01 -1.26 -5.01 116.67 120.49 1zaq s ASP 4 Ca 0.28 -0.52 -0.07 0.00 0.71 0.00 0.00 52.55 52.95 1zaq s ASP 4 Cb 0.22 -1.00 0.24 0.00 1.01 0.00 0.00 42.92 43.39 1zaq s ASP 4 CO -0.15 0.22 1.90 1.55 0.21 0.00 0.00 175.17 178.91 1zaq h PRO 5 N 6.23 1.15 0.00 8.23 0.13 -1.88 -1.57 132.00 144.29 1zaq h PRO 5 Ca -0.28 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1zaq h PRO 5 Cb 1.19 -0.26 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1zaq h PRO 5 CO 0.47 0.76 -0.33 0.00 -0.23 0.00 0.00 178.00 178.68 1zaq n PHE 7 N -2.89 -4.08 -1.53 0.00 -0.00 -0.59 -4.68 117.46 103.69 1zaq n PHE 7 Ca 0.03 2.19 -0.08 0.00 -0.00 0.00 0.00 57.45 59.59 1zaq n PHE 7 Cb 0.53 -3.36 -0.02 0.00 -0.00 0.00 0.00 39.48 36.62 1zaq n PHE 7 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1zaq n ARG 8 N 0.60 -0.58 -3.78 -4.13 5.12 -1.26 -4.95 116.66 107.68 1zaq n ARG 8 Ca 0.00 0.65 0.02 0.00 -1.93 0.00 0.00 57.85 56.60 1zaq n ARG 8 Cb 0.00 -4.52 0.00 0.00 -1.16 0.00 0.00 32.46 26.78 1zaq n ARG 8 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1zaq s ALA 9 N -2.33 -2.39 -0.55 7.54 0.00 -1.26 -4.75 121.76 118.02 1zaq s ALA 9 Ca 0.00 0.43 0.07 0.00 0.00 0.00 0.00 51.96 52.45 1zaq s ALA 9 Cb 0.00 0.59 0.27 0.00 0.00 0.00 0.00 23.12 23.98 1zaq s ALA 9 CO 0.00 -1.10 0.71 0.09 0.00 0.00 0.00 175.76 175.46 1zaq n ASN 10 N -0.76 2.71 -4.83 0.00 4.13 -1.26 -4.67 115.26 110.58 1zaq n ASN 10 Ca -0.03 -3.25 -0.34 0.00 1.68 0.00 0.00 54.58 52.64 1zaq n ASN 10 Cb 0.61 -0.64 -0.06 0.00 -1.54 0.00 0.00 39.78 38.14 1zaq n ASN 10 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1zaq n GLU 12 N 0.17 3.91 0.00 0.00 2.13 -1.09 -4.82 120.64 120.95 1zaq n GLU 12 Ca 0.01 -3.04 0.00 0.00 0.66 0.00 0.00 57.16 54.79 1zaq n GLU 12 Cb 0.52 -2.09 0.00 0.00 0.27 0.00 0.00 31.44 30.14 1zaq n GLU 12 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 1zaq n TYR 13 N 0.03 0.00 -1.29 4.31 9.36 -1.26 -4.92 117.16 123.39 1zaq n TYR 13 Ca 0.27 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 61.19 1zaq n TYR 13 Cb 1.10 0.00 0.22 0.00 -0.63 0.00 0.00 39.34 40.03 1zaq n TYR 13 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 1zaq s GLN 14 N 4.47 -0.57 0.00 2.98 1.11 -1.26 -4.89 119.66 121.51 1zaq s GLN 14 Ca 0.00 -0.07 0.00 0.00 0.01 0.00 0.00 55.36 55.30 1zaq s GLN 14 Cb 0.00 -1.67 0.00 0.00 -1.01 0.00 0.00 33.01 30.33 1zaq s GLN 14 CO 0.00 -3.27 0.00 0.00 0.01 0.00 0.00 175.29 172.03 1zaq s GLN 16 N -1.09 2.57 -0.91 0.00 -0.21 -0.83 -4.88 119.66 114.31 1zaq s GLN 16 Ca 0.00 -2.65 -0.26 0.00 0.02 0.00 0.00 55.36 52.46 1zaq s GLN 16 Cb 0.00 -3.70 -0.18 0.00 1.00 0.00 0.00 33.01 30.13 1zaq s GLN 16 CO 0.00 -1.18 2.29 -2.30 -2.12 0.00 0.00 175.29 171.98 1zaq n PRO 17 N 3.26 0.36 0.07 2.91 -0.02 -1.24 -2.89 135.00 137.45 1zaq n PRO 17 Ca 0.09 -1.21 0.00 0.00 -2.02 0.00 0.00 63.50 60.37 1zaq n PRO 17 Cb 0.37 -3.79 0.00 0.00 -0.02 0.00 0.00 33.50 30.06 1zaq n PRO 17 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1zaq n LEU 18 N 19.26 -1.22 0.00 2.45 -0.00 -0.01 -4.70 117.00 132.79 1zaq n LEU 18 Ca 0.44 0.61 0.00 0.00 -0.00 0.00 0.00 56.01 57.07 1zaq n LEU 18 Cb 0.45 1.48 0.00 0.00 -0.00 0.00 0.00 43.42 45.34 1zaq n LEU 18 CO 0.56 0.09 0.00 -0.46 -0.00 0.00 0.00 177.39 177.58 1zaq n ASN 19 N -3.11 0.00 0.00 1.45 0.23 -1.22 -1.58 115.26 111.02 1zaq n ASN 19 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1zaq n ASN 19 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1zaq n ASN 19 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1zaq n GLN 20 N 5.01 0.00 -2.78 -3.83 6.02 -1.26 -4.52 117.38 116.01 1zaq n GLN 20 Ca 0.00 0.11 -0.15 0.00 -0.01 0.00 0.00 57.00 56.95 1zaq n GLN 20 Cb 0.00 -0.87 0.01 0.00 1.02 0.00 0.00 30.24 30.39 1zaq n GLN 20 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1zaq n THR 21 N -0.48 1.00 0.00 5.09 -2.24 -1.23 -5.06 114.28 111.36 1zaq n THR 21 Ca 0.00 -3.82 0.00 0.00 -2.27 0.00 0.00 64.05 57.96 1zaq n THR 21 Cb 0.00 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 1zaq n THR 21 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1zaq n SER 22 N -0.04 0.46 -3.84 3.42 3.41 -0.61 -5.09 113.62 111.33 1zaq n SER 22 Ca 0.18 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.64 1zaq n SER 22 Cb 0.74 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.53 1zaq n SER 22 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 1zaq s TYR 23 N 1.39 0.17 0.25 7.33 -0.85 -1.26 -0.83 117.35 123.56 1zaq s TYR 23 Ca 0.00 0.02 0.12 0.00 -0.52 0.00 0.00 57.07 56.69 1zaq s TYR 23 Cb 0.00 -0.24 -0.05 0.00 0.38 0.00 0.00 41.96 42.05 1zaq s TYR 23 CO 0.00 -0.07 -0.19 -1.17 -1.52 0.00 0.00 175.55 172.60 1zaq s LEU 24 N 0.62 2.61 0.20 -3.49 2.96 -1.14 -4.72 118.68 115.72 1zaq s LEU 24 Ca -0.06 -0.94 0.11 0.00 -0.22 0.00 0.00 54.13 53.03 1zaq s LEU 24 Cb -0.08 -1.19 -0.04 0.00 0.50 0.00 0.00 46.19 45.37 1zaq s LEU 24 CO -0.01 0.06 -0.24 0.00 -1.32 0.00 0.00 176.35 174.84 1zaq n VAL 26 N 0.19 0.00 0.00 0.00 0.31 -0.71 -4.35 118.33 113.77 1zaq n VAL 26 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 1zaq n VAL 26 Cb 0.56 -0.99 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 1zaq n VAL 26 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1zaq n ALA 28 N -3.00 0.00 -0.23 0.00 0.00 -1.26 -4.16 120.51 111.86 1zaq n ALA 28 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1zaq n ALA 28 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 1zaq n ALA 28 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1zaq h GLU 29 N 0.00 0.87 0.00 0.00 4.81 -2.02 -3.44 114.58 114.80 1zaq h GLU 29 Ca 0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1zaq h GLU 29 Cb 0.00 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.19 1zaq h GLU 29 CO 0.00 0.60 0.00 0.41 -0.73 0.00 0.00 179.01 179.29 1zaq n GLY 30 N -1.20 -1.89 0.00 1.92 0.00 -1.26 -5.17 105.19 97.58 1zaq n GLY 30 Ca 0.05 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.96 1zaq n GLY 30 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1zaq n PHE 31 N 0.00 0.00 -4.05 1.61 3.72 -1.26 -4.48 117.46 112.99 1zaq n PHE 31 Ca 0.00 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.11 1zaq n PHE 31 Cb 0.00 0.00 -0.17 0.00 -0.94 0.00 0.00 39.48 38.37 1zaq n PHE 31 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1zaq s ALA 32 N -2.49 1.73 -0.05 4.37 0.00 -1.26 -4.60 121.76 119.46 1zaq s ALA 32 Ca 0.00 -0.81 -0.32 0.00 0.00 0.00 0.00 51.96 50.83 1zaq s ALA 32 Cb 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 23.12 22.02 1zaq s ALA 32 CO 0.00 -0.35 1.96 -0.35 0.00 0.00 0.00 175.76 177.02 1zaq n PRO 33 N 4.73 2.44 -0.35 0.00 -0.05 -1.26 -2.28 135.00 138.24 1zaq n PRO 33 Ca -0.16 0.88 -0.12 0.00 -0.05 0.00 0.00 63.50 64.04 1zaq n PRO 33 Cb 0.50 -2.84 0.12 0.00 -0.05 0.00 0.00 33.50 31.23 1zaq n PRO 33 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 175.50 175.89 1zaq n ILE 34 N 5.57 0.00 0.01 0.52 -6.64 -1.26 -4.93 119.36 112.62 1zaq n ILE 34 Ca 0.23 0.00 0.03 0.00 -1.77 0.00 0.00 62.75 61.23 1zaq n ILE 34 Cb 0.35 -0.40 -0.04 0.00 -1.44 0.00 0.00 39.64 38.12 1zaq n ILE 34 CO 0.00 0.00 0.00 -0.81 -1.77 0.00 0.00 176.55 173.97 1zaq n PRO 35 N -1.58 0.35 0.15 6.28 -0.04 -1.26 -4.61 135.00 134.29 1zaq n PRO 35 Ca 0.06 -0.04 0.02 0.00 -0.04 0.00 0.00 63.50 63.49 1zaq n PRO 35 Cb 0.24 -1.11 0.18 0.00 -0.04 0.00 0.00 33.50 32.77 1zaq n PRO 35 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1zaq h HIS 36 N 0.00 0.00 0.00 0.54 2.07 -2.03 -3.47 115.15 112.26 1zaq h HIS 36 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1zaq h HIS 36 Cb 0.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.21 1zaq h HIS 36 CO 0.00 0.54 0.00 0.39 -3.07 0.00 0.00 177.93 175.79 1zaq n GLU 37 N -3.51 0.00 -0.53 5.12 1.02 -1.26 -5.14 120.64 116.34 1zaq n GLU 37 Ca 0.00 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.94 1zaq n GLU 37 Cb 0.64 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 32.21 1zaq n GLU 37 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1zaq n PRO 38 N -0.44 -2.31 -0.62 3.49 -0.04 -1.26 -4.44 135.00 129.37 1zaq n PRO 38 Ca 0.00 -0.68 0.00 0.00 -0.04 0.00 0.00 63.50 62.78 1zaq n PRO 38 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 1zaq n PRO 38 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1zaq n HIS 39 N -4.45 0.00 0.09 0.54 1.44 -1.26 -4.88 115.22 106.69 1zaq n HIS 39 Ca 0.06 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.77 1zaq n HIS 39 Cb 0.38 -0.31 0.00 0.00 0.12 0.00 0.00 29.99 30.18 1zaq n HIS 39 CO 0.00 0.00 0.00 -2.13 -2.81 0.00 0.00 176.34 171.40 1zaq n ARG 40 N -1.00 0.00 -1.15 -1.40 0.63 -1.26 -2.65 116.66 109.83 1zaq n ARG 40 Ca 0.00 0.00 0.14 0.00 -0.92 0.00 0.00 57.85 57.07 1zaq n ARG 40 Cb 0.16 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 33.00 1zaq n ARG 40 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1zaq n GLN 42 N -3.90 2.38 -3.51 0.00 10.64 -0.97 -4.83 117.38 117.21 1zaq n GLN 42 Ca -0.06 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 54.94 1zaq n GLN 42 Cb 0.54 0.00 -0.13 0.00 -0.86 0.00 0.00 30.24 29.80 1zaq n GLN 42 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.06 176.64 1zaq s MET 43 N 4.95 0.19 0.00 2.61 -2.45 -1.26 -4.22 119.30 119.12 1zaq s MET 43 Ca 0.00 0.31 0.00 0.00 -1.25 0.00 0.00 55.69 54.75 1zaq s MET 43 Cb 0.00 -0.97 0.00 0.00 1.25 0.00 0.00 34.83 35.11 1zaq s MET 43 CO 0.00 -0.60 0.09 0.34 1.05 0.00 0.00 175.02 175.90