#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zad s LYS 2 N 0.00 2.90 0.06 3.23 1.02 -1.26 0.58 119.74 126.27 1zad s LYS 2 Ca 0.00 -0.97 0.05 0.00 0.02 0.00 0.00 55.97 55.07 1zad s LYS 2 Cb 0.00 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.00 1zad s LYS 2 CO 0.00 -0.48 -0.07 0.00 -0.92 0.00 0.00 175.35 173.88 1zad s ASN 4 N -1.89 5.22 0.08 0.00 0.01 -1.26 -1.05 114.94 116.04 1zad s ASN 4 Ca 0.20 -0.62 0.00 0.00 -0.71 0.00 0.00 52.86 51.73 1zad s ASN 4 Cb -0.11 -0.09 0.00 0.00 0.41 0.00 0.00 41.25 41.46 1zad s ASN 4 CO 0.12 -1.20 0.00 0.29 -1.51 0.00 0.00 177.10 174.80 1zad n LYS 5 N -2.18 1.94 -0.26 -0.60 4.01 -0.55 -4.59 118.16 115.93 1zad n LYS 5 Ca 0.13 0.00 0.27 0.00 -0.51 0.00 0.00 58.31 58.20 1zad n LYS 5 Cb 0.61 0.00 0.64 0.00 -0.51 0.00 0.00 35.03 35.77 1zad n LYS 5 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 1zad h LEU 6 N 0.00 0.18 -8.98 -0.35 6.46 -1.90 -3.37 115.31 107.36 1zad h LEU 6 Ca 0.00 0.03 -0.64 0.00 -0.12 0.00 0.00 57.88 57.15 1zad h LEU 6 Cb 0.00 -0.00 -0.19 0.00 -0.73 0.00 0.00 40.66 39.73 1zad h LEU 6 CO 0.00 0.05 -0.64 -0.69 -0.62 0.00 0.00 178.44 176.54 1zad s VAL 7 N -5.17 4.11 -0.16 1.05 1.01 -1.26 -4.88 120.40 115.10 1zad s VAL 7 Ca -0.06 -0.29 -0.04 0.00 0.00 0.00 0.00 61.98 61.59 1zad s VAL 7 Cb 0.23 -2.79 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1zad s VAL 7 CO 0.79 0.51 1.24 -2.65 0.00 0.00 0.00 175.10 174.99 1zad n PRO 8 N 3.23 0.35 0.00 2.72 -0.02 -1.26 -3.67 135.00 136.35 1zad n PRO 8 Ca -0.17 -0.71 0.00 0.00 -2.02 0.00 0.00 63.50 60.59 1zad n PRO 8 Cb 0.53 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1zad n PRO 8 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 1zad n ILE 9 N 5.06 0.00 -4.48 4.25 0.00 -1.26 -5.08 119.36 117.85 1zad n ILE 9 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 62.75 62.53 1zad n ILE 9 Cb 0.06 -0.40 -0.12 0.00 0.00 0.00 0.00 39.64 39.18 1zad n ILE 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1zad s ALA 10 N -1.82 3.00 -0.06 1.51 0.00 -1.24 -5.06 121.76 118.08 1zad s ALA 10 Ca 0.00 -0.84 -0.21 0.00 0.00 0.00 0.00 51.96 50.91 1zad s ALA 10 Cb 0.00 -1.45 0.04 0.00 0.00 0.00 0.00 23.12 21.71 1zad s ALA 10 CO 0.00 0.33 0.48 1.52 0.00 0.00 0.00 175.76 178.09 1zad s TYR 11 N -0.01 -0.42 0.13 0.00 1.13 -1.26 -1.48 117.35 115.45 1zad s TYR 11 Ca 0.00 0.78 0.02 0.00 -1.41 0.00 0.00 57.07 56.46 1zad s TYR 11 Cb -0.13 0.23 -0.01 0.00 -1.10 0.00 0.00 41.96 40.95 1zad s TYR 11 CO 0.03 -0.45 0.06 1.63 -2.51 0.00 0.00 175.55 174.31 1zad n LYS 12 N 1.44 0.69 -2.95 -3.49 4.76 -0.21 -4.90 118.16 113.50 1zad n LYS 12 Ca -0.19 -1.15 -0.40 0.00 -2.87 0.00 0.00 58.31 53.69 1zad n LYS 12 Cb 0.56 0.68 -0.04 0.00 -1.84 0.00 0.00 35.03 34.40 1zad n LYS 12 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1zad s THR 13 N -2.13 4.99 -0.33 -0.18 2.01 -1.26 -0.48 115.64 118.27 1zad s THR 13 Ca 0.08 1.62 -0.29 0.00 0.31 0.00 0.00 61.69 63.42 1zad s THR 13 Cb 0.00 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.39 1zad s THR 13 CO 0.06 0.22 1.56 0.00 -0.69 0.00 0.00 174.62 175.77 1zad n PRO 15 N 8.01 -3.23 -1.63 0.00 -0.04 -1.22 -4.49 135.00 132.40 1zad n PRO 15 Ca 0.19 -0.75 -0.44 0.00 -0.04 0.00 0.00 63.50 62.45 1zad n PRO 15 Cb 0.47 -0.93 -0.04 0.00 -0.04 0.00 0.00 33.50 32.96 1zad n PRO 15 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1zad n GLU 16 N -3.79 2.31 0.00 0.54 2.13 -1.26 -1.41 120.64 119.16 1zad n GLU 16 Ca 0.07 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.67 1zad n GLU 16 Cb 0.30 -2.96 0.00 0.00 0.27 0.00 0.00 31.44 29.05 1zad n GLU 16 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1zad n GLY 17 N 5.05 2.93 3.06 8.31 0.00 -1.26 -5.04 105.19 118.24 1zad n GLY 17 Ca 0.25 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 1zad n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zad s LYS 18 N 0.00 2.27 -0.00 1.61 1.02 -0.50 -4.20 119.74 119.94 1zad s LYS 18 Ca 0.00 -1.20 0.05 0.00 0.02 0.00 0.00 55.97 54.84 1zad s LYS 18 Cb 0.00 -2.78 -0.07 0.00 -0.52 0.00 0.00 37.83 34.47 1zad s LYS 18 CO 0.00 -0.51 0.16 -1.71 -0.92 0.00 0.00 175.35 172.37 1zad n ASN 19 N 4.50 2.02 -4.94 2.83 5.15 -1.07 -3.40 115.26 120.36 1zad n ASN 19 Ca -0.15 -0.31 -0.23 0.00 -0.60 0.00 0.00 54.58 53.30 1zad n ASN 19 Cb 0.44 1.12 -0.03 0.00 -0.53 0.00 0.00 39.78 40.78 1zad n ASN 19 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1zad s LEU 20 N -2.79 4.23 0.11 1.20 1.43 -0.28 -4.38 118.68 118.20 1zad s LEU 20 Ca 0.00 0.04 0.10 0.00 -1.03 0.00 0.00 54.13 53.24 1zad s LEU 20 Cb 0.03 -2.78 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 1zad s LEU 20 CO 0.21 -0.03 -0.26 0.00 0.23 0.00 0.00 176.35 176.50 1zad s TYR 22 N -1.03 0.22 -0.15 0.00 -0.85 0.15 0.10 117.35 115.78 1zad s TYR 22 Ca 0.12 -0.65 -0.04 0.00 -0.52 0.00 0.00 57.07 55.98 1zad s TYR 22 Cb -0.10 -0.12 0.07 0.00 0.38 0.00 0.00 41.96 42.19 1zad s TYR 22 CO 0.05 -0.49 0.24 -1.59 -1.52 0.00 0.00 175.55 172.24 1zad s LYS 23 N -3.69 0.15 -0.08 -3.49 -2.85 0.02 -0.91 119.74 108.88 1zad s LYS 23 Ca 0.04 0.53 -0.18 0.00 -1.00 0.00 0.00 55.97 55.36 1zad s LYS 23 Cb 0.05 -0.47 -0.05 0.00 -2.06 0.00 0.00 37.83 35.30 1zad s LYS 23 CO -0.10 -0.43 0.50 -1.64 0.10 0.00 0.00 175.35 173.79 1zad s MET 24 N 2.38 4.29 -0.21 1.78 -1.94 0.26 -1.88 119.30 123.98 1zad s MET 24 Ca 0.04 0.52 -0.01 0.00 -1.71 0.00 0.00 55.69 54.52 1zad s MET 24 Cb -0.13 -3.39 0.01 0.00 2.01 0.00 0.00 34.83 33.32 1zad s MET 24 CO -0.10 0.26 -0.12 -0.06 -0.01 0.00 0.00 175.02 174.99 1zad s PHE 25 N 0.28 2.91 0.46 -0.03 0.40 0.92 -1.69 117.98 121.22 1zad s PHE 25 Ca 0.27 -1.38 -0.11 0.00 -0.60 0.00 0.00 56.93 55.11 1zad s PHE 25 Cb -0.16 -2.01 -0.06 0.00 0.51 0.00 0.00 43.02 41.30 1zad s PHE 25 CO 0.12 -0.70 0.84 1.41 0.70 0.00 0.00 175.22 177.59 1zad s MET 26 N 1.36 3.76 0.00 0.44 1.75 -1.26 0.99 119.30 126.34 1zad s MET 26 Ca 0.04 0.55 0.00 0.00 -1.25 0.00 0.00 55.69 55.03 1zad s MET 26 Cb -0.14 -2.31 0.00 0.00 2.84 0.00 0.00 34.83 35.22 1zad s MET 26 CO -0.08 -0.15 0.00 -1.33 -0.65 0.00 0.00 175.02 172.81 1zad n MET 27 N -1.62 0.00 -4.14 4.11 2.81 0.48 -4.42 117.12 114.35 1zad n MET 27 Ca 0.03 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.76 1zad n MET 27 Cb 0.54 0.00 -0.12 0.00 -0.71 0.00 0.00 33.22 32.94 1zad n MET 27 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 1zad s SER 28 N -3.34 1.37 -0.06 7.83 0.01 -1.26 -4.87 113.70 113.38 1zad s SER 28 Ca 0.00 -0.63 0.21 0.00 1.31 0.00 0.00 55.95 56.84 1zad s SER 28 Cb 0.00 -0.01 -0.32 0.00 0.21 0.00 0.00 66.02 65.90 1zad s SER 28 CO 0.00 -0.15 0.40 -0.90 0.41 0.00 0.00 173.24 173.00 1zad n ASP 29 N 1.20 0.12 -0.24 2.44 5.75 -1.26 -4.26 116.55 120.30 1zad n ASP 29 Ca -0.21 0.00 0.32 0.00 -0.01 0.00 0.00 54.79 54.89 1zad n ASP 29 Cb 0.55 1.81 0.63 0.00 -1.03 0.00 0.00 41.12 43.08 1zad n ASP 29 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1zad h LEU 30 N 0.00 0.00 0.00 -2.12 3.38 -1.96 -3.39 115.31 111.22 1zad h LEU 30 Ca -0.09 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.42 1zad h LEU 30 Cb 1.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1zad h LEU 30 CO 0.00 0.00 -0.17 0.35 0.09 0.00 0.00 178.44 178.72 1zad n THR 31 N -3.62 0.00 -1.52 0.22 -2.24 -1.26 -5.08 114.28 100.77 1zad n THR 31 Ca 0.23 -1.77 -0.36 0.00 -2.27 0.00 0.00 64.05 59.89 1zad n THR 31 Cb 1.35 -0.28 0.08 0.00 -2.10 0.00 0.00 70.33 69.38 1zad n THR 31 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1zad n ILE 32 N -1.77 3.89 -0.39 2.28 5.41 -1.26 -5.00 119.36 122.53 1zad n ILE 32 Ca 0.04 -0.42 -0.12 0.00 1.00 0.00 0.00 62.75 63.25 1zad n ILE 32 Cb 0.52 -1.34 0.11 0.00 -0.71 0.00 0.00 39.64 38.23 1zad n ILE 32 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1zad n PRO 33 N -2.12 -2.58 -0.00 0.38 -0.04 -1.26 -4.90 135.00 124.48 1zad n PRO 33 Ca 0.15 -0.65 -0.00 0.00 -0.04 0.00 0.00 63.50 62.96 1zad n PRO 33 Cb 0.49 -0.72 -0.00 0.00 -0.04 0.00 0.00 33.50 33.22 1zad n PRO 33 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1zad n VAL 34 N -3.83 0.02 -3.76 0.52 0.24 -0.68 -4.90 118.33 105.93 1zad n VAL 34 Ca 0.06 -0.01 -0.11 0.00 -2.04 0.00 0.00 64.34 62.25 1zad n VAL 34 Cb 0.24 -0.75 -0.07 0.00 -1.47 0.00 0.00 33.84 31.80 1zad n VAL 34 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1zad s LYS 35 N -2.01 0.87 0.18 7.34 2.20 -0.99 -5.03 119.74 122.30 1zad s LYS 35 Ca -0.01 -0.67 -0.24 0.00 -0.36 0.00 0.00 55.97 54.70 1zad s LYS 35 Cb 0.00 0.37 0.06 0.00 -1.51 0.00 0.00 37.83 36.76 1zad s LYS 35 CO 0.01 -0.29 0.95 -0.98 -0.36 0.00 0.00 175.35 174.68 1zad s ARG 36 N -3.15 1.29 0.00 4.03 1.04 -1.26 0.90 118.95 121.80 1zad s ARG 36 Ca -0.01 -0.74 0.00 0.00 -1.04 0.00 0.00 55.73 53.94 1zad s ARG 36 Cb 0.01 0.42 0.00 0.00 -2.04 0.00 0.00 34.95 33.34 1zad s ARG 36 CO -0.07 -0.59 0.00 0.41 -0.04 0.00 0.00 175.30 175.00 1zad n GLY 37 N -0.51 -1.06 3.94 3.88 0.00 -0.09 -4.81 105.19 106.53 1zad n GLY 37 Ca -0.06 -1.06 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 1zad n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zad s ILE 39 N -1.75 0.00 -0.07 0.00 2.07 0.18 -4.88 121.20 116.74 1zad s ILE 39 Ca 0.35 -1.28 0.01 0.00 -1.41 0.00 0.00 60.65 58.32 1zad s ILE 39 Cb -0.11 -2.72 -0.05 0.00 0.13 0.00 0.00 42.46 39.71 1zad s ILE 39 CO 0.29 0.00 -0.06 -0.67 -1.91 0.00 0.00 174.94 172.58 1zad n ASP 40 N -1.35 3.44 -3.93 4.50 2.03 -1.26 -1.13 116.55 118.86 1zad n ASP 40 Ca -0.04 -0.04 -0.23 0.00 0.52 0.00 0.00 54.79 55.01 1zad n ASP 40 Cb 0.61 -0.09 -0.17 0.00 -0.72 0.00 0.00 41.12 40.75 1zad n ASP 40 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1zad s VAL 41 N -2.14 0.78 -0.04 5.18 1.01 -1.26 -4.87 120.40 119.05 1zad s VAL 41 Ca -0.09 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 1zad s VAL 41 Cb 0.02 -0.78 -0.06 0.00 0.00 0.00 0.00 36.38 35.56 1zad s VAL 41 CO 0.17 0.29 1.79 0.00 0.00 0.00 0.00 175.10 177.35 1zad s PRO 43 N 4.34 -0.55 -0.04 0.00 0.02 -1.26 -5.00 135.00 132.52 1zad s PRO 43 Ca 0.80 0.89 -0.30 0.00 0.02 0.00 0.00 61.00 62.41 1zad s PRO 43 Cb -0.36 -1.59 -0.04 0.00 0.02 0.00 0.00 34.50 32.53 1zad s PRO 43 CO 0.34 -3.49 1.25 0.15 -0.33 0.00 0.00 177.00 174.92 1zad s LYS 44 N -4.54 4.33 0.78 5.54 1.02 -1.26 -5.00 119.74 120.61 1zad s LYS 44 Ca 0.68 1.75 -0.11 0.00 0.02 0.00 0.00 55.97 58.31 1zad s LYS 44 Cb -0.24 -3.56 0.06 0.00 -0.52 0.00 0.00 37.83 33.57 1zad s LYS 44 CO 0.63 -0.48 1.10 1.21 -0.92 0.00 0.00 175.35 176.89 1zad s ASN 45 N 1.58 4.63 0.40 2.83 2.47 -1.26 -4.99 114.94 120.60 1zad s ASN 45 Ca 0.58 1.30 0.02 0.00 0.42 0.00 0.00 52.86 55.18 1zad s ASN 45 Cb -0.27 -2.05 -0.01 0.00 -1.45 0.00 0.00 41.25 37.48 1zad s ASN 45 CO 0.23 -1.88 0.08 -1.54 -3.72 0.00 0.00 177.10 170.27 1zad n SER 46 N -3.37 2.03 0.04 -4.21 3.41 -1.18 -5.02 113.62 105.32 1zad n SER 46 Ca 0.07 -2.94 0.03 0.00 -0.26 0.00 0.00 58.87 55.76 1zad n SER 46 Cb 0.56 0.67 -0.07 0.00 -0.26 0.00 0.00 64.21 65.11 1zad n SER 46 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1zad n LEU 47 N 0.00 0.82 0.09 1.04 0.00 -1.26 -3.95 117.00 113.74 1zad n LEU 47 Ca -0.11 0.35 -0.16 0.00 0.00 0.00 0.00 56.01 56.10 1zad n LEU 47 Cb 0.55 0.05 -0.14 0.00 0.00 0.00 0.00 43.42 43.88 1zad n LEU 47 CO 0.29 0.07 -0.11 -0.07 0.00 0.00 0.00 177.39 177.57 1zad h LEU 48 N 0.00 0.40 -9.12 -1.96 -0.00 -1.94 -3.47 115.31 99.22 1zad h LEU 48 Ca -0.13 -0.45 -0.52 0.00 -0.00 0.00 0.00 57.88 56.78 1zad h LEU 48 Cb 1.45 -0.13 -0.14 0.00 -0.00 0.00 0.00 40.66 41.84 1zad h LEU 48 CO 0.03 1.36 -0.70 -0.69 -0.00 0.00 0.00 178.44 178.44 1zad s VAL 49 N -2.65 1.89 -0.16 1.22 1.01 -1.25 -0.39 120.40 120.07 1zad s VAL 49 Ca -0.05 -2.20 0.00 0.00 0.00 0.00 0.00 61.98 59.73 1zad s VAL 49 Cb 0.07 -2.35 0.03 0.00 0.00 0.00 0.00 36.38 34.14 1zad s VAL 49 CO 0.87 -0.38 -0.11 -0.75 0.00 0.00 0.00 175.10 174.74 1zad s LYS 50 N -3.65 1.97 -0.29 2.72 2.20 0.28 -3.11 119.74 119.85 1zad s LYS 50 Ca 0.28 -0.60 -0.18 0.00 -0.36 0.00 0.00 55.97 55.11 1zad s LYS 50 Cb 0.01 -2.12 -0.02 0.00 -1.51 0.00 0.00 37.83 34.19 1zad s LYS 50 CO 0.12 -0.33 0.53 0.71 -0.36 0.00 0.00 175.35 176.01 1zad s TYR 51 N 1.51 3.24 -0.37 4.03 1.51 -1.26 -0.06 117.35 125.95 1zad s TYR 51 Ca 0.02 0.52 0.02 0.00 -1.01 0.00 0.00 57.07 56.63 1zad s TYR 51 Cb -0.14 -2.80 0.11 0.00 -0.11 0.00 0.00 41.96 39.01 1zad s TYR 51 CO -0.09 -0.37 0.11 0.08 -1.11 0.00 0.00 175.55 174.17 1zad s VAL 52 N 2.37 2.56 0.21 0.71 1.01 -0.78 -4.95 120.40 121.52 1zad s VAL 52 Ca 0.21 -2.37 -0.05 0.00 0.00 0.00 0.00 61.98 59.77 1zad s VAL 52 Cb -0.15 -2.84 -0.06 0.00 0.00 0.00 0.00 36.38 33.33 1zad s VAL 52 CO 0.10 -0.64 0.46 0.00 0.00 0.00 0.00 175.10 175.02 1zad n ASN 55 N -0.65 0.62 -4.70 0.00 6.94 -1.26 -1.02 115.26 115.19 1zad n ASN 55 Ca -0.03 -2.27 -0.35 0.00 -0.02 0.00 0.00 54.58 51.91 1zad n ASN 55 Cb 0.61 -0.27 -0.09 0.00 -2.36 0.00 0.00 39.78 37.67 1zad n ASN 55 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1zad s THR 56 N -0.67 4.49 0.03 5.53 -4.23 -1.26 -4.97 115.64 114.56 1zad s THR 56 Ca 0.11 -0.17 -0.30 0.00 -1.18 0.00 0.00 61.69 60.15 1zad s THR 56 Cb 0.11 -2.92 -0.08 0.00 1.34 0.00 0.00 72.50 70.95 1zad s THR 56 CO -0.01 0.59 1.83 -1.81 -0.54 0.00 0.00 174.62 174.67 1zad s ASP 57 N -0.73 6.53 -0.45 3.99 1.01 -1.26 -1.50 116.67 124.26 1zad s ASP 57 Ca 0.12 2.54 -0.02 0.00 0.71 0.00 0.00 52.55 55.89 1zad s ASP 57 Cb -0.12 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.28 1zad s ASP 57 CO 0.02 -0.99 0.28 0.54 0.21 0.00 0.00 175.17 175.23 1zad n ARG 58 N 6.98 -2.02 0.07 8.23 1.74 0.22 -4.92 116.66 126.96 1zad n ARG 58 Ca 0.18 0.27 -0.11 0.00 -0.77 0.00 0.00 57.85 57.42 1zad n ARG 58 Cb 0.41 -3.69 -0.03 0.00 -1.02 0.00 0.00 32.46 28.13 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11