#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 2.94 0.04 3.23 1.02 -1.26 0.74 119.74 126.45 1zad s LYS 2 Ca 0.00 -0.94 0.04 0.00 0.02 0.00 0.00 55.97 55.08 1zad s LYS 2 Cb 0.00 -3.26 -0.04 0.00 -0.52 0.00 0.00 37.83 34.01 1zad s LYS 2 CO 0.00 -0.46 -0.03 0.00 -0.92 0.00 0.00 175.35 173.94 1zad s ASN 4 N -1.85 5.31 0.00 0.00 0.01 -1.26 -1.54 114.94 115.61 1zad s ASN 4 Ca 0.21 -0.45 0.00 0.00 -0.71 0.00 0.00 52.86 51.91 1zad s ASN 4 Cb -0.11 -1.06 0.00 0.00 0.41 0.00 0.00 41.25 40.48 1zad s ASN 4 CO 0.13 -0.27 0.00 0.29 -1.51 0.00 0.00 177.10 175.73 1zad n LYS 5 N -1.31 1.88 -0.27 -0.60 4.01 -1.01 -4.60 118.16 116.25 1zad n LYS 5 Ca -0.03 0.00 0.26 0.00 -0.51 0.00 0.00 58.31 58.03 1zad n LYS 5 Cb 0.59 0.00 0.62 0.00 -0.51 0.00 0.00 35.03 35.73 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 0.22 -8.56 -0.35 6.46 -1.91 -3.36 115.31 107.82 1zad h LEU 6 Ca 0.00 0.03 -0.66 0.00 -0.12 0.00 0.00 57.88 57.14 1zad h LEU 6 Cb 0.00 -0.00 -0.27 0.00 -0.73 0.00 0.00 40.66 39.66 1zad h LEU 6 CO 0.00 0.06 -0.76 -0.69 -0.62 0.00 0.00 178.44 176.43 1zad s VAL 7 N -5.22 3.11 0.00 1.05 1.01 -1.26 -5.01 120.40 114.07 1zad s VAL 7 Ca -0.07 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 1zad s VAL 7 Cb 0.23 -2.33 -0.00 0.00 0.00 0.00 0.00 36.38 34.28 1zad s VAL 7 CO 0.79 0.50 0.07 -2.65 0.00 0.00 0.00 175.10 173.81 1zad n PRO 8 N 3.83 0.01 -0.02 2.72 -0.02 -1.26 -3.26 135.00 136.99 1zad n PRO 8 Ca -0.18 -0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.27 1zad n PRO 8 Cb 0.52 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.47 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 2.10 0.29 -4.64 4.25 0.00 -1.26 -5.01 119.36 115.10 1zad n ILE 9 Ca 0.00 -0.16 -0.24 0.00 0.00 0.00 0.00 62.75 62.35 1zad n ILE 9 Cb 0.00 -0.83 -0.16 0.00 0.00 0.00 0.00 39.64 38.65 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 -2.10 1.28 0.06 1.51 0.00 -1.20 -5.11 121.76 116.20 1zad s ALA 10 Ca -0.04 -0.49 -0.17 0.00 0.00 0.00 0.00 51.96 51.26 1zad s ALA 10 Cb 0.01 -0.50 0.03 0.00 0.00 0.00 0.00 23.12 22.66 1zad s ALA 10 CO 0.16 0.17 0.39 1.52 0.00 0.00 0.00 175.76 178.00 1zad s TYR 11 N 0.37 -0.22 0.15 0.00 1.13 -1.26 -2.41 117.35 115.11 1zad s TYR 11 Ca -0.09 0.12 0.02 0.00 -1.41 0.00 0.00 57.07 55.71 1zad s TYR 11 Cb -0.13 0.20 -0.01 0.00 -1.10 0.00 0.00 41.96 40.92 1zad s TYR 11 CO 0.03 -0.58 0.07 1.63 -2.51 0.00 0.00 175.55 174.19 1zad n LYS 12 N 0.40 0.59 -2.98 -3.49 4.76 -0.59 -4.93 118.16 111.91 1zad n LYS 12 Ca -0.18 -1.33 -0.41 0.00 -2.87 0.00 0.00 58.31 53.52 1zad n LYS 12 Cb 0.60 0.84 -0.05 0.00 -1.84 0.00 0.00 35.03 34.59 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 -2.27 4.94 -0.49 -0.18 2.01 -1.26 -1.02 115.64 117.38 1zad s THR 13 Ca 0.11 1.46 -0.27 0.00 0.31 0.00 0.00 61.69 63.29 1zad s THR 13 Cb 0.01 -4.06 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 1zad s THR 13 CO 0.07 0.07 1.87 0.00 -0.69 0.00 0.00 174.62 175.94 1zad n PRO 15 N 8.85 -3.21 -1.67 0.00 -0.04 -1.19 -4.29 135.00 133.46 1zad n PRO 15 Ca 0.22 -0.71 -0.47 0.00 -0.04 0.00 0.00 63.50 62.50 1zad n PRO 15 Cb 0.50 -0.95 -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 -3.67 2.15 0.00 0.54 2.13 -1.26 -1.05 120.64 119.47 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 0.29 -2.58 0.00 0.00 0.27 0.00 0.00 31.44 29.42 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 3.87 3.02 3.14 8.31 0.00 -1.26 -4.98 105.19 117.28 1zad n GLY 17 Ca 0.20 -0.83 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 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 2.22 -0.01 1.61 1.02 -0.21 -4.25 119.74 120.11 1zad s LYS 18 Ca 0.00 -1.48 0.02 0.00 0.02 0.00 0.00 55.97 54.53 1zad s LYS 18 Cb 0.00 -3.29 0.03 0.00 -0.52 0.00 0.00 37.83 34.05 1zad s LYS 18 CO 0.00 -0.78 1.00 -1.71 -0.92 0.00 0.00 175.35 172.95 1zad n ASN 19 N 4.58 1.99 -4.37 2.83 5.15 -1.13 -3.13 115.26 121.18 1zad n ASN 19 Ca -0.08 -2.08 -0.31 0.00 -0.60 0.00 0.00 54.58 51.51 1zad n ASN 19 Cb 0.43 -0.04 -0.15 0.00 -0.53 0.00 0.00 39.78 39.49 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 -1.14 2.27 -0.15 1.20 1.43 -0.71 -4.65 118.68 116.92 1zad s LEU 20 Ca 0.03 -0.44 -0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1zad s LEU 20 Cb 0.02 -1.39 -0.01 0.00 0.03 0.00 0.00 46.19 44.85 1zad s LEU 20 CO 0.00 0.30 -0.14 0.00 0.23 0.00 0.00 176.35 176.75 1zad s TYR 22 N 0.68 2.15 -0.18 0.00 -0.85 0.18 -0.26 117.35 119.07 1zad s TYR 22 Ca -0.07 -0.55 -0.04 0.00 -0.52 0.00 0.00 57.07 55.89 1zad s TYR 22 Cb -0.15 -1.15 0.08 0.00 0.38 0.00 0.00 41.96 41.12 1zad s TYR 22 CO 0.02 0.48 0.24 -1.59 -1.52 0.00 0.00 175.55 173.18 1zad s LYS 23 N -3.64 0.18 -0.11 -3.49 0.00 0.21 -0.85 119.74 112.04 1zad s LYS 23 Ca 0.30 0.42 -0.20 0.00 0.00 0.00 0.00 55.97 56.49 1zad s LYS 23 Cb 0.01 -0.72 -0.04 0.00 0.00 0.00 0.00 37.83 37.08 1zad s LYS 23 CO 0.14 -0.52 0.56 -1.64 0.00 0.00 0.00 175.35 173.89 1zad s MET 24 N 2.37 4.35 -0.20 1.78 -1.94 0.23 -2.17 119.30 123.72 1zad s MET 24 Ca 0.05 0.60 -0.03 0.00 -1.71 0.00 0.00 55.69 54.60 1zad s MET 24 Cb -0.14 -3.46 -0.01 0.00 2.01 0.00 0.00 34.83 33.23 1zad s MET 24 CO -0.11 0.09 -0.06 -0.06 -0.01 0.00 0.00 175.02 174.87 1zad s PHE 25 N 0.82 2.93 0.44 -0.03 0.40 -0.06 -2.29 117.98 120.20 1zad s PHE 25 Ca 0.30 -0.90 -0.12 0.00 -0.60 0.00 0.00 56.93 55.61 1zad s PHE 25 Cb -0.16 -2.06 -0.07 0.00 0.51 0.00 0.00 43.02 41.25 1zad s PHE 25 CO 0.13 -0.49 0.83 1.41 0.70 0.00 0.00 175.22 177.80 1zad s MET 26 N 1.27 3.82 0.00 0.44 1.75 -1.26 0.31 119.30 125.63 1zad s MET 26 Ca 0.03 0.61 0.00 0.00 -1.25 0.00 0.00 55.69 55.08 1zad s MET 26 Cb -0.14 -2.32 0.00 0.00 2.84 0.00 0.00 34.83 35.21 1zad s MET 26 CO -0.02 -0.11 0.00 -1.33 -0.65 0.00 0.00 175.02 172.91 1zad n MET 27 N -1.41 0.00 -3.75 4.11 2.81 0.44 -4.50 117.12 114.83 1zad n MET 27 Ca 0.04 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.79 1zad n MET 27 Cb 0.54 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 32.97 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 0.00 -0.20 0.05 7.83 0.01 -1.26 -4.85 113.70 115.28 1zad s SER 28 Ca 0.00 0.09 0.21 0.00 1.31 0.00 0.00 55.95 57.55 1zad s SER 28 Cb 0.00 0.32 -0.18 0.00 0.21 0.00 0.00 66.02 66.38 1zad s SER 28 CO 0.00 -0.47 0.70 -0.90 0.41 0.00 0.00 173.24 172.98 1zad n ASP 29 N 1.19 0.46 -0.17 2.44 5.75 -1.26 -4.07 116.55 120.90 1zad n ASP 29 Ca -0.21 0.19 0.29 0.00 -0.01 0.00 0.00 54.79 55.04 1zad n ASP 29 Cb 0.56 1.00 0.63 0.00 -1.03 0.00 0.00 41.12 42.28 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 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1zad h LEU 30 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1zad h LEU 30 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 1zad n THR 31 N -3.59 0.00 -3.15 0.22 -2.24 -1.26 -5.10 114.28 99.16 1zad n THR 31 Ca 0.20 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.64 1zad n THR 31 Cb 1.22 -0.65 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 1zad n THR 31 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1zad s ILE 32 N 2.21 4.67 0.49 2.28 1.09 -1.26 -5.07 121.20 125.60 1zad s ILE 32 Ca 0.00 1.02 -0.08 0.00 -1.10 0.00 0.00 60.65 60.49 1zad s ILE 32 Cb 0.00 -3.69 0.12 0.00 -1.06 0.00 0.00 42.46 37.83 1zad s ILE 32 CO 0.00 -0.04 0.35 -0.81 -0.10 0.00 0.00 174.94 174.33 1zad n PRO 33 N 0.02 -2.45 0.00 2.79 -0.04 -1.26 -4.86 135.00 129.20 1zad n PRO 33 Ca 0.01 -0.57 0.00 0.00 -0.04 0.00 0.00 63.50 62.90 1zad n PRO 33 Cb 0.52 -0.64 0.00 0.00 -0.04 0.00 0.00 33.50 33.35 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 -3.70 0.00 -3.78 0.52 0.24 -0.97 -4.88 118.33 105.76 1zad n VAL 34 Ca 0.05 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.23 1zad n VAL 34 Cb 0.21 -0.81 -0.08 0.00 -1.47 0.00 0.00 33.84 31.69 1zad n VAL 34 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1zad s LYS 35 N -1.94 0.73 -0.28 7.34 -2.85 -0.97 -4.99 119.74 116.78 1zad s LYS 35 Ca 0.00 -0.42 -0.20 0.00 -1.00 0.00 0.00 55.97 54.34 1zad s LYS 35 Cb 0.00 0.32 0.12 0.00 -2.06 0.00 0.00 37.83 36.20 1zad s LYS 35 CO 0.00 -0.22 0.91 -0.98 0.10 0.00 0.00 175.35 175.16 1zad s ARG 36 N -2.12 0.54 0.00 1.78 3.03 -1.26 0.75 118.95 121.68 1zad s ARG 36 Ca -0.08 0.79 0.00 0.00 2.03 0.00 0.00 55.73 58.47 1zad s ARG 36 Cb -0.03 0.19 0.00 0.00 -1.03 0.00 0.00 34.95 34.08 1zad s ARG 36 CO -0.01 -0.09 0.00 0.41 -1.13 0.00 0.00 175.30 174.48 1zad n GLY 37 N 3.17 3.66 3.93 3.88 0.00 -0.03 -4.55 105.19 115.24 1zad n GLY 37 Ca -0.16 -0.90 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.17 0.00 -0.11 0.00 2.07 0.27 -4.83 121.20 116.44 1zad s ILE 39 Ca 0.40 -0.83 0.04 0.00 -1.41 0.00 0.00 60.65 58.86 1zad s ILE 39 Cb -0.08 -2.46 -0.10 0.00 0.13 0.00 0.00 42.46 39.96 1zad s ILE 39 CO 0.29 0.00 -0.05 -0.90 -1.91 0.00 0.00 174.94 172.37 1zad n ASP 40 N -0.91 2.89 -3.81 4.50 5.75 -1.26 -1.74 116.55 121.96 1zad n ASP 40 Ca -0.06 -0.04 -0.19 0.00 -0.01 0.00 0.00 54.79 54.50 1zad n ASP 40 Cb 0.60 0.19 -0.17 0.00 -1.03 0.00 0.00 41.12 40.71 1zad n ASP 40 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1zad s VAL 41 N -2.24 0.24 -0.07 2.12 1.01 -1.26 -4.89 120.40 115.30 1zad s VAL 41 Ca -0.12 0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.66 1zad s VAL 41 Cb 0.04 -0.34 -0.06 0.00 0.00 0.00 0.00 36.38 36.01 1zad s VAL 41 CO 0.33 0.18 1.84 0.00 0.00 0.00 0.00 175.10 177.45 1zad s PRO 43 N 4.63 -1.31 -0.02 0.00 0.02 -1.26 -5.00 135.00 132.06 1zad s PRO 43 Ca 0.82 0.61 -0.30 0.00 0.02 0.00 0.00 61.00 62.15 1zad s PRO 43 Cb -0.35 -1.53 -0.04 0.00 0.02 0.00 0.00 34.50 32.60 1zad s PRO 43 CO 0.35 -3.92 1.19 0.15 -0.33 0.00 0.00 177.00 174.43 1zad s LYS 44 N -4.65 4.38 0.80 5.54 1.02 -1.26 -5.00 119.74 120.57 1zad s LYS 44 Ca 0.68 1.68 -0.12 0.00 0.02 0.00 0.00 55.97 58.24 1zad s LYS 44 Cb -0.22 -3.50 0.07 0.00 -0.52 0.00 0.00 37.83 33.66 1zad s LYS 44 CO 0.63 -0.38 1.10 1.21 -0.92 0.00 0.00 175.35 176.99 1zad s ASN 45 N 1.36 4.51 0.48 2.83 2.47 -1.26 -4.98 114.94 120.35 1zad s ASN 45 Ca 0.56 1.27 0.02 0.00 0.42 0.00 0.00 52.86 55.13 1zad s ASN 45 Cb -0.26 -2.00 -0.01 0.00 -1.45 0.00 0.00 41.25 37.53 1zad s ASN 45 CO 0.24 -1.95 0.05 -0.94 -3.72 0.00 0.00 177.10 170.77 1zad s SER 46 N -3.95 3.72 0.12 -4.21 1.04 -1.20 -5.01 113.70 104.20 1zad s SER 46 Ca 0.61 -1.68 0.23 0.00 0.48 0.00 0.00 55.95 55.59 1zad s SER 46 Cb -0.14 0.57 0.15 0.00 0.10 0.00 0.00 66.02 66.70 1zad s SER 46 CO 0.54 -0.91 1.14 0.18 0.98 0.00 0.00 173.24 175.17 1zad n LEU 47 N -1.17 0.70 -0.03 2.42 7.99 -1.26 -3.88 117.00 121.78 1zad n LEU 47 Ca -0.15 0.19 -0.11 0.00 -0.01 0.00 0.00 56.01 55.92 1zad n LEU 47 Cb 0.66 -0.12 -0.14 0.00 -0.11 0.00 0.00 43.42 43.71 1zad n LEU 47 CO 0.37 -0.07 -0.66 -0.11 -1.51 0.00 0.00 177.39 175.41 1zad n LEU 48 N -2.24 1.17 -4.48 2.23 -0.00 -1.26 -4.93 117.00 107.49 1zad n LEU 48 Ca 0.02 0.32 -0.23 0.00 -0.00 0.00 0.00 56.01 56.12 1zad n LEU 48 Cb 0.47 -0.06 -0.10 0.00 -0.00 0.00 0.00 43.42 43.73 1zad n LEU 48 CO 0.39 0.50 -0.36 -0.69 -0.00 0.00 0.00 177.39 177.23 1zad s VAL 49 N -2.58 1.81 -0.19 1.96 1.01 -1.25 -0.42 120.40 120.74 1zad s VAL 49 Ca -0.09 -2.13 0.00 0.00 0.00 0.00 0.00 61.98 59.76 1zad s VAL 49 Cb 0.08 -2.58 0.05 0.00 0.00 0.00 0.00 36.38 33.93 1zad s VAL 49 CO 0.81 -0.22 -0.06 -0.75 0.00 0.00 0.00 175.10 174.87 1zad s LYS 50 N -3.70 1.61 -0.58 2.72 2.47 0.15 -3.26 119.74 119.14 1zad s LYS 50 Ca 0.31 -0.71 -0.22 0.00 -1.56 0.00 0.00 55.97 53.79 1zad s LYS 50 Cb 0.04 -2.26 0.06 0.00 -1.46 0.00 0.00 37.83 34.21 1zad s LYS 50 CO 0.14 -0.48 0.87 0.71 0.16 0.00 0.00 175.35 176.75 1zad s TYR 51 N 1.52 2.82 -0.46 4.03 1.51 -1.26 -0.88 117.35 124.63 1zad s TYR 51 Ca -0.01 -0.40 -0.10 0.00 -1.01 0.00 0.00 57.07 55.55 1zad s TYR 51 Cb -0.16 -4.04 0.11 0.00 -0.11 0.00 0.00 41.96 37.75 1zad s TYR 51 CO -0.08 -1.39 0.33 0.08 -1.11 0.00 0.00 175.55 173.39 1zad s VAL 52 N 3.62 4.31 0.22 0.71 1.01 -0.92 -4.93 120.40 124.42 1zad s VAL 52 Ca 0.23 -1.64 -0.04 0.00 0.00 0.00 0.00 61.98 60.52 1zad s VAL 52 Cb -0.16 -3.77 -0.05 0.00 0.00 0.00 0.00 36.38 32.39 1zad s VAL 52 CO 0.13 -0.70 0.47 0.00 0.00 0.00 0.00 175.10 175.00 1zad n ASN 55 N -0.37 1.20 -4.65 0.00 6.94 -1.26 -1.09 115.26 116.03 1zad n ASN 55 Ca -0.05 -2.67 -0.35 0.00 -0.02 0.00 0.00 54.58 51.49 1zad n ASN 55 Cb 0.62 -0.35 -0.10 0.00 -2.36 0.00 0.00 39.78 37.59 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 -1.43 4.35 -0.02 5.53 -4.23 -1.26 -4.98 115.64 113.61 1zad s THR 56 Ca 0.24 -0.22 -0.30 0.00 -1.18 0.00 0.00 61.69 60.23 1zad s THR 56 Cb 0.24 -2.87 -0.07 0.00 1.34 0.00 0.00 72.50 71.13 1zad s THR 56 CO -0.04 0.56 1.90 -1.81 -0.54 0.00 0.00 174.62 174.69 1zad s ASP 57 N -0.46 6.40 -0.22 3.99 1.01 -1.26 -1.26 116.67 124.88 1zad s ASP 57 Ca 0.08 2.45 -0.01 0.00 0.71 0.00 0.00 52.55 55.79 1zad s ASP 57 Cb -0.12 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.28 1zad s ASP 57 CO 0.02 -1.12 0.09 0.54 0.21 0.00 0.00 175.17 174.91 1zad n ARG 58 N 7.57 -0.69 0.06 8.23 1.74 0.19 -4.91 116.66 128.84 1zad n ARG 58 Ca 0.20 0.13 -0.15 0.00 -0.77 0.00 0.00 57.85 57.26 1zad n ARG 58 Cb 0.42 -3.36 -0.06 0.00 -1.02 0.00 0.00 32.46 28.44 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11