#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 3.01 0.07 3.23 1.02 -1.26 0.54 119.74 126.36 1zad s LYS 2 Ca 0.00 -0.93 0.04 0.00 0.02 0.00 0.00 55.97 55.10 1zad s LYS 2 Cb 0.00 -3.49 -0.04 0.00 -0.52 0.00 0.00 37.83 33.78 1zad s LYS 2 CO 0.00 -0.52 0.02 0.00 -0.92 0.00 0.00 175.35 173.92 1zad s ASN 4 N -2.20 5.87 0.00 0.00 0.01 -1.26 -1.14 114.94 116.22 1zad s ASN 4 Ca 0.25 -0.24 0.00 0.00 -0.71 0.00 0.00 52.86 52.16 1zad s ASN 4 Cb -0.12 -1.16 0.00 0.00 0.41 0.00 0.00 41.25 40.38 1zad s ASN 4 CO 0.18 -0.45 0.00 0.29 -1.51 0.00 0.00 177.10 175.61 1zad n LYS 5 N -1.62 2.26 -0.33 -0.60 4.01 -0.77 -4.60 118.16 116.50 1zad n LYS 5 Ca 0.00 0.00 0.15 0.00 -0.51 0.00 0.00 58.31 57.95 1zad n LYS 5 Cb 0.58 0.00 0.37 0.00 -0.51 0.00 0.00 35.03 35.47 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 0.70 -9.21 -0.35 6.46 -1.91 -3.38 115.31 107.62 1zad h LEU 6 Ca 0.00 0.09 -0.63 0.00 -0.12 0.00 0.00 57.88 57.22 1zad h LEU 6 Cb 0.00 -0.04 -0.14 0.00 -0.73 0.00 0.00 40.66 39.75 1zad h LEU 6 CO 0.00 0.24 -0.55 -0.69 -0.62 0.00 0.00 178.44 176.82 1zad s VAL 7 N -5.75 4.87 -0.07 1.05 1.01 -1.26 -4.96 120.40 115.28 1zad s VAL 7 Ca -0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 61.98 61.86 1zad s VAL 7 Cb 0.25 -3.17 -0.00 0.00 0.00 0.00 0.00 36.38 33.46 1zad s VAL 7 CO 0.80 0.50 1.07 -2.65 0.00 0.00 0.00 175.10 174.82 1zad n PRO 8 N 3.11 0.16 0.09 2.72 -0.02 -1.26 -3.78 135.00 136.02 1zad n PRO 8 Ca -0.17 -0.56 0.00 0.00 -2.02 0.00 0.00 63.50 60.75 1zad n PRO 8 Cb 0.53 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.99 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 4.87 0.09 -3.91 4.25 0.13 -1.26 -5.08 119.36 118.45 1zad n ILE 9 Ca 0.03 0.03 -0.36 0.00 -1.10 0.00 0.00 62.75 61.35 1zad n ILE 9 Cb 0.01 -0.62 -0.07 0.00 -0.84 0.00 0.00 39.64 38.12 1zad n ILE 9 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1zad s ALA 10 N -2.00 3.73 -0.02 1.51 0.00 -1.25 -5.05 121.76 118.69 1zad s ALA 10 Ca 0.00 -0.68 -0.21 0.00 0.00 0.00 0.00 51.96 51.07 1zad s ALA 10 Cb 0.00 -1.96 0.04 0.00 0.00 0.00 0.00 23.12 21.20 1zad s ALA 10 CO 0.00 0.47 0.46 1.52 0.00 0.00 0.00 175.76 178.21 1zad s TYR 11 N -0.56 -0.37 0.34 0.00 1.13 -1.26 -1.84 117.35 114.79 1zad s TYR 11 Ca 0.12 0.56 0.04 0.00 -1.41 0.00 0.00 57.07 56.38 1zad s TYR 11 Cb -0.12 0.23 -0.01 0.00 -1.10 0.00 0.00 41.96 40.96 1zad s TYR 11 CO 0.02 -0.50 0.13 1.63 -2.51 0.00 0.00 175.55 174.32 1zad n LYS 12 N 1.02 0.62 -2.91 -3.49 4.76 -0.29 -4.90 118.16 112.98 1zad n LYS 12 Ca -0.20 -2.89 -0.41 0.00 -2.87 0.00 0.00 58.31 51.94 1zad n LYS 12 Cb 0.57 1.61 -0.04 0.00 -1.84 0.00 0.00 35.03 35.32 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 -2.85 4.91 -0.43 -0.18 2.01 -1.26 -0.72 115.64 117.13 1zad s THR 13 Ca 0.18 1.62 -0.28 0.00 0.31 0.00 0.00 61.69 63.51 1zad s THR 13 Cb 0.01 -4.13 -0.00 0.00 0.01 0.00 0.00 72.50 68.39 1zad s THR 13 CO 0.13 0.08 1.57 0.00 -0.69 0.00 0.00 174.62 175.71 1zad n PRO 15 N 8.37 -3.38 -1.67 0.00 -0.04 -1.17 -4.29 135.00 132.83 1zad n PRO 15 Ca 0.18 -0.70 -0.47 0.00 -0.04 0.00 0.00 63.50 62.46 1zad n PRO 15 Cb 0.48 -0.92 -0.05 0.00 -0.04 0.00 0.00 33.50 32.97 1zad n PRO 15 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1zad n GLU 16 N -3.82 2.10 0.00 0.54 1.02 -1.26 -1.04 120.64 118.17 1zad n GLU 16 Ca 0.07 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.97 1zad n GLU 16 Cb 0.29 -2.55 0.00 0.00 -0.02 0.00 0.00 31.44 29.16 1zad n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1zad n GLY 17 N 3.77 2.99 3.08 0.62 0.00 -1.26 -4.98 105.19 109.41 1zad n GLY 17 Ca 0.19 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 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 1.94 -0.06 1.61 3.01 -0.21 -4.28 119.74 121.75 1zad s LYS 18 Ca 0.00 -1.62 0.09 0.00 -1.01 0.00 0.00 55.97 53.43 1zad s LYS 18 Cb 0.00 -3.19 0.14 0.00 -1.01 0.00 0.00 37.83 33.78 1zad s LYS 18 CO 0.00 -0.81 1.04 -1.71 0.51 0.00 0.00 175.35 174.38 1zad n ASN 19 N 4.42 1.86 -4.30 2.83 5.15 -1.14 -3.04 115.26 121.05 1zad n ASN 19 Ca -0.05 -2.47 -0.28 0.00 -0.60 0.00 0.00 54.58 51.18 1zad n ASN 19 Cb 0.42 -0.23 -0.15 0.00 -0.53 0.00 0.00 39.78 39.29 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 -1.77 2.15 -0.02 1.20 1.43 -0.55 -4.64 118.68 116.48 1zad s LEU 20 Ca 0.16 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 1zad s LEU 20 Cb 0.14 -1.17 -0.03 0.00 0.03 0.00 0.00 46.19 45.16 1zad s LEU 20 CO 0.01 0.23 -0.11 0.00 0.23 0.00 0.00 176.35 176.72 1zad s TYR 22 N -0.87 0.39 -0.17 0.00 -0.85 0.16 0.99 117.35 116.99 1zad s TYR 22 Ca 0.14 -0.88 -0.04 0.00 -0.52 0.00 0.00 57.07 55.77 1zad s TYR 22 Cb -0.11 -0.27 0.08 0.00 0.38 0.00 0.00 41.96 42.04 1zad s TYR 22 CO 0.04 -0.43 0.24 -1.59 -1.52 0.00 0.00 175.55 172.29 1zad s LYS 23 N -3.81 0.17 -0.08 -3.49 -2.85 0.00 -0.68 119.74 109.01 1zad s LYS 23 Ca 0.05 0.42 -0.20 0.00 -1.00 0.00 0.00 55.97 55.25 1zad s LYS 23 Cb 0.06 -0.73 -0.04 0.00 -2.06 0.00 0.00 37.83 35.06 1zad s LYS 23 CO -0.10 -0.51 0.55 -1.64 0.10 0.00 0.00 175.35 173.75 1zad s MET 24 N 2.36 4.34 -0.19 1.78 -1.94 0.24 -1.99 119.30 123.91 1zad s MET 24 Ca 0.05 0.62 -0.02 0.00 -1.71 0.00 0.00 55.69 54.63 1zad s MET 24 Cb -0.14 -3.41 -0.01 0.00 2.01 0.00 0.00 34.83 33.28 1zad s MET 24 CO -0.11 0.20 -0.08 -0.06 -0.01 0.00 0.00 175.02 174.96 1zad s PHE 25 N 0.42 2.90 0.38 -0.03 0.40 0.15 -2.09 117.98 120.11 1zad s PHE 25 Ca 0.30 -0.88 -0.10 0.00 -0.60 0.00 0.00 56.93 55.65 1zad s PHE 25 Cb -0.16 -2.00 -0.06 0.00 0.51 0.00 0.00 43.02 41.30 1zad s PHE 25 CO 0.14 -0.44 0.73 1.41 0.70 0.00 0.00 175.22 177.76 1zad s MET 26 N 1.06 3.77 0.00 0.44 1.75 -1.26 0.97 119.30 126.04 1zad s MET 26 Ca 0.00 0.41 0.00 0.00 -1.25 0.00 0.00 55.69 54.86 1zad s MET 26 Cb -0.15 -2.43 0.00 0.00 2.84 0.00 0.00 34.83 35.09 1zad s MET 26 CO -0.01 0.02 0.00 -1.33 -0.65 0.00 0.00 175.02 173.05 1zad n MET 27 N -1.16 0.00 -3.68 4.11 2.81 0.53 -4.53 117.12 115.21 1zad n MET 27 Ca 0.02 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.78 1zad n MET 27 Cb 0.54 0.00 -0.07 0.00 -0.71 0.00 0.00 33.22 32.98 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 -0.28 0.05 7.83 0.01 -1.26 -4.84 113.70 115.20 1zad s SER 28 Ca 0.00 0.04 0.19 0.00 1.31 0.00 0.00 55.95 57.50 1zad s SER 28 Cb 0.00 0.41 -0.16 0.00 0.21 0.00 0.00 66.02 66.48 1zad s SER 28 CO 0.00 -0.62 0.72 -0.90 0.41 0.00 0.00 173.24 172.85 1zad n ASP 29 N 0.66 0.59 -0.04 2.44 5.75 -1.26 -3.99 116.55 120.69 1zad n ASP 29 Ca -0.19 0.25 0.24 0.00 -0.01 0.00 0.00 54.79 55.08 1zad n ASP 29 Cb 0.59 0.69 0.61 0.00 -1.03 0.00 0.00 41.12 41.98 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 -3.40 115.31 111.21 1zad h LEU 30 Ca -0.14 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.36 1zad h LEU 30 Cb 1.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 1zad h LEU 30 CO 0.02 0.00 -0.15 0.35 0.09 0.00 0.00 178.44 178.75 1zad n THR 31 N -3.48 0.00 -2.04 0.22 -2.24 -1.26 -5.09 114.28 100.40 1zad n THR 31 Ca 0.14 -1.83 -0.36 0.00 -2.27 0.00 0.00 64.05 59.73 1zad n THR 31 Cb 1.03 -0.31 0.03 0.00 -2.10 0.00 0.00 70.33 68.97 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 -2.31 2.67 0.97 2.28 1.09 -1.26 -5.01 121.20 119.62 1zad s ILE 32 Ca 0.40 0.44 -0.16 0.00 -1.10 0.00 0.00 60.65 60.23 1zad s ILE 32 Cb -0.03 -3.19 0.25 0.00 -1.06 0.00 0.00 42.46 38.42 1zad s ILE 32 CO 0.26 -0.07 0.73 -0.81 -0.10 0.00 0.00 174.94 174.95 1zad n PRO 33 N -1.33 -3.23 -0.02 2.79 -0.04 -1.26 -4.85 135.00 127.06 1zad n PRO 33 Ca 0.12 -1.19 -0.04 0.00 -0.04 0.00 0.00 63.50 62.36 1zad n PRO 33 Cb 0.49 -1.27 -0.02 0.00 -0.04 0.00 0.00 33.50 32.66 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 -4.58 0.22 -3.88 0.52 0.24 -0.89 -4.89 118.33 105.06 1zad n VAL 34 Ca 0.11 -0.07 -0.10 0.00 -2.04 0.00 0.00 64.34 62.24 1zad n VAL 34 Cb 0.43 -1.18 -0.09 0.00 -1.47 0.00 0.00 33.84 31.53 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 -2.07 0.60 -0.28 7.34 -2.85 -0.98 -5.03 119.74 116.46 1zad s LYS 35 Ca -0.05 -0.58 -0.18 0.00 -1.00 0.00 0.00 55.97 54.15 1zad s LYS 35 Cb 0.02 0.24 0.12 0.00 -2.06 0.00 0.00 37.83 36.15 1zad s LYS 35 CO 0.08 -0.16 0.90 -0.98 0.10 0.00 0.00 175.35 175.29 1zad s ARG 36 N -2.18 0.52 0.00 1.78 1.70 -1.26 0.82 118.95 120.33 1zad s ARG 36 Ca -0.08 0.81 0.00 0.00 -0.47 0.00 0.00 55.73 55.99 1zad s ARG 36 Cb -0.03 0.15 0.00 0.00 -0.57 0.00 0.00 34.95 34.50 1zad s ARG 36 CO -0.02 -0.09 0.00 0.41 -1.08 0.00 0.00 175.30 174.51 1zad n GLY 37 N 3.48 3.24 3.98 3.88 0.00 0.14 -4.49 105.19 115.43 1zad n GLY 37 Ca -0.17 -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 -2.25 0.00 -0.07 0.00 2.07 0.28 -4.84 121.20 116.40 1zad s ILE 39 Ca 0.45 -0.72 0.03 0.00 -1.41 0.00 0.00 60.65 59.00 1zad s ILE 39 Cb -0.10 -2.73 -0.06 0.00 0.13 0.00 0.00 42.46 39.71 1zad s ILE 39 CO 0.32 0.00 -0.02 -0.67 -1.91 0.00 0.00 174.94 172.66 1zad n ASP 40 N -1.14 3.47 -3.84 4.50 2.03 -1.26 -1.48 116.55 118.83 1zad n ASP 40 Ca -0.05 -0.02 -0.18 0.00 0.52 0.00 0.00 54.79 55.06 1zad n ASP 40 Cb 0.60 0.28 -0.16 0.00 -0.72 0.00 0.00 41.12 41.12 1zad n ASP 40 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1zad s VAL 41 N -2.15 0.28 -0.12 5.18 0.11 -1.26 -4.90 120.40 117.54 1zad s VAL 41 Ca -0.06 0.02 -0.29 0.00 -2.93 0.00 0.00 61.98 58.72 1zad s VAL 41 Cb 0.02 -0.35 -0.05 0.00 -1.53 0.00 0.00 36.38 34.46 1zad s VAL 41 CO 0.21 0.17 1.89 0.00 -3.33 0.00 0.00 175.10 174.04 1zad n PRO 43 N 7.86 -4.23 -2.48 0.00 -0.02 -1.26 -4.97 135.00 129.91 1zad n PRO 43 Ca 0.22 -1.25 -0.42 0.00 -2.02 0.00 0.00 63.50 60.03 1zad n PRO 43 Cb 0.44 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 1zad n PRO 43 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1zad s LYS 44 N -4.69 4.43 0.66 -0.52 1.02 -1.26 -5.01 119.74 114.37 1zad s LYS 44 Ca 0.61 1.69 -0.12 0.00 0.02 0.00 0.00 55.97 58.16 1zad s LYS 44 Cb -0.12 -3.41 -0.01 0.00 -0.52 0.00 0.00 37.83 33.77 1zad s LYS 44 CO 0.52 -0.27 1.05 1.21 -0.92 0.00 0.00 175.35 176.94 1zad s ASN 45 N 1.15 5.57 0.36 2.83 2.47 -1.26 -4.98 114.94 121.09 1zad s ASN 45 Ca 0.57 1.65 0.06 0.00 0.42 0.00 0.00 52.86 55.56 1zad s ASN 45 Cb -0.27 -2.50 -0.07 0.00 -1.45 0.00 0.00 41.25 36.96 1zad s ASN 45 CO 0.27 -1.31 0.03 -0.94 -3.72 0.00 0.00 177.10 171.43 1zad s SER 46 N -3.55 3.13 0.17 -4.21 1.04 -1.19 -5.04 113.70 104.05 1zad s SER 46 Ca 0.59 -1.36 0.23 0.00 0.48 0.00 0.00 55.95 55.89 1zad s SER 46 Cb -0.14 -0.24 0.06 0.00 0.10 0.00 0.00 66.02 65.80 1zad s SER 46 CO 0.50 -0.51 1.08 -0.11 0.98 0.00 0.00 173.24 175.17 1zad n LEU 47 N -0.82 0.78 0.05 2.42 -0.00 -1.26 -3.75 117.00 114.41 1zad n LEU 47 Ca -0.04 0.27 0.11 0.00 -0.00 0.00 0.00 56.01 56.35 1zad n LEU 47 Cb 0.67 -0.08 -0.09 0.00 -0.00 0.00 0.00 43.42 43.92 1zad n LEU 47 CO 0.45 -0.14 -0.38 -0.11 -0.00 0.00 0.00 177.39 177.22 1zad n LEU 48 N -2.49 0.43 -4.21 -1.96 -0.00 -1.26 -4.94 117.00 102.57 1zad n LEU 48 Ca 0.01 0.17 -0.14 0.00 -0.00 0.00 0.00 56.01 56.04 1zad n LEU 48 Cb 0.52 -0.02 -0.10 0.00 -0.00 0.00 0.00 43.42 43.81 1zad n LEU 48 CO 0.40 -0.08 -0.41 -0.69 -0.00 0.00 0.00 177.39 176.60 1zad s VAL 49 N -3.42 1.04 -0.15 1.96 1.01 -1.25 -0.34 120.40 119.25 1zad s VAL 49 Ca -0.04 -1.85 0.01 0.00 0.00 0.00 0.00 61.98 60.10 1zad s VAL 49 Cb 0.12 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.90 1zad s VAL 49 CO 0.85 -0.66 -0.18 -0.75 0.00 0.00 0.00 175.10 174.36 1zad s LYS 50 N -3.29 2.69 -0.32 2.72 2.47 0.27 -3.16 119.74 121.12 1zad s LYS 50 Ca 0.11 -0.72 -0.15 0.00 -1.56 0.00 0.00 55.97 53.65 1zad s LYS 50 Cb 0.00 -2.30 -0.02 0.00 -1.46 0.00 0.00 37.83 34.05 1zad s LYS 50 CO -0.00 -0.14 0.35 0.71 0.16 0.00 0.00 175.35 176.43 1zad s TYR 51 N 1.16 3.22 -0.42 4.03 1.51 -1.26 0.31 117.35 125.90 1zad s TYR 51 Ca -0.00 0.08 -0.01 0.00 -1.01 0.00 0.00 57.07 56.12 1zad s TYR 51 Cb -0.14 -2.62 0.11 0.00 -0.11 0.00 0.00 41.96 39.20 1zad s TYR 51 CO -0.08 -0.36 0.20 0.08 -1.11 0.00 0.00 175.55 174.28 1zad s VAL 52 N 2.00 3.11 0.16 0.71 1.01 -0.84 -4.97 120.40 121.57 1zad s VAL 52 Ca 0.12 -2.25 -0.06 0.00 0.00 0.00 0.00 61.98 59.79 1zad s VAL 52 Cb -0.16 -3.15 -0.06 0.00 0.00 0.00 0.00 36.38 33.01 1zad s VAL 52 CO 0.11 -0.70 0.41 0.00 0.00 0.00 0.00 175.10 174.93 1zad n ASN 55 N -0.65 0.81 -4.70 0.00 6.94 -1.26 -0.94 115.26 115.46 1zad n ASN 55 Ca -0.03 -2.36 -0.35 0.00 -0.02 0.00 0.00 54.58 51.82 1zad n ASN 55 Cb 0.61 -0.29 -0.09 0.00 -2.36 0.00 0.00 39.78 37.64 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 -0.79 4.65 -0.02 5.53 -4.23 -1.26 -4.97 115.64 114.56 1zad s THR 56 Ca 0.18 -0.11 -0.30 0.00 -1.18 0.00 0.00 61.69 60.28 1zad s THR 56 Cb 0.18 -3.01 -0.08 0.00 1.34 0.00 0.00 72.50 70.94 1zad s THR 56 CO -0.04 0.57 1.90 -1.81 -0.54 0.00 0.00 174.62 174.70 1zad s ASP 57 N -0.55 6.42 -0.37 3.99 1.01 -1.26 -1.33 116.67 124.58 1zad s ASP 57 Ca 0.10 2.46 -0.02 0.00 0.71 0.00 0.00 52.55 55.81 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 -1.11 0.21 0.54 0.21 0.00 0.00 175.17 175.05 1zad n ARG 58 N 7.55 -1.54 0.06 8.23 1.74 0.24 -4.91 116.66 128.03 1zad n ARG 58 Ca 0.20 0.22 -0.15 0.00 -0.77 0.00 0.00 57.85 57.35 1zad n ARG 58 Cb 0.42 -3.55 -0.06 0.00 -1.02 0.00 0.00 32.46 28.25 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11