#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 3.52 0.14 3.23 1.02 -1.26 0.71 119.74 127.10 1zad s LYS 2 Ca 0.00 -0.58 0.08 0.00 0.02 0.00 0.00 55.97 55.49 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 -0.31 -0.10 0.00 -0.92 0.00 0.00 175.35 174.03 1zad s ASN 4 N -2.50 5.49 0.01 0.00 -0.87 -1.26 -1.31 114.94 114.50 1zad s ASN 4 Ca 0.23 -0.48 0.00 0.00 -1.57 0.00 0.00 52.86 51.04 1zad s ASN 4 Cb -0.10 -0.78 0.00 0.00 -0.02 0.00 0.00 41.25 40.35 1zad s ASN 4 CO 0.14 -0.62 0.00 0.29 -2.57 0.00 0.00 177.10 174.35 1zad n LYS 5 N -1.66 2.25 0.23 -0.60 5.02 -0.99 -4.62 118.16 117.79 1zad n LYS 5 Ca 0.04 0.00 0.18 0.00 -2.02 0.00 0.00 58.31 56.51 1zad n LYS 5 Cb 0.60 0.00 0.85 0.00 -0.02 0.00 0.00 35.03 36.46 1zad n LYS 5 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1zad h LEU 6 N 0.00 0.00 -8.25 -0.35 5.85 -1.91 -3.36 115.31 107.29 1zad h LEU 6 Ca 0.00 0.00 -0.66 0.00 0.84 0.00 0.00 57.88 58.06 1zad h LEU 6 Cb 0.00 0.00 -0.31 0.00 0.37 0.00 0.00 40.66 40.72 1zad h LEU 6 CO 0.00 0.00 -0.77 -0.69 -0.34 0.00 0.00 178.44 176.64 1zad s VAL 7 N -4.46 2.88 0.00 1.05 1.01 -1.26 -5.01 120.40 114.61 1zad s VAL 7 Ca -0.04 -0.72 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1zad s VAL 7 Cb 0.14 -2.31 0.00 0.00 0.00 0.00 0.00 36.38 34.20 1zad s VAL 7 CO 0.47 0.42 0.33 -2.65 0.00 0.00 0.00 175.10 173.67 1zad n PRO 8 N 4.72 0.00 0.00 2.72 -0.02 -1.26 -3.19 135.00 137.98 1zad n PRO 8 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1zad n PRO 8 Cb 0.50 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 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 2.58 0.00 -4.65 4.25 0.00 -1.26 -5.05 119.36 115.23 1zad n ILE 9 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 62.75 62.42 1zad n ILE 9 Cb 0.00 -0.67 -0.13 0.00 0.00 0.00 0.00 39.64 38.84 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 -1.78 2.85 -0.05 1.51 0.00 -1.19 -5.08 121.76 118.01 1zad s ALA 10 Ca 0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 51.96 50.84 1zad s ALA 10 Cb 0.00 -1.27 0.05 0.00 0.00 0.00 0.00 23.12 21.90 1zad s ALA 10 CO 0.00 0.40 0.51 1.52 0.00 0.00 0.00 175.76 178.19 1zad s TYR 11 N -0.20 -0.45 0.15 0.00 1.13 -1.26 -2.34 117.35 114.38 1zad s TYR 11 Ca 0.02 0.79 0.02 0.00 -1.41 0.00 0.00 57.07 56.49 1zad s TYR 11 Cb -0.13 0.26 -0.01 0.00 -1.10 0.00 0.00 41.96 40.98 1zad s TYR 11 CO 0.03 -0.49 0.08 0.36 -2.51 0.00 0.00 175.55 173.01 1zad n LYS 12 N 1.21 0.58 -2.92 -3.49 2.85 -0.43 -4.90 118.16 111.06 1zad n LYS 12 Ca -0.20 -1.36 -0.41 0.00 -1.05 0.00 0.00 58.31 55.29 1zad n LYS 12 Cb 0.56 0.86 -0.04 0.00 -0.65 0.00 0.00 35.03 35.77 1zad n LYS 12 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1zad s THR 13 N -2.28 4.93 -0.35 0.58 2.01 -1.26 -0.24 115.64 119.03 1zad s THR 13 Ca 0.11 1.62 -0.28 0.00 0.31 0.00 0.00 61.69 63.45 1zad s THR 13 Cb 0.01 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.36 1zad s THR 13 CO 0.08 0.12 1.91 0.00 -0.69 0.00 0.00 174.62 176.03 1zad n PRO 15 N 8.60 -3.15 -1.62 0.00 -0.04 -1.20 -4.34 135.00 133.26 1zad n PRO 15 Ca 0.25 -0.73 -0.48 0.00 -0.04 0.00 0.00 63.50 62.50 1zad n PRO 15 Cb 0.48 -0.89 -0.05 0.00 -0.04 0.00 0.00 33.50 33.00 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 -3.71 1.94 0.00 0.54 1.02 -1.26 -0.97 120.64 118.20 1zad n GLU 16 Ca 0.07 0.65 0.00 0.00 -0.02 0.00 0.00 57.16 57.86 1zad n GLU 16 Cb 0.29 -2.73 0.00 0.00 -0.02 0.00 0.00 31.44 28.98 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 5.10 1.98 2.89 0.62 0.00 -1.26 -5.03 105.19 109.49 1zad n GLY 17 Ca 0.28 -0.68 -0.29 0.00 0.00 0.00 0.00 46.02 45.32 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 1.43 -0.02 1.61 1.02 -0.14 -4.04 119.74 119.60 1zad s LYS 18 Ca 0.00 -0.74 0.06 0.00 0.02 0.00 0.00 55.97 55.31 1zad s LYS 18 Cb 0.00 -2.33 -0.09 0.00 -0.52 0.00 0.00 37.83 34.89 1zad s LYS 18 CO 0.00 -0.54 0.11 -1.71 -0.92 0.00 0.00 175.35 172.28 1zad n ASN 19 N 4.80 3.56 -4.92 2.83 5.15 -0.93 -3.21 115.26 122.53 1zad n ASN 19 Ca -0.12 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 53.59 1zad n ASN 19 Cb 0.46 1.11 -0.03 0.00 -0.53 0.00 0.00 39.78 40.79 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 -3.71 4.14 0.08 1.20 1.43 0.24 -4.35 118.68 117.71 1zad s LEU 20 Ca -0.02 0.50 0.08 0.00 -1.03 0.00 0.00 54.13 53.66 1zad s LEU 20 Cb 0.03 -3.30 -0.04 0.00 0.03 0.00 0.00 46.19 42.92 1zad s LEU 20 CO 0.26 -0.13 -0.20 0.00 0.23 0.00 0.00 176.35 176.50 1zad s TYR 22 N -1.01 0.31 -0.17 0.00 -0.85 0.13 0.84 117.35 116.60 1zad s TYR 22 Ca 0.15 -0.77 -0.04 0.00 -0.52 0.00 0.00 57.07 55.89 1zad s TYR 22 Cb -0.10 -0.20 0.08 0.00 0.38 0.00 0.00 41.96 42.11 1zad s TYR 22 CO 0.07 -0.46 0.24 -1.59 -1.52 0.00 0.00 175.55 172.29 1zad s LYS 23 N -3.75 0.17 -0.05 -3.49 0.00 -0.06 -0.76 119.74 111.80 1zad s LYS 23 Ca 0.05 0.42 -0.20 0.00 0.00 0.00 0.00 55.97 56.24 1zad s LYS 23 Cb 0.06 -0.72 -0.05 0.00 0.00 0.00 0.00 37.83 37.12 1zad s LYS 23 CO -0.10 -0.51 0.58 -1.64 0.00 0.00 0.00 175.35 173.68 1zad s MET 24 N 2.36 4.34 -0.21 1.78 -1.94 0.28 -2.20 119.30 123.70 1zad s MET 24 Ca 0.05 0.67 -0.02 0.00 -1.71 0.00 0.00 55.69 54.68 1zad s MET 24 Cb -0.14 -3.39 0.01 0.00 2.01 0.00 0.00 34.83 33.32 1zad s MET 24 CO -0.11 0.25 -0.10 -0.06 -0.01 0.00 0.00 175.02 174.99 1zad s PHE 25 N 0.24 2.91 0.42 -0.03 0.40 0.09 -1.82 117.98 120.19 1zad s PHE 25 Ca 0.31 -1.27 -0.13 0.00 -0.60 0.00 0.00 56.93 55.24 1zad s PHE 25 Cb -0.17 -2.03 -0.07 0.00 0.51 0.00 0.00 43.02 41.25 1zad s PHE 25 CO 0.15 -0.67 0.82 1.41 0.70 0.00 0.00 175.22 177.64 1zad s MET 26 N 1.39 3.85 0.00 0.44 1.75 -1.26 0.19 119.30 125.66 1zad s MET 26 Ca 0.05 0.62 0.00 0.00 -1.25 0.00 0.00 55.69 55.11 1zad s MET 26 Cb -0.14 -2.33 0.00 0.00 2.84 0.00 0.00 34.83 35.20 1zad s MET 26 CO -0.07 -0.07 0.00 -1.33 -0.65 0.00 0.00 175.02 172.90 1zad n MET 27 N -1.25 0.00 -3.99 4.11 2.81 0.48 -4.51 117.12 114.78 1zad n MET 27 Ca 0.04 0.00 -0.09 0.00 -1.81 0.00 0.00 57.70 55.84 1zad n MET 27 Cb 0.54 0.00 -0.10 0.00 -0.71 0.00 0.00 33.22 32.95 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 -1.01 0.28 -0.07 7.83 0.01 -1.26 -4.84 113.70 114.65 1zad s SER 28 Ca 0.00 -0.64 0.20 0.00 1.31 0.00 0.00 55.95 56.82 1zad s SER 28 Cb 0.00 0.18 -0.30 0.00 0.21 0.00 0.00 66.02 66.11 1zad s SER 28 CO 0.00 -0.47 0.35 -0.90 0.41 0.00 0.00 173.24 172.64 1zad n ASP 29 N 0.86 0.31 -0.12 2.44 5.75 -1.26 -4.26 116.55 120.28 1zad n ASP 29 Ca -0.19 0.00 0.27 0.00 -0.01 0.00 0.00 54.79 54.85 1zad n ASP 29 Cb 0.58 1.70 0.60 0.00 -1.03 0.00 0.00 41.12 42.97 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 -3.40 115.31 111.22 1zad h LEU 30 Ca -0.13 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.53 1zad h LEU 30 Cb 1.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1zad h LEU 30 CO 0.01 0.00 -0.11 0.35 0.09 0.00 0.00 178.44 178.77 1zad n THR 31 N -3.51 0.00 -2.17 0.22 -2.24 -1.26 -5.09 114.28 100.23 1zad n THR 31 Ca 0.18 -1.22 -0.37 0.00 -2.27 0.00 0.00 64.05 60.37 1zad n THR 31 Cb 1.17 -0.42 -0.00 0.00 -2.10 0.00 0.00 70.33 68.98 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 -1.40 2.91 0.00 2.28 1.09 -1.26 -5.02 121.20 119.80 1zad s ILE 32 Ca 0.25 0.69 0.00 0.00 -1.10 0.00 0.00 60.65 60.49 1zad s ILE 32 Cb -0.02 -3.35 0.00 0.00 -1.06 0.00 0.00 42.46 38.03 1zad s ILE 32 CO 0.16 -0.00 0.00 -0.81 -0.10 0.00 0.00 174.94 174.18 1zad n PRO 33 N -0.56 -0.89 0.00 2.79 -0.04 -1.26 -4.91 135.00 130.13 1zad n PRO 33 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1zad n PRO 33 Cb 0.47 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.93 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 -2.26 0.00 -3.83 0.52 0.24 -0.75 -4.88 118.33 107.37 1zad n VAL 34 Ca 0.00 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.19 1zad n VAL 34 Cb 0.00 -0.89 -0.08 0.00 -1.47 0.00 0.00 33.84 31.39 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 -1.98 0.69 -0.28 7.34 2.47 -0.97 -5.03 119.74 121.98 1zad s LYS 35 Ca 0.00 -0.57 -0.17 0.00 -1.56 0.00 0.00 55.97 53.67 1zad s LYS 35 Cb 0.00 0.29 0.12 0.00 -1.46 0.00 0.00 37.83 36.78 1zad s LYS 35 CO 0.00 -0.20 0.88 -0.98 0.16 0.00 0.00 175.35 175.21 1zad s ARG 36 N -2.38 0.51 0.00 4.03 1.70 -1.26 0.98 118.95 122.53 1zad s ARG 36 Ca -0.06 0.86 0.00 0.00 -0.47 0.00 0.00 55.73 56.05 1zad s ARG 36 Cb -0.02 0.12 0.00 0.00 -0.57 0.00 0.00 34.95 34.48 1zad s ARG 36 CO -0.03 -0.10 0.00 0.41 -1.08 0.00 0.00 175.30 174.50 1zad n GLY 37 N 3.76 4.20 3.76 3.88 0.00 0.06 -4.49 105.19 116.36 1zad n GLY 37 Ca -0.18 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.07 0.00 2.07 0.25 -4.86 121.20 116.42 1zad s ILE 39 Ca 0.32 -0.98 0.03 0.00 -1.41 0.00 0.00 60.65 58.61 1zad s ILE 39 Cb -0.07 -2.79 -0.06 0.00 0.13 0.00 0.00 42.46 39.67 1zad s ILE 39 CO 0.23 0.00 -0.03 -0.67 -1.91 0.00 0.00 174.94 172.56 1zad n ASP 40 N -1.30 3.48 -3.82 4.50 2.03 -1.26 -0.59 116.55 119.59 1zad n ASP 40 Ca -0.08 -0.02 -0.18 0.00 0.52 0.00 0.00 54.79 55.03 1zad n ASP 40 Cb 0.60 0.21 -0.16 0.00 -0.72 0.00 0.00 41.12 41.04 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 -2.15 0.24 -0.04 5.18 1.01 -1.26 -4.86 120.40 118.53 1zad s VAL 41 Ca -0.07 0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.69 1zad s VAL 41 Cb 0.02 -0.34 -0.07 0.00 0.00 0.00 0.00 36.38 35.99 1zad s VAL 41 CO 0.20 0.17 1.80 0.00 0.00 0.00 0.00 175.10 177.28 1zad s PRO 43 N 4.37 -1.34 -0.03 0.00 0.02 -1.26 -5.00 135.00 131.76 1zad s PRO 43 Ca 0.81 0.56 -0.30 0.00 0.02 0.00 0.00 61.00 62.09 1zad s PRO 43 Cb -0.36 -1.53 -0.04 0.00 0.02 0.00 0.00 34.50 32.59 1zad s PRO 43 CO 0.35 -3.93 1.20 0.15 -0.33 0.00 0.00 177.00 174.43 1zad s LYS 44 N -4.70 4.37 0.80 5.54 1.02 -1.26 -5.00 119.74 120.52 1zad s LYS 44 Ca 0.68 1.69 -0.12 0.00 0.02 0.00 0.00 55.97 58.25 1zad s LYS 44 Cb -0.21 -3.51 0.07 0.00 -0.52 0.00 0.00 37.83 33.66 1zad s LYS 44 CO 0.62 -0.40 1.10 1.21 -0.92 0.00 0.00 175.35 176.96 1zad s ASN 45 N 1.40 4.45 0.49 2.83 2.47 -1.26 -4.98 114.94 120.34 1zad s ASN 45 Ca 0.57 1.26 0.02 0.00 0.42 0.00 0.00 52.86 55.13 1zad s ASN 45 Cb -0.26 -1.98 -0.02 0.00 -1.45 0.00 0.00 41.25 37.54 1zad s ASN 45 CO 0.24 -1.99 0.02 -0.94 -3.72 0.00 0.00 177.10 170.70 1zad s SER 46 N -3.94 3.95 0.10 -4.21 1.04 -1.20 -5.01 113.70 104.43 1zad s SER 46 Ca 0.61 -1.65 0.23 0.00 0.48 0.00 0.00 55.95 55.62 1zad s SER 46 Cb -0.14 0.49 0.13 0.00 0.10 0.00 0.00 66.02 66.60 1zad s SER 46 CO 0.54 -0.85 1.12 -0.11 0.98 0.00 0.00 173.24 174.92 1zad n LEU 47 N -1.21 0.67 0.01 2.42 7.94 -1.26 -3.81 117.00 121.76 1zad n LEU 47 Ca -0.17 0.14 0.02 0.00 -1.11 0.00 0.00 56.01 54.90 1zad n LEU 47 Cb 0.67 -0.12 -0.11 0.00 0.53 0.00 0.00 43.42 44.39 1zad n LEU 47 CO 0.38 -0.04 -0.52 0.18 -1.11 0.00 0.00 177.39 176.27 1zad n LEU 48 N -2.18 0.50 -4.35 -1.96 7.99 -1.26 -4.94 117.00 110.80 1zad n LEU 48 Ca 0.02 0.21 -0.18 0.00 -0.01 0.00 0.00 56.01 56.05 1zad n LEU 48 Cb 0.47 0.12 -0.10 0.00 -0.11 0.00 0.00 43.42 43.79 1zad n LEU 48 CO 0.39 0.13 -0.34 -0.69 -1.51 0.00 0.00 177.39 175.37 1zad s VAL 49 N -3.04 1.16 -0.17 4.08 1.01 -1.25 -0.38 120.40 121.81 1zad s VAL 49 Ca -0.05 -2.05 -0.00 0.00 0.00 0.00 0.00 61.98 59.88 1zad s VAL 49 Cb 0.10 -2.34 0.04 0.00 0.00 0.00 0.00 36.38 34.17 1zad s VAL 49 CO 0.84 -0.34 -0.08 -0.75 0.00 0.00 0.00 175.10 174.77 1zad s LYS 50 N -3.83 1.69 -0.61 2.72 2.47 0.13 -3.24 119.74 119.07 1zad s LYS 50 Ca 0.28 -0.57 -0.21 0.00 -1.56 0.00 0.00 55.97 53.91 1zad s LYS 50 Cb 0.05 -2.07 0.08 0.00 -1.46 0.00 0.00 37.83 34.43 1zad s LYS 50 CO 0.09 -0.39 0.81 0.71 0.16 0.00 0.00 175.35 176.73 1zad s TYR 51 N 1.57 2.87 -0.52 4.03 1.51 -1.26 -0.74 117.35 124.81 1zad s TYR 51 Ca 0.01 -0.72 -0.14 0.00 -1.01 0.00 0.00 57.07 55.21 1zad s TYR 51 Cb -0.15 -4.08 0.13 0.00 -0.11 0.00 0.00 41.96 37.75 1zad s TYR 51 CO -0.08 -1.41 0.45 0.08 -1.11 0.00 0.00 175.55 173.48 1zad s VAL 52 N 3.27 4.89 0.21 0.71 1.01 -0.94 -4.93 120.40 124.62 1zad s VAL 52 Ca 0.17 -1.59 -0.04 0.00 0.00 0.00 0.00 61.98 60.52 1zad s VAL 52 Cb -0.20 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 31.97 1zad s VAL 52 CO 0.09 -0.84 0.45 0.00 0.00 0.00 0.00 175.10 174.80 1zad n ASN 55 N -0.40 0.96 -4.70 0.00 0.23 -1.26 -0.90 115.26 109.19 1zad n ASN 55 Ca -0.03 -2.48 -0.35 0.00 -0.53 0.00 0.00 54.58 51.19 1zad n ASN 55 Cb 0.61 -0.31 -0.09 0.00 -2.08 0.00 0.00 39.78 37.91 1zad n ASN 55 CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 1zad s THR 56 N -1.06 4.64 -0.01 5.53 -4.23 -1.26 -4.96 115.64 114.29 1zad s THR 56 Ca 0.19 -0.11 -0.30 0.00 -1.18 0.00 0.00 61.69 60.29 1zad s THR 56 Cb 0.19 -3.00 -0.08 0.00 1.34 0.00 0.00 72.50 70.96 1zad s THR 56 CO -0.04 0.57 1.89 -1.81 -0.54 0.00 0.00 174.62 174.70 1zad s ASP 57 N -0.60 6.44 -0.39 3.99 1.01 -1.26 -1.35 116.67 124.51 1zad s ASP 57 Ca 0.11 2.48 -0.02 0.00 0.71 0.00 0.00 52.55 55.83 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 -1.08 0.23 0.54 0.21 0.00 0.00 175.17 175.09 1zad n ARG 58 N 7.52 -1.69 0.07 8.23 1.74 0.26 -4.91 116.66 127.87 1zad n ARG 58 Ca 0.20 0.24 -0.14 0.00 -0.77 0.00 0.00 57.85 57.37 1zad n ARG 58 Cb 0.42 -3.59 -0.05 0.00 -1.02 0.00 0.00 32.46 28.22 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11