#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 3.22 -0.01 3.23 1.02 -1.26 0.37 119.74 126.31 1zad s LYS 2 Ca 0.00 -0.76 0.03 0.00 0.02 0.00 0.00 55.97 55.27 1zad s LYS 2 Cb 0.00 -3.25 -0.03 0.00 -0.52 0.00 0.00 37.83 34.03 1zad s LYS 2 CO 0.00 -0.34 -0.09 0.00 -0.92 0.00 0.00 175.35 173.99 1zad s ASN 4 N -1.20 5.87 0.20 0.00 0.01 -1.26 -1.08 114.94 117.47 1zad s ASN 4 Ca 0.15 0.07 0.00 0.00 -0.71 0.00 0.00 52.86 52.37 1zad s ASN 4 Cb -0.11 -1.38 0.00 0.00 0.41 0.00 0.00 41.25 40.17 1zad s ASN 4 CO 0.05 -0.61 0.00 0.29 -1.51 0.00 0.00 177.10 175.32 1zad n LYS 5 N -1.90 1.34 -0.13 -0.60 4.01 0.04 -4.61 118.16 116.30 1zad n LYS 5 Ca 0.01 0.00 0.28 0.00 -0.51 0.00 0.00 58.31 58.09 1zad n LYS 5 Cb 0.58 0.00 0.70 0.00 -0.51 0.00 0.00 35.03 35.80 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 0.00 -8.85 -0.35 5.85 -1.89 -3.36 115.31 106.72 1zad h LEU 6 Ca 0.00 0.00 -0.65 0.00 0.84 0.00 0.00 57.88 58.07 1zad h LEU 6 Cb 0.00 0.00 -0.22 0.00 0.37 0.00 0.00 40.66 40.81 1zad h LEU 6 CO 0.00 0.00 -0.69 -0.69 -0.34 0.00 0.00 178.44 176.72 1zad s VAL 7 N -4.76 3.72 -0.09 1.05 1.01 -1.26 -5.00 120.40 115.07 1zad s VAL 7 Ca -0.04 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1zad s VAL 7 Cb 0.19 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1zad s VAL 7 CO 0.66 0.52 1.03 -2.65 0.00 0.00 0.00 175.10 174.66 1zad n PRO 8 N 3.33 0.24 0.00 2.72 -0.02 -1.26 -3.49 135.00 136.52 1zad n PRO 8 Ca -0.18 -0.47 0.00 0.00 -2.02 0.00 0.00 63.50 60.83 1zad n PRO 8 Cb 0.53 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 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 4.36 0.00 -3.67 4.25 0.00 -1.26 -5.08 119.36 117.96 1zad n ILE 9 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 62.75 62.44 1zad n ILE 9 Cb 0.03 -0.37 -0.09 0.00 0.00 0.00 0.00 39.64 39.22 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 -2.00 3.64 0.12 1.51 0.00 -1.23 -5.03 121.76 118.76 1zad s ALA 10 Ca 0.00 -0.79 -0.11 0.00 0.00 0.00 0.00 51.96 51.07 1zad s ALA 10 Cb 0.00 -2.29 0.01 0.00 0.00 0.00 0.00 23.12 20.84 1zad s ALA 10 CO 0.00 -0.06 0.27 1.52 0.00 0.00 0.00 175.76 177.49 1zad s TYR 11 N 0.80 0.13 0.25 0.00 1.13 -1.26 -0.78 117.35 117.62 1zad s TYR 11 Ca 0.09 -0.52 0.01 0.00 -1.41 0.00 0.00 57.07 55.24 1zad s TYR 11 Cb -0.13 0.02 -0.00 0.00 -1.10 0.00 0.00 41.96 40.75 1zad s TYR 11 CO 0.02 -0.63 0.30 0.36 -2.51 0.00 0.00 175.55 173.09 1zad n LYS 12 N -0.14 0.43 -2.91 -3.49 0.00 -0.24 -4.94 118.16 106.87 1zad n LYS 12 Ca -0.13 -2.21 -0.41 0.00 -0.00 0.00 0.00 58.31 55.56 1zad n LYS 12 Cb 0.63 1.99 -0.04 0.00 -0.00 0.00 0.00 35.03 37.61 1zad n LYS 12 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1zad s THR 13 N -2.82 4.89 -0.51 0.58 2.01 -1.26 -0.58 115.64 117.95 1zad s THR 13 Ca 0.24 1.60 -0.27 0.00 0.31 0.00 0.00 61.69 63.57 1zad s THR 13 Cb 0.00 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.37 1zad s THR 13 CO 0.17 0.03 1.76 0.00 -0.69 0.00 0.00 174.62 175.90 1zad n PRO 15 N 8.83 -3.44 -1.67 0.00 -0.04 -1.19 -4.31 135.00 133.18 1zad n PRO 15 Ca 0.20 -0.72 -0.47 0.00 -0.04 0.00 0.00 63.50 62.47 1zad n PRO 15 Cb 0.50 -0.93 -0.04 0.00 -0.04 0.00 0.00 33.50 32.98 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 -3.89 2.11 0.00 0.54 4.71 -1.26 -1.36 120.64 121.50 1zad n GLU 16 Ca 0.07 0.77 0.00 0.00 -0.01 0.00 0.00 57.16 57.98 1zad n GLU 16 Cb 0.30 -2.56 0.00 0.00 -1.01 0.00 0.00 31.44 28.17 1zad n GLU 16 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1zad n GLY 17 N 3.79 3.09 3.15 0.62 0.00 -1.26 -4.97 105.19 109.60 1zad n GLY 17 Ca 0.19 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 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 2.16 -0.17 1.61 1.02 -0.46 -4.24 119.74 119.66 1zad s LYS 18 Ca 0.00 -1.71 0.16 0.00 0.02 0.00 0.00 55.97 54.43 1zad s LYS 18 Cb 0.00 -3.60 0.38 0.00 -0.52 0.00 0.00 37.83 34.09 1zad s LYS 18 CO 0.00 -1.02 1.24 -1.71 -0.92 0.00 0.00 175.35 172.94 1zad n ASN 19 N 4.66 2.41 -4.09 2.83 5.15 -1.04 -3.17 115.26 122.01 1zad n ASN 19 Ca -0.05 -3.36 -0.22 0.00 -0.60 0.00 0.00 54.58 50.35 1zad n ASN 19 Cb 0.42 -0.49 -0.15 0.00 -0.53 0.00 0.00 39.78 39.02 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 -3.00 2.00 -0.14 1.20 1.43 -0.48 -4.79 118.68 114.89 1zad s LEU 20 Ca 0.36 -0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.19 1zad s LEU 20 Cb 0.32 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.84 1zad s LEU 20 CO 0.01 0.15 -0.05 0.00 0.23 0.00 0.00 176.35 176.69 1zad s TYR 22 N 0.23 1.44 -0.20 0.00 -0.85 0.13 -0.49 117.35 117.60 1zad s TYR 22 Ca -0.03 -0.77 -0.04 0.00 -0.52 0.00 0.00 57.07 55.71 1zad s TYR 22 Cb -0.14 -0.76 0.09 0.00 0.38 0.00 0.00 41.96 41.54 1zad s TYR 22 CO 0.03 0.10 0.23 -1.59 -1.52 0.00 0.00 175.55 172.81 1zad s LYS 23 N -3.76 0.20 -0.02 -3.49 -2.85 -0.29 -0.85 119.74 108.68 1zad s LYS 23 Ca 0.21 0.27 -0.25 0.00 -1.00 0.00 0.00 55.97 55.19 1zad s LYS 23 Cb 0.03 -1.07 -0.04 0.00 -2.06 0.00 0.00 37.83 34.69 1zad s LYS 23 CO 0.04 -0.63 0.79 -1.64 0.10 0.00 0.00 175.35 174.01 1zad s MET 24 N 2.35 4.49 -0.21 1.78 -1.94 0.23 -2.15 119.30 123.84 1zad s MET 24 Ca 0.07 1.06 -0.02 0.00 -1.71 0.00 0.00 55.69 55.10 1zad s MET 24 Cb -0.15 -3.43 0.01 0.00 2.01 0.00 0.00 34.83 33.27 1zad s MET 24 CO -0.12 0.10 -0.10 -0.06 -0.01 0.00 0.00 175.02 174.83 1zad s PHE 25 N 0.61 2.91 0.44 -0.03 0.40 0.13 -1.88 117.98 120.56 1zad s PHE 25 Ca 0.41 -1.29 -0.10 0.00 -0.60 0.00 0.00 56.93 55.35 1zad s PHE 25 Cb -0.19 -2.03 -0.06 0.00 0.51 0.00 0.00 43.02 41.25 1zad s PHE 25 CO 0.22 -0.67 0.81 1.41 0.70 0.00 0.00 175.22 177.68 1zad s MET 26 N 1.39 3.74 0.00 0.44 1.75 -1.26 0.31 119.30 125.66 1zad s MET 26 Ca 0.05 0.48 0.00 0.00 -1.25 0.00 0.00 55.69 54.97 1zad s MET 26 Cb -0.14 -2.35 0.00 0.00 2.84 0.00 0.00 34.83 35.18 1zad s MET 26 CO -0.07 -0.12 0.00 -1.33 -0.65 0.00 0.00 175.02 172.85 1zad n MET 27 N -1.57 0.00 -3.92 4.11 2.81 0.26 -4.43 117.12 114.38 1zad n MET 27 Ca 0.03 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.81 1zad n MET 27 Cb 0.54 0.00 -0.12 0.00 -0.71 0.00 0.00 33.22 32.93 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 -2.63 0.10 0.09 7.83 0.01 -1.26 -4.69 113.70 113.15 1zad s SER 28 Ca 0.00 -0.22 0.19 0.00 1.31 0.00 0.00 55.95 57.23 1zad s SER 28 Cb 0.00 0.08 -0.11 0.00 0.21 0.00 0.00 66.02 66.21 1zad s SER 28 CO 0.00 -0.17 0.86 -0.90 0.41 0.00 0.00 173.24 173.44 1zad n ASP 29 N 2.27 0.80 -0.39 2.44 5.75 -1.26 -3.96 116.55 122.21 1zad n ASP 29 Ca -0.18 0.34 0.38 0.00 -0.01 0.00 0.00 54.79 55.31 1zad n ASP 29 Cb 0.57 0.35 0.66 0.00 -1.03 0.00 0.00 41.12 41.67 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 0.00-10.37 -2.12 3.38 -1.95 -3.39 115.31 100.86 1zad h LEU 30 Ca -0.12 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.29 1zad h LEU 30 Cb 1.40 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.11 1zad h LEU 30 CO 0.03 0.00 -0.28 0.42 0.09 0.00 0.00 178.44 178.69 1zad s THR 31 N -4.70 1.79 0.49 0.22 -4.23 -1.25 -5.08 115.64 102.89 1zad s THR 31 Ca -0.04 -1.42 -0.23 0.00 -1.18 0.00 0.00 61.69 58.81 1zad s THR 31 Cb 0.20 -2.21 -0.07 0.00 1.34 0.00 0.00 72.50 71.76 1zad s THR 31 CO 0.69 0.00 1.31 -0.38 -0.54 0.00 0.00 174.62 175.70 1zad n ILE 32 N -1.80 3.22 -0.19 2.99 -0.00 -1.26 -4.99 119.36 117.33 1zad n ILE 32 Ca 0.01 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.26 1zad n ILE 32 Cb 0.64 -1.62 0.00 0.00 -0.00 0.00 0.00 39.64 38.66 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 -0.52 -0.41 -0.01 0.38 -0.04 -1.26 -4.91 135.00 128.23 1zad n PRO 33 Ca 0.09 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.52 1zad n PRO 33 Cb 0.43 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.88 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 -1.88 0.12 -3.85 0.52 0.24 -0.79 -4.87 118.33 107.83 1zad n VAL 34 Ca 0.00 -0.04 -0.10 0.00 -2.04 0.00 0.00 64.34 62.17 1zad n VAL 34 Cb 0.00 -1.23 -0.08 0.00 -1.47 0.00 0.00 33.84 31.05 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 -2.04 0.72 -0.28 7.34 -2.85 -0.98 -5.02 119.74 116.62 1zad s LYS 35 Ca -0.03 -0.72 -0.21 0.00 -1.00 0.00 0.00 55.97 54.01 1zad s LYS 35 Cb 0.01 0.30 0.11 0.00 -2.06 0.00 0.00 37.83 36.19 1zad s LYS 35 CO 0.04 -0.21 0.92 -0.98 0.10 0.00 0.00 175.35 175.22 1zad s ARG 36 N -2.88 0.55 0.00 1.78 1.70 -1.26 0.77 118.95 119.61 1zad s ARG 36 Ca -0.03 0.77 0.00 0.00 -0.47 0.00 0.00 55.73 56.00 1zad s ARG 36 Cb 0.00 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.59 1zad s ARG 36 CO -0.06 -0.08 0.00 0.41 -1.08 0.00 0.00 175.30 174.49 1zad n GLY 37 N 3.00 3.28 3.92 3.88 0.00 -0.03 -4.45 105.19 114.79 1zad n GLY 37 Ca -0.15 -0.71 -0.20 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.20 0.00 -0.12 0.00 2.07 0.28 -4.84 121.20 116.38 1zad s ILE 39 Ca 0.41 -0.73 0.08 0.00 -1.41 0.00 0.00 60.65 59.00 1zad s ILE 39 Cb -0.08 -2.59 -0.13 0.00 0.13 0.00 0.00 42.46 39.78 1zad s ILE 39 CO 0.29 0.00 -0.00 -0.67 -1.91 0.00 0.00 174.94 172.64 1zad n ASP 40 N -1.02 2.29 -3.87 4.50 2.03 -1.26 -1.38 116.55 117.85 1zad n ASP 40 Ca -0.05 -0.02 -0.12 0.00 0.52 0.00 0.00 54.79 55.12 1zad n ASP 40 Cb 0.60 0.52 -0.13 0.00 -0.72 0.00 0.00 41.12 41.39 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 -2.29 0.02 -0.11 5.18 0.11 -1.26 -4.88 120.40 117.17 1zad s VAL 41 Ca -0.10 -0.14 -0.29 0.00 -2.93 0.00 0.00 61.98 58.53 1zad s VAL 41 Cb 0.04 -0.13 -0.05 0.00 -1.53 0.00 0.00 36.38 34.71 1zad s VAL 41 CO 0.45 -0.07 1.84 0.00 -3.33 0.00 0.00 175.10 173.98 1zad n PRO 43 N 7.74 -0.21 -0.56 0.00 -0.02 -1.26 -5.04 135.00 135.65 1zad n PRO 43 Ca 0.21 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.49 1zad n PRO 43 Cb 0.43 0.00 0.17 0.00 -0.02 0.00 0.00 33.50 34.09 1zad n PRO 43 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1zad n LYS 44 N -0.95 -2.77 -3.64 -0.52 4.01 -1.26 -5.05 118.16 107.99 1zad n LYS 44 Ca 0.00 -1.10 -0.05 0.00 -0.51 0.00 0.00 58.31 56.65 1zad n LYS 44 Cb 0.00 -1.11 -0.07 0.00 -0.51 0.00 0.00 35.03 33.34 1zad n LYS 44 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 1zad s ASN 45 N -3.27 -0.76 0.07 4.39 2.47 -1.26 -4.66 114.94 111.92 1zad s ASN 45 Ca 0.46 1.21 0.00 0.00 0.42 0.00 0.00 52.86 54.95 1zad s ASN 45 Cb -0.05 1.32 -0.00 0.00 -1.45 0.00 0.00 41.25 41.07 1zad s ASN 45 CO 0.36 -0.19 0.00 -1.54 -3.72 0.00 0.00 177.10 172.01 1zad n SER 46 N 4.07 2.08 0.04 -4.21 3.41 -1.24 -5.05 113.62 112.71 1zad n SER 46 Ca -0.19 -1.31 0.02 0.00 -0.26 0.00 0.00 58.87 57.13 1zad n SER 46 Cb 0.58 0.06 -0.08 0.00 -0.26 0.00 0.00 64.21 64.51 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 0.78 0.13 1.04 -0.00 -1.26 -3.82 117.00 113.88 1zad n LEU 47 Ca -0.03 0.34 0.01 0.00 -0.00 0.00 0.00 56.01 56.33 1zad n LEU 47 Cb 0.09 0.07 0.07 0.00 -0.00 0.00 0.00 43.42 43.65 1zad n LEU 47 CO 0.05 0.10 0.45 0.25 -0.00 0.00 0.00 177.39 178.24 1zad h LEU 48 N 0.00 0.00 -9.09 -1.96 7.12 -1.94 -3.46 115.31 105.97 1zad h LEU 48 Ca -0.15 0.00 -0.44 0.00 0.13 0.00 0.00 57.88 57.42 1zad h LEU 48 Cb 1.49 0.00 -0.14 0.00 -0.53 0.00 0.00 40.66 41.48 1zad h LEU 48 CO 0.04 0.58 -0.63 -0.69 -0.13 0.00 0.00 178.44 177.60 1zad s VAL 49 N -3.07 1.19 -0.06 1.05 1.01 -1.25 0.89 120.40 120.16 1zad s VAL 49 Ca 0.02 -2.03 -0.03 0.00 0.00 0.00 0.00 61.98 59.95 1zad s VAL 49 Cb 0.09 -2.59 0.04 0.00 0.00 0.00 0.00 36.38 33.91 1zad s VAL 49 CO 0.75 -0.15 0.07 -0.75 0.00 0.00 0.00 175.10 175.02 1zad s LYS 50 N -3.86 -0.05 -0.66 2.72 2.47 0.15 -3.69 119.74 116.81 1zad s LYS 50 Ca 0.33 0.33 -0.16 0.00 -1.56 0.00 0.00 55.97 54.91 1zad s LYS 50 Cb 0.07 -0.67 0.15 0.00 -1.46 0.00 0.00 37.83 35.92 1zad s LYS 50 CO 0.13 -0.38 0.67 0.71 0.16 0.00 0.00 175.35 176.64 1zad s TYR 51 N 2.18 3.32 -0.65 4.03 1.51 -1.26 0.22 117.35 126.71 1zad s TYR 51 Ca 0.04 -1.42 -0.21 0.00 -1.01 0.00 0.00 57.07 54.48 1zad s TYR 51 Cb -0.13 -3.89 0.09 0.00 -0.11 0.00 0.00 41.96 37.92 1zad s TYR 51 CO -0.04 -1.11 0.86 0.08 -1.11 0.00 0.00 175.55 174.22 1zad s VAL 52 N 1.54 4.58 0.16 0.71 1.01 -0.92 -4.94 120.40 122.55 1zad s VAL 52 Ca 0.11 -0.74 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 1zad s VAL 52 Cb -0.21 -4.60 -0.06 0.00 0.00 0.00 0.00 36.38 31.51 1zad s VAL 52 CO -0.00 -1.31 0.40 0.00 0.00 0.00 0.00 175.10 174.18 1zad n ASN 55 N -0.53 1.05 -4.53 0.00 6.94 -1.26 -1.59 115.26 115.34 1zad n ASN 55 Ca -0.03 -2.43 -0.33 0.00 -0.02 0.00 0.00 54.58 51.78 1zad n ASN 55 Cb 0.61 -0.34 -0.12 0.00 -2.36 0.00 0.00 39.78 37.57 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 3.31 0.06 5.53 -4.23 -1.26 -4.98 115.64 113.29 1zad s THR 56 Ca 0.29 -0.74 -0.31 0.00 -1.18 0.00 0.00 61.69 59.76 1zad s THR 56 Cb 0.32 -2.36 -0.09 0.00 1.34 0.00 0.00 72.50 71.71 1zad s THR 56 CO -0.11 0.51 1.75 -1.81 -0.54 0.00 0.00 174.62 174.43 1zad s ASP 57 N -1.01 6.54 -0.72 3.99 1.01 -1.26 -1.54 116.67 123.69 1zad s ASP 57 Ca 0.13 2.56 -0.03 0.00 0.71 0.00 0.00 52.55 55.93 1zad s ASP 57 Cb -0.11 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.27 1zad s ASP 57 CO 0.03 -0.95 0.37 0.54 0.21 0.00 0.00 175.17 175.36 1zad n ARG 58 N 6.14 -2.74 0.06 8.23 1.74 -0.07 -4.93 116.66 125.10 1zad n ARG 58 Ca 0.17 0.42 -0.19 0.00 -0.77 0.00 0.00 57.85 57.49 1zad n ARG 58 Cb 0.40 -4.26 -0.09 0.00 -1.02 0.00 0.00 32.46 27.49 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11