#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 3.29 0.08 3.23 1.02 -1.26 0.65 119.74 126.74 1zad s LYS 2 Ca 0.00 -0.72 0.07 0.00 0.02 0.00 0.00 55.97 55.34 1zad s LYS 2 Cb 0.00 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.96 1zad s LYS 2 CO 0.00 -0.34 -0.12 0.00 -0.92 0.00 0.00 175.35 173.97 1zad s ASN 4 N -1.95 5.91 0.00 0.00 0.01 -1.26 -1.48 114.94 116.17 1zad s ASN 4 Ca 0.19 -0.17 0.00 0.00 -0.71 0.00 0.00 52.86 52.17 1zad s ASN 4 Cb -0.11 -1.18 0.00 0.00 0.41 0.00 0.00 41.25 40.37 1zad s ASN 4 CO 0.11 -0.51 0.00 0.29 -1.51 0.00 0.00 177.10 175.48 1zad n LYS 5 N -1.72 2.77 -0.29 -0.60 4.01 -0.85 -4.57 118.16 116.90 1zad n LYS 5 Ca 0.01 0.00 0.22 0.00 -0.51 0.00 0.00 58.31 58.03 1zad n LYS 5 Cb 0.58 0.00 0.52 0.00 -0.51 0.00 0.00 35.03 35.62 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 0.41 -8.88 -0.35 6.46 -1.90 -3.37 115.31 107.68 1zad h LEU 6 Ca 0.00 0.06 -0.63 0.00 -0.12 0.00 0.00 57.88 57.19 1zad h LEU 6 Cb 0.00 -0.01 -0.20 0.00 -0.73 0.00 0.00 40.66 39.72 1zad h LEU 6 CO 0.00 0.12 -0.64 -0.69 -0.62 0.00 0.00 178.44 176.60 1zad s VAL 7 N -5.44 4.09 -0.01 1.05 1.01 -1.26 -5.00 120.40 114.85 1zad s VAL 7 Ca -0.08 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 1zad s VAL 7 Cb 0.24 -2.81 -0.00 0.00 0.00 0.00 0.00 36.38 33.81 1zad s VAL 7 CO 0.79 0.48 0.69 -2.65 0.00 0.00 0.00 175.10 174.41 1zad n PRO 8 N 3.61 0.03 0.00 2.72 -0.02 -1.26 -3.49 135.00 136.59 1zad n PRO 8 Ca -0.17 -0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.13 1zad n PRO 8 Cb 0.52 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 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 3.63 0.00 -4.08 4.25 0.13 -1.26 -5.07 119.36 116.96 1zad n ILE 9 Ca 0.01 0.00 -0.35 0.00 -1.10 0.00 0.00 62.75 61.31 1zad n ILE 9 Cb 0.01 -0.69 -0.09 0.00 -0.84 0.00 0.00 39.64 38.03 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 -1.96 3.40 0.04 1.51 0.00 -1.23 -5.06 121.76 118.46 1zad s ALA 10 Ca 0.00 -0.75 -0.15 0.00 0.00 0.00 0.00 51.96 51.06 1zad s ALA 10 Cb 0.00 -1.82 0.03 0.00 0.00 0.00 0.00 23.12 21.32 1zad s ALA 10 CO 0.00 0.30 0.34 1.52 0.00 0.00 0.00 175.76 177.92 1zad s TYR 11 N 0.02 -0.16 0.19 0.00 1.13 -1.26 -2.01 117.35 115.25 1zad s TYR 11 Ca 0.05 0.07 0.03 0.00 -1.41 0.00 0.00 57.07 55.81 1zad s TYR 11 Cb -0.12 0.14 -0.01 0.00 -1.10 0.00 0.00 41.96 40.87 1zad s TYR 11 CO 0.01 -0.52 0.09 0.36 -2.51 0.00 0.00 175.55 172.98 1zad n LYS 12 N 0.58 0.59 -3.08 -3.49 2.85 -0.55 -4.92 118.16 110.14 1zad n LYS 12 Ca -0.19 -1.67 -0.40 0.00 -1.05 0.00 0.00 58.31 55.00 1zad n LYS 12 Cb 0.59 1.05 -0.05 0.00 -0.65 0.00 0.00 35.03 35.97 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 -2.41 5.00 -0.50 0.58 2.01 -1.26 -1.06 115.64 118.01 1zad s THR 13 Ca 0.13 1.27 -0.28 0.00 0.31 0.00 0.00 61.69 63.12 1zad s THR 13 Cb 0.01 -3.98 0.00 0.00 0.01 0.00 0.00 72.50 68.54 1zad s THR 13 CO 0.09 0.11 1.56 0.00 -0.69 0.00 0.00 174.62 175.69 1zad n PRO 15 N 8.59 -3.78 -1.68 0.00 -0.04 -1.23 -4.28 135.00 132.58 1zad n PRO 15 Ca 0.17 -0.91 -0.48 0.00 -0.04 0.00 0.00 63.50 62.24 1zad n PRO 15 Cb 0.49 -1.19 -0.05 0.00 -0.04 0.00 0.00 33.50 32.71 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 -4.34 2.16 0.00 0.54 1.02 -1.26 -1.17 120.64 117.59 1zad n GLU 16 Ca 0.09 0.79 0.00 0.00 -0.02 0.00 0.00 57.16 58.01 1zad n GLU 16 Cb 0.37 -2.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.19 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 4.04 2.84 3.02 0.62 0.00 -1.26 -4.98 105.19 109.46 1zad n GLY 17 Ca 0.21 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 45.07 1zad n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zad s LYS 18 N 0.00 1.79 -0.20 1.61 -2.85 -0.32 -4.00 119.74 115.77 1zad s LYS 18 Ca 0.00 -2.15 0.15 0.00 -1.00 0.00 0.00 55.97 52.97 1zad s LYS 18 Cb 0.00 -3.34 0.47 0.00 -2.06 0.00 0.00 37.83 32.91 1zad s LYS 18 CO 0.00 -1.03 1.37 -1.71 0.10 0.00 0.00 175.35 174.09 1zad n ASN 19 N 3.89 3.18 -4.11 0.03 5.15 -1.04 -3.50 115.26 118.86 1zad n ASN 19 Ca 0.04 -3.25 -0.21 0.00 -0.60 0.00 0.00 54.58 50.56 1zad n ASN 19 Cb 0.39 -0.55 -0.14 0.00 -0.53 0.00 0.00 39.78 38.95 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 -2.96 2.08 -0.17 1.20 1.43 -0.32 -4.76 118.68 115.20 1zad s LEU 20 Ca 0.41 -0.33 -0.01 0.00 -1.03 0.00 0.00 54.13 53.17 1zad s LEU 20 Cb 0.35 -0.64 -0.01 0.00 0.03 0.00 0.00 46.19 45.92 1zad s LEU 20 CO 0.05 0.11 -0.11 0.00 0.23 0.00 0.00 176.35 176.63 1zad s TYR 22 N 0.84 2.05 -0.21 0.00 -0.85 0.13 -0.83 117.35 118.48 1zad s TYR 22 Ca -0.04 -0.53 -0.04 0.00 -0.52 0.00 0.00 57.07 55.94 1zad s TYR 22 Cb -0.15 -1.03 0.10 0.00 0.38 0.00 0.00 41.96 41.25 1zad s TYR 22 CO 0.00 0.47 0.24 -1.59 -1.52 0.00 0.00 175.55 173.16 1zad s LYS 23 N -3.63 0.21 -0.01 -3.49 -2.85 -0.02 -0.78 119.74 109.17 1zad s LYS 23 Ca 0.28 0.26 -0.26 0.00 -1.00 0.00 0.00 55.97 55.26 1zad s LYS 23 Cb -0.00 -1.08 -0.04 0.00 -2.06 0.00 0.00 37.83 34.65 1zad s LYS 23 CO 0.12 -0.64 0.80 -1.64 0.10 0.00 0.00 175.35 174.09 1zad s MET 24 N 2.36 4.50 -0.19 1.78 -1.94 0.25 -2.01 119.30 124.04 1zad s MET 24 Ca 0.07 1.09 -0.01 0.00 -1.71 0.00 0.00 55.69 55.14 1zad s MET 24 Cb -0.16 -3.42 0.00 0.00 2.01 0.00 0.00 34.83 33.27 1zad s MET 24 CO -0.12 0.11 -0.12 -0.06 -0.01 0.00 0.00 175.02 174.81 1zad s PHE 25 N 0.55 2.86 0.35 -0.03 0.40 0.16 -1.92 117.98 120.35 1zad s PHE 25 Ca 0.42 -1.20 -0.11 0.00 -0.60 0.00 0.00 56.93 55.44 1zad s PHE 25 Cb -0.20 -1.99 -0.07 0.00 0.51 0.00 0.00 43.02 41.27 1zad s PHE 25 CO 0.23 -0.61 0.72 1.41 0.70 0.00 0.00 175.22 177.66 1zad s MET 26 N 1.24 3.84 0.00 0.44 1.75 -1.26 0.50 119.30 125.81 1zad s MET 26 Ca 0.03 0.48 0.00 0.00 -1.25 0.00 0.00 55.69 54.94 1zad s MET 26 Cb -0.14 -2.45 0.00 0.00 2.84 0.00 0.00 34.83 35.08 1zad s MET 26 CO -0.06 0.08 0.00 -1.33 -0.65 0.00 0.00 175.02 173.06 1zad n MET 27 N -0.86 0.00 -3.87 4.11 2.81 0.17 -4.54 117.12 114.95 1zad n MET 27 Ca 0.02 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.82 1zad n MET 27 Cb 0.54 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 32.96 1zad n MET 27 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1zad s SER 28 N 0.00 0.09 -0.21 7.83 0.15 -1.26 -4.77 113.70 115.53 1zad s SER 28 Ca 0.00 -0.49 0.09 0.00 0.70 0.00 0.00 55.95 56.25 1zad s SER 28 Cb 0.00 0.29 -0.19 0.00 -1.71 0.00 0.00 66.02 64.41 1zad s SER 28 CO 0.00 -0.60 -0.07 -0.90 1.20 0.00 0.00 173.24 172.86 1zad n ASP 29 N 0.46 1.29 -0.62 5.45 5.75 -1.26 -4.31 116.55 123.31 1zad n ASP 29 Ca -0.18 -0.06 0.49 0.00 -0.01 0.00 0.00 54.79 55.03 1zad n ASP 29 Cb 0.60 0.28 0.77 0.00 -1.03 0.00 0.00 41.12 41.74 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 -3.37 115.31 111.23 1zad h LEU 30 Ca -0.52 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1zad h LEU 30 Cb 1.99 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.74 1zad h LEU 30 CO -0.03 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.85 1zad n THR 31 N -3.86 0.00 -4.13 0.22 -2.24 -1.26 -5.08 114.28 97.93 1zad n THR 31 Ca 0.40 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.83 1zad n THR 31 Cb 1.90 -0.40 -0.08 0.00 -2.10 0.00 0.00 70.33 69.66 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 1.29 4.87 0.00 2.28 1.09 -1.26 -5.09 121.20 124.37 1zad s ILE 32 Ca 0.00 -0.03 0.00 0.00 -1.10 0.00 0.00 60.65 59.52 1zad s ILE 32 Cb 0.00 -3.09 0.00 0.00 -1.06 0.00 0.00 42.46 38.31 1zad s ILE 32 CO 0.00 0.60 0.00 -0.81 -0.10 0.00 0.00 174.94 174.63 1zad n PRO 33 N 2.16 -0.80 -0.01 2.79 -0.04 -1.26 -4.91 135.00 132.93 1zad n PRO 33 Ca -0.19 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.25 1zad n PRO 33 Cb 0.54 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.99 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 -2.19 0.10 -3.82 0.52 0.24 -0.81 -4.86 118.33 107.52 1zad n VAL 34 Ca 0.00 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.34 62.16 1zad n VAL 34 Cb 0.00 -1.17 -0.08 0.00 -1.47 0.00 0.00 33.84 31.12 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 -2.03 0.75 -0.28 7.34 -2.85 -0.98 -5.03 119.74 116.65 1zad s LYS 35 Ca -0.03 -0.63 -0.17 0.00 -1.00 0.00 0.00 55.97 54.14 1zad s LYS 35 Cb 0.01 0.31 0.12 0.00 -2.06 0.00 0.00 37.83 36.21 1zad s LYS 35 CO 0.04 -0.23 0.88 -0.98 0.10 0.00 0.00 175.35 175.16 1zad s ARG 36 N -2.73 0.52 0.00 1.78 3.03 -1.26 0.87 118.95 121.16 1zad s ARG 36 Ca -0.04 0.84 0.00 0.00 2.03 0.00 0.00 55.73 58.56 1zad s ARG 36 Cb -0.00 0.13 0.00 0.00 -1.03 0.00 0.00 34.95 34.05 1zad s ARG 36 CO -0.05 -0.10 0.00 0.41 -1.13 0.00 0.00 175.30 174.43 1zad n GLY 37 N 3.68 4.08 3.82 3.88 0.00 0.04 -4.52 105.19 116.17 1zad n GLY 37 Ca -0.18 -0.85 -0.22 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.30 0.00 -0.16 0.00 2.07 0.28 -4.83 121.20 116.25 1zad s ILE 39 Ca 0.39 -0.72 0.10 0.00 -1.41 0.00 0.00 60.65 59.01 1zad s ILE 39 Cb -0.05 -2.61 -0.17 0.00 0.13 0.00 0.00 42.46 39.76 1zad s ILE 39 CO 0.25 0.00 -0.02 -0.90 -1.91 0.00 0.00 174.94 172.36 1zad n ASP 40 N -1.03 1.66 -3.85 4.50 5.75 -1.26 -1.17 116.55 121.15 1zad n ASP 40 Ca -0.05 -0.03 -0.12 0.00 -0.01 0.00 0.00 54.79 54.58 1zad n ASP 40 Cb 0.60 0.49 -0.11 0.00 -1.03 0.00 0.00 41.12 41.06 1zad n ASP 40 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1zad s VAL 41 N -2.37 0.04 -0.11 2.12 0.11 -1.26 -4.85 120.40 114.08 1zad s VAL 41 Ca -0.14 -0.35 -0.29 0.00 -2.93 0.00 0.00 61.98 58.27 1zad s VAL 41 Cb 0.05 -0.30 -0.06 0.00 -1.53 0.00 0.00 36.38 34.54 1zad s VAL 41 CO 0.56 -0.19 1.85 0.00 -3.33 0.00 0.00 175.10 173.99 1zad n PRO 43 N 7.75 0.11 -0.49 0.00 -0.02 -1.26 -5.04 135.00 136.04 1zad n PRO 43 Ca 0.21 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.52 1zad n PRO 43 Cb 0.43 0.00 0.14 0.00 -0.02 0.00 0.00 33.50 34.06 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 -0.68 -2.48 -3.63 -0.52 5.02 -1.26 -5.05 118.16 109.56 1zad n LYS 44 Ca 0.00 -0.94 -0.05 0.00 -2.02 0.00 0.00 58.31 55.30 1zad n LYS 44 Cb 0.00 -0.94 -0.07 0.00 -0.02 0.00 0.00 35.03 34.00 1zad n LYS 44 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1zad s ASN 45 N -3.05 -0.78 0.39 4.39 2.47 -1.26 -4.68 114.94 112.42 1zad s ASN 45 Ca 0.39 1.23 0.02 0.00 0.42 0.00 0.00 52.86 54.92 1zad s ASN 45 Cb -0.04 1.38 0.02 0.00 -1.45 0.00 0.00 41.25 41.16 1zad s ASN 45 CO 0.30 -0.19 0.16 -1.54 -3.72 0.00 0.00 177.10 172.11 1zad n SER 46 N 4.18 2.62 0.11 -4.21 3.41 -1.24 -5.03 113.62 113.45 1zad n SER 46 Ca -0.19 -2.49 0.12 0.00 -0.26 0.00 0.00 58.87 56.05 1zad n SER 46 Cb 0.58 0.10 0.04 0.00 -0.26 0.00 0.00 64.21 64.67 1zad n SER 46 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1zad h LEU 47 N 0.00 0.00 0.05 1.04 7.12 -2.00 -3.31 115.31 118.21 1zad h LEU 47 Ca -0.28 -0.03 -0.26 0.00 0.13 0.00 0.00 57.88 57.44 1zad h LEU 47 Cb 0.93 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.03 1zad h LEU 47 CO 0.45 0.02 -1.33 0.25 -0.13 0.00 0.00 178.44 177.69 1zad h LEU 48 N 0.00 0.16 -9.34 2.25 7.12 -1.94 -3.47 115.31 110.08 1zad h LEU 48 Ca 0.00 -0.21 -0.57 0.00 0.13 0.00 0.00 57.88 57.23 1zad h LEU 48 Cb 0.96 -0.05 -0.14 0.00 -0.53 0.00 0.00 40.66 40.90 1zad h LEU 48 CO 0.00 1.17 -0.67 -0.69 -0.13 0.00 0.00 178.44 178.13 1zad s VAL 49 N -2.65 1.97 -0.08 1.05 1.01 -1.25 0.42 120.40 120.88 1zad s VAL 49 Ca -0.04 -2.15 -0.01 0.00 0.00 0.00 0.00 61.98 59.78 1zad s VAL 49 Cb 0.08 -2.62 0.03 0.00 0.00 0.00 0.00 36.38 33.87 1zad s VAL 49 CO 0.84 -0.21 0.01 -0.75 0.00 0.00 0.00 175.10 174.99 1zad s LYS 50 N -3.67 0.57 -0.88 2.72 2.47 0.18 -3.64 119.74 117.49 1zad s LYS 50 Ca 0.32 0.09 -0.15 0.00 -1.56 0.00 0.00 55.97 54.67 1zad s LYS 50 Cb 0.04 -1.01 0.20 0.00 -1.46 0.00 0.00 37.83 35.59 1zad s LYS 50 CO 0.15 -0.33 0.90 0.71 0.16 0.00 0.00 175.35 176.95 1zad s TYR 51 N 1.98 3.62 -0.70 4.03 1.51 -1.26 0.37 117.35 126.90 1zad s TYR 51 Ca 0.05 -1.88 -0.24 0.00 -1.01 0.00 0.00 57.07 53.98 1zad s TYR 51 Cb -0.12 -3.96 0.06 0.00 -0.11 0.00 0.00 41.96 37.82 1zad s TYR 51 CO -0.05 -1.13 1.10 0.08 -1.11 0.00 0.00 175.55 174.43 1zad s VAL 52 N 0.79 4.09 0.22 0.71 1.01 -0.85 -4.91 120.40 121.45 1zad s VAL 52 Ca 0.23 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 62.08 1zad s VAL 52 Cb -0.08 -4.79 -0.05 0.00 0.00 0.00 0.00 36.38 31.46 1zad s VAL 52 CO -0.09 -1.62 0.46 0.00 0.00 0.00 0.00 175.10 173.84 1zad n ASN 55 N -0.40 1.17 -4.47 0.00 6.94 -1.26 -1.72 115.26 115.52 1zad n ASN 55 Ca -0.03 -2.62 -0.33 0.00 -0.02 0.00 0.00 54.58 51.58 1zad n ASN 55 Cb 0.61 -0.36 -0.13 0.00 -2.36 0.00 0.00 39.78 37.54 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 -1.11 3.13 -0.01 5.53 -4.23 -1.26 -4.98 115.64 112.72 1zad s THR 56 Ca 0.31 -0.69 -0.30 0.00 -1.18 0.00 0.00 61.69 59.83 1zad s THR 56 Cb 0.33 -2.24 -0.08 0.00 1.34 0.00 0.00 72.50 71.85 1zad s THR 56 CO -0.11 0.58 1.92 -1.81 -0.54 0.00 0.00 174.62 174.66 1zad s ASP 57 N -0.60 6.41 -0.26 3.99 1.01 -1.26 -1.39 116.67 124.57 1zad s ASP 57 Ca 0.09 2.49 -0.01 0.00 0.71 0.00 0.00 52.55 55.82 1zad s ASP 57 Cb -0.11 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.29 1zad s ASP 57 CO 0.01 -1.11 0.17 0.54 0.21 0.00 0.00 175.17 174.99 1zad n ARG 58 N 7.57 -1.22 0.02 8.23 1.74 0.18 -4.91 116.66 128.27 1zad n ARG 58 Ca 0.20 0.16 -0.19 0.00 -0.77 0.00 0.00 57.85 57.25 1zad n ARG 58 Cb 0.42 -3.26 -0.11 0.00 -1.02 0.00 0.00 32.46 28.49 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11