#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 2.89 -0.02 3.23 3.01 -1.26 0.70 119.74 128.30 1zad s LYS 2 Ca 0.00 -1.01 0.01 0.00 -1.01 0.00 0.00 55.97 53.97 1zad s LYS 2 Cb 0.00 -3.49 -0.03 0.00 -1.01 0.00 0.00 37.83 33.30 1zad s LYS 2 CO 0.00 -0.57 -0.01 0.00 0.51 0.00 0.00 175.35 175.28 1zad s ASN 4 N -1.40 5.19 0.02 0.00 -0.87 -1.26 -0.69 114.94 115.93 1zad s ASN 4 Ca 0.18 -0.53 0.00 0.00 -1.57 0.00 0.00 52.86 50.94 1zad s ASN 4 Cb -0.11 -0.21 0.00 0.00 -0.02 0.00 0.00 41.25 40.91 1zad s ASN 4 CO 0.08 -1.21 0.00 0.29 -2.57 0.00 0.00 177.10 173.69 1zad n LYS 5 N -2.22 2.29 -0.32 -0.60 4.01 -0.72 -4.65 118.16 115.94 1zad n LYS 5 Ca 0.12 0.00 0.19 0.00 -0.51 0.00 0.00 58.31 58.11 1zad n LYS 5 Cb 0.60 0.00 0.44 0.00 -0.51 0.00 0.00 35.03 35.57 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 0.56 -9.18 -0.35 6.46 -1.90 -3.37 115.31 107.53 1zad h LEU 6 Ca 0.00 0.09 -0.62 0.00 -0.12 0.00 0.00 57.88 57.23 1zad h LEU 6 Cb 0.00 -0.00 -0.14 0.00 -0.73 0.00 0.00 40.66 39.78 1zad h LEU 6 CO 0.00 0.15 -0.54 -0.69 -0.62 0.00 0.00 178.44 176.73 1zad s VAL 7 N -5.61 4.96 -0.03 1.05 1.01 -1.26 -4.89 120.40 115.62 1zad s VAL 7 Ca -0.10 0.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.90 1zad s VAL 7 Cb 0.25 -3.23 -0.00 0.00 0.00 0.00 0.00 36.38 33.40 1zad s VAL 7 CO 0.80 0.48 0.93 -2.65 0.00 0.00 0.00 175.10 174.65 1zad n PRO 8 N 3.35 0.09 0.09 2.72 -0.02 -1.26 -3.73 135.00 136.23 1zad n PRO 8 Ca -0.17 -0.41 0.00 0.00 -2.02 0.00 0.00 63.50 60.90 1zad n PRO 8 Cb 0.52 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 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 4.43 0.15 -3.84 4.25 0.13 -1.26 -5.07 119.36 118.14 1zad n ILE 9 Ca 0.02 0.05 -0.35 0.00 -1.10 0.00 0.00 62.75 61.36 1zad n ILE 9 Cb 0.01 -0.69 -0.08 0.00 -0.84 0.00 0.00 39.64 38.05 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 3.67 0.01 1.51 0.00 -1.24 -5.05 121.76 118.66 1zad s ALA 10 Ca 0.00 -0.69 -0.17 0.00 0.00 0.00 0.00 51.96 51.10 1zad s ALA 10 Cb 0.00 -2.05 0.03 0.00 0.00 0.00 0.00 23.12 21.10 1zad s ALA 10 CO 0.00 0.29 0.36 1.52 0.00 0.00 0.00 175.76 177.94 1zad s TYR 11 N -0.03 -0.22 0.22 0.00 1.13 -1.26 -1.76 117.35 115.43 1zad s TYR 11 Ca 0.09 0.26 0.03 0.00 -1.41 0.00 0.00 57.07 56.03 1zad s TYR 11 Cb -0.11 0.15 -0.01 0.00 -1.10 0.00 0.00 41.96 40.89 1zad s TYR 11 CO -0.00 -0.48 0.09 1.17 -2.51 0.00 0.00 175.55 173.82 1zad n LYS 12 N 0.89 0.65 -3.15 -3.49 4.81 0.13 -4.91 118.16 113.10 1zad n LYS 12 Ca -0.20 -1.91 -0.39 0.00 -0.87 0.00 0.00 58.31 54.94 1zad n LYS 12 Cb 0.58 1.12 -0.05 0.00 0.02 0.00 0.00 35.03 36.69 1zad n LYS 12 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1zad s THR 13 N -2.45 5.09 -0.29 3.15 2.01 -1.26 0.07 115.64 121.95 1zad s THR 13 Ca 0.13 1.22 -0.29 0.00 0.31 0.00 0.00 61.69 63.07 1zad s THR 13 Cb 0.01 -3.95 -0.00 0.00 0.01 0.00 0.00 72.50 68.57 1zad s THR 13 CO 0.09 0.24 1.38 0.00 -0.69 0.00 0.00 174.62 175.64 1zad n PRO 15 N 7.42 -4.77 -1.67 0.00 -0.04 -1.25 -4.30 135.00 130.39 1zad n PRO 15 Ca 0.16 -1.49 -0.44 0.00 -0.04 0.00 0.00 63.50 61.68 1zad n PRO 15 Cb 0.46 -1.88 -0.04 0.00 -0.04 0.00 0.00 33.50 32.00 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 -5.76 2.58 0.00 0.54 1.02 -1.26 -1.72 120.64 116.04 1zad n GLU 16 Ca 0.14 0.94 0.00 0.00 -0.02 0.00 0.00 57.16 58.22 1zad n GLU 16 Cb 0.60 -2.84 0.00 0.00 -0.02 0.00 0.00 31.44 29.18 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 4.35 2.89 2.99 0.62 0.00 -1.26 -5.02 105.19 109.76 1zad n GLY 17 Ca 0.20 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 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 1.67 -0.08 1.61 -2.85 -0.70 -4.30 119.74 115.09 1zad s LYS 18 Ca 0.00 -1.44 0.12 0.00 -1.00 0.00 0.00 55.97 53.64 1zad s LYS 18 Cb 0.00 -2.86 0.27 0.00 -2.06 0.00 0.00 37.83 33.18 1zad s LYS 18 CO 0.00 -0.75 1.19 -1.71 0.10 0.00 0.00 175.35 174.18 1zad n ASN 19 N 4.46 2.71 -4.28 0.03 5.15 -1.14 -3.77 115.26 118.41 1zad n ASN 19 Ca -0.06 -2.57 -0.28 0.00 -0.60 0.00 0.00 54.58 51.07 1zad n ASN 19 Cb 0.42 -0.30 -0.15 0.00 -0.53 0.00 0.00 39.78 39.22 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 -2.00 2.12 -0.09 1.20 1.43 -0.49 -4.72 118.68 116.14 1zad s LEU 20 Ca 0.24 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.86 1zad s LEU 20 Cb 0.19 -1.14 -0.02 0.00 0.03 0.00 0.00 46.19 45.25 1zad s LEU 20 CO 0.06 0.23 -0.15 0.00 0.23 0.00 0.00 176.35 176.72 1zad s TYR 22 N -0.17 1.01 -0.12 0.00 -0.85 0.15 0.02 117.35 117.40 1zad s TYR 22 Ca -0.01 -0.95 -0.04 0.00 -0.52 0.00 0.00 57.07 55.55 1zad s TYR 22 Cb -0.13 -0.58 0.06 0.00 0.38 0.00 0.00 41.96 41.69 1zad s TYR 22 CO 0.03 -0.17 0.23 -1.59 -1.52 0.00 0.00 175.55 172.54 1zad s LYS 23 N -3.86 0.11 -0.14 -3.49 -2.85 0.03 -0.79 119.74 108.75 1zad s LYS 23 Ca 0.16 0.67 -0.15 0.00 -1.00 0.00 0.00 55.97 55.65 1zad s LYS 23 Cb 0.05 -0.16 -0.04 0.00 -2.06 0.00 0.00 37.83 35.62 1zad s LYS 23 CO -0.02 -0.31 0.36 -1.64 0.10 0.00 0.00 175.35 173.85 1zad s MET 24 N 2.38 4.29 -0.12 1.78 -1.94 0.24 -2.09 119.30 123.84 1zad s MET 24 Ca 0.02 0.23 0.02 0.00 -1.71 0.00 0.00 55.69 54.25 1zad s MET 24 Cb -0.12 -3.43 -0.01 0.00 2.01 0.00 0.00 34.83 33.28 1zad s MET 24 CO -0.08 0.21 -0.18 -0.06 -0.01 0.00 0.00 175.02 174.90 1zad s PHE 25 N 0.53 2.70 0.48 -0.03 0.40 -0.40 -2.00 117.98 119.67 1zad s PHE 25 Ca 0.20 -0.91 -0.09 0.00 -0.60 0.00 0.00 56.93 55.53 1zad s PHE 25 Cb -0.14 -1.80 -0.05 0.00 0.51 0.00 0.00 43.02 41.54 1zad s PHE 25 CO 0.06 -0.36 0.85 1.41 0.70 0.00 0.00 175.22 177.88 1zad s MET 26 N 0.46 3.68 -0.38 0.44 1.75 -1.26 0.26 119.30 124.25 1zad s MET 26 Ca -0.13 0.48 -0.03 0.00 -1.25 0.00 0.00 55.69 54.76 1zad s MET 26 Cb -0.17 -2.30 0.01 0.00 2.84 0.00 0.00 34.83 35.21 1zad s MET 26 CO 0.05 -0.22 0.30 -1.33 -0.65 0.00 0.00 175.02 173.18 1zad n MET 27 N -1.92 -0.79 0.00 4.11 2.81 0.95 -4.50 117.12 117.77 1zad n MET 27 Ca 0.03 0.42 0.00 0.00 -1.81 0.00 0.00 57.70 56.34 1zad n MET 27 Cb 0.54 -1.07 0.00 0.00 -0.71 0.00 0.00 33.22 31.99 1zad n MET 27 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1zad n SER 28 N -0.79 0.00 -0.05 7.83 2.88 -1.25 -4.91 113.62 117.31 1zad n SER 28 Ca -0.14 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.33 1zad n SER 28 Cb 0.34 0.40 -0.07 0.00 -0.75 0.00 0.00 64.21 64.14 1zad n SER 28 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1zad n ASP 29 N -0.77 2.74 -0.68 -3.46 5.75 -1.26 -4.49 116.55 114.38 1zad n ASP 29 Ca 0.00 -0.03 0.52 0.00 -0.01 0.00 0.00 54.79 55.27 1zad n ASP 29 Cb 0.00 0.36 0.80 0.00 -1.03 0.00 0.00 41.12 41.25 1zad n ASP 29 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1zad n LEU 30 N -2.57 0.00 0.00 -2.12 4.77 -1.26 -4.23 117.00 111.59 1zad n LEU 30 Ca -0.19 0.98 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 1zad n LEU 30 Cb 0.79 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1zad n LEU 30 CO 0.18 -0.98 0.00 0.35 -1.33 0.00 0.00 177.39 175.61 1zad n THR 31 N -3.87 0.00 -3.70 -5.08 -2.24 -1.26 -5.05 114.28 93.07 1zad n THR 31 Ca 0.43 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.88 1zad n THR 31 Cb 1.99 -1.81 -0.05 0.00 -2.10 0.00 0.00 70.33 68.36 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 -0.15 5.22 0.94 2.28 1.09 -1.26 -5.07 121.20 124.25 1zad s ILE 32 Ca 0.00 0.18 -0.11 0.00 -1.10 0.00 0.00 60.65 59.62 1zad s ILE 32 Cb 0.00 -3.60 0.16 0.00 -1.06 0.00 0.00 42.46 37.95 1zad s ILE 32 CO 0.00 0.26 1.11 -2.16 -0.10 0.00 0.00 174.94 174.05 1zad s PRO 33 N -2.03 0.88 -0.18 2.79 0.04 -1.26 -4.81 135.00 130.41 1zad s PRO 33 Ca 0.32 1.24 0.02 0.00 0.04 0.00 0.00 61.00 62.62 1zad s PRO 33 Cb -0.13 -1.73 -0.12 0.00 0.04 0.00 0.00 34.50 32.55 1zad s PRO 33 CO 0.19 -2.63 -0.15 1.33 0.04 0.00 0.00 177.00 175.78 1zad n VAL 34 N -4.20 1.05 -3.63 -0.36 0.24 -0.85 -4.96 118.33 105.63 1zad n VAL 34 Ca 0.09 -0.41 -0.16 0.00 -2.04 0.00 0.00 64.34 61.82 1zad n VAL 34 Cb 0.53 -1.12 -0.07 0.00 -1.47 0.00 0.00 33.84 31.71 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 -2.37 0.89 0.25 7.34 2.36 -0.97 -5.04 119.74 122.21 1zad s LYS 35 Ca -0.24 0.05 -0.18 0.00 -2.55 0.00 0.00 55.97 53.05 1zad s LYS 35 Cb 0.06 0.41 0.01 0.00 -1.05 0.00 0.00 37.83 37.27 1zad s LYS 35 CO 0.43 -0.27 0.60 -0.98 1.55 0.00 0.00 175.35 176.68 1zad s ARG 36 N -1.29 1.63 0.00 4.03 1.04 -1.26 0.83 118.95 123.92 1zad s ARG 36 Ca -0.12 -1.06 0.00 0.00 -1.04 0.00 0.00 55.73 53.51 1zad s ARG 36 Cb -0.02 0.55 0.00 0.00 -2.04 0.00 0.00 34.95 33.43 1zad s ARG 36 CO 0.07 -0.72 0.00 0.41 -0.04 0.00 0.00 175.30 175.03 1zad n GLY 37 N -0.41 -1.22 3.98 3.88 0.00 0.03 -4.80 105.19 106.64 1zad n GLY 37 Ca -0.04 -0.94 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.38 0.00 -0.14 0.00 2.07 0.28 -4.83 121.20 116.18 1zad s ILE 39 Ca 0.48 -0.74 0.00 0.00 -1.41 0.00 0.00 60.65 58.99 1zad s ILE 39 Cb -0.10 -2.48 -0.09 0.00 0.13 0.00 0.00 42.46 39.92 1zad s ILE 39 CO 0.34 0.00 -0.14 -0.90 -1.91 0.00 0.00 174.94 172.34 1zad n ASP 40 N -0.92 2.68 -3.90 4.50 5.75 -1.26 -1.39 116.55 122.02 1zad n ASP 40 Ca -0.05 -0.05 -0.20 0.00 -0.01 0.00 0.00 54.79 54.48 1zad n ASP 40 Cb 0.60 -0.25 -0.16 0.00 -1.03 0.00 0.00 41.12 40.27 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 -2.29 0.57 -0.05 2.12 0.11 -1.26 -4.86 120.40 114.75 1zad s VAL 41 Ca -0.20 -0.14 -0.30 0.00 -2.93 0.00 0.00 61.98 58.42 1zad s VAL 41 Cb 0.05 -0.59 -0.06 0.00 -1.53 0.00 0.00 36.38 34.24 1zad s VAL 41 CO 0.32 0.23 1.81 0.00 -3.33 0.00 0.00 175.10 174.14 1zad s PRO 43 N 4.42 -1.25 -0.04 0.00 0.02 -1.26 -5.00 135.00 131.90 1zad s PRO 43 Ca 0.81 0.60 -0.30 0.00 0.02 0.00 0.00 61.00 62.13 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 0.34 -3.88 1.21 0.15 -0.33 0.00 0.00 177.00 174.49 1zad s LYS 44 N -4.67 4.36 0.80 5.54 1.02 -1.26 -5.00 119.74 120.53 1zad s LYS 44 Ca 0.68 1.70 -0.12 0.00 0.02 0.00 0.00 55.97 58.25 1zad s LYS 44 Cb -0.22 -3.53 0.07 0.00 -0.52 0.00 0.00 37.83 33.64 1zad s LYS 44 CO 0.62 -0.42 1.10 1.21 -0.92 0.00 0.00 175.35 176.94 1zad s ASN 45 N 1.44 4.45 0.23 2.83 2.47 -1.26 -4.99 114.94 120.11 1zad s ASN 45 Ca 0.57 1.25 0.00 0.00 0.42 0.00 0.00 52.86 55.10 1zad s ASN 45 Cb -0.26 -1.97 0.00 0.00 -1.45 0.00 0.00 41.25 37.57 1zad s ASN 45 CO 0.23 -1.99 0.00 -1.54 -3.72 0.00 0.00 177.10 170.08 1zad n SER 46 N -3.44 2.63 0.01 -4.21 3.41 -1.21 -5.02 113.62 105.80 1zad n SER 46 Ca 0.07 -1.99 0.05 0.00 -0.26 0.00 0.00 58.87 56.73 1zad n SER 46 Cb 0.57 0.16 -0.11 0.00 -0.26 0.00 0.00 64.21 64.57 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 0.41 0.06 1.04 7.94 -1.26 -4.24 117.00 120.96 1zad n LEU 47 Ca -0.09 0.17 -0.23 0.00 -1.11 0.00 0.00 56.01 54.75 1zad n LEU 47 Cb 0.29 0.09 -0.15 0.00 0.53 0.00 0.00 43.42 44.18 1zad n LEU 47 CO 0.15 0.08 -0.46 0.25 -1.11 0.00 0.00 177.39 176.30 1zad h LEU 48 N 0.00 0.57 -9.68 -1.96 7.12 -1.96 -3.45 115.31 105.95 1zad h LEU 48 Ca -0.13 -0.92 -0.57 0.00 0.13 0.00 0.00 57.88 56.40 1zad h LEU 48 Cb 1.35 -0.19 -0.09 0.00 -0.53 0.00 0.00 40.66 41.20 1zad h LEU 48 CO 0.02 1.72 -0.59 -0.69 -0.13 0.00 0.00 178.44 178.77 1zad s VAL 49 N -2.55 2.85 -0.14 1.05 1.01 -1.26 -0.04 120.40 121.33 1zad s VAL 49 Ca -0.16 -1.86 -0.00 0.00 0.00 0.00 0.00 61.98 59.96 1zad s VAL 49 Cb 0.05 -2.87 0.03 0.00 0.00 0.00 0.00 36.38 33.58 1zad s VAL 49 CO 0.84 -0.21 -0.10 -0.75 0.00 0.00 0.00 175.10 174.88 1zad s LYS 50 N -3.76 1.83 -0.42 2.72 2.36 0.14 -3.29 119.74 119.32 1zad s LYS 50 Ca 0.36 -0.42 -0.20 0.00 -2.55 0.00 0.00 55.97 53.15 1zad s LYS 50 Cb -0.02 -1.86 0.02 0.00 -1.05 0.00 0.00 37.83 34.92 1zad s LYS 50 CO 0.21 -0.28 0.62 0.71 1.55 0.00 0.00 175.35 178.16 1zad s TYR 51 N 1.60 3.09 -0.43 4.03 1.51 -1.26 -1.27 117.35 124.62 1zad s TYR 51 Ca 0.04 -0.01 -0.05 0.00 -1.01 0.00 0.00 57.07 56.04 1zad s TYR 51 Cb -0.13 -3.28 0.11 0.00 -0.11 0.00 0.00 41.96 38.55 1zad s TYR 51 CO -0.09 -0.81 0.26 0.08 -1.11 0.00 0.00 175.55 173.87 1zad s VAL 52 N 2.75 3.67 0.13 0.71 1.01 -0.89 -4.95 120.40 122.83 1zad s VAL 52 Ca 0.22 -1.92 -0.01 0.00 0.00 0.00 0.00 61.98 60.28 1zad s VAL 52 Cb -0.14 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1zad s VAL 52 CO 0.18 -0.71 0.30 0.00 0.00 0.00 0.00 175.10 174.88 1zad n ASN 55 N -0.40 1.21 -4.54 0.00 6.94 -1.26 -1.50 115.26 115.71 1zad n ASN 55 Ca -0.03 -2.71 -0.33 0.00 -0.02 0.00 0.00 54.58 51.49 1zad n ASN 55 Cb 0.61 -0.37 -0.12 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 -1.33 3.40 0.11 5.53 -4.23 -1.26 -5.00 115.64 112.87 1zad s THR 56 Ca 0.29 -0.68 -0.31 0.00 -1.18 0.00 0.00 61.69 59.81 1zad s THR 56 Cb 0.31 -2.40 -0.09 0.00 1.34 0.00 0.00 72.50 71.66 1zad s THR 56 CO -0.09 0.53 1.65 -1.81 -0.54 0.00 0.00 174.62 174.37 1zad s ASP 57 N -0.96 6.57 -0.99 3.99 1.01 -1.26 -1.67 116.67 123.35 1zad s ASP 57 Ca 0.13 2.58 -0.03 0.00 0.71 0.00 0.00 52.55 55.94 1zad s ASP 57 Cb -0.11 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.25 1zad s ASP 57 CO 0.03 -0.89 0.42 0.54 0.21 0.00 0.00 175.17 175.48 1zad n ARG 58 N 5.06 -3.30 0.15 8.23 1.74 0.17 -4.89 116.66 123.82 1zad n ARG 58 Ca 0.15 0.58 0.03 0.00 -0.77 0.00 0.00 57.85 57.84 1zad n ARG 58 Cb 0.39 -4.76 0.16 0.00 -1.02 0.00 0.00 32.46 27.23 1zad n ARG 58 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11