#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zrp s LYS 2 N 0.00 3.12 -0.20 0.00 1.02 -1.26 -2.20 119.74 120.22 1zrp s LYS 2 Ca 0.00 -0.78 -0.02 0.00 0.02 0.00 0.00 55.97 55.19 1zrp s LYS 2 Cb 0.00 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.87 1zrp s LYS 2 CO 0.00 0.24 -0.10 -1.58 -0.92 0.00 0.00 175.35 172.99 1zrp s TRP 3 N 0.22 2.89 0.55 3.18 0.52 -0.42 -2.24 118.94 123.64 1zrp s TRP 3 Ca -0.12 -1.15 -0.06 0.00 0.02 0.00 0.00 56.10 54.79 1zrp s TRP 3 Cb -0.16 -2.03 -0.01 0.00 -1.15 0.00 0.00 33.47 30.12 1zrp s TRP 3 CO 0.06 -0.61 0.86 0.54 0.02 0.00 0.00 176.95 177.82 1zrp s VAL 4 N 1.34 4.28 -0.28 4.03 0.11 0.20 0.59 120.40 130.68 1zrp s VAL 4 Ca 0.04 0.16 -0.23 0.00 -2.93 0.00 0.00 61.98 59.03 1zrp s VAL 4 Cb -0.14 -3.67 -0.01 0.00 -1.53 0.00 0.00 36.38 31.04 1zrp s VAL 4 CO -0.06 -0.69 0.74 0.00 -3.33 0.00 0.00 175.10 171.76 1zrp n LYS 6 N 6.00 1.62 0.00 0.00 4.76 -0.89 -1.63 118.16 128.02 1zrp n LYS 6 Ca 0.02 -0.73 0.00 0.00 -2.87 0.00 0.00 58.31 54.74 1zrp n LYS 6 Cb 0.48 -1.32 0.00 0.00 -1.84 0.00 0.00 35.03 32.35 1zrp n LYS 6 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1zrp n ILE 7 N 0.09 0.00 0.06 -0.18 -0.00 -1.26 -4.92 119.36 113.15 1zrp n ILE 7 Ca 0.07 0.07 -0.20 0.00 -0.00 0.00 0.00 62.75 62.69 1zrp n ILE 7 Cb 0.27 -0.99 -0.15 0.00 -0.00 0.00 0.00 39.64 38.77 1zrp n ILE 7 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1zrp n GLY 9 N 1.79 1.31 3.74 0.00 0.00 -0.65 -5.06 105.19 106.31 1zrp n GLY 9 Ca -0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 1zrp n GLY 9 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1zrp s TYR 10 N -2.00 2.36 0.13 1.61 5.04 -1.26 -4.78 117.35 118.45 1zrp s TYR 10 Ca 0.00 1.48 0.07 0.00 -2.44 0.00 0.00 57.07 56.18 1zrp s TYR 10 Cb 0.00 -3.12 -0.04 0.00 0.35 0.00 0.00 41.96 39.16 1zrp s TYR 10 CO 0.00 -2.15 -0.16 0.42 -1.34 0.00 0.00 175.55 172.32 1zrp s ILE 11 N -2.87 1.55 -0.08 3.14 -1.09 -1.26 0.60 121.20 121.18 1zrp s ILE 11 Ca 0.63 -1.75 0.03 0.00 -2.23 0.00 0.00 60.65 57.32 1zrp s ILE 11 Cb -0.18 -1.63 -0.02 0.00 -1.58 0.00 0.00 42.46 39.05 1zrp s ILE 11 CO 0.57 -0.33 -0.17 -0.47 -1.23 0.00 0.00 174.94 173.31 1zrp s TYR 12 N -1.95 2.68 -0.28 3.97 5.04 0.20 -4.96 117.35 122.04 1zrp s TYR 12 Ca 0.11 -0.49 0.01 0.00 -2.44 0.00 0.00 57.07 54.25 1zrp s TYR 12 Cb -0.06 -1.70 0.06 0.00 0.35 0.00 0.00 41.96 40.60 1zrp s TYR 12 CO 0.04 -0.07 -0.05 0.34 -1.34 0.00 0.00 175.55 174.47 1zrp s ASP 13 N -0.17 4.65 0.56 4.32 2.15 -1.26 -1.30 116.67 125.62 1zrp s ASP 13 Ca -0.01 -1.40 0.32 0.00 0.43 0.00 0.00 52.55 51.89 1zrp s ASP 13 Cb -0.14 -1.62 1.64 0.00 -0.30 0.00 0.00 42.92 42.50 1zrp s ASP 13 CO 0.03 -0.23 2.12 -0.33 -0.17 0.00 0.00 175.17 176.59 1zrp h GLU 14 N 7.86 0.00 -0.09 4.34 5.08 -1.69 0.89 114.58 130.96 1zrp h GLU 14 Ca -0.19 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.06 1zrp h GLU 14 Cb 1.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 1zrp h GLU 14 CO 0.50 0.07 -0.44 0.22 -1.00 0.00 0.00 179.01 178.35 1zrp h ASP 15 N 0.00 0.22 0.20 1.42 3.58 -1.80 -3.09 116.42 116.96 1zrp h ASP 15 Ca -0.00 -0.10 -0.34 0.00 0.42 0.00 0.00 57.03 57.01 1zrp h ASP 15 Cb 0.30 -0.06 -0.06 0.00 1.72 0.00 0.00 39.33 41.23 1zrp h ASP 15 CO 0.01 0.64 -2.11 0.00 -2.88 0.00 0.00 179.24 174.90 1zrp n ALA 16 N -2.47 1.49 -0.08 -0.78 0.00 0.16 -4.20 120.51 114.62 1zrp n ALA 16 Ca -0.02 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.34 1zrp n ALA 16 Cb 0.50 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.48 1zrp n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zrp n GLY 17 N 1.68 -0.25 2.59 0.00 0.00 0.26 -4.34 105.19 105.13 1zrp n GLY 17 Ca -0.27 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.58 1zrp n GLY 17 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zrp n ASP 18 N 0.85 -0.99 0.31 1.61 2.03 -0.95 -4.48 116.55 114.93 1zrp n ASP 18 Ca 0.00 -3.10 0.11 0.00 0.52 0.00 0.00 54.79 52.32 1zrp n ASP 18 Cb 0.00 0.78 0.61 0.00 -0.72 0.00 0.00 41.12 41.80 1zrp n ASP 18 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1zrp h PRO 19 N 2.75 0.00 -0.75 -0.67 0.13 -1.81 0.65 132.00 132.30 1zrp h PRO 19 Ca -0.10 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.02 1zrp h PRO 19 Cb 1.13 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.23 1zrp h PRO 19 CO 0.22 0.00 0.44 0.22 -0.23 0.00 0.00 178.00 178.65 1zrp h ASP 20 N 0.00 0.91 0.00 1.44 3.58 -1.94 -2.30 116.42 118.11 1zrp h ASP 20 Ca 0.00 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1zrp h ASP 20 Cb 0.90 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.72 1zrp h ASP 20 CO 0.00 0.71 -0.02 0.59 -2.88 0.00 0.00 179.24 177.64 1zrp n ASN 21 N -4.38 2.24 -2.18 2.28 3.02 0.20 -4.99 115.26 111.45 1zrp n ASN 21 Ca 0.08 -2.98 -0.08 0.00 -0.03 0.00 0.00 54.58 51.58 1zrp n ASN 21 Cb 0.07 -0.39 0.04 0.00 -0.61 0.00 0.00 39.78 38.89 1zrp n ASN 21 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1zrp n GLY 22 N -1.33 0.03 3.45 7.41 0.00 0.56 -5.04 105.19 110.28 1zrp n GLY 22 Ca 0.14 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1zrp n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1zrp s ILE 23 N -3.17 4.13 0.21 -0.61 1.09 -0.68 -4.92 121.20 117.25 1zrp s ILE 23 Ca 0.07 -0.25 -0.30 0.00 -1.10 0.00 0.00 60.65 59.07 1zrp s ILE 23 Cb -0.01 -2.89 -0.09 0.00 -1.06 0.00 0.00 42.46 38.42 1zrp s ILE 23 CO 0.34 0.40 1.22 -0.55 -0.10 0.00 0.00 174.94 176.25 1zrp s SER 24 N 1.20 7.04 -0.26 3.58 0.15 -1.26 -2.24 113.70 121.91 1zrp s SER 24 Ca 0.04 2.32 -0.25 0.00 0.70 0.00 0.00 55.95 58.75 1zrp s SER 24 Cb -0.14 -2.61 -0.29 0.00 -1.71 0.00 0.00 66.02 61.27 1zrp s SER 24 CO 0.02 -0.39 1.57 -0.81 1.20 0.00 0.00 173.24 174.82 1zrp n PRO 25 N 2.24 0.02 0.00 5.44 -0.05 -1.26 -1.14 135.00 140.25 1zrp n PRO 25 Ca 0.04 -1.01 0.00 0.00 -0.05 0.00 0.00 63.50 62.48 1zrp n PRO 25 Cb 0.44 -2.61 0.00 0.00 -0.05 0.00 0.00 33.50 31.28 1zrp n PRO 25 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1zrp n GLY 26 N 5.08 0.18 3.72 0.55 0.00 -1.17 -4.86 105.19 108.69 1zrp n GLY 26 Ca 0.38 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 46.04 1zrp n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1zrp s THR 27 N 0.00 2.06 0.47 2.61 2.01 -0.29 -4.92 115.64 117.58 1zrp s THR 27 Ca 0.00 0.03 0.04 0.00 0.31 0.00 0.00 61.69 62.07 1zrp s THR 27 Cb 0.00 -2.73 -0.04 0.00 0.01 0.00 0.00 72.50 69.74 1zrp s THR 27 CO 0.00 -0.01 0.04 -1.59 -0.69 0.00 0.00 174.62 172.37 1zrp s LYS 28 N -3.75 2.11 0.03 4.92 0.00 -1.26 -4.50 119.74 117.30 1zrp s LYS 28 Ca 0.78 -2.23 -0.22 0.00 0.00 0.00 0.00 55.97 54.31 1zrp s LYS 28 Cb -0.33 -1.64 -0.12 0.00 0.00 0.00 0.00 37.83 35.74 1zrp s LYS 28 CO 0.45 -0.24 1.28 0.35 0.00 0.00 0.00 175.35 177.19 1zrp h PHE 29 N 1.48 -0.72 0.00 1.78 3.57 -1.96 -0.20 116.94 120.89 1zrp h PHE 29 Ca -0.43 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.05 1zrp h PHE 29 Cb 1.28 0.24 0.00 0.00 2.79 0.00 0.00 35.95 40.26 1zrp h PHE 29 CO 1.13 -0.45 0.00 -1.91 -2.23 0.00 0.00 178.31 174.85 1zrp n GLU 30 N -4.15 0.94 0.00 1.11 4.07 -1.26 0.59 120.64 121.94 1zrp n GLU 30 Ca -0.10 0.00 0.10 0.00 -0.06 0.00 0.00 57.16 57.10 1zrp n GLU 30 Cb 0.31 -1.03 -0.09 0.00 -0.06 0.00 0.00 31.44 30.56 1zrp n GLU 30 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1zrp n GLU 31 N -0.53 0.56 -0.72 5.31 0.00 -0.41 -4.96 120.64 119.89 1zrp n GLU 31 Ca 0.01 -0.18 -0.31 0.00 0.00 0.00 0.00 57.16 56.69 1zrp n GLU 31 Cb 0.01 -1.44 0.16 0.00 0.00 0.00 0.00 31.44 30.17 1zrp n GLU 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1zrp s LEU 32 N -2.84 2.86 0.41 4.31 1.43 0.20 -4.85 118.68 120.19 1zrp s LEU 32 Ca 0.09 2.18 -0.23 0.00 -1.03 0.00 0.00 54.13 55.14 1zrp s LEU 32 Cb 0.15 -4.57 -0.12 0.00 0.03 0.00 0.00 46.19 41.69 1zrp s LEU 32 CO 0.77 -3.07 0.73 -0.81 0.23 0.00 0.00 176.35 174.20 1zrp n PRO 33 N -4.21 0.84 -0.23 1.29 -0.04 -1.26 -4.90 135.00 126.48 1zrp n PRO 33 Ca 0.12 0.30 -0.06 0.00 -0.04 0.00 0.00 63.50 63.82 1zrp n PRO 33 Cb 0.52 -1.69 0.04 0.00 -0.04 0.00 0.00 33.50 32.33 1zrp n PRO 33 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1zrp h ASP 34 N 1.08 0.80 0.67 3.54 5.19 -1.97 -1.77 116.42 123.96 1zrp h ASP 34 Ca -0.41 -0.09 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 1zrp h ASP 34 Cb 1.38 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 40.68 1zrp h ASP 34 CO 0.54 0.66 0.00 0.47 -3.12 0.00 0.00 179.24 177.79 1zrp n ASP 35 N -4.55 0.60 -4.73 6.45 8.00 -1.26 -4.86 116.55 116.20 1zrp n ASP 35 Ca 0.05 0.65 -0.42 0.00 0.71 0.00 0.00 54.79 55.78 1zrp n ASP 35 Cb 0.08 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.12 40.38 1zrp n ASP 35 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1zrp s TRP 36 N -3.30 2.84 0.29 1.24 -0.00 -0.67 -4.85 118.94 114.50 1zrp s TRP 36 Ca 0.04 0.56 0.04 0.00 -0.00 0.00 0.00 56.10 56.74 1zrp s TRP 36 Cb 0.09 -4.10 -0.01 0.00 -0.00 0.00 0.00 33.47 29.44 1zrp s TRP 36 CO 0.37 -3.95 0.14 1.33 -0.00 0.00 0.00 176.95 174.84 1zrp n VAL 37 N 3.14 0.00 -2.24 5.86 0.24 -1.26 -1.70 118.33 122.36 1zrp n VAL 37 Ca 0.12 -1.83 -0.42 0.00 -2.04 0.00 0.00 64.34 60.17 1zrp n VAL 37 Cb 0.36 0.74 -0.03 0.00 -1.47 0.00 0.00 33.84 33.44 1zrp n VAL 37 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1zrp h PRO 39 N 7.98 0.00 0.00 0.00 0.13 -1.98 -1.64 132.00 136.49 1zrp h PRO 39 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1zrp h PRO 39 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1zrp h PRO 39 CO 0.91 0.00 0.00 -0.89 -0.23 0.00 0.00 178.00 177.79 1zrp n ILE 40 N -3.35 0.00 0.19 -3.56 -0.00 -1.26 -4.84 119.36 106.55 1zrp n ILE 40 Ca -0.01 0.00 0.09 0.00 -0.00 0.00 0.00 62.75 62.83 1zrp n ILE 40 Cb 0.27 -0.72 0.17 0.00 -0.00 0.00 0.00 39.64 39.36 1zrp n ILE 40 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1zrp n GLY 42 N 1.02 0.45 3.79 0.00 0.00 -0.62 -5.01 105.19 104.82 1zrp n GLY 42 Ca 0.03 -0.84 -0.38 0.00 0.00 0.00 0.00 46.02 44.83 1zrp n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zrp s ALA 43 N -2.18 3.38 0.92 4.61 0.00 -1.26 -4.67 121.76 122.55 1zrp s ALA 43 Ca 0.00 0.34 -0.11 0.00 0.00 0.00 0.00 51.96 52.20 1zrp s ALA 43 Cb -0.00 -2.97 0.12 0.00 0.00 0.00 0.00 23.12 20.27 1zrp s ALA 43 CO 0.00 0.28 1.00 -2.30 0.00 0.00 0.00 175.76 174.73 1zrp n PRO 44 N 1.06 -0.42 0.08 0.00 -0.02 -1.26 0.58 135.00 135.02 1zrp n PRO 44 Ca -0.03 -0.06 0.05 0.00 -2.02 0.00 0.00 63.50 61.45 1zrp n PRO 44 Cb 0.50 -2.27 0.28 0.00 -0.02 0.00 0.00 33.50 31.98 1zrp n PRO 44 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1zrp n LYS 45 N -3.71 0.07 -0.70 -0.52 0.00 -0.69 -0.27 118.16 112.34 1zrp n LYS 45 Ca 0.11 0.56 0.01 0.00 0.00 0.00 0.00 58.31 58.99 1zrp n LYS 45 Cb 0.52 -1.72 0.26 0.00 0.00 0.00 0.00 35.03 34.10 1zrp n LYS 45 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1zrp n SER 46 N -1.86 4.26 -0.89 3.14 2.88 -1.26 -2.14 113.62 117.74 1zrp n SER 46 Ca -0.01 -2.77 0.02 0.00 -1.33 0.00 0.00 58.87 54.78 1zrp n SER 46 Cb 0.02 -0.66 0.01 0.00 -0.75 0.00 0.00 64.21 62.83 1zrp n SER 46 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1zrp n GLU 47 N 0.23 0.01 -3.47 -1.46 -0.58 0.62 -5.03 120.64 110.96 1zrp n GLU 47 Ca 0.25 -1.40 -0.42 0.00 -0.42 0.00 0.00 57.16 55.16 1zrp n GLU 47 Cb 1.02 -0.31 -0.10 0.00 -0.57 0.00 0.00 31.44 31.48 1zrp n GLU 47 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 1zrp s PHE 48 N -0.01 3.23 0.10 -0.32 0.40 -0.91 -2.09 117.98 118.38 1zrp s PHE 48 Ca 0.14 -0.48 -0.17 0.00 -0.60 0.00 0.00 56.93 55.82 1zrp s PHE 48 Cb 0.16 -2.58 -0.07 0.00 0.51 0.00 0.00 43.02 41.03 1zrp s PHE 48 CO -0.07 -0.54 0.55 -2.00 0.70 0.00 0.00 175.22 173.86 1zrp s GLU 49 N 1.72 4.08 -0.13 0.44 2.56 0.20 -4.81 118.70 122.76 1zrp s GLU 49 Ca 0.06 0.61 -0.17 0.00 0.00 0.00 0.00 54.97 55.47 1zrp s GLU 49 Cb -0.18 -3.10 -0.04 0.00 2.00 0.00 0.00 34.13 32.81 1zrp s GLU 49 CO 0.10 0.57 0.44 -1.59 -0.56 0.00 0.00 175.26 174.22 1zrp s LYS 50 N -1.49 4.31 -0.40 4.30 0.00 -1.26 0.58 119.74 125.79 1zrp s LYS 50 Ca 0.33 0.36 -0.12 0.00 0.00 0.00 0.00 55.97 56.54 1zrp s LYS 50 Cb -0.17 -3.44 0.01 0.00 0.00 0.00 0.00 37.83 34.23 1zrp s LYS 50 CO 0.19 0.16 0.44 -0.11 0.00 0.00 0.00 175.35 176.03 1zrp n LEU 51 N 3.72 -7.97 -4.33 2.77 0.00 -0.95 -4.95 117.00 105.28 1zrp n LEU 51 Ca -0.08 0.77 -0.46 0.00 0.00 0.00 0.00 56.01 56.23 1zrp n LEU 51 Cb 0.52 -3.39 -0.01 0.00 0.00 0.00 0.00 43.42 40.53 1zrp n LEU 51 CO 0.42 -2.59 0.53 -0.70 0.00 0.00 0.00 177.39 175.05 1zrp s GLU 52 N -2.36 3.77 0.00 1.96 -6.30 -1.26 -5.09 118.70 109.43 1zrp s GLU 52 Ca 0.19 -2.67 0.24 0.00 -2.50 0.00 0.00 54.97 50.22 1zrp s GLU 52 Cb -0.05 -4.47 0.21 0.00 0.00 0.00 0.00 34.13 29.82 1zrp s GLU 52 CO 0.77 -1.28 1.27 -0.25 0.02 0.00 0.00 175.26 175.80