#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 3.25 0.15 0.00 -2.85 -1.26 -1.77 119.74 117.25 1zrp s LYS 2 Ca 0.00 -0.70 0.04 0.00 -1.00 0.00 0.00 55.97 54.31 1zrp s LYS 2 Cb 0.00 -2.94 -0.04 0.00 -2.06 0.00 0.00 37.83 32.79 1zrp s LYS 2 CO 0.00 -0.23 0.16 -1.58 0.10 0.00 0.00 175.35 173.80 1zrp s TRP 3 N 1.43 3.23 0.19 1.78 0.52 0.14 -2.18 118.94 124.05 1zrp s TRP 3 Ca 0.05 0.02 0.09 0.00 0.02 0.00 0.00 56.10 56.29 1zrp s TRP 3 Cb -0.14 -1.56 -0.04 0.00 -1.15 0.00 0.00 33.47 30.58 1zrp s TRP 3 CO -0.05 0.52 -0.19 0.54 0.02 0.00 0.00 176.95 177.79 1zrp s VAL 4 N -1.72 2.00 -0.37 4.03 0.11 0.12 0.08 120.40 124.66 1zrp s VAL 4 Ca 0.32 -2.02 -0.28 0.00 -2.93 0.00 0.00 61.98 57.06 1zrp s VAL 4 Cb -0.10 -1.97 0.02 0.00 -1.53 0.00 0.00 36.38 32.79 1zrp s VAL 4 CO 0.24 -0.31 1.04 0.00 -3.33 0.00 0.00 175.10 172.74 1zrp h LYS 6 N 8.46 0.00 0.00 0.00 3.64 -1.73 -1.85 116.57 125.09 1zrp h LYS 6 Ca -0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 1zrp h LYS 6 Cb 1.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1zrp h LYS 6 CO 1.04 0.04 -0.00 0.82 -2.27 0.00 0.00 179.45 179.07 1zrp h ILE 7 N 0.00 0.00 0.06 2.00 2.04 -1.91 -3.43 117.51 116.27 1zrp h ILE 7 Ca -0.00 -0.09 -0.33 0.00 1.00 0.00 0.00 64.86 65.44 1zrp h ILE 7 Cb 0.12 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.16 1zrp h ILE 7 CO 0.00 0.00 -1.89 0.00 0.00 0.00 0.00 178.15 176.26 1zrp n GLY 9 N 1.79 1.54 3.93 0.00 0.00 -0.70 -5.09 105.19 106.66 1zrp n GLY 9 Ca -0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 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 2.89 -0.03 1.61 5.04 -1.25 -4.87 117.35 118.74 1zrp s TYR 10 Ca 0.00 0.43 -0.03 0.00 -2.44 0.00 0.00 57.07 55.03 1zrp s TYR 10 Cb 0.00 -3.20 0.01 0.00 0.35 0.00 0.00 41.96 39.11 1zrp s TYR 10 CO 0.00 -1.43 0.08 0.42 -1.34 0.00 0.00 175.55 173.29 1zrp s ILE 11 N -3.25 0.01 -0.12 3.14 1.09 -1.26 0.60 121.20 121.40 1zrp s ILE 11 Ca 0.60 -0.06 -0.04 0.00 -1.10 0.00 0.00 60.65 60.05 1zrp s ILE 11 Cb -0.11 -0.14 -0.04 0.00 -1.06 0.00 0.00 42.46 41.12 1zrp s ILE 11 CO 0.45 -0.03 0.05 -0.47 -0.10 0.00 0.00 174.94 174.84 1zrp s TYR 12 N -0.06 3.30 -0.24 3.97 5.04 0.11 -4.96 117.35 124.51 1zrp s TYR 12 Ca -0.01 0.25 0.02 0.00 -2.44 0.00 0.00 57.07 54.89 1zrp s TYR 12 Cb -0.01 -1.90 0.06 0.00 0.35 0.00 0.00 41.96 40.46 1zrp s TYR 12 CO 0.00 0.46 -0.09 0.34 -1.34 0.00 0.00 175.55 174.92 1zrp s ASP 13 N -0.63 4.10 0.51 4.32 2.15 -1.26 0.28 116.67 126.14 1zrp s ASP 13 Ca 0.11 -1.25 0.34 0.00 0.43 0.00 0.00 52.55 52.18 1zrp s ASP 13 Cb -0.12 -1.39 1.79 0.00 -0.30 0.00 0.00 42.92 42.90 1zrp s ASP 13 CO 0.02 -0.19 2.05 -0.33 -0.17 0.00 0.00 175.17 176.55 1zrp h GLU 14 N 7.86 0.00 0.00 4.34 5.08 -1.56 0.66 114.58 130.95 1zrp h GLU 14 Ca -0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1zrp h GLU 14 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1zrp h GLU 14 CO 0.45 0.00 0.00 -3.47 -1.00 0.00 0.00 179.01 174.99 1zrp n ASP 15 N -2.75 0.00 0.28 1.42 2.03 -1.26 -1.32 116.55 114.95 1zrp n ASP 15 Ca -0.02 0.65 0.19 0.00 0.52 0.00 0.00 54.79 56.14 1zrp n ASP 15 Cb 0.10 -0.17 1.03 0.00 -0.72 0.00 0.00 41.12 41.36 1zrp n ASP 15 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1zrp h ALA 16 N -2.00 1.00 -1.15 -1.67 0.00 -0.19 -2.79 119.26 112.46 1zrp h ALA 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1zrp h ALA 16 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1zrp h ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1zrp n GLY 17 N -1.14 -0.06 2.62 0.00 0.00 0.52 -4.14 105.19 103.00 1zrp n GLY 17 Ca -0.02 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.46 2.06 0.23 1.61 2.03 -0.71 -4.46 116.55 114.84 1zrp n ASP 18 Ca 0.00 -2.90 0.08 0.00 0.52 0.00 0.00 54.79 52.48 1zrp n ASP 18 Cb 0.00 -0.52 0.41 0.00 -0.72 0.00 0.00 41.12 40.29 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 2.92 0.00 0.00 -0.67 0.13 -1.55 0.35 132.00 133.18 1zrp h PRO 19 Ca -0.02 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.10 1zrp h PRO 19 Cb 1.13 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 1zrp h PRO 19 CO 0.57 0.00 -0.04 -0.44 -0.23 0.00 0.00 178.00 177.86 1zrp h ASP 20 N 0.00 0.00 0.00 1.44 5.19 -1.91 -2.53 116.42 118.60 1zrp h ASP 20 Ca 0.00 0.00 -0.13 0.00 -0.62 0.00 0.00 57.03 56.28 1zrp h ASP 20 Cb 0.86 0.00 -0.29 0.00 0.18 0.00 0.00 39.33 40.08 1zrp h ASP 20 CO 0.00 0.04 -0.90 0.59 -3.12 0.00 0.00 179.24 175.85 1zrp n ASN 21 N -4.11 0.98 -1.15 6.45 3.02 0.11 -4.99 115.26 115.57 1zrp n ASN 21 Ca -0.03 -2.24 -0.02 0.00 -0.03 0.00 0.00 54.58 52.27 1zrp n ASN 21 Cb 0.12 -0.32 0.01 0.00 -0.61 0.00 0.00 39.78 38.98 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 0.22 0.45 3.27 7.41 0.00 -0.80 -5.06 105.19 110.68 1zrp n GLY 22 Ca 0.07 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 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 -3.03 2.48 0.30 -0.61 1.09 -0.45 -4.90 121.20 116.08 1zrp s ILE 23 Ca 0.01 -0.86 -0.28 0.00 -1.10 0.00 0.00 60.65 58.42 1zrp s ILE 23 Cb -0.00 -2.01 -0.09 0.00 -1.06 0.00 0.00 42.46 39.30 1zrp s ILE 23 CO 0.07 0.54 1.03 -0.44 -0.10 0.00 0.00 174.94 176.04 1zrp s SER 24 N 0.48 7.28 -0.84 3.58 0.01 -1.26 -1.63 113.70 121.31 1zrp s SER 24 Ca -0.13 2.09 -0.22 0.00 1.31 0.00 0.00 55.95 59.01 1zrp s SER 24 Cb -0.17 -2.61 -0.19 0.00 0.21 0.00 0.00 66.02 63.26 1zrp s SER 24 CO 0.05 -0.12 2.32 -0.81 0.41 0.00 0.00 173.24 175.09 1zrp n PRO 25 N 0.95 0.40 0.00 12.44 -0.04 -1.26 -1.07 135.00 146.42 1zrp n PRO 25 Ca 0.00 -0.67 0.00 0.00 -0.04 0.00 0.00 63.50 62.79 1zrp n PRO 25 Cb 0.47 -3.02 0.00 0.00 -0.04 0.00 0.00 33.50 30.91 1zrp n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zrp n GLY 26 N 6.44 0.53 3.83 0.55 0.00 -0.44 -4.84 105.19 111.27 1zrp n GLY 26 Ca 0.51 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.20 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 -0.62 4.56 0.49 2.61 2.01 -0.23 -4.97 115.64 119.48 1zrp s THR 27 Ca 0.00 1.20 -0.01 0.00 0.31 0.00 0.00 61.69 63.19 1zrp s THR 27 Cb 0.00 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.82 1zrp s THR 27 CO 0.00 -0.11 0.73 -0.75 -0.69 0.00 0.00 174.62 173.80 1zrp s LYS 28 N -2.76 3.01 0.02 4.92 2.47 -1.26 -4.44 119.74 121.70 1zrp s LYS 28 Ca 0.53 -0.38 -0.12 0.00 -1.56 0.00 0.00 55.97 54.45 1zrp s LYS 28 Cb -0.12 -2.48 -0.07 0.00 -1.46 0.00 0.00 37.83 33.70 1zrp s LYS 28 CO 0.18 -0.39 1.10 0.35 0.16 0.00 0.00 175.35 176.75 1zrp h PHE 29 N 0.24 -0.40 0.00 4.03 3.57 -1.96 -0.35 116.94 122.07 1zrp h PHE 29 Ca -0.46 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.03 1zrp h PHE 29 Cb 1.25 0.13 0.00 0.00 2.79 0.00 0.00 35.95 40.13 1zrp h PHE 29 CO 0.46 -0.25 0.00 -0.85 -2.23 0.00 0.00 178.31 175.43 1zrp n GLU 30 N -3.25 0.95 -0.95 1.11 -0.00 -1.26 0.27 120.64 117.51 1zrp n GLU 30 Ca -0.05 0.00 0.02 0.00 -0.00 0.00 0.00 57.16 57.13 1zrp n GLU 30 Cb 0.17 -1.19 0.37 0.00 -0.00 0.00 0.00 31.44 30.79 1zrp n GLU 30 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1zrp n GLU 31 N -0.69 4.49 -2.45 3.44 -0.58 -0.24 -4.92 120.64 119.69 1zrp n GLU 31 Ca 0.09 -3.11 -0.24 0.00 -0.42 0.00 0.00 57.16 53.47 1zrp n GLU 31 Cb 0.04 -2.25 0.09 0.00 -0.57 0.00 0.00 31.44 28.74 1zrp n GLU 31 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1zrp s LEU 32 N -2.82 2.99 0.75 -4.62 1.43 0.14 -4.53 118.68 112.02 1zrp s LEU 32 Ca 0.55 -0.02 -0.16 0.00 -1.03 0.00 0.00 54.13 53.47 1zrp s LEU 32 Cb 0.42 -2.51 -0.03 0.00 0.03 0.00 0.00 46.19 44.10 1zrp s LEU 32 CO 0.15 -1.69 0.48 -2.65 0.23 0.00 0.00 176.35 172.86 1zrp n PRO 33 N -2.81 0.22 0.07 1.29 -0.02 -1.26 -4.87 135.00 127.61 1zrp n PRO 33 Ca 0.12 0.11 -0.02 0.00 -2.02 0.00 0.00 63.50 61.69 1zrp n PRO 33 Cb 0.60 -1.80 0.25 0.00 -0.02 0.00 0.00 33.50 32.53 1zrp n PRO 33 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1zrp h ASP 34 N -0.53 0.33 -0.39 2.55 3.32 -1.97 -2.16 116.42 117.57 1zrp h ASP 34 Ca -0.45 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.48 1zrp h ASP 34 Cb 1.34 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 1zrp h ASP 34 CO 0.41 0.62 0.00 0.47 -1.72 0.00 0.00 179.24 179.03 1zrp n ASP 35 N -4.11 4.63 -4.57 6.45 9.92 -1.26 -4.85 116.55 122.75 1zrp n ASP 35 Ca -0.01 -3.00 -0.39 0.00 -0.53 0.00 0.00 54.79 50.86 1zrp n ASP 35 Cb 0.41 -0.61 -0.03 0.00 -0.64 0.00 0.00 41.12 40.25 1zrp n ASP 35 CO 0.00 0.00 0.00 0.86 0.13 0.00 0.00 177.20 178.19 1zrp s TRP 36 N -2.82 1.14 0.54 1.24 -0.00 -0.81 -4.94 118.94 113.29 1zrp s TRP 36 Ca 0.47 1.07 0.03 0.00 -0.00 0.00 0.00 56.10 57.67 1zrp s TRP 36 Cb 0.37 -3.76 0.02 0.00 -0.00 0.00 0.00 33.47 30.10 1zrp s TRP 36 CO 0.12 -3.23 0.21 0.14 -0.00 0.00 0.00 176.95 174.19 1zrp s VAL 37 N 10.28 1.31 0.06 5.86 -7.23 -1.26 -1.72 120.40 127.70 1zrp s VAL 37 Ca 0.98 -1.74 -0.30 0.00 -1.81 0.00 0.00 61.98 59.10 1zrp s VAL 37 Cb -0.24 -2.06 -0.09 0.00 0.56 0.00 0.00 36.38 34.56 1zrp s VAL 37 CO 0.30 0.00 1.76 0.00 -0.31 0.00 0.00 175.10 176.85 1zrp h PRO 39 N 8.98 0.00 0.00 0.00 0.11 -1.97 -1.70 132.00 137.42 1zrp h PRO 39 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1zrp h PRO 39 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1zrp h PRO 39 CO 0.94 0.00 0.00 -0.89 -0.21 0.00 0.00 178.00 177.84 1zrp n ILE 40 N -3.60 0.00 0.36 4.15 -0.00 -1.26 -4.83 119.36 114.18 1zrp n ILE 40 Ca 0.06 0.00 0.14 0.00 -0.00 0.00 0.00 62.75 62.94 1zrp n ILE 40 Cb 0.58 -0.62 0.41 0.00 -0.00 0.00 0.00 39.64 40.00 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 0.71 0.78 3.64 0.00 0.00 -0.64 -5.00 105.19 104.68 1zrp n GLY 42 Ca 0.03 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.00 3.57 1.15 4.61 0.00 -1.26 -4.54 121.76 123.29 1zrp s ALA 43 Ca 0.00 -0.66 -0.18 0.00 0.00 0.00 0.00 51.96 51.13 1zrp s ALA 43 Cb 0.00 -2.68 0.18 0.00 0.00 0.00 0.00 23.12 20.62 1zrp s ALA 43 CO 0.00 -0.48 0.30 -2.30 0.00 0.00 0.00 175.76 173.29 1zrp n PRO 44 N 4.91 -2.32 0.03 0.00 -0.02 -1.26 0.57 135.00 136.91 1zrp n PRO 44 Ca -0.08 -0.67 0.03 0.00 -2.02 0.00 0.00 63.50 60.76 1zrp n PRO 44 Cb 0.51 -1.73 0.14 0.00 -0.02 0.00 0.00 33.50 32.40 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 -2.85 0.03 -0.58 -0.52 4.81 -0.70 -1.57 118.16 116.78 1zrp n LYS 45 Ca 0.03 0.49 0.01 0.00 -0.87 0.00 0.00 58.31 57.98 1zrp n LYS 45 Cb 0.55 -1.59 0.23 0.00 0.02 0.00 0.00 35.03 34.24 1zrp n LYS 45 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1zrp n SER 46 N -1.64 3.82 -0.88 3.14 2.88 -1.26 -1.89 113.62 117.78 1zrp n SER 46 Ca 0.00 -2.63 0.01 0.00 -1.33 0.00 0.00 58.87 54.92 1zrp n SER 46 Cb 0.03 -0.63 -0.00 0.00 -0.75 0.00 0.00 64.21 62.86 1zrp n SER 46 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1zrp n GLU 47 N 0.25 0.00 -3.38 -1.46 0.00 -0.61 -5.03 120.64 110.41 1zrp n GLU 47 Ca 0.20 -1.20 -0.43 0.00 0.00 0.00 0.00 57.16 55.73 1zrp n GLU 47 Cb 0.89 -0.16 -0.09 0.00 0.00 0.00 0.00 31.44 32.07 1zrp n GLU 47 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.13 177.07 1zrp s PHE 48 N 0.00 3.20 0.85 4.31 0.40 -0.79 -2.14 117.98 123.81 1zrp s PHE 48 Ca 0.11 -0.48 -0.14 0.00 -0.60 0.00 0.00 56.93 55.82 1zrp s PHE 48 Cb 0.13 -2.76 0.21 0.00 0.51 0.00 0.00 43.02 41.10 1zrp s PHE 48 CO -0.06 -0.65 0.91 -1.91 0.70 0.00 0.00 175.22 174.21 1zrp n GLU 49 N 5.41 -1.92 -4.49 0.44 2.13 0.20 -4.81 120.64 117.60 1zrp n GLU 49 Ca -0.09 -1.44 -0.24 0.00 0.66 0.00 0.00 57.16 56.06 1zrp n GLU 49 Cb 0.47 -1.16 -0.13 0.00 0.27 0.00 0.00 31.44 30.89 1zrp n GLU 49 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1zrp s LYS 50 N -5.04 1.20 -0.22 5.31 1.02 -1.26 0.14 119.74 120.89 1zrp s LYS 50 Ca 0.56 -0.94 -0.10 0.00 0.02 0.00 0.00 55.97 55.51 1zrp s LYS 50 Cb -0.04 -1.32 0.04 0.00 -0.52 0.00 0.00 37.83 35.99 1zrp s LYS 50 CO 0.41 0.33 0.20 -0.11 -0.92 0.00 0.00 175.35 175.25 1zrp n LEU 51 N 1.69 -6.63 0.00 3.17 7.94 -0.93 -4.91 117.00 117.34 1zrp n LEU 51 Ca -0.18 2.13 -0.19 0.00 -1.11 0.00 0.00 56.01 56.66 1zrp n LEU 51 Cb 0.54 -3.33 0.18 0.00 0.53 0.00 0.00 43.42 41.35 1zrp n LEU 51 CO 0.23 -3.90 0.24 -0.62 -1.11 0.00 0.00 177.39 172.23 1zrp n GLU 52 N 1.47 -3.70 0.00 1.96 1.02 -1.26 -5.05 120.64 115.09 1zrp n GLU 52 Ca -0.33 -0.95 0.00 0.00 -0.02 0.00 0.00 57.16 55.86 1zrp n GLU 52 Cb 0.51 -1.19 0.00 0.00 -0.02 0.00 0.00 31.44 30.74 1zrp n GLU 52 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84