#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 2.83 0.48 0.00 1.02 -1.26 -1.98 119.74 120.82 1zrp s LYS 2 Ca 0.00 -0.77 0.05 0.00 0.02 0.00 0.00 55.97 55.27 1zrp s LYS 2 Cb 0.00 -2.39 -0.02 0.00 -0.52 0.00 0.00 37.83 34.90 1zrp s LYS 2 CO 0.00 0.40 0.14 -1.58 -0.92 0.00 0.00 175.35 173.39 1zrp s TRP 3 N -0.16 2.12 0.01 3.18 0.52 0.49 -2.09 118.94 123.01 1zrp s TRP 3 Ca -0.02 -0.78 -0.01 0.00 0.02 0.00 0.00 56.10 55.30 1zrp s TRP 3 Cb -0.14 -1.80 -0.01 0.00 -1.15 0.00 0.00 33.47 30.37 1zrp s TRP 3 CO 0.04 0.10 0.01 0.54 0.02 0.00 0.00 176.95 177.65 1zrp s VAL 4 N -2.75 0.09 -0.36 4.03 0.11 -0.28 -0.20 120.40 121.04 1zrp s VAL 4 Ca 0.26 -0.75 -0.27 0.00 -2.93 0.00 0.00 61.98 58.29 1zrp s VAL 4 Cb 0.03 -0.26 0.02 0.00 -1.53 0.00 0.00 36.38 34.63 1zrp s VAL 4 CO 0.15 -0.41 0.97 0.00 -3.33 0.00 0.00 175.10 172.47 1zrp n LYS 6 N 6.82 2.91 0.00 0.00 3.00 -0.85 -1.61 118.16 128.42 1zrp n LYS 6 Ca 0.08 -1.63 0.00 0.00 -0.00 0.00 0.00 58.31 56.76 1zrp n LYS 6 Cb 0.48 -1.82 0.00 0.00 0.00 0.00 0.00 35.03 33.68 1zrp n LYS 6 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1zrp n ILE 7 N 0.37 0.00 0.03 3.15 2.08 -1.25 -4.84 119.36 118.90 1zrp n ILE 7 Ca 0.14 0.41 -0.19 0.00 0.56 0.00 0.00 62.75 63.68 1zrp n ILE 7 Cb 0.69 -1.36 -0.14 0.00 -0.75 0.00 0.00 39.64 38.08 1zrp n ILE 7 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1zrp n GLY 9 N 1.83 1.89 3.92 0.00 0.00 -0.63 -5.11 105.19 107.09 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 2.93 -0.00 1.61 5.04 -1.23 -4.88 117.35 118.81 1zrp s TYR 10 Ca 0.00 0.50 0.01 0.00 -2.44 0.00 0.00 57.07 55.14 1zrp s TYR 10 Cb 0.00 -3.24 0.00 0.00 0.35 0.00 0.00 41.96 39.07 1zrp s TYR 10 CO 0.00 -1.46 -0.02 0.42 -1.34 0.00 0.00 175.55 173.14 1zrp s ILE 11 N -3.30 0.18 -0.22 3.14 1.09 -1.26 0.58 121.20 121.41 1zrp s ILE 11 Ca 0.60 -0.08 -0.13 0.00 -1.10 0.00 0.00 60.65 59.94 1zrp s ILE 11 Cb -0.11 -0.17 -0.04 0.00 -1.06 0.00 0.00 42.46 41.07 1zrp s ILE 11 CO 0.45 0.06 0.28 -0.47 -0.10 0.00 0.00 174.94 175.17 1zrp s TYR 12 N 0.06 3.34 -0.36 3.97 5.04 0.72 -4.94 117.35 125.17 1zrp s TYR 12 Ca -0.00 0.41 -0.09 0.00 -2.44 0.00 0.00 57.07 54.95 1zrp s TYR 12 Cb -0.02 -2.40 0.03 0.00 0.35 0.00 0.00 41.96 39.92 1zrp s TYR 12 CO -0.00 0.02 0.16 0.34 -1.34 0.00 0.00 175.55 174.73 1zrp s ASP 13 N 1.08 5.55 0.43 4.32 -1.08 -1.26 -0.38 116.67 125.32 1zrp s ASP 13 Ca 0.13 -1.08 0.16 0.00 -0.52 0.00 0.00 52.55 51.25 1zrp s ASP 13 Cb -0.14 -1.95 0.97 0.00 -1.46 0.00 0.00 42.92 40.33 1zrp s ASP 13 CO 0.06 -0.36 1.94 -0.33 0.52 0.00 0.00 175.17 177.00 1zrp h GLU 14 N 8.34 0.00 0.00 4.34 5.08 -1.64 -1.78 114.58 128.91 1zrp h GLU 14 Ca -0.24 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.07 1zrp h GLU 14 Cb 1.09 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1zrp h GLU 14 CO 0.64 0.25 -0.20 0.22 -1.00 0.00 0.00 179.01 178.91 1zrp h ASP 15 N 0.00 0.00 0.27 1.42 3.58 -1.80 -1.52 116.42 118.37 1zrp h ASP 15 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1zrp h ASP 15 Cb 0.47 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.52 1zrp h ASP 15 CO 0.03 0.20 -1.64 0.00 -2.88 0.00 0.00 179.24 174.96 1zrp n ALA 16 N -2.33 2.88 -0.07 -0.78 0.00 -0.69 -3.67 120.51 115.84 1zrp n ALA 16 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1zrp n ALA 16 Cb 0.31 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.91 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 1.26 0.53 2.92 0.00 0.00 -1.08 -3.52 105.19 105.30 1zrp n GLY 17 Ca -0.02 -0.89 0.01 0.00 0.00 0.00 0.00 46.02 45.12 1zrp n GLY 17 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1zrp s ASP 18 N -4.00 -0.75 0.53 1.61 1.47 0.20 -4.56 116.67 111.16 1zrp s ASP 18 Ca 0.00 -0.40 0.33 0.00 1.18 0.00 0.00 52.55 53.66 1zrp s ASP 18 Cb 0.00 0.97 1.49 0.00 -0.34 0.00 0.00 42.92 45.03 1zrp s ASP 18 CO 0.00 -0.08 1.84 -0.65 0.68 0.00 0.00 175.17 176.96 1zrp h PRO 19 N 5.94 0.03 0.00 2.11 0.10 -1.84 0.69 132.00 139.02 1zrp h PRO 19 Ca -0.01 -0.00 0.00 0.00 0.10 0.00 0.00 66.00 66.09 1zrp h PRO 19 Cb 1.21 -0.01 0.00 0.00 0.10 0.00 0.00 31.00 32.31 1zrp h PRO 19 CO -0.01 0.02 0.00 0.22 0.10 0.00 0.00 178.00 178.33 1zrp h ASP 20 N 0.03 0.00 0.00 -2.05 1.82 -1.96 -2.35 116.42 111.91 1zrp h ASP 20 Ca 0.50 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.14 1zrp h ASP 20 Cb 1.94 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.95 1zrp h ASP 20 CO -0.03 0.00 -0.22 0.59 -1.61 0.00 0.00 179.24 177.98 1zrp n ASN 21 N -2.70 1.12 -3.20 2.28 3.02 -0.64 -5.01 115.26 110.12 1zrp n ASN 21 Ca 0.03 -2.38 -0.16 0.00 -0.03 0.00 0.00 54.58 52.04 1zrp n ASN 21 Cb 0.39 -0.27 0.08 0.00 -0.61 0.00 0.00 39.78 39.37 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 -0.64 -0.29 3.63 7.41 0.00 0.12 -4.99 105.19 110.44 1zrp n GLY 22 Ca 0.07 0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.32 5.10 0.16 -0.61 1.09 0.20 -4.87 121.20 118.94 1zrp s ILE 23 Ca 0.03 0.09 -0.24 0.00 -1.10 0.00 0.00 60.65 59.43 1zrp s ILE 23 Cb -0.01 -3.36 -0.08 0.00 -1.06 0.00 0.00 42.46 37.95 1zrp s ILE 23 CO 0.66 0.37 0.75 -0.55 -0.10 0.00 0.00 174.94 176.07 1zrp s SER 24 N 0.94 7.33 -0.24 3.58 0.15 -1.26 0.58 113.70 124.77 1zrp s SER 24 Ca 0.06 1.58 -0.29 0.00 0.70 0.00 0.00 55.95 58.00 1zrp s SER 24 Cb -0.13 -2.48 -0.33 0.00 -1.71 0.00 0.00 66.02 61.37 1zrp s SER 24 CO 0.03 0.21 1.70 -2.65 1.20 0.00 0.00 173.24 173.73 1zrp n PRO 25 N 1.55 0.28 0.00 5.44 -0.02 -1.23 -1.07 135.00 139.96 1zrp n PRO 25 Ca -0.06 -1.23 0.00 0.00 -2.02 0.00 0.00 63.50 60.19 1zrp n PRO 25 Cb 0.49 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.25 1zrp n PRO 25 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zrp n GLY 26 N 5.04 0.23 3.64 -1.23 0.00 -0.58 -4.63 105.19 107.66 1zrp n GLY 26 Ca 0.47 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 46.17 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 2.10 0.43 2.61 2.01 -0.23 -4.85 115.64 117.71 1zrp s THR 27 Ca 0.00 0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.10 1zrp s THR 27 Cb 0.00 -2.08 -0.03 0.00 0.01 0.00 0.00 72.50 70.40 1zrp s THR 27 CO 0.00 -0.04 0.24 -0.75 -0.69 0.00 0.00 174.62 173.38 1zrp s LYS 28 N -4.62 2.29 0.02 4.92 2.20 -1.26 -4.53 119.74 118.76 1zrp s LYS 28 Ca 0.67 -1.83 -0.17 0.00 -0.36 0.00 0.00 55.97 54.28 1zrp s LYS 28 Cb -0.23 -2.06 -0.09 0.00 -1.51 0.00 0.00 37.83 33.94 1zrp s LYS 28 CO 0.59 -0.20 1.17 0.35 -0.36 0.00 0.00 175.35 176.90 1zrp h PHE 29 N 1.26 -0.56 0.00 4.03 3.57 -1.96 0.40 116.94 123.68 1zrp h PHE 29 Ca -0.42 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1zrp h PHE 29 Cb 1.26 0.19 0.00 0.00 2.79 0.00 0.00 35.95 40.19 1zrp h PHE 29 CO 0.68 -0.35 0.00 -1.91 -2.23 0.00 0.00 178.31 174.50 1zrp n GLU 30 N -3.74 0.96 -0.43 1.11 0.00 -1.26 0.58 120.64 117.86 1zrp n GLU 30 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.16 1zrp n GLU 30 Cb 0.24 -1.14 0.24 0.00 0.00 0.00 0.00 31.44 30.78 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 -0.64 2.66 -1.62 5.31 -0.58 -0.29 -5.00 120.64 120.48 1zrp n GLU 31 Ca 0.06 -2.84 -0.29 0.00 -0.42 0.00 0.00 57.16 53.68 1zrp n GLU 31 Cb 0.03 -1.81 0.14 0.00 -0.57 0.00 0.00 31.44 29.23 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 -2.87 2.10 0.92 -4.62 1.43 0.20 -4.37 118.68 111.48 1zrp s LEU 32 Ca 0.41 0.83 -0.15 0.00 -1.03 0.00 0.00 54.13 54.19 1zrp s LEU 32 Cb 0.34 -3.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 1zrp s LEU 32 CO 0.08 -2.55 0.02 -2.65 0.23 0.00 0.00 176.35 171.48 1zrp n PRO 33 N -3.74 -0.12 0.00 1.29 -0.02 -1.26 -4.89 135.00 126.27 1zrp n PRO 33 Ca 0.08 -0.01 -0.11 0.00 -2.02 0.00 0.00 63.50 61.44 1zrp n PRO 33 Cb 0.60 -1.55 -0.06 0.00 -0.02 0.00 0.00 33.50 32.46 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 -1.19 0.09 -0.82 2.55 3.32 -1.99 -2.46 116.42 115.92 1zrp h ASP 34 Ca -0.44 -0.08 -0.57 0.00 0.02 0.00 0.00 57.03 55.96 1zrp h ASP 34 Cb 1.30 -0.02 -0.41 0.00 0.22 0.00 0.00 39.33 40.42 1zrp h ASP 34 CO 0.32 0.15 -0.59 0.47 -1.72 0.00 0.00 179.24 177.87 1zrp n ASP 35 N -4.99 5.30 -4.75 6.45 8.00 -1.26 -5.05 116.55 120.25 1zrp n ASP 35 Ca -0.06 -3.75 -0.42 0.00 0.71 0.00 0.00 54.79 51.27 1zrp n ASP 35 Cb 0.07 -0.43 -0.02 0.00 -0.02 0.00 0.00 41.12 40.72 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 -3.63 2.81 0.29 1.24 -0.00 -0.93 -4.83 118.94 113.89 1zrp s TRP 36 Ca 0.53 0.77 0.02 0.00 -0.00 0.00 0.00 56.10 57.42 1zrp s TRP 36 Cb 0.42 -4.04 -0.05 0.00 -0.00 0.00 0.00 33.47 29.80 1zrp s TRP 36 CO 0.02 -3.52 0.09 0.14 -0.00 0.00 0.00 176.95 173.68 1zrp s VAL 37 N 0.14 0.76 0.04 5.86 -7.23 -1.26 -1.71 120.40 117.00 1zrp s VAL 37 Ca 0.64 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.51 1zrp s VAL 37 Cb -0.47 -2.68 -0.08 0.00 0.56 0.00 0.00 36.38 33.72 1zrp s VAL 37 CO 0.45 0.00 1.68 0.00 -0.31 0.00 0.00 175.10 176.92 1zrp h PRO 39 N 8.76 0.00 0.00 0.00 0.13 -1.97 -1.67 132.00 137.24 1zrp h PRO 39 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1zrp h PRO 39 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1zrp h PRO 39 CO 0.94 0.00 0.00 -0.89 -0.23 0.00 0.00 178.00 177.82 1zrp n ILE 40 N -3.45 0.00 0.17 -3.56 -0.00 -1.26 -4.83 119.36 106.42 1zrp n ILE 40 Ca 0.01 0.00 0.07 0.00 -0.00 0.00 0.00 62.75 62.83 1zrp n ILE 40 Cb 0.37 -0.75 0.08 0.00 -0.00 0.00 0.00 39.64 39.34 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 1.18 0.70 3.58 0.00 0.00 -0.63 -5.01 105.19 105.01 1zrp n GLY 42 Ca 0.03 -0.72 -0.42 0.00 0.00 0.00 0.00 46.02 44.90 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 3.43 1.05 4.61 0.00 -1.26 -4.62 121.76 122.97 1zrp s ALA 43 Ca 0.00 -0.67 -0.21 0.00 0.00 0.00 0.00 51.96 51.08 1zrp s ALA 43 Cb 0.00 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1zrp s ALA 43 CO 0.00 -1.48 -0.54 -2.30 0.00 0.00 0.00 175.76 171.43 1zrp n PRO 44 N 6.40 -0.81 0.03 0.00 -0.02 -1.26 -0.54 135.00 138.80 1zrp n PRO 44 Ca 0.03 -0.22 0.03 0.00 -2.02 0.00 0.00 63.50 61.31 1zrp n PRO 44 Cb 0.48 -1.42 0.13 0.00 -0.02 0.00 0.00 33.50 32.66 1zrp n PRO 44 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1zrp n LYS 45 N -0.13 0.03 -0.34 -0.52 -0.00 -0.70 -1.73 118.16 114.77 1zrp n LYS 45 Ca 0.00 0.50 -0.04 0.00 -0.00 0.00 0.00 58.31 58.77 1zrp n LYS 45 Cb 0.65 -1.58 0.09 0.00 -0.00 0.00 0.00 35.03 34.20 1zrp n LYS 45 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1zrp h SER 46 N 0.00 1.13 -0.47 -5.58 4.64 -1.87 -2.16 113.55 109.24 1zrp h SER 46 Ca 0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1zrp h SER 46 Cb 0.03 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 61.83 1zrp h SER 46 CO 0.00 0.90 0.00 -0.62 -0.87 0.00 0.00 176.83 176.24 1zrp n GLU 47 N -4.33 4.19 -3.66 4.77 4.71 -0.70 -4.82 120.64 120.80 1zrp n GLU 47 Ca 0.10 -2.58 -0.36 0.00 -0.01 0.00 0.00 57.16 54.31 1zrp n GLU 47 Cb 0.09 -2.13 -0.08 0.00 -1.01 0.00 0.00 31.44 28.32 1zrp n GLU 47 CO 0.00 0.00 0.00 -0.06 0.09 0.00 0.00 177.13 177.16 1zrp s PHE 48 N -2.43 3.44 0.79 -0.32 0.40 -0.81 -2.01 117.98 117.03 1zrp s PHE 48 Ca 0.45 0.45 -0.04 0.00 -0.60 0.00 0.00 56.93 57.18 1zrp s PHE 48 Cb 0.34 -2.22 0.15 0.00 0.51 0.00 0.00 43.02 41.80 1zrp s PHE 48 CO 0.13 0.30 1.08 -2.00 0.70 0.00 0.00 175.22 175.43 1zrp s GLU 49 N 0.31 1.37 0.02 0.44 -6.30 0.20 -4.88 118.70 109.87 1zrp s GLU 49 Ca 0.12 -1.01 0.08 0.00 -2.50 0.00 0.00 54.97 51.66 1zrp s GLU 49 Cb -0.12 -2.22 -0.03 0.00 0.00 0.00 0.00 34.13 31.76 1zrp s GLU 49 CO 0.01 -1.72 -0.24 -1.59 0.02 0.00 0.00 175.26 171.74 1zrp s LYS 50 N -5.33 1.96 -1.36 4.30 0.00 -1.26 -1.13 119.74 116.92 1zrp s LYS 50 Ca 0.69 -1.02 -0.09 0.00 0.00 0.00 0.00 55.97 55.54 1zrp s LYS 50 Cb -0.04 -2.05 0.01 0.00 0.00 0.00 0.00 37.83 35.75 1zrp s LYS 50 CO 0.47 0.53 1.17 1.28 0.00 0.00 0.00 175.35 178.80 1zrp n LEU 51 N 1.92 -3.38 0.00 2.77 4.32 -0.89 -4.54 117.00 117.21 1zrp n LEU 51 Ca -0.17 -0.53 0.00 0.00 -0.02 0.00 0.00 56.01 55.30 1zrp n LEU 51 Cb 0.52 -3.03 0.00 0.00 -1.62 0.00 0.00 43.42 39.29 1zrp n LEU 51 CO 0.24 0.64 0.00 1.21 -1.22 0.00 0.00 177.39 178.26 1zrp n GLU 52 N -4.97 0.00 0.00 3.23 2.13 -1.26 -5.08 120.64 114.68 1zrp n GLU 52 Ca 0.01 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.93 1zrp n GLU 52 Cb 0.56 0.00 0.09 0.00 0.27 0.00 0.00 31.44 32.36 1zrp n GLU 52 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47