#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zrx n GLY 2 N 0.00 2.17 0.26 5.14 0.00 -1.26 -4.99 105.19 106.51 1zrx n GLY 2 Ca 0.00 -0.22 0.10 0.00 0.00 0.00 0.00 46.02 45.91 1zrx n GLY 2 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1zrx h PHE 3 N 0.00 0.00 0.00 1.61 -0.00 -2.05 -1.72 116.94 114.77 1zrx h PHE 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 1zrx h PHE 3 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 35.95 1zrx h PHE 3 CO 0.00 0.08 0.00 0.54 -0.00 0.00 0.00 178.31 178.93 1zrx n ARG 4 N -4.11 0.17 0.24 6.09 1.74 -1.26 -2.61 116.66 116.92 1zrx n ARG 4 Ca -0.03 0.41 -0.10 0.00 -0.77 0.00 0.00 57.85 57.37 1zrx n ARG 4 Cb 0.16 -1.83 -0.05 0.00 -1.02 0.00 0.00 32.46 29.72 1zrx n ARG 4 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1zrx h LYS 5 N 0.00 -0.60 0.00 5.56 3.64 -1.74 -0.20 116.57 123.23 1zrx h LYS 5 Ca 0.00 0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.34 1zrx h LYS 5 Cb 0.35 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1zrx h LYS 5 CO 0.00 -0.40 -0.38 1.12 -2.27 0.00 0.00 179.45 177.52 1zrx h HIS 6 N -0.73 0.00 -0.40 1.91 2.07 -1.74 -3.02 115.15 113.24 1zrx h HIS 6 Ca -0.06 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.36 1zrx h HIS 6 Cb 0.48 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.44 1zrx h HIS 6 CO 0.08 0.38 -0.13 0.35 -3.07 0.00 0.00 177.93 175.55 1zrx h PHE 7 N 0.00 0.89 -0.72 6.12 3.57 -1.54 -2.81 116.94 122.44 1zrx h PHE 7 Ca -0.00 -0.20 0.05 0.00 3.53 0.00 0.00 57.97 61.34 1zrx h PHE 7 Cb 0.89 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.37 1zrx h PHE 7 CO 0.00 0.93 0.48 -0.97 -2.23 0.00 0.00 178.31 176.52 1zrx h ASN 8 N 0.60 0.72 -0.58 0.41 -1.24 -0.90 -0.39 115.58 114.19 1zrx h ASN 8 Ca 0.10 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 57.07 1zrx h ASN 8 Cb 0.66 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.52 1zrx h ASN 8 CO 0.05 0.48 0.26 0.50 -1.29 0.00 0.00 177.43 177.43 1zrx h LYS 9 N 0.82 0.88 -0.50 6.67 1.63 -1.44 0.21 116.57 124.85 1zrx h LYS 9 Ca 0.30 -0.13 -0.10 0.00 -0.85 0.00 0.00 60.65 59.87 1zrx h LYS 9 Cb 0.15 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1zrx h LYS 9 CO -0.09 0.71 -0.08 -0.07 -3.45 0.00 0.00 179.45 176.46 1zrx h LEU 10 N 0.87 0.88 -0.85 5.20 3.38 -0.98 -2.64 115.31 121.18 1zrx h LEU 10 Ca 0.21 -0.27 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1zrx h LEU 10 Cb 0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1zrx h LEU 10 CO -0.02 0.99 -0.11 0.58 0.09 0.00 0.00 178.44 179.97 1zrx h VAL 11 N 0.81 1.25 -0.80 1.22 2.07 -0.08 0.64 116.25 121.37 1zrx h VAL 11 Ca 0.14 -1.15 0.06 0.00 0.82 0.00 0.00 66.70 66.57 1zrx h VAL 11 Cb 0.60 1.05 -0.06 0.00 -1.52 0.00 0.00 31.29 31.36 1zrx h VAL 11 CO 0.04 0.39 0.48 0.11 0.02 0.00 0.00 177.57 178.61 1zrx h LYS 12 N 0.67 0.86 0.03 1.57 1.79 -0.29 -1.36 116.57 119.84 1zrx h LYS 12 Ca 0.12 -0.05 -0.23 0.00 -2.18 0.00 0.00 60.65 58.30 1zrx h LYS 12 Cb 0.58 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 31.01 1zrx h LYS 12 CO 0.04 0.57 -1.11 0.87 -1.08 0.00 0.00 179.45 178.74 1zrx h LYS 13 N 0.88 0.06 -0.67 3.15 1.79 -1.27 -3.27 116.57 117.24 1zrx h LYS 13 Ca 0.35 -0.10 0.05 0.00 -2.18 0.00 0.00 60.65 58.77 1zrx h LYS 13 Cb 0.18 0.04 -0.05 0.00 -1.58 0.00 0.00 32.23 30.81 1zrx h LYS 13 CO -0.17 1.01 0.39 -0.24 -1.08 0.00 0.00 179.45 179.35 1zrx h VAL 14 N 0.02 1.00 -0.43 0.50 3.04 0.14 0.46 116.25 120.98 1zrx h VAL 14 Ca -0.06 -0.25 -0.11 0.00 -1.01 0.00 0.00 66.70 65.28 1zrx h VAL 14 Cb 1.83 0.21 -0.02 0.00 -2.01 0.00 0.00 31.29 31.31 1zrx h VAL 14 CO 0.14 0.13 -0.17 0.11 -1.01 0.00 0.00 177.57 176.78 1zrx h LYS 15 N 0.73 0.83 -0.42 4.17 1.57 -1.51 -2.55 116.57 119.38 1zrx h LYS 15 Ca 0.29 -0.31 -0.13 0.00 -1.87 0.00 0.00 60.65 58.64 1zrx h LYS 15 Cb 0.14 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1zrx h LYS 15 CO -0.16 0.93 -0.23 1.25 -0.57 0.00 0.00 179.45 180.68 1zrx h HIS 16 N 0.73 1.04 0.44 -1.35 2.76 -1.31 -2.33 115.15 115.14 1zrx h HIS 16 Ca 0.11 -0.27 -0.02 0.00 -2.20 0.00 0.00 60.37 57.99 1zrx h HIS 16 Cb 0.68 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.40 1zrx h HIS 16 CO 0.04 1.06 -0.21 1.15 -1.30 0.00 0.00 177.93 178.67 1zrx h THR 17 N 0.73 0.55 -0.58 6.26 2.02 -0.01 0.56 112.91 122.44 1zrx h THR 17 Ca 0.09 -0.24 0.06 0.00 0.77 0.00 0.00 66.41 67.09 1zrx h THR 17 Cb 0.80 0.66 -0.05 0.00 -1.74 0.00 0.00 68.15 67.82 1zrx h THR 17 CO 0.07 0.04 0.28 0.40 0.37 0.00 0.00 175.52 176.68 1zrx h ILE 18 N -0.74 0.91 -0.12 3.11 2.04 -1.53 -1.85 117.51 119.34 1zrx h ILE 18 Ca -0.06 -0.18 -0.14 0.00 1.00 0.00 0.00 64.86 65.48 1zrx h ILE 18 Cb 0.53 0.34 0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1zrx h ILE 18 CO 0.10 0.10 -0.46 0.28 0.00 0.00 0.00 178.15 178.17 1zrx h SER 19 N 0.53 0.60 -0.57 1.72 0.02 -1.35 -3.31 113.55 111.19 1zrx h SER 19 Ca 0.27 -0.62 0.05 0.00 -0.84 0.00 0.00 61.79 60.64 1zrx h SER 19 Cb 0.21 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.53 1zrx h SER 19 CO -0.20 1.12 0.30 -0.08 -1.14 0.00 0.00 176.83 176.84 1zrx h GLU 20 N 0.11 0.56 -0.88 3.45 4.81 0.37 0.55 114.58 123.56 1zrx h GLU 20 Ca -0.02 -0.03 0.17 0.00 -0.13 0.00 0.00 59.36 59.34 1zrx h GLU 20 Cb 1.09 -0.13 -0.07 0.00 0.63 0.00 0.00 28.75 30.28 1zrx h GLU 20 CO 0.10 0.37 0.57 1.15 -0.73 0.00 0.00 179.01 180.47 1zrx h THR 21 N 0.58 0.76 0.02 0.32 2.02 -1.43 -2.84 112.91 112.33 1zrx h THR 21 Ca 0.25 -0.18 -0.37 0.00 0.77 0.00 0.00 66.41 66.87 1zrx h THR 21 Cb 0.13 0.17 -0.06 0.00 -1.74 0.00 0.00 68.15 66.66 1zrx h THR 21 CO -0.16 0.10 -2.31 0.00 0.37 0.00 0.00 175.52 173.52 1zrx n ALA 22 N -2.47 1.38 1.14 6.16 0.00 -0.84 -4.37 120.51 121.51 1zrx n ALA 22 Ca 0.18 -1.07 0.00 0.00 0.00 0.00 0.00 53.44 52.54 1zrx n ALA 22 Cb 0.57 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.75 1zrx n ALA 22 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1zrx n HIS 23 N -3.12 0.00 0.32 0.00 1.44 0.19 -3.64 115.22 110.41 1zrx n HIS 23 Ca -0.37 0.00 0.21 0.00 -2.01 0.00 0.00 57.72 55.55 1zrx n HIS 23 Cb 1.06 -0.03 1.07 0.00 0.12 0.00 0.00 29.99 32.21 1zrx n HIS 23 CO 0.00 0.00 0.00 -0.39 -2.81 0.00 0.00 176.34 173.14 1zrx h VAL 24 N 0.00 0.03 -0.96 0.61 -1.51 -1.71 0.18 116.25 112.89 1zrx h VAL 24 Ca 0.00 -0.15 0.02 0.00 -1.23 0.00 0.00 66.70 65.34 1zrx h VAL 24 Cb 0.13 1.14 -0.05 0.00 -2.13 0.00 0.00 31.29 30.39 1zrx h VAL 24 CO 0.00 0.00 0.64 0.00 -1.23 0.00 0.00 177.57 176.98 1zrx h ALA 25 N 2.00 1.33 0.03 5.19 0.00 -1.90 0.13 119.26 126.03 1zrx h ALA 25 Ca -0.00 -0.06 -0.38 0.00 0.00 0.00 0.00 54.91 54.46 1zrx h ALA 25 Cb 0.14 -0.38 -0.05 0.00 0.00 0.00 0.00 17.79 17.50 1zrx h ALA 25 CO 0.00 0.61 -2.24 0.36 0.00 0.00 0.00 179.25 177.98 1zrx n LYS 26 N -4.40 0.65 -1.13 0.00 2.85 -0.75 -4.39 118.16 110.98 1zrx n LYS 26 Ca 0.12 0.25 -0.24 0.00 -1.05 0.00 0.00 58.31 57.39 1zrx n LYS 26 Cb 0.03 -1.58 0.04 0.00 -0.65 0.00 0.00 35.03 32.87 1zrx n LYS 26 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1zrx n ASP 27 N -3.69 6.91 -0.17 -5.58 9.92 -0.02 -4.43 116.55 119.49 1zrx n ASP 27 Ca -0.43 -3.34 -0.10 0.00 -0.53 0.00 0.00 54.79 50.39 1zrx n ASP 27 Cb 0.94 -1.05 0.00 0.00 -0.64 0.00 0.00 41.12 40.37 1zrx n ASP 27 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1zrx h THR 28 N 1.14 1.26 0.00 -3.53 1.03 -0.94 -3.41 112.91 108.47 1zrx h THR 28 Ca 0.41 -1.05 -0.06 0.00 -0.01 0.00 0.00 66.41 65.71 1zrx h THR 28 Cb 0.82 0.98 -0.06 0.00 -1.07 0.00 0.00 68.15 68.83 1zrx h THR 28 CO 1.06 0.37 -0.12 0.00 -0.01 0.00 0.00 175.52 176.81 1zrx n ALA 29 N -2.43 2.25 0.09 0.00 0.00 -1.26 -4.95 120.51 114.22 1zrx n ALA 29 Ca 0.01 -0.29 -0.05 0.00 0.00 0.00 0.00 53.44 53.10 1zrx n ALA 29 Cb 0.30 -0.16 0.10 0.00 0.00 0.00 0.00 19.45 19.68 1zrx n ALA 29 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1zrx h VAL 30 N 4.10 1.42 0.00 0.00 3.04 -1.79 -2.92 116.25 120.11 1zrx h VAL 30 Ca -0.24 -2.16 -0.07 0.00 -1.01 0.00 0.00 66.70 63.22 1zrx h VAL 30 Cb 1.04 2.13 -0.01 0.00 -2.01 0.00 0.00 31.29 32.44 1zrx h VAL 30 CO -0.12 0.63 -0.34 0.40 -1.01 0.00 0.00 177.57 177.13 1zrx h ILE 31 N 0.14 1.25 0.00 3.17 2.04 -1.87 0.21 117.51 122.45 1zrx h ILE 31 Ca -0.01 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.67 1zrx h ILE 31 Cb 1.20 1.63 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 1zrx h ILE 31 CO 0.10 0.34 0.00 0.00 0.00 0.00 0.00 178.15 178.59 1zrx n ALA 32 N -2.47 3.27 0.00 1.87 0.00 -1.10 -0.91 120.51 121.16 1zrx n ALA 32 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1zrx n ALA 32 Cb 0.38 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 18.63 1zrx n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zrx n GLY 33 N 1.49 -1.34 2.28 0.00 0.00 -1.16 -4.80 105.19 101.66 1zrx n GLY 33 Ca 0.00 0.43 -0.24 0.00 0.00 0.00 0.00 46.02 46.21 1zrx n GLY 33 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1zrx n SER 34 N 0.00 6.46 0.00 1.61 7.64 0.74 -3.30 113.62 126.76 1zrx n SER 34 Ca 0.00 -2.85 0.00 0.00 1.01 0.00 0.00 58.87 57.03 1zrx n SER 34 Cb 0.00 -1.36 0.00 0.00 -1.01 0.00 0.00 64.21 61.84 1zrx n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zrx n GLY 35 N 1.90 -0.61 0.25 0.23 0.00 -1.24 -4.67 105.19 101.06 1zrx n GLY 35 Ca 0.52 0.36 -0.09 0.00 0.00 0.00 0.00 46.02 46.81 1zrx n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zrx h ALA 36 N 0.00 0.69 -0.30 4.61 0.00 -1.20 -0.73 119.26 122.32 1zrx h ALA 36 Ca 0.00 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 1zrx h ALA 36 Cb 0.00 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1zrx h ALA 36 CO 0.00 0.42 -0.48 0.00 0.00 0.00 0.00 179.25 179.19 1zrx h ALA 37 N 0.98 0.57 -0.18 0.00 0.00 -1.76 -2.02 119.26 116.85 1zrx h ALA 37 Ca 0.16 -0.49 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1zrx h ALA 37 Cb 0.40 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1zrx h ALA 37 CO 0.01 0.68 0.08 0.28 0.00 0.00 0.00 179.25 180.30 1zrx h VAL 38 N 0.65 1.13 -0.57 0.00 2.07 -1.60 -0.34 116.25 117.59 1zrx h VAL 38 Ca 0.03 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 1zrx h VAL 38 Cb 1.07 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1zrx h VAL 38 CO 0.11 0.13 0.02 1.62 0.02 0.00 0.00 177.57 179.46 1zrx h VAL 39 N 0.16 1.26 -0.50 2.57 3.04 -1.15 -0.48 116.25 121.14 1zrx h VAL 39 Ca 0.06 -1.08 -0.02 0.00 -1.01 0.00 0.00 66.70 64.65 1zrx h VAL 39 Cb 0.13 0.80 -0.02 0.00 -2.01 0.00 0.00 31.29 30.18 1zrx h VAL 39 CO -0.01 0.39 0.24 0.00 -1.01 0.00 0.00 177.57 177.18 1zrx h ALA 40 N 1.12 0.64 -0.54 3.17 0.00 -1.15 -2.79 119.26 119.70 1zrx h ALA 40 Ca 0.17 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1zrx h ALA 40 Cb 0.50 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1zrx h ALA 40 CO 0.02 0.21 -0.08 0.00 0.00 0.00 0.00 179.25 179.40 1zrx h ALA 41 N 1.08 0.74 0.00 0.00 0.00 -0.85 -3.51 119.26 116.72 1zrx h ALA 41 Ca 0.17 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1zrx h ALA 41 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1zrx h ALA 41 CO -0.02 0.63 0.00 2.41 0.00 0.00 0.00 179.25 182.27