#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozz s LYS 2 N 0.00 0.56 -0.13 -1.24 2.47 -1.25 -4.95 119.74 115.20 1ozz s LYS 2 Ca 0.00 1.03 -0.19 0.00 -1.56 0.00 0.00 55.97 55.25 1ozz s LYS 2 Cb 0.00 0.08 -0.04 0.00 -1.46 0.00 0.00 37.83 36.41 1ozz s LYS 2 CO 0.00 -0.16 0.50 -1.17 0.16 0.00 0.00 175.35 174.69 1ozz s LEU 3 N 1.56 4.26 -0.01 5.43 2.96 -1.26 -0.79 118.68 130.84 1ozz s LEU 3 Ca -0.10 0.83 0.03 0.00 -0.22 0.00 0.00 54.13 54.68 1ozz s LEU 3 Cb -0.07 -2.73 -0.05 0.00 0.50 0.00 0.00 46.19 43.84 1ozz s LEU 3 CO -0.17 -0.04 0.07 2.30 -1.32 0.00 0.00 176.35 177.19 1ozz n ILE 4 N 3.81 0.03 0.00 6.68 -5.35 -1.12 -5.01 119.36 118.39 1ozz n ILE 4 Ca -0.06 -0.08 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 1ozz n ILE 4 Cb 0.51 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.68 1ozz n ILE 4 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ozz n GLY 5 N 2.37 -0.68 2.88 3.28 0.00 -1.26 -4.96 105.19 106.83 1ozz n GLY 5 Ca -0.01 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 1ozz n GLY 5 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ozz s SER 6 N -4.00 -0.02 0.09 1.61 0.01 0.72 0.48 113.70 112.58 1ozz s SER 6 Ca 0.00 0.10 -0.11 0.00 1.31 0.00 0.00 55.95 57.25 1ozz s SER 6 Cb 0.00 0.06 -0.20 0.00 0.21 0.00 0.00 66.02 66.09 1ozz s SER 6 CO 0.00 -0.06 1.21 0.00 0.41 0.00 0.00 173.24 174.80 1ozz s VAL 8 N -3.24 3.01 0.50 0.00 0.11 -1.26 -4.74 120.40 114.78 1ozz s VAL 8 Ca -0.08 0.93 -0.22 0.00 -2.93 0.00 0.00 61.98 59.68 1ozz s VAL 8 Cb 0.07 -3.59 -0.06 0.00 -1.53 0.00 0.00 36.38 31.27 1ozz s VAL 8 CO 0.91 0.19 1.23 0.26 -3.33 0.00 0.00 175.10 174.36 1ozz s TRP 9 N -0.63 2.63 0.00 1.54 0.52 -1.26 -3.01 118.94 118.72 1ozz s TRP 9 Ca 0.52 1.48 0.00 0.00 0.02 0.00 0.00 56.10 58.12 1ozz s TRP 9 Cb -0.37 -3.53 0.00 0.00 -1.15 0.00 0.00 33.47 28.42 1ozz s TRP 9 CO 0.45 -2.04 0.00 0.41 0.02 0.00 0.00 176.95 175.79 1ozz n GLY 10 N 0.54 2.82 3.78 0.98 0.00 -1.26 -5.01 105.19 107.03 1ozz n GLY 10 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1ozz n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ozz s ALA 11 N -1.33 2.64 0.44 4.61 0.00 -1.16 -4.98 121.76 121.98 1ozz s ALA 11 Ca 0.00 0.70 -0.26 0.00 0.00 0.00 0.00 51.96 52.40 1ozz s ALA 11 Cb 0.00 -3.33 -0.08 0.00 0.00 0.00 0.00 23.12 19.70 1ozz s ALA 11 CO 0.00 -0.90 1.43 0.54 0.00 0.00 0.00 175.76 176.83 1ozz s VAL 12 N -2.00 2.09 -1.18 0.00 0.11 -1.26 -3.06 120.40 115.10 1ozz s VAL 12 Ca 0.70 0.08 -0.02 0.00 -2.93 0.00 0.00 61.98 59.81 1ozz s VAL 12 Cb -0.22 -3.05 0.00 0.00 -1.53 0.00 0.00 36.38 31.59 1ozz s VAL 12 CO 0.32 0.01 1.00 0.59 -3.33 0.00 0.00 175.10 173.68 1ozz n ASN 13 N -0.13 -3.17 -4.69 3.54 3.02 -1.26 -3.61 115.26 108.95 1ozz n ASN 13 Ca 0.05 -0.57 -0.44 0.00 -0.03 0.00 0.00 54.58 53.59 1ozz n ASN 13 Cb 0.42 -4.86 -0.02 0.00 -0.61 0.00 0.00 39.78 34.71 1ozz n ASN 13 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ozz n TYR 14 N -4.21 2.34 -3.43 3.10 9.36 -1.17 -0.20 117.16 122.93 1ozz n TYR 14 Ca -0.20 0.39 -0.16 0.00 3.32 0.00 0.00 57.90 61.25 1ozz n TYR 14 Cb 0.63 -2.49 -0.11 0.00 -0.63 0.00 0.00 39.34 36.74 1ozz n TYR 14 CO 0.00 0.00 0.00 -0.08 0.22 0.00 0.00 176.86 177.00 1ozz s THR 15 N -0.05 -0.41 0.19 2.97 -1.32 0.53 -4.77 115.64 112.78 1ozz s THR 15 Ca 0.67 -0.23 -0.09 0.00 -1.21 0.00 0.00 61.69 60.84 1ozz s THR 15 Cb -0.61 -0.80 0.07 0.00 -1.51 0.00 0.00 72.50 69.64 1ozz s THR 15 CO 0.49 -0.27 1.64 -1.28 -2.21 0.00 0.00 174.62 172.99 1ozz h SER 16 N 8.27 1.04 -0.41 8.08 0.87 -1.85 -3.06 113.55 126.48 1ozz h SER 16 Ca -0.16 -0.30 -0.43 0.00 -1.23 0.00 0.00 61.79 59.66 1ozz h SER 16 Cb 1.13 -0.28 -0.08 0.00 -0.44 0.00 0.00 62.40 62.73 1ozz h SER 16 CO 0.30 1.10 1.00 0.59 -0.53 0.00 0.00 176.83 179.29 1ozz n ASN 17 N -4.17 6.61 -0.25 6.23 3.02 -1.26 -4.67 115.26 120.76 1ozz n ASN 17 Ca 0.03 -2.76 0.06 0.00 -0.03 0.00 0.00 54.58 51.87 1ozz n ASN 17 Cb 0.36 -1.39 0.19 0.00 -0.61 0.00 0.00 39.78 38.32 1ozz n ASN 17 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ozz h ASN 19 N 0.33 0.00 -0.85 0.00 -0.73 -1.83 -3.32 115.58 109.17 1ozz h ASN 19 Ca 0.42 -0.59 0.10 0.00 1.87 0.00 0.00 56.30 58.10 1ozz h ASN 19 Cb 0.71 0.00 -0.07 0.00 0.27 0.00 0.00 38.32 39.22 1ozz h ASN 19 CO -0.48 0.91 0.50 0.00 -0.37 0.00 0.00 177.43 177.99 1ozz h ALA 20 N -0.41 1.23 -0.54 1.57 0.00 -1.87 -1.54 119.26 117.71 1ozz h ALA 20 Ca -0.05 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ozz h ALA 20 Cb 0.73 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1ozz h ALA 20 CO -0.03 0.12 0.34 1.49 0.00 0.00 0.00 179.25 181.18 1ozz h GLU 21 N 0.83 0.68 -0.71 0.00 4.57 -0.34 -1.16 114.58 118.44 1ozz h GLU 21 Ca 0.41 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.54 1ozz h GLU 21 Cb 0.38 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.78 1ozz h GLU 21 CO -0.25 0.45 0.41 0.00 -1.18 0.00 0.00 179.01 178.44 1ozz h LYS 23 N 0.98 1.20 -0.15 0.00 1.57 -0.67 -0.77 116.57 118.73 1ozz h LYS 23 Ca 0.25 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.89 1ozz h LYS 23 Cb 0.01 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 1ozz h LYS 23 CO -0.04 0.79 -0.24 0.00 -0.57 0.00 0.00 179.45 179.39 1ozz h ARG 24 N 1.23 0.27 -0.55 3.15 -0.00 -0.66 -1.97 114.38 115.85 1ozz h ARG 24 Ca 0.36 -0.09 0.00 0.00 -0.50 0.00 0.00 59.98 59.76 1ozz h ARG 24 Cb -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 29.88 1ozz h ARG 24 CO -0.10 0.49 0.00 0.54 0.00 0.00 0.00 179.97 180.90 1ozz n ARG 25 N -4.17 1.53 -2.32 0.04 1.74 -0.41 -4.86 116.66 108.20 1ozz n ARG 25 Ca -0.01 -0.54 -0.04 0.00 -0.77 0.00 0.00 57.85 56.48 1ozz n ARG 25 Cb 0.35 -1.39 0.02 0.00 -1.02 0.00 0.00 32.46 30.43 1ozz n ARG 25 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ozz n GLY 26 N 0.40 0.25 3.22 -0.13 0.00 -0.74 -5.04 105.19 103.15 1ozz n GLY 26 Ca 0.05 -0.29 -0.14 0.00 0.00 0.00 0.00 46.02 45.65 1ozz n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ozz s TYR 27 N -3.10 1.16 0.17 1.61 1.51 -0.50 -4.99 117.35 113.22 1ozz s TYR 27 Ca 0.02 -0.75 -0.13 0.00 -1.01 0.00 0.00 57.07 55.20 1ozz s TYR 27 Cb -0.00 -0.61 0.06 0.00 -0.11 0.00 0.00 41.96 41.30 1ozz s TYR 27 CO 0.20 0.03 1.77 0.87 -1.11 0.00 0.00 175.55 177.30 1ozz h LYS 28 N 3.04 0.76 0.00 -0.62 1.57 -1.02 -3.33 116.57 116.97 1ozz h LYS 28 Ca -0.37 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 1ozz h LYS 28 Cb 1.19 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1ozz h LYS 28 CO 0.60 0.60 0.00 0.41 -0.57 0.00 0.00 179.45 180.49 1ozz n GLY 29 N -0.99 1.75 3.60 3.86 0.00 -1.22 -4.82 105.19 107.37 1ozz n GLY 29 Ca 0.03 -0.43 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 1ozz n GLY 29 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ozz s GLY 30 N -0.20 -0.31 -0.15 -0.02 0.00 -1.26 -0.02 107.32 105.37 1ozz s GLY 30 Ca 0.00 2.19 -0.28 0.00 0.00 0.00 0.00 44.72 46.64 1ozz s GLY 30 CO 0.00 1.46 0.68 -2.38 0.00 0.00 0.00 173.10 172.86 1ozz s HIS 31 N -0.34 -0.70 0.60 1.90 -3.43 -0.19 -4.02 115.29 109.12 1ozz s HIS 31 Ca -0.01 1.45 -0.15 0.00 -0.80 0.00 0.00 55.06 55.55 1ozz s HIS 31 Cb -0.03 0.34 -0.03 0.00 -1.43 0.00 0.00 32.58 31.42 1ozz s HIS 31 CO -0.00 -0.50 1.05 0.00 -2.00 0.00 0.00 174.74 173.29 1ozz n GLY 33 N -1.16 1.67 7.00 0.00 0.00 -1.12 -4.88 105.19 106.70 1ozz n GLY 33 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1ozz n GLY 33 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ozz n SER 34 N 0.00 0.00 -4.68 1.61 7.64 -1.26 -3.44 113.62 113.49 1ozz n SER 34 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1ozz n SER 34 Cb 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.17 1ozz n SER 34 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1ozz s PHE 35 N 0.00 2.29 0.00 1.43 5.36 -1.26 -4.59 117.98 121.21 1ozz s PHE 35 Ca 0.00 0.25 0.00 0.00 -0.96 0.00 0.00 56.93 56.22 1ozz s PHE 35 Cb 0.00 -3.98 0.00 0.00 -0.34 0.00 0.00 43.02 38.70 1ozz s PHE 35 CO 0.00 -4.00 0.00 0.00 -1.46 0.00 0.00 175.22 169.76 1ozz n ALA 36 N 5.89 0.00 -2.75 11.12 0.00 -1.26 -3.39 120.51 130.13 1ozz n ALA 36 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.60 1ozz n ALA 36 Cb 0.41 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.91 1ozz n ALA 36 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ozz n ASN 37 N 7.44 0.89 -4.94 0.00 5.03 -1.26 -4.70 115.26 117.73 1ozz n ASN 37 Ca 0.00 -2.05 -0.21 0.00 0.87 0.00 0.00 54.58 53.19 1ozz n ASN 37 Cb 0.00 -0.23 -0.02 0.00 -1.02 0.00 0.00 39.78 38.51 1ozz n ASN 37 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 1ozz s VAL 38 N -2.59 4.51 0.13 2.41 -7.23 -1.22 -4.44 120.40 111.98 1ozz s VAL 38 Ca 0.24 -1.11 0.00 0.00 -1.81 0.00 0.00 61.98 59.29 1ozz s VAL 38 Cb 0.34 -3.55 0.00 0.00 0.56 0.00 0.00 36.38 33.74 1ozz s VAL 38 CO -0.07 -0.26 0.00 0.59 -0.31 0.00 0.00 175.10 175.05 1ozz n ASN 39 N -1.44 -5.41 -4.64 4.85 3.02 -1.26 -3.22 115.26 107.17 1ozz n ASN 39 Ca -0.05 0.65 -0.41 0.00 -0.03 0.00 0.00 54.58 54.74 1ozz n ASN 39 Cb 0.58 -2.49 -0.06 0.00 -0.61 0.00 0.00 39.78 37.20 1ozz n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ozz s TRP 41 N 2.37 3.05 0.05 0.00 0.52 -0.09 -2.78 118.94 122.06 1ozz s TRP 41 Ca 0.29 -0.57 -0.31 0.00 0.02 0.00 0.00 56.10 55.54 1ozz s TRP 41 Cb -0.16 -2.18 -0.06 0.00 -1.15 0.00 0.00 33.47 29.93 1ozz s TRP 41 CO 0.09 -0.39 1.22 0.00 0.02 0.00 0.00 176.95 177.88 1ozz s GLU 43 N 1.21 3.16 0.00 0.00 2.02 0.97 -3.87 118.70 122.19 1ozz s GLU 43 Ca 0.59 0.80 0.24 0.00 0.02 0.00 0.00 54.97 56.63 1ozz s GLU 43 Cb -0.30 -4.20 1.44 0.00 0.10 0.00 0.00 34.13 31.17 1ozz s GLU 43 CO 0.29 -2.08 1.80 2.41 0.02 0.00 0.00 175.26 177.69