#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 4.41 -0.13 -1.24 1.02 -1.12 -4.80 119.74 117.88 1ozz s LYS 2 Ca 0.00 0.89 -0.22 0.00 0.02 0.00 0.00 55.97 56.66 1ozz s LYS 2 Cb 0.00 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.91 1ozz s LYS 2 CO 0.00 0.29 0.64 -1.17 -0.92 0.00 0.00 175.35 174.20 1ozz s LEU 3 N -0.01 4.24 -0.12 3.17 2.96 -1.26 -0.41 118.68 127.25 1ozz s LEU 3 Ca 0.35 1.00 0.14 0.00 -0.22 0.00 0.00 54.13 55.40 1ozz s LEU 3 Cb -0.19 -2.95 -0.20 0.00 0.50 0.00 0.00 46.19 43.34 1ozz s LEU 3 CO 0.20 -0.16 0.12 2.30 -1.32 0.00 0.00 176.35 177.48 1ozz n ILE 4 N 4.11 0.83 0.00 6.68 -5.35 -1.21 -4.98 119.36 119.45 1ozz n ILE 4 Ca -0.02 -0.59 0.00 0.00 -0.27 0.00 0.00 62.75 61.87 1ozz n ILE 4 Cb 0.51 -0.45 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 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 1.96 -0.82 3.11 3.28 0.00 -1.25 -4.97 105.19 106.50 1ozz n GLY 5 Ca -0.20 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 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 1.57 -0.49 1.61 0.01 -0.36 -1.02 113.70 111.02 1ozz s SER 6 Ca 0.00 -0.35 0.02 0.00 1.31 0.00 0.00 55.95 56.93 1ozz s SER 6 Cb 0.00 -0.13 0.58 0.00 0.21 0.00 0.00 66.02 66.68 1ozz s SER 6 CO 0.00 0.09 1.92 0.00 0.41 0.00 0.00 173.24 175.66 1ozz s VAL 8 N -3.54 1.05 0.59 0.00 0.11 -1.23 -4.86 120.40 112.53 1ozz s VAL 8 Ca 0.56 -0.64 -0.19 0.00 -2.93 0.00 0.00 61.98 58.79 1ozz s VAL 8 Cb 0.46 -0.89 -0.04 0.00 -1.53 0.00 0.00 36.38 34.39 1ozz s VAL 8 CO 0.07 0.25 1.23 -1.66 -3.33 0.00 0.00 175.10 171.66 1ozz s TRP 9 N -0.40 2.36 0.00 1.54 1.48 -1.26 -3.17 118.94 119.49 1ozz s TRP 9 Ca 0.04 1.50 0.00 0.00 -1.06 0.00 0.00 56.10 56.59 1ozz s TRP 9 Cb -0.06 -3.53 0.00 0.00 -1.16 0.00 0.00 33.47 28.72 1ozz s TRP 9 CO -0.00 -2.33 0.00 0.41 -4.06 0.00 0.00 176.95 170.96 1ozz n GLY 10 N 0.58 1.90 3.77 3.67 0.00 -1.26 -4.99 105.19 108.85 1ozz n GLY 10 Ca 0.13 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.36 3.44 0.48 4.61 0.00 -1.19 -4.97 121.76 123.76 1ozz s ALA 11 Ca 0.00 1.13 -0.24 0.00 0.00 0.00 0.00 51.96 52.84 1ozz s ALA 11 Cb 0.00 -3.42 -0.07 0.00 0.00 0.00 0.00 23.12 19.62 1ozz s ALA 11 CO 0.00 -0.49 1.40 0.54 0.00 0.00 0.00 175.76 177.21 1ozz s VAL 12 N -1.17 2.09 -0.91 0.00 0.11 -1.26 -2.96 120.40 116.29 1ozz s VAL 12 Ca 0.48 0.08 -0.03 0.00 -2.93 0.00 0.00 61.98 59.58 1ozz s VAL 12 Cb -0.37 -3.04 0.00 0.00 -1.53 0.00 0.00 36.38 31.44 1ozz s VAL 12 CO 0.48 0.01 0.78 0.59 -3.33 0.00 0.00 175.10 173.63 1ozz n ASN 13 N -0.42 -3.58 -4.62 3.54 3.02 -1.26 -4.13 115.26 107.81 1ozz n ASN 13 Ca 0.06 -0.41 -0.43 0.00 -0.03 0.00 0.00 54.58 53.77 1ozz n ASN 13 Cb 0.43 -3.77 -0.02 0.00 -0.61 0.00 0.00 39.78 35.81 1ozz n ASN 13 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1ozz s TYR 14 N -3.24 2.20 -0.43 3.10 5.04 -1.16 -1.23 117.35 121.64 1ozz s TYR 14 Ca 0.21 0.64 0.01 0.00 -2.44 0.00 0.00 57.07 55.48 1ozz s TYR 14 Cb -0.09 -4.05 0.12 0.00 0.35 0.00 0.00 41.96 38.28 1ozz s TYR 14 CO 0.52 -2.57 0.19 -0.08 -1.34 0.00 0.00 175.55 172.27 1ozz s THR 15 N 5.39 2.85 -0.00 4.34 -1.32 0.13 -4.94 115.64 122.09 1ozz s THR 15 Ca 0.69 -2.51 -0.25 0.00 -1.21 0.00 0.00 61.69 58.40 1ozz s THR 15 Cb -0.21 -2.99 -0.19 0.00 -1.51 0.00 0.00 72.50 67.60 1ozz s THR 15 CO 0.30 -0.70 1.31 0.77 -2.21 0.00 0.00 174.62 174.08 1ozz h SER 16 N 7.47 -0.07 -0.61 8.08 4.64 -1.89 -3.05 113.55 128.13 1ozz h SER 16 Ca -0.07 -0.36 -0.36 0.00 -0.47 0.00 0.00 61.79 60.53 1ozz h SER 16 Cb 1.00 0.02 -0.13 0.00 -0.31 0.00 0.00 62.40 62.97 1ozz h SER 16 CO 0.63 0.34 0.11 -0.46 -0.87 0.00 0.00 176.83 176.58 1ozz n ASN 17 N -4.94 6.01 -0.11 4.97 6.94 -1.26 -4.64 115.26 122.23 1ozz n ASN 17 Ca -0.08 -2.92 -0.05 0.00 -0.02 0.00 0.00 54.58 51.51 1ozz n ASN 17 Cb 0.22 -1.28 0.02 0.00 -2.36 0.00 0.00 39.78 36.38 1ozz n ASN 17 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ozz h ASN 19 N 0.09 0.10 -0.36 0.00 -1.24 -1.82 0.30 115.58 112.64 1ozz h ASN 19 Ca 0.18 0.07 -0.05 0.00 0.71 0.00 0.00 56.30 57.21 1ozz h ASN 19 Cb 0.25 0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.36 1ozz h ASN 19 CO -0.31 0.09 0.04 0.00 -1.29 0.00 0.00 177.43 175.95 1ozz h ALA 20 N 1.33 0.49 -0.35 1.57 0.00 -1.79 -1.05 119.26 119.46 1ozz h ALA 20 Ca 0.22 -0.22 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1ozz h ALA 20 Cb 0.26 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1ozz h ALA 20 CO -0.26 0.22 0.03 1.49 0.00 0.00 0.00 179.25 180.73 1ozz h GLU 21 N 0.45 0.14 -0.34 0.00 4.57 0.62 0.77 114.58 120.80 1ozz h GLU 21 Ca 0.11 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.27 1ozz h GLU 21 Cb 0.40 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 1ozz h GLU 21 CO 0.01 0.09 0.16 0.00 -1.18 0.00 0.00 179.01 178.10 1ozz h LYS 23 N 0.41 1.18 -0.50 0.00 1.57 -0.56 -0.09 116.57 118.59 1ozz h LYS 23 Ca 0.12 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1ozz h LYS 23 Cb 0.11 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 1ozz h LYS 23 CO -0.02 0.78 0.12 0.00 -0.57 0.00 0.00 179.45 179.77 1ozz h ARG 24 N 1.22 0.76 -0.81 3.15 2.47 -0.55 -2.03 114.38 118.58 1ozz h ARG 24 Ca 0.40 -0.15 0.00 0.00 -1.26 0.00 0.00 59.98 58.98 1ozz h ARG 24 Cb 0.05 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.25 1ozz h ARG 24 CO -0.14 0.69 0.00 0.54 0.56 0.00 0.00 179.97 181.62 1ozz n ARG 25 N -4.29 1.31 0.00 0.04 1.74 -0.43 -4.83 116.66 110.20 1ozz n ARG 25 Ca 0.03 -0.27 0.00 0.00 -0.77 0.00 0.00 57.85 56.85 1ozz n ARG 25 Cb 0.22 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 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 0.15 2.62 3.77 -0.13 0.00 -0.76 -5.03 105.19 105.81 1ozz n GLY 26 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.13 2.66 0.25 1.61 1.51 -0.18 -4.94 117.35 116.13 1ozz s TYR 27 Ca 0.00 1.54 -0.05 0.00 -1.01 0.00 0.00 57.07 57.56 1ozz s TYR 27 Cb 0.00 -3.15 0.28 0.00 -0.11 0.00 0.00 41.96 38.99 1ozz s TYR 27 CO 0.00 -1.63 1.83 0.87 -1.11 0.00 0.00 175.55 175.51 1ozz h LYS 28 N 0.02 1.06 0.00 -0.62 1.79 -1.81 -3.24 116.57 113.77 1ozz h LYS 28 Ca -0.47 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 57.83 1ozz h LYS 28 Cb 1.24 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 1ozz h LYS 28 CO 0.54 0.86 0.00 0.41 -1.08 0.00 0.00 179.45 180.18 1ozz n GLY 29 N -0.96 0.77 3.21 3.86 0.00 -1.26 -4.69 105.19 106.11 1ozz n GLY 29 Ca 0.07 -0.51 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.77 -0.16 -0.03 -0.02 0.00 -1.26 0.39 107.32 105.47 1ozz s GLY 30 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 44.72 45.19 1ozz s GLY 30 CO 0.00 0.32 0.07 -2.38 0.00 0.00 0.00 173.10 171.11 1ozz s HIS 31 N -0.74 -0.05 0.34 1.90 -3.43 0.12 -4.48 115.29 108.95 1ozz s HIS 31 Ca -0.08 0.23 -0.27 0.00 -0.80 0.00 0.00 55.06 54.14 1ozz s HIS 31 Cb -0.04 -0.13 -0.09 0.00 -1.43 0.00 0.00 32.58 30.89 1ozz s HIS 31 CO 0.02 -0.09 1.06 0.00 -2.00 0.00 0.00 174.74 173.73 1ozz n GLY 33 N 0.78 4.31 7.00 0.00 0.00 0.15 -4.87 105.19 112.56 1ozz n GLY 33 Ca 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 -4.66 1.61 7.64 -1.26 -2.28 113.62 114.67 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 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 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 3.39 -1.83 1.43 5.36 -1.26 -3.81 117.98 121.26 1ozz s PHE 35 Ca 0.00 1.24 0.00 0.00 -0.96 0.00 0.00 56.93 57.21 1ozz s PHE 35 Cb 0.00 -3.04 0.00 0.00 -0.34 0.00 0.00 43.02 39.64 1ozz s PHE 35 CO 0.00 -0.30 0.00 0.00 -1.46 0.00 0.00 175.22 173.46 1ozz n ALA 36 N 5.50 -0.54 -3.83 11.12 0.00 -1.26 -2.68 120.51 128.80 1ozz n ALA 36 Ca 0.05 0.20 -0.30 0.00 0.00 0.00 0.00 53.44 53.39 1ozz n ALA 36 Cb 0.48 -2.14 0.02 0.00 0.00 0.00 0.00 19.45 17.82 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 -1.79 -4.71 -0.06 0.00 4.13 -1.02 -4.90 115.26 106.91 1ozz n ASN 37 Ca -0.24 -0.73 -0.17 0.00 1.68 0.00 0.00 54.58 55.13 1ozz n ASN 37 Cb 0.68 -3.78 -0.13 0.00 -1.54 0.00 0.00 39.78 35.01 1ozz n ASN 37 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 1ozz h VAL 38 N -1.90 1.51 -3.84 2.41 -1.51 -1.23 -3.40 116.25 108.28 1ozz h VAL 38 Ca -0.56 -2.34 -0.48 0.00 -1.23 0.00 0.00 66.70 62.09 1ozz h VAL 38 Cb 1.37 3.06 -0.02 0.00 -2.13 0.00 0.00 31.29 33.57 1ozz h VAL 38 CO 0.66 0.56 0.35 0.20 -1.23 0.00 0.00 177.57 178.12 1ozz s ASN 39 N -6.51 7.42 -0.17 4.19 -0.87 -1.23 0.14 114.94 117.91 1ozz s ASN 39 Ca -0.21 1.89 -0.02 0.00 -1.57 0.00 0.00 52.86 52.95 1ozz s ASN 39 Cb 0.00 -2.59 -0.01 0.00 -0.02 0.00 0.00 41.25 38.62 1ozz s ASN 39 CO 0.69 -0.01 -0.07 0.00 -2.57 0.00 0.00 177.10 175.14 1ozz s TRP 41 N 0.83 3.05 0.20 0.00 0.52 0.76 -3.32 118.94 120.98 1ozz s TRP 41 Ca -0.02 -0.32 -0.30 0.00 0.02 0.00 0.00 56.10 55.48 1ozz s TRP 41 Cb -0.15 -2.02 -0.08 0.00 -1.15 0.00 0.00 33.47 30.07 1ozz s TRP 41 CO 0.01 -0.09 1.09 0.00 0.02 0.00 0.00 176.95 177.98 1ozz s GLU 43 N -0.58 3.64 0.00 0.00 2.02 0.16 -2.77 118.70 121.17 1ozz s GLU 43 Ca 0.48 2.25 0.00 0.00 0.02 0.00 0.00 54.97 57.72 1ozz s GLU 43 Cb -0.30 -4.25 0.00 0.00 0.10 0.00 0.00 34.13 29.69 1ozz s GLU 43 CO 0.36 -1.52 0.37 2.41 0.02 0.00 0.00 175.26 176.89