#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 2.41 -0.08 -1.24 2.20 0.54 -4.84 119.74 118.72 1ozz s LYS 2 Ca 0.00 -0.66 -0.28 0.00 -0.36 0.00 0.00 55.97 54.68 1ozz s LYS 2 Cb 0.00 -1.87 -0.02 0.00 -1.51 0.00 0.00 37.83 34.42 1ozz s LYS 2 CO 0.00 0.10 0.91 -1.17 -0.36 0.00 0.00 175.35 174.83 1ozz s LEU 3 N 0.50 4.28 -0.11 5.43 2.96 -1.26 -0.02 118.68 130.45 1ozz s LEU 3 Ca -0.17 1.43 0.10 0.00 -0.22 0.00 0.00 54.13 55.28 1ozz s LEU 3 Cb -0.17 -3.41 -0.14 0.00 0.50 0.00 0.00 46.19 42.97 1ozz s LEU 3 CO 0.06 -0.33 0.05 2.30 -1.32 0.00 0.00 176.35 177.11 1ozz n ILE 4 N 4.28 0.76 -0.61 6.68 -5.35 -1.12 -4.99 119.36 119.01 1ozz n ILE 4 Ca 0.05 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 1ozz n ILE 4 Cb 0.50 -0.66 0.00 0.00 -1.74 0.00 0.00 39.64 37.74 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 2.27 1.52 3.08 3.28 0.00 -1.26 -4.92 105.19 109.16 1ozz n GLY 5 Ca -0.18 -0.08 -0.22 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 2.00 1.56 0.10 1.61 0.01 -0.09 -2.43 113.70 116.46 1ozz s SER 6 Ca 0.00 -0.24 0.04 0.00 1.31 0.00 0.00 55.95 57.06 1ozz s SER 6 Cb 0.00 -0.25 -0.23 0.00 0.21 0.00 0.00 66.02 65.75 1ozz s SER 6 CO 0.00 0.14 1.21 0.00 0.41 0.00 0.00 173.24 175.00 1ozz s VAL 8 N -2.69 2.68 0.36 0.00 0.11 -1.24 -4.51 120.40 115.10 1ozz s VAL 8 Ca -0.01 0.59 -0.28 0.00 -2.93 0.00 0.00 61.98 59.35 1ozz s VAL 8 Cb 0.09 -3.38 -0.11 0.00 -1.53 0.00 0.00 36.38 31.46 1ozz s VAL 8 CO 0.84 0.11 1.41 0.26 -3.33 0.00 0.00 175.10 174.38 1ozz s TRP 9 N -0.30 2.79 0.00 1.54 0.52 -1.26 -2.77 118.94 119.45 1ozz s TRP 9 Ca 0.56 1.27 0.00 0.00 0.02 0.00 0.00 56.10 57.96 1ozz s TRP 9 Cb -0.41 -3.87 0.00 0.00 -1.15 0.00 0.00 33.47 28.03 1ozz s TRP 9 CO 0.46 -2.50 0.00 0.41 0.02 0.00 0.00 176.95 175.34 1ozz n GLY 10 N 0.61 2.84 3.76 0.98 0.00 -1.26 -5.03 105.19 107.10 1ozz n GLY 10 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.83 2.39 0.39 4.61 0.00 -1.12 -4.97 121.76 121.24 1ozz s ALA 11 Ca 0.00 0.59 -0.27 0.00 0.00 0.00 0.00 51.96 52.28 1ozz s ALA 11 Cb 0.00 -3.34 -0.10 0.00 0.00 0.00 0.00 23.12 19.68 1ozz s ALA 11 CO 0.00 -1.41 1.41 0.54 0.00 0.00 0.00 175.76 176.30 1ozz s VAL 12 N -2.31 2.26 -1.18 0.00 0.11 -1.26 -3.00 120.40 115.02 1ozz s VAL 12 Ca 0.68 0.25 -0.01 0.00 -2.93 0.00 0.00 61.98 59.97 1ozz s VAL 12 Cb -0.22 -3.15 -0.01 0.00 -1.53 0.00 0.00 36.38 31.47 1ozz s VAL 12 CO 0.43 0.05 0.99 0.59 -3.33 0.00 0.00 175.10 173.83 1ozz n ASN 13 N 0.28 -2.47 -4.72 3.54 4.13 -1.26 -3.22 115.26 111.54 1ozz n ASN 13 Ca 0.02 -0.63 -0.42 0.00 1.68 0.00 0.00 54.58 55.23 1ozz n ASN 13 Cb 0.41 -5.13 -0.03 0.00 -1.54 0.00 0.00 39.78 33.50 1ozz n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ozz n TYR 14 N -4.04 2.76 -3.33 3.10 9.36 -1.16 -0.92 117.16 122.93 1ozz n TYR 14 Ca -0.27 0.09 -0.12 0.00 3.32 0.00 0.00 57.90 60.92 1ozz n TYR 14 Cb 0.66 -2.66 -0.07 0.00 -0.63 0.00 0.00 39.34 36.65 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 0.92 -0.52 0.20 2.97 -1.32 0.34 -4.87 115.64 113.37 1ozz s THR 15 Ca 0.73 -0.55 -0.01 0.00 -1.21 0.00 0.00 61.69 60.65 1ozz s THR 15 Cb -0.51 -0.80 -0.05 0.00 -1.51 0.00 0.00 72.50 69.63 1ozz s THR 15 CO 0.36 -0.40 1.53 -1.28 -2.21 0.00 0.00 174.62 172.61 1ozz h SER 16 N 7.71 0.54 -1.53 8.08 0.87 -1.81 -3.15 113.55 124.25 1ozz h SER 16 Ca -0.04 -0.29 -0.69 0.00 -1.23 0.00 0.00 61.79 59.55 1ozz h SER 16 Cb 1.09 -0.15 -0.20 0.00 -0.44 0.00 0.00 62.40 62.70 1ozz h SER 16 CO 0.24 0.98 1.23 0.59 -0.53 0.00 0.00 176.83 179.34 1ozz n ASN 17 N -3.95 7.32 -0.06 6.23 3.02 -1.26 -4.76 115.26 121.80 1ozz n ASN 17 Ca -0.03 -3.42 -0.08 0.00 -0.03 0.00 0.00 54.58 51.02 1ozz n ASN 17 Cb 0.60 -1.22 -0.01 0.00 -0.61 0.00 0.00 39.78 38.53 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 -0.24 -0.01 -0.53 0.00 -1.24 -1.86 -2.80 115.58 108.89 1ozz h ASN 19 Ca 0.15 -0.22 0.01 0.00 0.71 0.00 0.00 56.30 56.95 1ozz h ASN 19 Cb 0.47 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.49 1ozz h ASN 19 CO -0.42 0.22 0.34 0.00 -1.29 0.00 0.00 177.43 176.28 1ozz h ALA 20 N 0.76 0.68 0.16 1.57 0.00 -1.83 -0.92 119.26 119.68 1ozz h ALA 20 Ca -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1ozz h ALA 20 Cb 0.23 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1ozz h ALA 20 CO 0.00 0.08 -0.08 1.49 0.00 0.00 0.00 179.25 180.75 1ozz h GLU 21 N 0.69 -0.21 0.00 0.00 4.81 -0.20 -2.35 114.58 117.32 1ozz h GLU 21 Ca 0.20 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.39 1ozz h GLU 21 Cb -0.04 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1ozz h GLU 21 CO -0.06 -0.13 -0.28 0.00 -0.73 0.00 0.00 179.01 177.80 1ozz h LYS 23 N 0.00 1.15 -0.39 0.00 1.57 -0.80 0.16 116.57 118.25 1ozz h LYS 23 Ca -0.00 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.47 1ozz h LYS 23 Cb 0.54 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1ozz h LYS 23 CO 0.04 0.91 -0.24 0.00 -0.57 0.00 0.00 179.45 179.58 1ozz h ARG 24 N 1.12 0.85 -0.32 3.15 3.08 -0.90 -3.13 114.38 118.23 1ozz h ARG 24 Ca 0.27 -0.39 0.04 0.00 0.07 0.00 0.00 59.98 59.96 1ozz h ARG 24 Cb 0.16 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 1ozz h ARG 24 CO -0.03 1.03 0.09 0.00 -1.07 0.00 0.00 179.97 180.00 1ozz h ARG 25 N 0.66 0.22 0.00 0.04 3.08 -0.76 -3.46 114.38 114.15 1ozz h ARG 25 Ca 0.08 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1ozz h ARG 25 Cb 0.81 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1ozz h ARG 25 CO 0.07 0.14 0.00 0.41 -1.07 0.00 0.00 179.97 179.52 1ozz n GLY 26 N -1.21 -0.06 3.94 0.04 0.00 0.01 -5.10 105.19 102.81 1ozz n GLY 26 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.14 3.17 0.34 1.61 1.51 0.34 -4.98 117.35 119.19 1ozz s TYR 27 Ca 0.00 0.35 0.07 0.00 -1.01 0.00 0.00 57.07 56.48 1ozz s TYR 27 Cb 0.00 -2.56 0.61 0.00 -0.11 0.00 0.00 41.96 39.90 1ozz s TYR 27 CO 0.00 -0.63 1.82 0.87 -1.11 0.00 0.00 175.55 176.50 1ozz h LYS 28 N 0.11 0.30 0.00 -0.62 1.57 -1.69 -3.39 116.57 112.86 1ozz h LYS 28 Ca -0.45 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 1ozz h LYS 28 Cb 1.26 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1ozz h LYS 28 CO 0.58 0.51 0.00 0.41 -0.57 0.00 0.00 179.45 180.38 1ozz n GLY 29 N -0.60 -0.77 3.61 3.86 0.00 -1.26 -4.92 105.19 105.11 1ozz n GLY 29 Ca -0.01 -0.32 -0.07 0.00 0.00 0.00 0.00 46.02 45.62 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 0.00 -0.11 -0.19 -0.02 0.00 -1.26 -1.29 107.32 104.44 1ozz s GLY 30 Ca 0.00 2.40 -0.17 0.00 0.00 0.00 0.00 44.72 46.95 1ozz s GLY 30 CO 0.00 1.11 0.50 -2.38 0.00 0.00 0.00 173.10 172.34 1ozz s HIS 31 N -1.00 -0.57 -0.23 1.90 -3.43 0.84 -4.10 115.29 108.71 1ozz s HIS 31 Ca 0.03 1.37 -0.26 0.00 -0.80 0.00 0.00 55.06 55.40 1ozz s HIS 31 Cb -0.01 0.20 -0.00 0.00 -1.43 0.00 0.00 32.58 31.34 1ozz s HIS 31 CO -0.03 -0.28 0.89 0.00 -2.00 0.00 0.00 174.74 173.32 1ozz s GLY 33 N 1.28 -0.08 0.00 0.00 0.00 0.34 -4.76 107.32 104.10 1ozz s GLY 33 Ca 0.38 0.64 0.00 0.00 0.00 0.00 0.00 44.72 45.74 1ozz s GLY 33 CO 0.08 2.06 0.00 -1.14 0.00 0.00 0.00 173.10 174.10 1ozz n SER 34 N 5.34 0.00 -4.65 1.64 3.41 -1.26 -4.53 113.62 113.57 1ozz n SER 34 Ca -0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.13 1ozz n SER 34 Cb 0.50 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 1ozz n SER 34 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1ozz s PHE 35 N -3.00 1.46 -2.07 7.33 5.36 -1.26 -0.92 117.98 124.88 1ozz s PHE 35 Ca 0.00 -0.14 0.00 0.00 -0.96 0.00 0.00 56.93 55.83 1ozz s PHE 35 Cb 0.00 -4.12 0.00 0.00 -0.34 0.00 0.00 43.02 38.56 1ozz s PHE 35 CO 0.00 -4.88 0.00 0.00 -1.46 0.00 0.00 175.22 168.88 1ozz n ALA 36 N 8.03 -0.42 -3.91 11.12 0.00 -1.26 -2.48 120.51 131.59 1ozz n ALA 36 Ca 0.21 0.28 -0.28 0.00 0.00 0.00 0.00 53.44 53.65 1ozz n ALA 36 Cb 0.42 -2.10 0.01 0.00 0.00 0.00 0.00 19.45 17.78 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 -1.59 -2.78 0.11 0.00 5.03 -0.09 -4.90 115.26 111.04 1ozz n ASN 37 Ca -0.22 -0.87 -0.18 0.00 0.87 0.00 0.00 54.58 54.18 1ozz n ASN 37 Cb 0.69 -3.60 -0.14 0.00 -1.02 0.00 0.00 39.78 35.71 1ozz n ASN 37 CO 0.00 0.00 0.00 -0.37 -1.83 0.00 0.00 177.26 175.06 1ozz h VAL 38 N -1.90 1.44 -3.46 2.41 -1.51 -1.70 -3.42 116.25 108.13 1ozz h VAL 38 Ca -0.60 -2.95 -0.54 0.00 -1.23 0.00 0.00 66.70 61.39 1ozz h VAL 38 Cb 1.37 2.94 -0.03 0.00 -2.13 0.00 0.00 31.29 33.45 1ozz h VAL 38 CO 0.65 0.87 0.31 0.20 -1.23 0.00 0.00 177.57 178.37 1ozz s ASN 39 N -7.25 7.35 -0.47 4.19 -0.87 -1.26 -0.47 114.94 116.16 1ozz s ASN 39 Ca -0.05 1.63 -0.18 0.00 -1.57 0.00 0.00 52.86 52.68 1ozz s ASN 39 Cb 0.06 -2.55 0.04 0.00 -0.02 0.00 0.00 41.25 38.79 1ozz s ASN 39 CO 0.90 -0.15 0.54 0.00 -2.57 0.00 0.00 177.10 175.82 1ozz s TRP 41 N 2.37 3.17 0.06 0.00 0.52 0.33 -2.80 118.94 122.59 1ozz s TRP 41 Ca 0.14 -0.61 -0.22 0.00 0.02 0.00 0.00 56.10 55.42 1ozz s TRP 41 Cb -0.19 -2.34 -0.06 0.00 -1.15 0.00 0.00 33.47 29.73 1ozz s TRP 41 CO 0.13 -0.46 0.66 0.00 0.02 0.00 0.00 176.95 177.30 1ozz s GLU 43 N -0.56 3.83 0.00 0.00 0.41 -0.42 -0.34 118.70 121.63 1ozz s GLU 43 Ca 0.33 2.29 0.19 0.00 -0.41 0.00 0.00 54.97 57.37 1ozz s GLU 43 Cb -0.20 -4.19 1.15 0.00 -1.78 0.00 0.00 34.13 29.12 1ozz s GLU 43 CO 0.21 -1.30 1.54 2.41 -0.49 0.00 0.00 175.26 177.63