#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bz5 s PRO 2 N 0.00 2.51 0.44 2.89 0.02 -1.26 -4.93 135.00 134.66 1bz5 s PRO 2 Ca 0.00 2.01 0.16 0.00 0.02 0.00 0.00 61.00 63.19 1bz5 s PRO 2 Cb 0.00 -1.85 0.99 0.00 0.02 0.00 0.00 34.50 33.66 1bz5 s PRO 2 CO 0.00 -1.61 1.95 -0.44 -0.33 0.00 0.00 177.00 176.57 1bz5 h ASP 3 N 0.44 0.00 0.60 2.53 5.19 -2.03 -2.37 116.42 120.79 1bz5 h ASP 3 Ca -0.50 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.91 1bz5 h ASP 3 Cb 1.33 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.84 1bz5 h ASP 3 CO 0.53 0.23 0.00 2.19 -3.12 0.00 0.00 179.24 179.07 1bz5 h PHE 4 N 0.00 0.00 0.00 4.55 -5.15 -1.98 -1.78 116.94 112.58 1bz5 h PHE 4 Ca -0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1bz5 h PHE 4 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.60 1bz5 h PHE 4 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.31 1bz5 n LEU 6 N -2.22 1.11 -4.80 0.00 4.77 -0.67 -4.45 117.00 110.74 1bz5 n LEU 6 Ca 0.02 -0.31 -0.34 0.00 -0.03 0.00 0.00 56.01 55.34 1bz5 n LEU 6 Cb 0.20 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 1bz5 n LEU 6 CO 0.18 0.21 0.72 -1.61 -1.33 0.00 0.00 177.39 175.56 1bz5 s GLU 7 N -2.60 3.70 0.58 3.23 2.02 -0.94 -4.94 118.70 119.75 1bz5 s GLU 7 Ca 0.21 1.36 -0.15 0.00 0.02 0.00 0.00 54.97 56.41 1bz5 s GLU 7 Cb 0.19 -2.08 -0.05 0.00 0.10 0.00 0.00 34.13 32.29 1bz5 s GLU 7 CO 0.57 -0.52 1.03 -2.14 0.02 0.00 0.00 175.26 174.22 1bz5 s PRO 8 N -3.35 3.54 0.42 0.39 0.02 -1.26 -4.89 135.00 129.88 1bz5 s PRO 8 Ca 0.67 1.03 -0.26 0.00 0.02 0.00 0.00 61.00 62.46 1bz5 s PRO 8 Cb -0.17 -2.07 -0.09 0.00 0.02 0.00 0.00 34.50 32.19 1bz5 s PRO 8 CO 0.23 -0.62 1.35 -1.25 -0.33 0.00 0.00 177.00 176.38 1bz5 s PRO 9 N -4.33 3.87 -0.24 5.54 0.04 -1.26 -4.97 135.00 133.64 1bz5 s PRO 9 Ca 0.60 2.26 0.02 0.00 0.04 0.00 0.00 61.00 63.92 1bz5 s PRO 9 Cb -0.13 -2.72 0.05 0.00 0.04 0.00 0.00 34.50 31.74 1bz5 s PRO 9 CO 0.39 -0.61 -0.12 -0.47 0.04 0.00 0.00 177.00 176.23 1bz5 s TYR 10 N -1.24 3.04 0.09 0.56 5.04 -1.26 -5.00 117.35 118.59 1bz5 s TYR 10 Ca 0.58 -2.11 -0.15 0.00 -2.44 0.00 0.00 57.07 52.95 1bz5 s TYR 10 Cb -0.40 -1.87 -0.11 0.00 0.35 0.00 0.00 41.96 39.93 1bz5 s TYR 10 CO 0.52 -0.85 1.38 1.15 -1.34 0.00 0.00 175.55 176.41 1bz5 h THR 11 N 6.60 1.31 0.00 4.34 2.02 -1.95 -3.44 112.91 121.79 1bz5 h THR 11 Ca -0.24 -1.60 0.00 0.00 0.77 0.00 0.00 66.41 65.34 1bz5 h THR 11 Cb 1.06 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 1bz5 h THR 11 CO 0.48 0.51 0.00 0.61 0.37 0.00 0.00 175.52 177.49 1bz5 n GLY 12 N 0.33 -0.27 0.13 2.16 0.00 -1.26 -0.37 105.19 105.90 1bz5 n GLY 12 Ca -0.05 -1.77 0.13 0.00 0.00 0.00 0.00 46.02 44.33 1bz5 n GLY 12 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1bz5 h PRO 13 N 0.00 0.00 -7.28 1.61 0.13 -1.94 -3.43 132.00 121.08 1bz5 h PRO 13 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 1bz5 h PRO 13 Cb 0.00 0.00 0.08 0.00 0.13 0.00 0.00 31.00 31.21 1bz5 h PRO 13 CO 0.00 0.00 0.38 0.00 -0.23 0.00 0.00 178.00 178.15 1bz5 n LYS 15 N -2.64 1.56 -2.18 0.00 4.76 -1.23 -4.47 118.16 113.96 1bz5 n LYS 15 Ca 0.08 -0.83 -0.31 0.00 -2.87 0.00 0.00 58.31 54.37 1bz5 n LYS 15 Cb 0.53 -1.42 -0.01 0.00 -1.84 0.00 0.00 35.03 32.29 1bz5 n LYS 15 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1bz5 s ALA 16 N -1.90 3.10 -0.67 7.82 0.00 -0.14 -5.03 121.76 124.94 1bz5 s ALA 16 Ca 0.35 0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.40 1bz5 s ALA 16 Cb 0.18 -3.08 0.21 0.00 0.00 0.00 0.00 23.12 20.43 1bz5 s ALA 16 CO 0.29 -0.43 0.61 0.54 0.00 0.00 0.00 175.76 176.76 1bz5 n ARG 17 N -2.10 2.09 -4.11 0.00 3.00 -1.26 -3.95 116.66 110.34 1bz5 n ARG 17 Ca 0.06 -4.53 -0.35 0.00 -0.01 0.00 0.00 57.85 53.02 1bz5 n ARG 17 Cb 0.54 -2.25 -0.09 0.00 0.00 0.00 0.00 32.46 30.67 1bz5 n ARG 17 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1bz5 s ILE 18 N -1.89 4.77 -0.03 0.55 -1.09 -0.92 -4.93 121.20 117.67 1bz5 s ILE 18 Ca 0.32 -0.06 -0.28 0.00 -2.23 0.00 0.00 60.65 58.40 1bz5 s ILE 18 Cb 0.05 -3.09 -0.03 0.00 -1.58 0.00 0.00 42.46 37.81 1bz5 s ILE 18 CO -0.10 0.54 0.90 -0.63 -1.23 0.00 0.00 174.94 174.42 1bz5 s ILE 19 N -0.35 4.92 0.27 2.92 1.01 -1.26 0.01 121.20 128.71 1bz5 s ILE 19 Ca 0.09 1.88 0.02 0.00 0.00 0.00 0.00 60.65 62.64 1bz5 s ILE 19 Cb -0.12 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.06 1bz5 s ILE 19 CO 0.02 0.18 0.09 -0.13 0.00 0.00 0.00 174.94 175.09 1bz5 s ARG 20 N 1.01 1.45 0.06 2.79 1.81 -0.56 -4.92 118.95 120.59 1bz5 s ARG 20 Ca 0.48 -1.79 0.08 0.00 -1.72 0.00 0.00 55.73 52.78 1bz5 s ARG 20 Cb -0.20 -0.39 -0.03 0.00 -0.45 0.00 0.00 34.95 33.88 1bz5 s ARG 20 CO 0.25 -0.27 -0.20 0.71 -0.68 0.00 0.00 175.30 175.10 1bz5 s TYR 21 N -3.66 2.49 0.05 -0.53 2.02 0.13 -1.41 117.35 116.44 1bz5 s TYR 21 Ca 0.37 -0.30 0.01 0.00 -0.37 0.00 0.00 57.07 56.78 1bz5 s TYR 21 Cb 0.08 -1.42 -0.03 0.00 -0.40 0.00 0.00 41.96 40.19 1bz5 s TYR 21 CO 0.14 0.25 -0.06 -0.59 -1.57 0.00 0.00 175.55 173.72 1bz5 s PHE 22 N -0.94 0.62 -0.15 2.71 -0.71 -0.22 -0.48 117.98 118.80 1bz5 s PHE 22 Ca 0.14 -0.69 -0.23 0.00 -1.04 0.00 0.00 56.93 55.12 1bz5 s PHE 22 Cb -0.10 -0.38 -0.02 0.00 -1.21 0.00 0.00 43.02 41.30 1bz5 s PHE 22 CO 0.05 -0.16 0.71 -0.47 -1.34 0.00 0.00 175.22 174.01 1bz5 s TYR 23 N -2.31 3.45 -0.61 3.49 5.04 -1.26 -0.98 117.35 124.17 1bz5 s TYR 23 Ca -0.03 1.12 -0.17 0.00 -2.44 0.00 0.00 57.07 55.54 1bz5 s TYR 23 Cb -0.04 -2.86 0.14 0.00 0.35 0.00 0.00 41.96 39.54 1bz5 s TYR 23 CO -0.03 -0.12 0.62 1.21 -1.34 0.00 0.00 175.55 175.89 1bz5 s ASN 24 N 1.07 6.28 0.31 4.32 3.04 -0.25 -4.79 114.94 124.92 1bz5 s ASN 24 Ca 0.34 -1.82 0.04 0.00 0.04 0.00 0.00 52.86 51.46 1bz5 s ASN 24 Cb -0.16 -2.24 0.65 0.00 -1.54 0.00 0.00 41.25 37.95 1bz5 s ASN 24 CO 0.13 -0.90 1.84 0.00 -3.04 0.00 0.00 177.10 175.13 1bz5 h ALA 25 N 8.82 1.63 0.06 1.71 0.00 -1.83 0.15 119.26 129.79 1bz5 h ALA 25 Ca -0.23 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1bz5 h ALA 25 Cb 1.09 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1bz5 h ALA 25 CO 1.02 0.11 -0.03 -0.22 0.00 0.00 0.00 179.25 180.13 1bz5 h LYS 26 N 0.88 -0.08 0.00 0.00 3.64 -1.94 -3.03 116.57 116.04 1bz5 h LYS 26 Ca 0.49 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.87 1bz5 h LYS 26 Cb 0.59 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.43 1bz5 h LYS 26 CO -0.26 0.19 -0.05 0.00 -2.27 0.00 0.00 179.45 177.07 1bz5 h ALA 27 N 0.56 1.01 -0.25 5.00 0.00 -1.90 -3.47 119.26 120.21 1bz5 h ALA 27 Ca -0.01 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1bz5 h ALA 27 Cb 0.31 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1bz5 h ALA 27 CO 0.01 0.06 -0.09 0.41 0.00 0.00 0.00 179.25 179.64 1bz5 n GLY 28 N 0.14 0.75 3.63 0.00 0.00 0.47 -5.01 105.19 105.17 1bz5 n GLY 28 Ca 0.01 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 1bz5 n GLY 28 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1bz5 s LEU 29 N -1.14 0.20 0.12 0.99 0.05 -1.16 -5.00 118.68 112.74 1bz5 s LEU 29 Ca 0.00 -0.82 -0.20 0.00 0.05 0.00 0.00 54.13 53.16 1bz5 s LEU 29 Cb 0.00 1.98 -0.07 0.00 -2.05 0.00 0.00 46.19 46.04 1bz5 s LEU 29 CO 0.00 -1.16 0.63 0.00 -0.55 0.00 0.00 176.35 175.27 1bz5 s GLN 31 N -1.32 1.45 0.36 0.00 -0.21 -0.15 -4.93 119.66 114.85 1bz5 s GLN 31 Ca 0.33 -1.77 -0.05 0.00 0.02 0.00 0.00 55.36 53.88 1bz5 s GLN 31 Cb -0.19 -0.53 -0.05 0.00 1.00 0.00 0.00 33.01 33.24 1bz5 s GLN 31 CO 0.21 -0.21 0.64 0.95 -2.12 0.00 0.00 175.29 174.76 1bz5 s THR 32 N -3.53 4.96 0.17 -0.19 -4.23 -1.26 -1.06 115.64 110.50 1bz5 s THR 32 Ca 0.34 0.13 -0.20 0.00 -1.18 0.00 0.00 61.69 60.79 1bz5 s THR 32 Cb 0.07 -3.77 0.05 0.00 1.34 0.00 0.00 72.50 70.19 1bz5 s THR 32 CO 0.12 -0.49 0.54 0.72 -0.54 0.00 0.00 174.62 174.97 1bz5 s PHE 33 N -2.29 -0.32 -0.29 3.99 -0.71 -0.50 -4.89 117.98 112.97 1bz5 s PHE 33 Ca 0.46 0.04 -0.16 0.00 -1.04 0.00 0.00 56.93 56.22 1bz5 s PHE 33 Cb -0.10 0.45 -0.03 0.00 -1.21 0.00 0.00 43.02 42.13 1bz5 s PHE 33 CO 0.34 -0.86 0.40 0.08 -1.34 0.00 0.00 175.22 173.84 1bz5 s VAL 34 N -3.81 5.14 -0.12 -2.49 1.01 -1.26 -1.49 120.40 117.39 1bz5 s VAL 34 Ca 0.04 0.49 -0.11 0.00 0.00 0.00 0.00 61.98 62.41 1bz5 s VAL 34 Cb -0.01 -3.76 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 1bz5 s VAL 34 CO -0.09 0.06 0.23 -0.47 0.00 0.00 0.00 175.10 174.84 1bz5 s TYR 35 N 2.13 3.57 -0.12 5.22 5.04 0.10 -4.39 117.35 128.90 1bz5 s TYR 35 Ca 0.16 0.62 0.28 0.00 -2.44 0.00 0.00 57.07 55.68 1bz5 s TYR 35 Cb -0.16 -2.14 0.86 0.00 0.35 0.00 0.00 41.96 40.87 1bz5 s TYR 35 CO 0.11 0.54 1.80 0.78 -1.34 0.00 0.00 175.55 177.43 1bz5 h GLY 36 N 5.56 0.00 0.00 8.97 0.00 -0.83 -2.44 103.07 114.33 1bz5 h GLY 36 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1bz5 h GLY 36 CO 0.65 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.80 1bz5 n GLY 37 N 0.52 1.09 3.38 4.60 0.00 -1.26 -0.97 105.19 112.55 1bz5 n GLY 37 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1bz5 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bz5 n ARG 39 N -0.24 -6.16 -1.88 0.00 3.00 -1.26 -4.56 116.66 105.56 1bz5 n ARG 39 Ca -0.10 0.66 -0.38 0.00 -0.01 0.00 0.00 57.85 58.02 1bz5 n ARG 39 Cb 0.63 -5.59 0.04 0.00 0.00 0.00 0.00 32.46 27.53 1bz5 n ARG 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1bz5 s ALA 40 N -3.30 2.73 0.51 7.54 0.00 -1.26 -4.88 121.76 123.10 1bz5 s ALA 40 Ca 0.65 1.21 0.04 0.00 0.00 0.00 0.00 51.96 53.86 1bz5 s ALA 40 Cb -0.32 -3.52 0.03 0.00 0.00 0.00 0.00 23.12 19.32 1bz5 s ALA 40 CO 0.81 -1.28 0.71 0.15 0.00 0.00 0.00 175.76 176.15 1bz5 s LYS 41 N -3.02 2.58 0.43 0.00 -0.14 -1.26 -5.02 119.74 113.31 1bz5 s LYS 41 Ca 0.73 -1.04 0.16 0.00 -1.36 0.00 0.00 55.97 54.46 1bz5 s LYS 41 Cb -0.37 -2.59 0.95 0.00 -1.68 0.00 0.00 37.83 34.14 1bz5 s LYS 41 CO 0.42 -0.60 1.93 0.00 -0.76 0.00 0.00 175.35 176.34 1bz5 h ARG 42 N 0.26 0.00 -3.29 1.68 3.08 -1.96 -3.28 114.38 110.86 1bz5 h ARG 42 Ca -0.40 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 58.92 1bz5 h ARG 42 Cb 1.29 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.25 1bz5 h ARG 42 CO 0.48 0.25 2.69 -1.71 -1.07 0.00 0.00 179.97 180.61 1bz5 n ASN 43 N -4.11 6.23 -3.45 7.04 5.15 -1.26 -4.74 115.26 120.12 1bz5 n ASN 43 Ca -0.02 -2.96 -0.09 0.00 -0.60 0.00 0.00 54.58 50.90 1bz5 n ASN 43 Cb 0.31 -1.50 -0.09 0.00 -0.53 0.00 0.00 39.78 37.98 1bz5 n ASN 43 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1bz5 s ASN 44 N 1.46 0.13 -0.04 1.20 3.84 -1.24 -4.54 114.94 115.75 1bz5 s ASN 44 Ca 0.50 0.44 0.05 0.00 0.21 0.00 0.00 52.86 54.06 1bz5 s ASN 44 Cb 0.14 1.15 -0.01 0.00 -0.55 0.00 0.00 41.25 41.98 1bz5 s ASN 44 CO -0.05 -0.28 -0.20 -0.36 -2.79 0.00 0.00 177.10 173.42 1bz5 s PHE 45 N 2.55 1.93 0.18 0.43 0.40 0.36 -4.94 117.98 118.90 1bz5 s PHE 45 Ca 0.08 -0.54 0.07 0.00 -0.60 0.00 0.00 56.93 55.94 1bz5 s PHE 45 Cb -0.14 -1.28 0.02 0.00 0.51 0.00 0.00 43.02 42.12 1bz5 s PHE 45 CO -0.15 -0.17 1.41 -0.22 0.70 0.00 0.00 175.22 176.79 1bz5 h LYS 46 N 6.14 0.05 -5.51 0.44 3.64 -1.92 0.39 116.57 119.80 1bz5 h LYS 46 Ca -0.33 -0.06 -0.67 0.00 -1.27 0.00 0.00 60.65 58.32 1bz5 h LYS 46 Cb 1.17 0.02 -0.28 0.00 -0.41 0.00 0.00 32.23 32.73 1bz5 h LYS 46 CO 0.48 0.87 -0.79 0.45 -2.27 0.00 0.00 179.45 178.18 1bz5 s SER 47 N -6.81 3.81 0.40 4.20 0.15 -1.26 -4.84 113.70 109.34 1bz5 s SER 47 Ca -0.01 -0.36 0.13 0.00 0.70 0.00 0.00 55.95 56.41 1bz5 s SER 47 Cb 0.11 -1.42 0.82 0.00 -1.71 0.00 0.00 66.02 63.82 1bz5 s SER 47 CO 0.80 0.19 1.89 0.00 1.20 0.00 0.00 173.24 177.33 1bz5 h ALA 48 N 6.47 1.51 -0.28 5.45 0.00 -1.98 -2.37 119.26 128.06 1bz5 h ALA 48 Ca -0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1bz5 h ALA 48 Cb 1.21 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1bz5 h ALA 48 CO 0.53 0.37 0.18 1.49 0.00 0.00 0.00 179.25 181.82 1bz5 h GLU 49 N 0.02 0.38 -0.59 0.00 4.81 -1.99 -2.01 114.58 115.20 1bz5 h GLU 49 Ca 0.00 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1bz5 h GLU 49 Cb 0.52 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.79 1bz5 h GLU 49 CO 0.04 0.28 0.18 -0.44 -0.73 0.00 0.00 179.01 178.34 1bz5 h ASP 50 N 0.37 0.84 -0.12 1.04 3.32 -1.89 -2.37 116.42 117.61 1bz5 h ASP 50 Ca 0.10 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1bz5 h ASP 50 Cb -0.01 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 1bz5 h ASP 50 CO -0.02 0.79 0.04 0.00 -1.72 0.00 0.00 179.24 178.33 1bz5 h MET 52 N 0.00 1.08 -0.10 0.00 2.86 -1.27 -1.00 114.93 116.49 1bz5 h MET 52 Ca 0.04 -0.24 -0.13 0.00 -2.06 0.00 0.00 59.70 57.30 1bz5 h MET 52 Cb 0.22 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 31.74 1bz5 h MET 52 CO -0.00 0.94 -0.45 -0.09 1.06 0.00 0.00 176.91 178.37 1bz5 h ARG 53 N 1.03 0.49 -0.20 1.72 2.43 -1.41 0.27 114.38 118.71 1bz5 h ARG 53 Ca 0.22 -0.39 -0.11 0.00 -0.81 0.00 0.00 59.98 58.89 1bz5 h ARG 53 Cb 0.34 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 1bz5 h ARG 53 CO -0.00 1.02 -0.29 1.15 -1.51 0.00 0.00 179.97 180.33 1bz5 h THR 54 N 0.08 1.33 0.00 0.20 2.02 -1.13 -3.37 112.91 112.04 1bz5 h THR 54 Ca -0.03 -1.50 -0.00 0.00 0.77 0.00 0.00 66.41 65.65 1bz5 h THR 54 Cb 1.09 1.83 -0.00 0.00 -1.74 0.00 0.00 68.15 69.33 1bz5 h THR 54 CO 0.09 0.46 -1.77 0.00 0.37 0.00 0.00 175.52 174.67