#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bnw s ILE 24 N 0.00 3.63 -0.22 5.18 -1.16 -1.26 -5.05 121.20 122.31 2bnw s ILE 24 Ca 0.00 1.15 -0.13 0.00 -0.51 0.00 0.00 60.65 61.17 2bnw s ILE 24 Cb 0.00 -3.55 0.07 0.00 0.61 0.00 0.00 42.46 39.59 2bnw s ILE 24 CO 0.00 -0.08 0.54 -0.32 -2.81 0.00 0.00 174.94 172.27 2bnw s MET 25 N -2.79 0.54 1.03 3.50 1.75 -1.26 -5.17 119.30 116.91 2bnw s MET 25 Ca 0.62 0.98 -0.15 0.00 -1.25 0.00 0.00 55.69 55.89 2bnw s MET 25 Cb -0.21 0.06 0.21 0.00 2.84 0.00 0.00 34.83 37.73 2bnw s MET 25 CO 0.26 -0.15 1.16 0.20 -0.65 0.00 0.00 175.02 175.84 2bnw s GLY 26 N 1.45 1.61 0.32 2.11 0.00 -1.26 -5.09 107.32 106.46 2bnw s GLY 26 Ca -0.09 -0.78 0.09 0.00 0.00 0.00 0.00 44.72 43.94 2bnw s GLY 26 CO -0.15 -0.06 -0.09 0.99 0.00 0.00 0.00 173.10 173.79 2bnw s ASP 27 N -4.06 3.38 -0.05 1.64 1.01 -1.26 -5.15 116.67 112.17 2bnw s ASP 27 Ca 0.68 -1.18 -0.02 0.00 0.71 0.00 0.00 52.55 52.74 2bnw s ASP 27 Cb -0.12 -0.28 0.04 0.00 1.01 0.00 0.00 42.92 43.57 2bnw s ASP 27 CO 0.55 -0.23 0.11 -0.75 0.21 0.00 0.00 175.17 175.06 2bnw s LYS 28 N -3.64 0.04 0.14 8.23 2.47 -1.26 -5.14 119.74 120.58 2bnw s LYS 28 Ca 0.31 0.34 -0.30 0.00 -1.56 0.00 0.00 55.97 54.76 2bnw s LYS 28 Cb 0.02 -0.22 -0.07 0.00 -1.46 0.00 0.00 37.83 36.10 2bnw s LYS 28 CO 0.15 -0.19 1.22 0.99 0.16 0.00 0.00 175.35 177.67 2bnw s THR 29 N 1.31 3.68 0.20 3.43 2.01 -1.26 -5.04 115.64 119.97 2bnw s THR 29 Ca -0.07 1.33 0.02 0.00 0.31 0.00 0.00 61.69 63.27 2bnw s THR 29 Cb -0.12 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.49 2bnw s THR 29 CO -0.05 0.17 0.03 0.68 -0.69 0.00 0.00 174.62 174.76 2bnw s VAL 30 N 0.38 0.64 -0.10 3.82 -7.23 -1.26 -5.15 120.40 111.49 2bnw s VAL 30 Ca 0.56 -1.99 -0.09 0.00 -1.81 0.00 0.00 61.98 58.65 2bnw s VAL 30 Cb -0.32 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.27 2bnw s VAL 30 CO 0.34 -0.31 0.20 -0.13 -0.31 0.00 0.00 175.10 174.89 2bnw s ARG 31 N -3.96 3.58 0.09 4.82 0.52 -1.26 -5.11 118.95 117.64 2bnw s ARG 31 Ca 0.29 -0.02 0.04 0.00 -0.52 0.00 0.00 55.73 55.52 2bnw s ARG 31 Cb 0.07 -3.21 -0.03 0.00 0.52 0.00 0.00 34.95 32.29 2bnw s ARG 31 CO 0.07 0.73 -0.12 0.14 0.02 0.00 0.00 175.30 176.15 2bnw s VAL 32 N -0.96 1.03 0.32 3.52 -7.23 -1.26 -5.13 120.40 110.70 2bnw s VAL 32 Ca 0.17 -1.55 -0.29 0.00 -1.81 0.00 0.00 61.98 58.49 2bnw s VAL 32 Cb -0.13 -1.28 -0.12 0.00 0.56 0.00 0.00 36.38 35.41 2bnw s VAL 32 CO 0.06 -0.45 1.48 -1.14 -0.31 0.00 0.00 175.10 174.74 2bnw n ARG 33 N 0.76 2.50 -0.14 4.82 0.63 -1.26 -4.87 116.66 119.10 2bnw n ARG 33 Ca -0.17 0.88 -0.06 0.00 -0.92 0.00 0.00 57.85 57.58 2bnw n ARG 33 Cb 0.57 -2.59 0.03 0.00 0.45 0.00 0.00 32.46 30.91 2bnw n ARG 33 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2bnw h ALA 34 N 3.67 0.55 -0.76 5.13 0.00 -2.00 -2.45 119.26 123.41 2bnw h ALA 34 Ca -0.48 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 2bnw h ALA 34 Cb 1.25 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 2bnw h ALA 34 CO 0.71 -0.11 0.41 0.38 0.00 0.00 0.00 179.25 180.64 2bnw h ASP 35 N 0.47 0.96 -0.45 0.00 2.03 -2.00 -1.18 116.42 116.25 2bnw h ASP 35 Ca 0.18 -0.10 -0.13 0.00 -0.73 0.00 0.00 57.03 56.25 2bnw h ASP 35 Cb 0.07 -0.25 -0.01 0.00 -0.83 0.00 0.00 39.33 38.31 2bnw h ASP 35 CO -0.11 0.79 -0.22 -0.07 -1.03 0.00 0.00 179.24 178.59 2bnw h LEU 36 N 1.06 0.97 -0.38 0.15 3.38 -1.91 -2.62 115.31 115.95 2bnw h LEU 36 Ca 0.27 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 57.88 2bnw h LEU 36 Cb 0.05 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 2bnw h LEU 36 CO -0.04 1.16 0.11 -0.74 0.09 0.00 0.00 178.44 179.02 2bnw h HIS 37 N 0.78 0.19 -0.28 1.13 2.76 -0.94 -2.89 115.15 115.90 2bnw h HIS 37 Ca 0.10 0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.34 2bnw h HIS 37 Cb 0.80 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 29.68 2bnw h HIS 37 CO 0.06 0.06 -0.00 1.25 -1.30 0.00 0.00 177.93 177.99 2bnw h HIS 38 N 0.25 -0.02 -0.68 5.26 -0.00 -1.02 0.61 115.15 119.55 2bnw h HIS 38 Ca 0.18 0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.71 2bnw h HIS 38 Cb 0.18 0.05 -0.10 0.00 -0.00 0.00 0.00 27.41 27.54 2bnw h HIS 38 CO -0.17 -0.05 0.17 0.82 -0.00 0.00 0.00 177.93 178.70 2bnw h ILE 39 N 0.08 0.58 -0.36 6.26 2.04 -1.27 0.22 117.51 125.05 2bnw h ILE 39 Ca 0.13 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.78 2bnw h ILE 39 Cb 0.18 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2bnw h ILE 39 CO -0.23 0.05 -0.25 0.40 0.00 0.00 0.00 178.15 178.12 2bnw h ILE 40 N 0.28 1.27 0.08 -0.67 1.08 -1.17 -1.71 117.51 116.68 2bnw h ILE 40 Ca 0.37 -1.37 -0.00 0.00 -0.39 0.00 0.00 64.86 63.47 2bnw h ILE 40 Cb 0.60 1.27 0.00 0.00 -3.07 0.00 0.00 36.82 35.61 2bnw h ILE 40 CO -0.46 0.45 -0.04 0.50 -0.69 0.00 0.00 178.15 177.92 2bnw h LYS 41 N 0.64 -0.10 -0.11 2.37 3.64 0.77 -0.34 116.57 123.45 2bnw h LYS 41 Ca 0.08 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2bnw h LYS 41 Cb 0.76 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2bnw h LYS 41 CO 0.06 0.05 0.06 0.82 -2.27 0.00 0.00 179.45 178.18 2bnw h ILE 42 N -0.23 1.02 -0.60 2.00 1.08 -0.62 -1.97 117.51 118.19 2bnw h ILE 42 Ca -0.01 -0.05 -0.05 0.00 -0.39 0.00 0.00 64.86 64.37 2bnw h ILE 42 Cb 0.20 0.87 -0.03 0.00 -3.07 0.00 0.00 36.82 34.79 2bnw h ILE 42 CO 0.02 0.02 0.19 -0.08 -0.69 0.00 0.00 178.15 177.61 2bnw h GLU 43 N 0.13 0.93 -0.40 2.37 4.57 -1.25 -1.05 114.58 119.89 2bnw h GLU 43 Ca 0.04 -0.20 -0.12 0.00 -1.18 0.00 0.00 59.36 57.90 2bnw h GLU 43 Cb -0.01 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.43 2bnw h GLU 43 CO -0.01 0.83 -0.25 1.79 -1.18 0.00 0.00 179.01 180.19 2bnw h THR 44 N 0.85 1.27 -0.04 0.32 1.35 -0.99 -0.38 112.91 115.30 2bnw h THR 44 Ca 0.19 -1.38 -0.08 0.00 -0.55 0.00 0.00 66.41 64.60 2bnw h THR 44 Cb 0.28 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.92 2bnw h THR 44 CO -0.01 0.46 -0.33 0.00 -0.25 0.00 0.00 175.52 175.39 2bnw h ALA 45 N 1.02 1.38 0.01 6.62 0.00 -1.24 0.10 119.26 127.15 2bnw h ALA 45 Ca 0.09 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2bnw h ALA 45 Cb 0.78 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.51 2bnw h ALA 45 CO 0.06 0.45 -0.48 -0.22 0.00 0.00 0.00 179.25 179.06 2bnw h LYS 46 N 0.06 0.30 0.00 0.00 3.64 -0.78 -3.39 116.57 116.41 2bnw h LYS 46 Ca 0.01 -0.34 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 2bnw h LYS 46 Cb 0.62 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 2bnw h LYS 46 CO 0.05 1.05 -0.14 0.09 -2.27 0.00 0.00 179.45 178.23 2bnw n ASN 47 N -4.32 1.68 0.00 4.20 5.03 -0.19 -5.10 115.26 116.56 2bnw n ASN 47 Ca -0.10 -2.76 0.00 0.00 0.87 0.00 0.00 54.58 52.58 2bnw n ASN 47 Cb 0.62 -0.36 0.00 0.00 -1.02 0.00 0.00 39.78 39.03 2bnw n ASN 47 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2bnw n GLY 48 N -1.02 0.91 0.03 7.41 0.00 0.34 -4.99 105.19 107.88 2bnw n GLY 48 Ca 0.11 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2bnw n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bnw n GLY 49 N 0.93 -4.06 3.25 -0.02 0.00 -1.25 -4.46 105.19 99.59 2bnw n GLY 49 Ca 0.00 -2.04 -0.14 0.00 0.00 0.00 0.00 46.02 43.84 2bnw n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bnw s ASN 50 N -0.38 1.24 0.20 1.61 2.20 -1.26 -4.59 114.94 113.96 2bnw s ASN 50 Ca 0.00 -1.20 -0.11 0.00 -0.94 0.00 0.00 52.86 50.62 2bnw s ASN 50 Cb 0.00 0.12 0.14 0.00 -2.00 0.00 0.00 41.25 39.50 2bnw s ASN 50 CO 0.00 -0.58 1.84 0.58 -2.94 0.00 0.00 177.10 175.99 2bnw h VAL 51 N 2.65 1.21 0.45 3.54 2.07 -1.95 -3.21 116.25 121.01 2bnw h VAL 51 Ca -0.37 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 2bnw h VAL 51 Cb 1.21 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 2bnw h VAL 51 CO 0.62 0.22 -0.29 0.50 0.02 0.00 0.00 177.57 178.65 2bnw h LYS 52 N 0.98 -0.69 -0.96 1.57 3.64 -1.99 0.01 116.57 119.15 2bnw h LYS 52 Ca 0.26 0.05 0.20 0.00 -1.27 0.00 0.00 60.65 59.88 2bnw h LYS 52 Cb -0.02 0.16 -0.18 0.00 -0.41 0.00 0.00 32.23 31.78 2bnw h LYS 52 CO -0.05 -0.46 -0.22 0.39 -2.27 0.00 0.00 179.45 176.84 2bnw n GLU 53 N -5.42 -0.09 -0.05 1.90 1.02 -1.22 -1.15 120.64 115.63 2bnw n GLU 53 Ca -0.11 1.49 -0.14 0.00 -0.02 0.00 0.00 57.16 58.38 2bnw n GLU 53 Cb 0.32 -2.23 -0.08 0.00 -0.02 0.00 0.00 31.44 29.43 2bnw n GLU 53 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2bnw h VAL 54 N 0.00 1.37 -0.42 2.62 2.07 -1.36 -2.30 116.25 118.22 2bnw h VAL 54 Ca 0.47 -1.42 0.06 0.00 0.82 0.00 0.00 66.70 66.63 2bnw h VAL 54 Cb 0.73 2.00 -0.05 0.00 -1.52 0.00 0.00 31.29 32.44 2bnw h VAL 54 CO -0.98 0.41 0.11 -0.03 0.02 0.00 0.00 177.57 177.10 2bnw h MET 55 N -0.05 0.25 -0.38 1.57 1.85 -0.03 0.59 114.93 118.73 2bnw h MET 55 Ca 0.01 -0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.16 2bnw h MET 55 Cb 0.75 -0.06 -0.07 0.00 0.43 0.00 0.00 31.60 32.66 2bnw h MET 55 CO 0.04 0.16 -0.05 -0.44 -0.40 0.00 0.00 176.91 176.23 2bnw h ASP 56 N 0.25 -0.25 -0.60 1.39 3.32 -1.10 0.34 116.42 119.78 2bnw h ASP 56 Ca 0.20 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.33 2bnw h ASP 56 Cb 0.23 0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 2bnw h ASP 56 CO -0.24 -0.08 0.29 -0.61 -1.72 0.00 0.00 179.24 176.87 2bnw h GLN 57 N 0.05 0.87 -0.72 3.56 4.15 -0.74 0.01 115.11 122.29 2bnw h GLN 57 Ca 0.18 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 2bnw h GLN 57 Cb 0.27 -0.16 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 2bnw h GLN 57 CO -0.35 0.70 0.42 0.00 -1.93 0.00 0.00 178.83 177.68 2bnw h ALA 58 N 1.12 0.92 0.27 3.38 0.00 -0.44 -1.13 119.26 123.38 2bnw h ALA 58 Ca 0.21 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2bnw h ALA 58 Cb 0.12 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2bnw h ALA 58 CO -0.03 0.40 -0.13 1.25 0.00 0.00 0.00 179.25 180.75 2bnw h LEU 59 N 0.98 -0.31 -0.58 0.00 6.46 -0.43 -1.08 115.31 120.35 2bnw h LEU 59 Ca 0.26 -0.13 0.11 0.00 -0.12 0.00 0.00 57.88 58.00 2bnw h LEU 59 Cb -0.01 0.08 -0.09 0.00 -0.73 0.00 0.00 40.66 39.91 2bnw h LEU 59 CO -0.05 -0.04 0.07 -0.08 -0.62 0.00 0.00 178.44 177.72 2bnw h GLU 60 N -0.58 0.18 -0.36 1.25 4.81 -0.91 -0.74 114.58 118.24 2bnw h GLU 60 Ca -0.04 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 2bnw h GLU 60 Cb 0.42 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 2bnw h GLU 60 CO 0.06 0.12 -0.12 0.93 -0.73 0.00 0.00 179.01 179.27 2bnw h GLU 61 N 0.19 0.63 -0.70 1.92 5.08 -1.07 0.27 114.58 120.90 2bnw h GLU 61 Ca 0.30 -0.20 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2bnw h GLU 61 Cb 0.47 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 2bnw h GLU 61 CO -0.44 0.74 0.27 -0.92 -1.00 0.00 0.00 179.01 177.65 2bnw h TYR 62 N 0.58 1.06 -0.05 4.33 5.03 -0.31 -1.19 116.97 126.42 2bnw h TYR 62 Ca 0.10 -0.08 -0.23 0.00 2.58 0.00 0.00 58.73 61.11 2bnw h TYR 62 Cb 0.54 -0.32 0.02 0.00 1.55 0.00 0.00 36.73 38.52 2bnw h TYR 62 CO 0.02 0.82 -0.85 0.82 -1.32 0.00 0.00 178.16 177.64 2bnw h ILE 63 N 1.02 1.31 -0.68 1.81 2.04 -0.18 -0.00 117.51 122.83 2bnw h ILE 63 Ca 0.24 -2.11 0.07 0.00 1.00 0.00 0.00 64.86 64.05 2bnw h ILE 63 Cb 0.21 2.30 -0.04 0.00 -0.74 0.00 0.00 36.82 38.55 2bnw h ILE 63 CO -0.02 0.65 0.45 0.03 0.00 0.00 0.00 178.15 179.26 2bnw h ARG 64 N 0.32 0.66 0.08 2.37 3.08 -0.44 0.52 114.38 120.97 2bnw h ARG 64 Ca -0.09 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 59.91 2bnw h ARG 64 Cb 1.51 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.41 2bnw h ARG 64 CO 0.17 0.44 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.25 2bnw h LYS 65 N 0.68 -0.10 0.00 0.04 3.64 -1.02 -3.31 116.57 116.50 2bnw h LYS 65 Ca 0.29 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.65 2bnw h LYS 65 Cb 0.28 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2bnw h LYS 65 CO -0.09 0.43 -1.74 0.66 -2.27 0.00 0.00 179.45 176.44 2bnw n TYR 66 N -4.81 0.31 -2.62 1.91 4.01 -0.03 -4.55 117.16 111.38 2bnw n TYR 66 Ca -0.07 0.09 -0.12 0.00 -0.16 0.00 0.00 57.90 57.64 2bnw n TYR 66 Cb 0.29 -0.68 0.03 0.00 -0.31 0.00 0.00 39.34 38.66 2bnw n TYR 66 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2bnw n LEU 67 N -2.43 2.27 -0.09 7.72 4.77 0.18 -4.94 117.00 124.46 2bnw n LEU 67 Ca -0.05 -3.96 0.10 0.00 -0.03 0.00 0.00 56.01 52.07 2bnw n LEU 67 Cb 0.62 0.22 0.47 0.00 -2.33 0.00 0.00 43.42 42.40 2bnw n LEU 67 CO 0.44 1.65 1.19 1.55 -1.33 0.00 0.00 177.39 180.89 2bnw h PRO 68 N 2.83 0.46 -0.65 3.23 0.13 -1.55 0.83 132.00 137.27 2bnw h PRO 68 Ca -0.00 -0.03 0.12 0.00 -0.87 0.00 0.00 66.00 65.22 2bnw h PRO 68 Cb 1.16 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 2bnw h PRO 68 CO 0.54 0.30 0.44 0.38 -0.23 0.00 0.00 178.00 179.43 2bnw h ASP 69 N 0.47 0.34 1.47 1.44 -0.00 -1.91 -3.28 116.42 114.97 2bnw h ASP 69 Ca 0.27 0.01 -0.06 0.00 -0.00 0.00 0.00 57.03 57.26 2bnw h ASP 69 Cb 0.45 -0.06 -0.01 0.00 -0.00 0.00 0.00 39.33 39.72 2bnw h ASP 69 CO -0.08 0.19 -0.28 0.11 -0.00 0.00 0.00 179.24 179.19 2bnw h LYS 70 N 0.37 0.00 -0.02 4.15 1.79 -1.17 -3.54 116.57 118.15 2bnw h LYS 70 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 2bnw h LYS 70 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 2bnw h LYS 70 CO -0.09 0.28 0.00 1.47 -1.08 0.00 0.00 179.45 180.03