#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bnz n GLY 26 N 0.00 0.31 3.34 3.03 0.00 -1.26 -5.13 105.19 105.48 2bnz n GLY 26 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2bnz n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bnz s ASP 27 N -0.37 2.60 -0.04 1.61 1.01 -1.26 -5.14 116.67 115.08 2bnz s ASP 27 Ca 0.00 -0.94 0.02 0.00 0.71 0.00 0.00 52.55 52.34 2bnz s ASP 27 Cb 0.00 -0.14 0.01 0.00 1.01 0.00 0.00 42.92 43.79 2bnz s ASP 27 CO 0.00 -0.11 -0.10 -0.75 0.21 0.00 0.00 175.17 174.42 2bnz s LYS 28 N -3.22 1.27 0.20 8.23 2.47 -1.26 -5.13 119.74 122.30 2bnz s LYS 28 Ca 0.19 -0.34 -0.30 0.00 -1.56 0.00 0.00 55.97 53.96 2bnz s LYS 28 Cb -0.03 -1.12 -0.09 0.00 -1.46 0.00 0.00 37.83 35.13 2bnz s LYS 28 CO 0.07 0.07 1.31 0.99 0.16 0.00 0.00 175.35 177.94 2bnz s THR 29 N 0.45 3.20 0.08 3.43 2.01 -1.26 -5.04 115.64 118.51 2bnz s THR 29 Ca -0.08 0.99 0.03 0.00 0.31 0.00 0.00 61.69 62.94 2bnz s THR 29 Cb -0.12 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 2bnz s THR 29 CO 0.02 0.15 -0.09 0.68 -0.69 0.00 0.00 174.62 174.69 2bnz s VAL 30 N 0.07 0.77 0.34 3.82 -7.23 -1.26 -5.16 120.40 111.76 2bnz s VAL 30 Ca 0.56 -1.48 -0.10 0.00 -1.81 0.00 0.00 61.98 59.15 2bnz s VAL 30 Cb -0.36 -1.15 -0.07 0.00 0.56 0.00 0.00 36.38 35.36 2bnz s VAL 30 CO 0.39 -0.53 0.68 -0.13 -0.31 0.00 0.00 175.10 175.20 2bnz s ARG 31 N -2.50 3.78 0.10 4.82 0.52 -1.26 -5.11 118.95 119.31 2bnz s ARG 31 Ca 0.01 0.37 -0.14 0.00 -0.52 0.00 0.00 55.73 55.45 2bnz s ARG 31 Cb -0.04 -2.49 0.02 0.00 0.52 0.00 0.00 34.95 32.96 2bnz s ARG 31 CO -0.01 0.10 0.33 0.14 0.02 0.00 0.00 175.30 175.88 2bnz s VAL 32 N -2.17 0.09 0.23 3.52 -7.23 -1.26 -5.13 120.40 108.46 2bnz s VAL 32 Ca 0.49 -0.77 -0.32 0.00 -1.81 0.00 0.00 61.98 59.58 2bnz s VAL 32 Cb -0.10 -1.19 -0.13 0.00 0.56 0.00 0.00 36.38 35.52 2bnz s VAL 32 CO 0.27 -0.42 1.50 0.54 -0.31 0.00 0.00 175.10 176.68 2bnz n ARG 33 N -0.07 2.24 0.20 4.82 1.74 -1.26 -4.88 116.66 119.46 2bnz n ARG 33 Ca -0.16 0.80 0.07 0.00 -0.77 0.00 0.00 57.85 57.79 2bnz n ARG 33 Cb 0.63 -2.52 0.40 0.00 -1.02 0.00 0.00 32.46 29.95 2bnz n ARG 33 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bnz h ALA 34 N 4.81 1.07 -0.10 7.54 0.00 -2.00 -1.66 119.26 128.92 2bnz h ALA 34 Ca -0.45 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 53.99 2bnz h ALA 34 Cb 1.26 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 2bnz h ALA 34 CO 0.80 0.40 -0.67 0.38 0.00 0.00 0.00 179.25 180.16 2bnz h ASP 35 N 0.00 0.46 -0.00 0.00 2.03 -1.99 -0.68 116.42 116.24 2bnz h ASP 35 Ca -0.00 -0.28 -0.01 0.00 -0.73 0.00 0.00 57.03 56.00 2bnz h ASP 35 Cb 0.79 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 39.15 2bnz h ASP 35 CO 0.04 1.00 -0.05 -0.07 -1.03 0.00 0.00 179.24 179.13 2bnz h LEU 36 N 0.28 0.05 -0.72 0.15 3.38 -1.93 -2.97 115.31 113.56 2bnz h LEU 36 Ca -0.02 -0.78 0.14 0.00 0.09 0.00 0.00 57.88 57.31 2bnz h LEU 36 Cb 1.22 -0.01 -0.14 0.00 0.09 0.00 0.00 40.66 41.82 2bnz h LEU 36 CO 0.11 0.82 -0.24 -0.74 0.09 0.00 0.00 178.44 178.49 2bnz h HIS 37 N -0.72 -0.58 -0.65 1.13 2.76 -1.35 -1.12 115.15 114.63 2bnz h HIS 37 Ca -0.01 0.07 0.08 0.00 -2.20 0.00 0.00 60.37 58.32 2bnz h HIS 37 Cb 0.83 0.36 -0.07 0.00 1.55 0.00 0.00 27.41 30.09 2bnz h HIS 37 CO 0.20 -0.34 0.30 1.25 -1.30 0.00 0.00 177.93 178.04 2bnz h HIS 38 N -0.05 0.55 -0.51 5.26 -0.00 -1.17 0.34 115.15 119.57 2bnz h HIS 38 Ca 0.32 0.03 0.06 0.00 -0.00 0.00 0.00 60.37 60.78 2bnz h HIS 38 Cb 0.55 -0.15 -0.05 0.00 -0.00 0.00 0.00 27.41 27.76 2bnz h HIS 38 CO -0.62 0.20 0.21 0.82 -0.00 0.00 0.00 177.93 178.55 2bnz h ILE 39 N 0.54 0.88 -0.29 6.26 2.04 -1.06 0.15 117.51 126.04 2bnz h ILE 39 Ca 0.31 -0.14 -0.12 0.00 1.00 0.00 0.00 64.86 65.91 2bnz h ILE 39 Cb 0.32 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 2bnz h ILE 39 CO -0.25 0.08 -0.33 0.40 0.00 0.00 0.00 178.15 178.04 2bnz h ILE 40 N 0.42 1.28 -0.39 -0.67 1.08 -0.66 -2.14 117.51 116.44 2bnz h ILE 40 Ca 0.24 -1.45 -0.03 0.00 -0.39 0.00 0.00 64.86 63.22 2bnz h ILE 40 Cb 0.21 1.42 -0.02 0.00 -3.07 0.00 0.00 36.82 35.37 2bnz h ILE 40 CO -0.21 0.47 0.11 0.50 -0.69 0.00 0.00 178.15 178.33 2bnz h LYS 41 N 0.53 0.61 -0.50 2.37 3.64 0.65 -1.40 116.57 122.46 2bnz h LYS 41 Ca 0.06 -0.14 -0.06 0.00 -1.27 0.00 0.00 60.65 59.24 2bnz h LYS 41 Cb 0.82 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.54 2bnz h LYS 41 CO 0.07 0.62 0.06 0.82 -2.27 0.00 0.00 179.45 178.75 2bnz h ILE 42 N 0.48 1.25 -0.14 2.00 1.08 -0.66 -2.77 117.51 118.75 2bnz h ILE 42 Ca 0.12 -0.97 -0.10 0.00 -0.39 0.00 0.00 64.86 63.53 2bnz h ILE 42 Cb 0.28 0.90 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 2bnz h ILE 42 CO -0.00 0.34 -0.29 -0.08 -0.69 0.00 0.00 178.15 177.43 2bnz h GLU 43 N 0.72 0.45 0.00 2.37 4.57 -1.23 -1.00 114.58 120.46 2bnz h GLU 43 Ca 0.15 -0.29 -0.05 0.00 -1.18 0.00 0.00 59.36 57.98 2bnz h GLU 43 Cb 0.42 0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.05 2bnz h GLU 43 CO 0.01 0.90 -0.25 1.79 -1.18 0.00 0.00 179.01 180.29 2bnz h THR 44 N 0.06 0.84 -0.15 0.32 1.35 -1.34 0.11 112.91 114.10 2bnz h THR 44 Ca 0.00 -0.97 -0.10 0.00 -0.55 0.00 0.00 66.41 64.79 2bnz h THR 44 Cb 0.89 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.89 2bnz h THR 44 CO 0.07 0.24 -0.30 0.00 -0.25 0.00 0.00 175.52 175.28 2bnz h ALA 45 N 1.75 0.24 0.18 6.62 0.00 -1.35 -3.33 119.26 123.37 2bnz h ALA 45 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2bnz h ALA 45 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2bnz h ALA 45 CO 0.03 0.26 -0.09 -0.22 0.00 0.00 0.00 179.25 179.24 2bnz h LYS 46 N 0.10 -0.23 0.00 0.00 3.64 -0.70 -3.46 116.57 115.91 2bnz h LYS 46 Ca 0.01 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2bnz h LYS 46 Cb 0.89 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 2bnz h LYS 46 CO 0.07 -0.16 0.00 0.09 -2.27 0.00 0.00 179.45 177.18 2bnz n ASN 47 N -2.99 0.00 -4.64 4.20 4.13 0.35 -5.07 115.26 111.23 2bnz n ASN 47 Ca -0.03 -0.94 -0.30 0.00 1.68 0.00 0.00 54.58 54.99 2bnz n ASN 47 Cb 0.10 0.00 0.18 0.00 -1.54 0.00 0.00 39.78 38.51 2bnz n ASN 47 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2bnz s GLY 48 N -2.25 1.64 0.00 7.41 0.00 -1.26 -4.38 107.32 108.48 2bnz s GLY 48 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 44.72 45.01 2bnz s GLY 48 CO 0.00 0.78 0.00 0.61 0.00 0.00 0.00 173.10 174.49 2bnz n GLY 49 N 0.01 -2.31 3.42 0.20 0.00 -1.25 -4.35 105.19 100.89 2bnz n GLY 49 Ca 0.09 -2.18 -0.21 0.00 0.00 0.00 0.00 46.02 43.71 2bnz n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bnz s ASN 50 N -0.90 2.09 0.03 1.61 4.22 -1.26 -4.64 114.94 116.09 2bnz s ASN 50 Ca 0.00 -1.54 -0.22 0.00 -2.14 0.00 0.00 52.86 48.96 2bnz s ASN 50 Cb 0.00 0.31 -0.16 0.00 1.28 0.00 0.00 41.25 42.68 2bnz s ASN 50 CO 0.00 -0.83 1.37 0.58 -2.04 0.00 0.00 177.10 176.18 2bnz h VAL 51 N 2.07 1.33 -0.68 3.54 2.07 -1.95 -3.20 116.25 119.43 2bnz h VAL 51 Ca -0.36 -1.10 0.10 0.00 0.82 0.00 0.00 66.70 66.17 2bnz h VAL 51 Cb 1.26 1.84 -0.08 0.00 -1.52 0.00 0.00 31.29 32.79 2bnz h VAL 51 CO 0.58 0.31 0.30 0.50 0.02 0.00 0.00 177.57 179.28 2bnz h LYS 52 N -0.15 0.49 -0.65 1.57 3.64 -1.98 -0.55 116.57 118.94 2bnz h LYS 52 Ca 0.02 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2bnz h LYS 52 Cb 0.52 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.19 2bnz h LYS 52 CO 0.02 0.32 0.41 0.93 -2.27 0.00 0.00 179.45 178.86 2bnz h GLU 53 N 0.50 0.81 -0.21 1.90 5.08 -1.99 0.09 114.58 120.76 2bnz h GLU 53 Ca 0.35 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.64 2bnz h GLU 53 Cb 0.42 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2bnz h GLU 53 CO -0.31 0.53 0.04 0.28 -1.00 0.00 0.00 179.01 178.56 2bnz h VAL 54 N 0.83 1.22 -0.62 3.13 2.07 -1.39 -1.11 116.25 120.37 2bnz h VAL 54 Ca 0.25 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 2bnz h VAL 54 Cb -0.04 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 2bnz h VAL 54 CO -0.08 0.22 0.31 -0.03 0.02 0.00 0.00 177.57 178.02 2bnz h MET 55 N 0.15 0.87 -0.44 1.57 1.85 -0.80 0.25 114.93 118.39 2bnz h MET 55 Ca 0.06 -0.10 -0.13 0.00 -0.61 0.00 0.00 59.70 58.92 2bnz h MET 55 Cb 0.29 -0.17 -0.01 0.00 0.43 0.00 0.00 31.60 32.14 2bnz h MET 55 CO 0.00 0.66 -0.25 -0.44 -0.40 0.00 0.00 176.91 176.48 2bnz h ASP 56 N 0.87 0.95 -0.23 1.39 3.32 -0.83 -1.35 116.42 120.54 2bnz h ASP 56 Ca 0.22 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.85 2bnz h ASP 56 Cb 0.07 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2bnz h ASP 56 CO -0.03 1.14 -0.05 -0.61 -1.72 0.00 0.00 179.24 177.97 2bnz h GLN 57 N 0.79 0.44 0.02 3.56 4.15 -0.30 -0.60 115.11 123.16 2bnz h GLN 57 Ca 0.10 -0.16 0.01 0.00 0.77 0.00 0.00 58.65 59.36 2bnz h GLN 57 Cb 0.81 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 2bnz h GLN 57 CO 0.07 0.67 -0.08 0.00 -1.93 0.00 0.00 178.83 177.56 2bnz h ALA 58 N 0.76 -0.09 -0.48 3.38 0.00 -0.51 0.53 119.26 122.84 2bnz h ALA 58 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.00 2bnz h ALA 58 Cb 0.50 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2bnz h ALA 58 CO 0.02 -0.57 0.27 1.25 0.00 0.00 0.00 179.25 180.22 2bnz h LEU 59 N -0.14 0.43 -0.65 0.00 6.46 -1.16 0.51 115.31 120.76 2bnz h LEU 59 Ca 0.02 0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.76 2bnz h LEU 59 Cb 0.17 -0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 39.99 2bnz h LEU 59 CO -0.07 0.30 0.27 -0.08 -0.62 0.00 0.00 178.44 178.24 2bnz h GLU 60 N 0.54 0.96 -0.22 1.25 4.81 -0.90 -0.83 114.58 120.19 2bnz h GLU 60 Ca 0.20 -0.17 -0.14 0.00 -0.13 0.00 0.00 59.36 59.12 2bnz h GLU 60 Cb 0.05 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 2bnz h GLU 60 CO -0.11 0.80 -0.46 0.93 -0.73 0.00 0.00 179.01 179.44 2bnz h GLU 61 N 0.91 0.57 -0.42 1.92 5.08 0.06 -1.41 114.58 121.28 2bnz h GLU 61 Ca 0.22 -0.31 0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2bnz h GLU 61 Cb 0.19 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2bnz h GLU 61 CO -0.02 0.91 0.26 -0.92 -1.00 0.00 0.00 179.01 178.24 2bnz h TYR 62 N 0.45 0.50 -0.52 4.33 5.03 0.37 -1.92 116.97 125.21 2bnz h TYR 62 Ca 0.03 0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.25 2bnz h TYR 62 Cb 0.97 -0.16 -0.02 0.00 1.55 0.00 0.00 36.73 39.07 2bnz h TYR 62 CO 0.04 0.30 -0.09 0.82 -1.32 0.00 0.00 178.16 177.92 2bnz h ILE 63 N 0.54 1.27 -0.19 1.81 2.04 -0.90 -1.13 117.51 120.94 2bnz h ILE 63 Ca 0.16 -1.23 -0.05 0.00 1.00 0.00 0.00 64.86 64.74 2bnz h ILE 63 Cb -0.03 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 37.04 2bnz h ILE 63 CO -0.05 0.43 -0.13 0.03 0.00 0.00 0.00 178.15 178.43 2bnz h ARG 64 N 0.84 0.30 -0.00 2.37 3.08 -1.14 0.46 114.38 120.29 2bnz h ARG 64 Ca 0.14 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2bnz h ARG 64 Cb 0.64 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2bnz h ARG 64 CO 0.04 0.44 -0.03 -0.22 -1.07 0.00 0.00 179.97 179.13 2bnz h LYS 65 N 0.29 0.03 0.00 0.04 3.64 -1.04 -3.35 116.57 116.18 2bnz h LYS 65 Ca 0.06 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 2bnz h LYS 65 Cb 0.40 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 2bnz h LYS 65 CO 0.02 0.72 -1.71 0.66 -2.27 0.00 0.00 179.45 176.87 2bnz n TYR 66 N -4.72 0.00 -3.11 1.91 4.01 -0.46 -4.64 117.16 110.16 2bnz n TYR 66 Ca -0.09 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.43 2bnz n TYR 66 Cb 0.36 -0.43 -0.04 0.00 -0.31 0.00 0.00 39.34 38.93 2bnz n TYR 66 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2bnz n LEU 67 N -2.16 2.35 -0.05 7.72 4.77 0.16 -4.98 117.00 124.82 2bnz n LEU 67 Ca -0.09 -5.27 -0.03 0.00 -0.03 0.00 0.00 56.01 50.59 2bnz n LEU 67 Cb 0.56 0.15 0.21 0.00 -2.33 0.00 0.00 43.42 42.01 2bnz n LEU 67 CO 0.28 2.29 0.86 1.55 -1.33 0.00 0.00 177.39 181.04 2bnz h PRO 68 N 3.12 0.64 0.00 3.23 0.13 -1.63 -2.56 132.00 134.93 2bnz h PRO 68 Ca 0.11 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2bnz h PRO 68 Cb 0.77 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.82 2bnz h PRO 68 CO 0.64 0.70 0.00 -0.44 -0.23 0.00 0.00 178.00 178.67 2bnz h ASP 69 N 0.60 0.00 -4.29 1.44 3.45 -1.91 -3.42 116.42 112.28 2bnz h ASP 69 Ca 0.11 0.00 -0.51 0.00 0.43 0.00 0.00 57.03 57.06 2bnz h ASP 69 Cb 0.46 0.00 0.12 0.00 -0.56 0.00 0.00 39.33 39.35 2bnz h ASP 69 CO 0.02 0.00 0.34 -0.54 -1.57 0.00 0.00 179.24 177.49 2bnz s LYS 70 N -3.39 2.45 0.00 3.56 3.01 -0.96 -5.22 119.74 119.18 2bnz s LYS 70 Ca 0.05 1.20 0.00 0.00 -1.01 0.00 0.00 55.97 56.20 2bnz s LYS 70 Cb 0.08 -1.92 0.00 0.00 -1.01 0.00 0.00 37.83 34.98 2bnz s LYS 70 CO 0.56 -1.50 0.00 1.47 0.51 0.00 0.00 175.35 176.39