#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fbm n ASP 28 N 0.00 1.91 0.04 7.83 9.92 -1.26 -4.67 116.55 130.32 1fbm n ASP 28 Ca 0.00 0.41 0.11 0.00 -0.53 0.00 0.00 54.79 54.79 1fbm n ASP 28 Cb 0.00 -0.82 0.02 0.00 -0.64 0.00 0.00 41.12 39.68 1fbm n ASP 28 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1fbm n LEU 29 N -4.44 0.61 -0.16 0.64 7.99 -1.26 -4.41 117.00 115.97 1fbm n LEU 29 Ca -0.25 0.09 -0.02 0.00 -0.01 0.00 0.00 56.01 55.83 1fbm n LEU 29 Cb 0.58 -0.09 0.07 0.00 -0.11 0.00 0.00 43.42 43.87 1fbm n LEU 29 CO 0.14 -0.03 0.90 0.00 -1.51 0.00 0.00 177.39 176.90 1fbm h ALA 30 N 2.36 0.57 0.00 -1.18 0.00 -1.98 0.71 119.26 119.74 1fbm h ALA 30 Ca 0.00 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1fbm h ALA 30 Cb 0.82 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1fbm h ALA 30 CO 0.00 -0.32 -0.21 -1.35 0.00 0.00 0.00 179.25 177.37 1fbm h PRO 31 N 0.22 0.00 0.00 0.00 0.11 -1.86 -2.33 132.00 128.14 1fbm h PRO 31 Ca 0.26 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.28 1fbm h PRO 31 Cb 0.36 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 1fbm h PRO 31 CO -0.35 0.21 -0.46 1.96 -0.21 0.00 0.00 178.00 179.15 1fbm h GLN 32 N 0.00 0.00 0.00 1.05 4.20 -1.08 -2.78 115.11 116.50 1fbm h GLN 32 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1fbm h GLN 32 Cb 0.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1fbm h GLN 32 CO 0.03 0.45 0.00 -1.33 -0.67 0.00 0.00 178.83 177.31 1fbm n MET 33 N -3.21 0.24 0.00 1.46 2.81 0.22 -2.83 117.12 115.82 1fbm n MET 33 Ca 0.02 0.20 -0.21 0.00 -1.81 0.00 0.00 57.70 55.90 1fbm n MET 33 Cb 0.72 -1.78 -0.14 0.00 -0.71 0.00 0.00 33.22 31.31 1fbm n MET 33 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1fbm n LEU 34 N -2.20 2.64 -0.05 4.03 7.94 -1.07 -3.39 117.00 124.91 1fbm n LEU 34 Ca 0.06 0.21 -0.09 0.00 -1.11 0.00 0.00 56.01 55.07 1fbm n LEU 34 Cb 0.42 -1.12 -0.03 0.00 0.53 0.00 0.00 43.42 43.22 1fbm n LEU 34 CO 0.30 0.85 0.93 0.03 -1.11 0.00 0.00 177.39 178.39 1fbm h ARG 35 N 0.06 0.22 -0.53 1.96 2.47 -1.50 -1.09 114.38 115.96 1fbm h ARG 35 Ca -0.43 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.27 1fbm h ARG 35 Cb 2.03 -0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 30.27 1fbm h ARG 35 CO 0.08 0.14 0.28 0.93 0.56 0.00 0.00 179.97 181.96 1fbm h GLU 36 N 0.22 0.75 -0.40 0.04 4.39 -1.70 -1.78 114.58 116.11 1fbm h GLU 36 Ca 0.08 -0.10 0.01 0.00 0.34 0.00 0.00 59.36 59.70 1fbm h GLU 36 Cb 0.02 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.50 1fbm h GLU 36 CO -0.05 0.60 0.25 1.25 -1.16 0.00 0.00 179.01 179.89 1fbm h LEU 37 N 0.71 0.41 -1.60 1.33 7.12 -1.50 -0.07 115.31 121.72 1fbm h LEU 37 Ca 0.19 -0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.19 1fbm h LEU 37 Cb 0.08 -0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.10 1fbm h LEU 37 CO -0.03 0.30 0.23 1.56 -0.13 0.00 0.00 178.44 180.36 1fbm h GLN 38 N 0.50 0.49 0.00 1.25 4.20 -0.93 0.32 115.11 120.94 1fbm h GLN 38 Ca 0.15 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 1fbm h GLN 38 Cb -0.02 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1fbm h GLN 38 CO -0.06 0.35 -0.18 0.93 -0.67 0.00 0.00 178.83 179.19 1fbm h GLU 39 N 0.51 0.00 -0.11 1.46 4.39 -0.40 -2.35 114.58 118.08 1fbm h GLU 39 Ca 0.13 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.71 1fbm h GLU 39 Cb -0.02 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1fbm h GLU 39 CO -0.03 0.18 -0.50 1.15 -1.16 0.00 0.00 179.01 178.66 1fbm h THR 40 N 0.00 1.34 0.18 1.13 2.02 0.89 -2.28 112.91 116.19 1fbm h THR 40 Ca -0.00 -1.73 -0.32 0.00 0.77 0.00 0.00 66.41 65.14 1fbm h THR 40 Cb 0.97 1.80 0.01 0.00 -1.74 0.00 0.00 68.15 69.19 1fbm h THR 40 CO 0.02 0.52 -1.47 0.78 0.37 0.00 0.00 175.52 175.74 1fbm h ASN 41 N 0.24 0.58 -0.63 4.18 -0.26 -1.33 -2.15 115.58 116.21 1fbm h ASN 41 Ca 0.01 -0.70 0.04 0.00 -0.56 0.00 0.00 56.30 55.09 1fbm h ASN 41 Cb 0.96 -0.19 -0.05 0.00 -1.06 0.00 0.00 38.32 37.98 1fbm h ASN 41 CO 0.08 1.56 0.37 0.00 -1.06 0.00 0.00 177.43 178.38 1fbm h ALA 42 N 0.35 0.83 0.23 -0.83 0.00 -1.37 0.94 119.26 119.41 1fbm h ALA 42 Ca -0.23 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1fbm h ALA 42 Cb 2.07 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.70 1fbm h ALA 42 CO 0.21 0.08 -0.11 0.00 0.00 0.00 0.00 179.25 179.44 1fbm h ALA 43 N 1.30 -0.31 0.00 0.00 0.00 -1.49 -2.45 119.26 116.31 1fbm h ALA 43 Ca 0.27 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1fbm h ALA 43 Cb 0.09 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1fbm h ALA 43 CO -0.14 -0.55 0.00 1.25 0.00 0.00 0.00 179.25 179.82 1fbm h LEU 44 N -0.55 0.00 0.01 0.00 5.85 -0.85 -0.72 115.31 119.04 1fbm h LEU 44 Ca -0.03 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.52 1fbm h LEU 44 Cb 0.41 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.45 1fbm h LEU 44 CO 0.05 0.00 -0.68 -0.61 -0.34 0.00 0.00 178.44 176.86 1fbm h GLN 45 N 0.00 0.44 -0.20 1.25 5.75 0.13 -1.57 115.11 120.91 1fbm h GLN 45 Ca 0.00 -0.49 -0.18 0.00 -0.15 0.00 0.00 58.65 57.83 1fbm h GLN 45 Cb 0.15 0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.84 1fbm h GLN 45 CO 0.00 1.14 -0.59 -0.44 -2.65 0.00 0.00 178.83 176.29 1fbm h ASP 46 N -0.05 0.76 -0.18 -0.69 3.45 -0.87 -2.54 116.42 116.30 1fbm h ASP 46 Ca -0.09 -0.42 -0.06 0.00 0.43 0.00 0.00 57.03 56.89 1fbm h ASP 46 Cb 1.39 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.92 1fbm h ASP 46 CO 0.13 1.18 -0.05 0.58 -1.57 0.00 0.00 179.24 179.51 1fbm h VAL 47 N 0.50 1.21 -0.40 -1.35 2.07 -1.21 0.87 116.25 117.93 1fbm h VAL 47 Ca -0.00 -0.86 -0.10 0.00 0.82 0.00 0.00 66.70 66.56 1fbm h VAL 47 Cb 1.17 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1fbm h VAL 47 CO 0.12 0.29 -0.15 -0.09 0.02 0.00 0.00 177.57 177.75 1fbm h ARG 48 N 0.47 0.82 0.00 1.57 2.43 -1.09 -2.15 114.38 116.42 1fbm h ARG 48 Ca 0.10 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1fbm h ARG 48 Cb 0.39 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1fbm h ARG 48 CO 0.02 0.97 -0.21 1.05 -1.51 0.00 0.00 179.97 180.28 1fbm h GLU 49 N 0.63 0.00 -0.12 0.20 4.11 -1.22 -3.17 114.58 115.01 1fbm h GLU 49 Ca 0.10 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.33 1fbm h GLU 49 Cb 0.70 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.96 1fbm h GLU 49 CO 0.05 0.00 -0.68 1.25 0.07 0.00 0.00 179.01 179.70 1fbm h LEU 50 N 0.00 0.81 -1.02 3.06 5.85 -0.73 -3.22 115.31 120.06 1fbm h LEU 50 Ca 0.00 -0.64 -0.08 0.00 0.84 0.00 0.00 57.88 58.00 1fbm h LEU 50 Cb 0.99 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1fbm h LEU 50 CO 0.00 1.33 -0.12 -0.07 -0.34 0.00 0.00 178.44 179.24 1fbm h LEU 51 N 0.36 0.55 -0.92 2.25 3.38 -1.43 -2.47 115.31 117.03 1fbm h LEU 51 Ca -0.05 -0.15 0.04 0.00 0.09 0.00 0.00 57.88 57.81 1fbm h LEU 51 Cb 1.32 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 1fbm h LEU 51 CO 0.14 0.71 0.59 0.03 0.09 0.00 0.00 178.44 180.00 1fbm h ARG 52 N 0.53 1.11 -0.08 1.13 3.08 -1.56 -0.35 114.38 118.23 1fbm h ARG 52 Ca 0.10 -0.07 -0.19 0.00 0.07 0.00 0.00 59.98 59.89 1fbm h ARG 52 Cb 0.51 -0.25 -0.00 0.00 0.08 0.00 0.00 29.97 30.31 1fbm h ARG 52 CO 0.03 0.73 -0.73 0.37 -1.07 0.00 0.00 179.97 179.30 1fbm h GLN 53 N 1.14 0.42 -0.39 0.04 4.15 -1.52 -2.86 115.11 116.08 1fbm h GLN 53 Ca 0.37 -0.35 -0.12 0.00 0.77 0.00 0.00 58.65 59.33 1fbm h GLN 53 Cb 0.03 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1fbm h GLN 53 CO -0.13 0.98 -0.23 0.37 -1.93 0.00 0.00 178.83 177.89 1fbm h GLN 54 N 0.29 0.80 -0.37 1.69 4.15 -0.92 -1.33 115.11 119.42 1fbm h GLN 54 Ca -0.03 -0.33 -0.03 0.00 0.77 0.00 0.00 58.65 59.03 1fbm h GLN 54 Cb 1.31 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.95 1fbm h GLN 54 CO 0.13 0.95 0.11 0.28 -1.93 0.00 0.00 178.83 178.37 1fbm h VAL 55 N 0.69 1.21 -0.65 2.39 2.07 -1.07 -1.32 116.25 119.56 1fbm h VAL 55 Ca 0.09 -0.70 -0.07 0.00 0.82 0.00 0.00 66.70 66.84 1fbm h VAL 55 Cb 0.76 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.47 1fbm h VAL 55 CO 0.06 0.24 0.14 0.50 0.02 0.00 0.00 177.57 178.53 1fbm h LYS 56 N 0.45 1.06 -0.32 1.57 1.63 -1.33 0.62 116.57 120.25 1fbm h LYS 56 Ca 0.12 -0.27 -0.01 0.00 -0.85 0.00 0.00 60.65 59.64 1fbm h LYS 56 Cb 0.26 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 1fbm h LYS 56 CO -0.00 0.97 0.17 0.93 -3.45 0.00 0.00 179.45 178.07 1fbm h GLU 57 N 0.99 0.45 -0.07 1.90 4.39 -1.14 -1.11 114.58 119.99 1fbm h GLU 57 Ca 0.20 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.81 1fbm h GLU 57 Cb 0.40 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1fbm h GLU 57 CO 0.01 0.39 -0.14 0.82 -1.16 0.00 0.00 179.01 178.93 1fbm h ILE 58 N 0.39 1.14 0.00 3.13 2.04 -0.82 -0.25 117.51 123.14 1fbm h ILE 58 Ca 0.11 -0.62 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 1fbm h ILE 58 Cb 0.07 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1fbm h ILE 58 CO -0.02 0.19 -0.29 0.74 0.00 0.00 0.00 178.15 178.77 1fbm h THR 59 N 0.10 0.51 0.13 -0.27 2.02 -0.47 -2.61 112.91 112.31 1fbm h THR 59 Ca 0.02 -1.67 -0.20 0.00 0.77 0.00 0.00 66.41 65.33 1fbm h THR 59 Cb 0.30 2.21 0.02 0.00 -1.74 0.00 0.00 68.15 68.95 1fbm h THR 59 CO 0.02 0.28 -0.87 0.15 0.37 0.00 0.00 175.52 175.47 1fbm h PHE 60 N 0.00 0.63 -0.65 3.16 3.04 -0.28 -2.85 116.94 120.00 1fbm h PHE 60 Ca -0.00 -0.43 0.00 0.00 3.98 0.00 0.00 57.97 61.51 1fbm h PHE 60 Cb 1.19 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 39.63 1fbm h PHE 60 CO 0.00 1.32 0.41 1.25 -2.02 0.00 0.00 178.31 179.26 1fbm h LEU 61 N -0.23 0.76 0.68 0.59 7.12 -1.08 -0.90 115.31 122.25 1fbm h LEU 61 Ca -0.14 -0.03 -0.03 0.00 0.13 0.00 0.00 57.88 57.80 1fbm h LEU 61 Cb 1.65 -0.19 0.01 0.00 -0.53 0.00 0.00 40.66 41.60 1fbm h LEU 61 CO 0.16 0.57 -0.33 0.50 -0.13 0.00 0.00 178.44 179.22 1fbm h LYS 62 N 0.89 -0.88 -0.98 1.25 3.64 -1.51 -0.99 116.57 117.98 1fbm h LYS 62 Ca 0.24 0.06 0.20 0.00 -1.27 0.00 0.00 60.65 59.88 1fbm h LYS 62 Cb -0.06 0.20 -0.11 0.00 -0.41 0.00 0.00 32.23 31.85 1fbm h LYS 62 CO -0.05 -0.58 0.57 -0.91 -2.27 0.00 0.00 179.45 176.22 1fbm h ASN 63 N -1.23 0.70 0.03 4.20 -0.26 -1.33 0.93 115.58 118.62 1fbm h ASN 63 Ca -0.09 0.11 -0.00 0.00 -0.56 0.00 0.00 56.30 55.76 1fbm h ASN 63 Cb 0.71 -0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.97 1fbm h ASN 63 CO 0.15 0.20 -0.01 0.74 -1.06 0.00 0.00 177.43 177.45 1fbm h THR 64 N 0.67 1.08 -0.37 2.81 2.02 -1.12 -2.35 112.91 115.65 1fbm h THR 64 Ca 0.58 -0.33 -0.05 0.00 0.77 0.00 0.00 66.41 67.38 1fbm h THR 64 Cb 0.98 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 68.67 1fbm h THR 64 CO -0.42 0.08 0.01 0.58 0.37 0.00 0.00 175.52 176.15 1fbm h VAL 65 N -0.18 1.20 0.15 3.16 2.07 -0.11 -2.88 116.25 119.67 1fbm h VAL 65 Ca -0.00 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 1fbm h VAL 65 Cb 0.17 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1fbm h VAL 65 CO 0.01 0.28 -0.08 0.24 0.02 0.00 0.00 177.57 178.03 1fbm h MET 66 N 0.55 -0.21 0.00 1.57 2.07 -0.51 -2.09 114.93 116.31 1fbm h MET 66 Ca 0.12 0.01 0.00 0.00 -2.07 0.00 0.00 59.70 57.76 1fbm h MET 66 Cb 0.33 0.05 0.00 0.00 -1.87 0.00 0.00 31.60 30.11 1fbm h MET 66 CO 0.01 -0.14 0.00 0.39 1.07 0.00 0.00 176.91 178.24 1fbm n GLU 67 N -5.19 0.43 -1.52 1.72 -0.58 -0.92 -4.52 120.64 110.06 1fbm n GLU 67 Ca -0.08 0.06 -0.46 0.00 -0.42 0.00 0.00 57.16 56.25 1fbm n GLU 67 Cb 0.12 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.44 1fbm n GLU 67 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1fbm n ASP 69 N 11.11 3.44 0.00 0.00 10.43 -1.26 -1.72 116.55 138.54 1fbm n ASP 69 Ca 0.36 -2.75 0.00 0.00 2.57 0.00 0.00 54.79 54.97 1fbm n ASP 69 Cb 0.35 -1.41 0.00 0.00 1.84 0.00 0.00 41.12 41.89 1fbm n ASP 69 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1fbm n ALA 70 N 6.58 0.00 -0.21 2.24 0.00 -1.26 -5.04 120.51 122.83 1fbm n ALA 70 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1fbm n ALA 70 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1fbm n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50