#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 0.00 0.09 7.83 5.75 -1.26 -3.44 116.55 125.52 1fbm n ASP 28 Ca 0.00 -1.57 0.12 0.00 -0.01 0.00 0.00 54.79 53.32 1fbm n ASP 28 Cb 0.00 0.00 0.12 0.00 -1.03 0.00 0.00 41.12 40.21 1fbm n ASP 28 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1fbm h LEU 29 N 0.00 0.00 -1.03 -2.12 5.85 -2.07 -3.38 115.31 112.57 1fbm h LEU 29 Ca 0.00 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1fbm h LEU 29 Cb 0.00 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 1fbm h LEU 29 CO 0.00 0.06 0.52 0.00 -0.34 0.00 0.00 178.44 178.67 1fbm h ALA 30 N 2.29 1.27 -0.32 1.25 0.00 -2.00 -2.65 119.26 119.10 1fbm h ALA 30 Ca 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1fbm h ALA 30 Cb 0.86 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1fbm h ALA 30 CO 0.00 0.62 0.12 -1.35 0.00 0.00 0.00 179.25 178.64 1fbm h PRO 31 N 1.20 0.45 0.05 0.00 0.11 -1.86 -2.43 132.00 129.53 1fbm h PRO 31 Ca 0.31 -0.06 -0.23 0.00 0.11 0.00 0.00 66.00 66.13 1fbm h PRO 31 Cb -0.04 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 1fbm h PRO 31 CO -0.06 0.39 -1.09 0.37 -0.21 0.00 0.00 178.00 177.40 1fbm h GLN 32 N 0.45 0.12 -0.55 1.05 4.15 -1.79 -3.00 115.11 115.55 1fbm h GLN 32 Ca 0.11 -0.20 0.07 0.00 0.77 0.00 0.00 58.65 59.40 1fbm h GLN 32 Cb 0.11 0.07 -0.03 0.00 0.21 0.00 0.00 27.48 27.85 1fbm h GLN 32 CO -0.01 1.08 0.37 0.52 -1.93 0.00 0.00 178.83 178.86 1fbm h MET 33 N 0.04 0.44 -0.05 1.69 2.86 -1.09 -0.42 114.93 118.40 1fbm h MET 33 Ca -0.06 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1fbm h MET 33 Cb 1.83 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 33.39 1fbm h MET 33 CO 0.16 0.29 -0.01 1.25 1.06 0.00 0.00 176.91 179.66 1fbm h LEU 34 N 0.45 0.10 -2.18 1.22 6.46 -1.40 -1.56 115.31 118.41 1fbm h LEU 34 Ca 0.24 -0.37 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 1fbm h LEU 34 Cb 0.38 -0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.28 1fbm h LEU 34 CO -0.07 0.45 -0.05 0.03 -0.62 0.00 0.00 178.44 178.18 1fbm h ARG 35 N -0.25 0.00 0.07 1.25 3.08 -1.17 0.37 114.38 117.74 1fbm h ARG 35 Ca 0.01 0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.80 1fbm h ARG 35 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.47 1fbm h ARG 35 CO 0.01 0.05 -1.13 0.93 -1.07 0.00 0.00 179.97 178.76 1fbm h GLU 36 N 0.00 0.47 0.00 0.04 4.39 -0.87 -1.08 114.58 117.53 1fbm h GLU 36 Ca -0.00 -0.60 0.00 0.00 0.34 0.00 0.00 59.36 59.10 1fbm h GLU 36 Cb 0.13 0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1fbm h GLU 36 CO 0.01 1.24 0.00 1.28 -1.16 0.00 0.00 179.01 180.38 1fbm n LEU 37 N -3.72 0.55 0.03 1.33 4.77 -0.61 -1.32 117.00 118.05 1fbm n LEU 37 Ca -0.10 0.56 -0.22 0.00 -0.03 0.00 0.00 56.01 56.22 1fbm n LEU 37 Cb 0.94 -0.38 -0.14 0.00 -2.33 0.00 0.00 43.42 41.50 1fbm n LEU 37 CO 0.55 -0.14 -0.35 -0.61 -1.33 0.00 0.00 177.39 175.50 1fbm h GLN 38 N 0.00 0.29 0.00 3.23 4.15 -0.19 -3.32 115.11 119.28 1fbm h GLN 38 Ca 0.00 -0.50 -0.03 0.00 0.77 0.00 0.00 58.65 58.88 1fbm h GLN 38 Cb 0.65 0.19 -0.00 0.00 0.21 0.00 0.00 27.48 28.52 1fbm h GLN 38 CO 0.00 1.24 -0.16 1.49 -1.93 0.00 0.00 178.83 179.47 1fbm h GLU 39 N -0.23 0.00 0.00 1.69 4.57 -1.14 -2.41 114.58 117.05 1fbm h GLU 39 Ca -0.28 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.90 1fbm h GLU 39 Cb 1.82 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.41 1fbm h GLU 39 CO 0.10 0.16 0.00 0.00 -1.18 0.00 0.00 179.01 178.10 1fbm h THR 40 N 0.00 0.00 0.00 0.32 1.03 -1.33 -2.74 112.91 110.19 1fbm h THR 40 Ca -0.00 -0.58 -0.31 0.00 -0.01 0.00 0.00 66.41 65.51 1fbm h THR 40 Cb 0.96 1.52 -0.06 0.00 -1.07 0.00 0.00 68.15 69.50 1fbm h THR 40 CO 0.02 0.00 -2.13 0.59 -0.01 0.00 0.00 175.52 173.99 1fbm n ASN 41 N -2.73 0.26 -0.08 0.00 3.02 -1.09 -3.11 115.26 111.54 1fbm n ASN 41 Ca 0.03 0.12 -0.14 0.00 -0.03 0.00 0.00 54.58 54.56 1fbm n ASN 41 Cb 0.38 0.78 -0.05 0.00 -0.61 0.00 0.00 39.78 40.28 1fbm n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1fbm h ALA 42 N 1.12 0.38 -0.06 5.41 0.00 -1.42 -1.76 119.26 122.92 1fbm h ALA 42 Ca -0.41 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.04 1fbm h ALA 42 Cb 2.04 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.76 1fbm h ALA 42 CO 0.04 0.44 -0.06 0.00 0.00 0.00 0.00 179.25 179.68 1fbm h ALA 43 N 0.66 0.09 -0.38 0.00 0.00 -1.68 -3.02 119.26 114.93 1fbm h ALA 43 Ca 0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1fbm h ALA 43 Cb 0.94 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1fbm h ALA 43 CO 0.08 -0.12 0.23 1.25 0.00 0.00 0.00 179.25 180.70 1fbm h LEU 44 N -0.27 0.45 -1.32 0.00 5.85 -1.58 0.28 115.31 118.71 1fbm h LEU 44 Ca 0.01 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1fbm h LEU 44 Cb 0.55 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1fbm h LEU 44 CO 0.01 0.34 0.42 -0.61 -0.34 0.00 0.00 178.44 178.27 1fbm h GLN 45 N 0.52 0.88 -0.05 1.25 -0.00 -1.27 0.81 115.11 117.25 1fbm h GLN 45 Ca 0.14 -0.06 -0.17 0.00 -0.00 0.00 0.00 58.65 58.56 1fbm h GLN 45 Cb -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 27.48 27.25 1fbm h GLN 45 CO -0.03 0.60 -0.72 -0.44 0.00 0.00 0.00 178.83 178.24 1fbm h ASP 46 N 0.90 0.31 0.67 -0.69 3.32 -0.85 -2.90 116.42 117.18 1fbm h ASP 46 Ca 0.24 -0.21 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 1fbm h ASP 46 Cb -0.07 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1fbm h ASP 46 CO -0.05 0.93 -0.64 0.58 -1.72 0.00 0.00 179.24 178.34 1fbm h VAL 47 N 0.18 1.44 -0.59 -1.35 2.07 -0.44 -2.44 116.25 115.11 1fbm h VAL 47 Ca -0.02 -2.21 -0.07 0.00 0.82 0.00 0.00 66.70 65.22 1fbm h VAL 47 Cb 1.28 2.20 -0.02 0.00 -1.52 0.00 0.00 31.29 33.22 1fbm h VAL 47 CO 0.11 0.63 0.09 -0.09 0.02 0.00 0.00 177.57 178.33 1fbm h ARG 48 N 0.00 0.97 0.08 1.57 2.43 -0.70 -1.97 114.38 116.76 1fbm h ARG 48 Ca -0.01 -0.24 -0.32 0.00 -0.81 0.00 0.00 59.98 58.60 1fbm h ARG 48 Cb 1.15 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1fbm h ARG 48 CO 0.08 0.90 -1.74 1.05 -1.51 0.00 0.00 179.97 178.76 1fbm h GLU 49 N 0.91 0.17 0.00 0.20 4.11 -1.49 -3.10 114.58 115.38 1fbm h GLU 49 Ca 0.18 -0.30 -0.01 0.00 0.07 0.00 0.00 59.36 59.30 1fbm h GLU 49 Cb 0.41 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1fbm h GLU 49 CO 0.01 0.95 -0.05 -0.07 0.07 0.00 0.00 179.01 179.92 1fbm h LEU 50 N 0.05 0.00 0.06 3.06 4.07 -1.44 -0.83 115.31 120.28 1fbm h LEU 50 Ca -0.31 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.54 1fbm h LEU 50 Cb 2.02 0.00 0.01 0.00 1.08 0.00 0.00 40.66 43.77 1fbm h LEU 50 CO 0.11 0.05 -0.48 0.25 -1.08 0.00 0.00 178.44 177.29 1fbm h LEU 51 N 0.00 0.21 -2.46 1.67 6.46 -1.46 -2.85 115.31 116.88 1fbm h LEU 51 Ca -0.00 -0.95 0.00 0.00 -0.12 0.00 0.00 57.88 56.81 1fbm h LEU 51 Cb 0.42 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.28 1fbm h LEU 51 CO 0.01 1.22 0.00 0.08 -0.62 0.00 0.00 178.44 179.13 1fbm h ARG 52 N -0.70 0.00 0.03 1.25 0.11 -1.34 0.49 114.38 114.21 1fbm h ARG 52 Ca -0.09 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.98 1fbm h ARG 52 Cb 1.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.40 1fbm h ARG 52 CO 0.05 0.00 -0.01 0.37 0.10 0.00 0.00 179.97 180.48 1fbm h GLN 53 N 0.00 -0.03 -0.25 0.08 5.75 -1.24 -3.15 115.11 116.26 1fbm h GLN 53 Ca 0.00 0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.58 1fbm h GLN 53 Cb 0.12 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 1fbm h GLN 53 CO 0.00 0.54 0.23 0.37 -2.65 0.00 0.00 178.83 177.32 1fbm h GLN 54 N -0.97 0.00 -0.15 1.69 4.15 -0.97 0.73 115.11 119.59 1fbm h GLN 54 Ca -0.00 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.32 1fbm h GLN 54 Cb 0.59 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.28 1fbm h GLN 54 CO 0.01 0.00 -0.27 0.28 -1.93 0.00 0.00 178.83 176.92 1fbm h VAL 55 N 0.00 1.36 -0.27 2.39 2.07 -1.03 -1.69 116.25 119.08 1fbm h VAL 55 Ca 0.12 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.12 1fbm h VAL 55 Cb 0.58 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1fbm h VAL 55 CO -0.00 0.45 0.12 0.11 0.02 0.00 0.00 177.57 178.27 1fbm h LYS 56 N 0.07 0.40 -0.69 1.57 1.57 -0.88 0.27 116.57 118.86 1fbm h LYS 56 Ca 0.01 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1fbm h LYS 56 Cb 0.85 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 33.05 1fbm h LYS 56 CO 0.06 0.41 0.44 0.93 -0.57 0.00 0.00 179.45 180.72 1fbm h GLU 57 N 0.29 0.85 -0.37 3.15 4.39 -1.17 -0.44 114.58 121.28 1fbm h GLU 57 Ca 0.09 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 1fbm h GLU 57 Cb 0.16 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 1fbm h GLU 57 CO -0.01 0.56 0.03 0.82 -1.16 0.00 0.00 179.01 179.25 1fbm h ILE 58 N 0.87 1.25 -0.74 3.13 2.04 -0.99 0.51 117.51 123.58 1fbm h ILE 58 Ca 0.27 -0.92 0.05 0.00 1.00 0.00 0.00 64.86 65.27 1fbm h ILE 58 Cb -0.01 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.14 1fbm h ILE 58 CO -0.10 0.31 0.44 0.74 0.00 0.00 0.00 178.15 179.54 1fbm h THR 59 N 0.46 1.02 -0.75 -0.27 2.02 -0.57 0.14 112.91 114.95 1fbm h THR 59 Ca 0.11 -0.28 -0.04 0.00 0.77 0.00 0.00 66.41 66.97 1fbm h THR 59 Cb 0.41 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 1fbm h THR 59 CO 0.01 0.15 0.32 -0.26 0.37 0.00 0.00 175.52 176.11 1fbm h PHE 60 N 0.82 1.13 -0.40 3.16 0.05 -0.82 0.59 116.94 121.46 1fbm h PHE 60 Ca 0.32 -0.08 -0.04 0.00 3.82 0.00 0.00 57.97 61.99 1fbm h PHE 60 Cb 0.15 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 37.74 1fbm h PHE 60 CO -0.06 0.85 0.07 1.25 -0.18 0.00 0.00 178.31 180.25 1fbm h LEU 61 N 1.08 0.57 -0.32 1.54 5.85 0.24 -2.00 115.31 122.27 1fbm h LEU 61 Ca 0.25 -0.09 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 1fbm h LEU 61 Cb 0.18 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1fbm h LEU 61 CO -0.02 0.59 -0.10 0.50 -0.34 0.00 0.00 178.44 179.06 1fbm h LYS 62 N 0.59 0.63 -0.45 1.25 3.64 0.58 -3.03 116.57 119.77 1fbm h LYS 62 Ca 0.13 -0.25 0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1fbm h LYS 62 Cb 0.27 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1fbm h LYS 62 CO 0.00 0.82 0.25 -0.91 -2.27 0.00 0.00 179.45 177.35 1fbm h ASN 63 N 0.39 0.40 -0.78 4.20 4.21 -0.32 -1.77 115.58 121.91 1fbm h ASN 63 Ca 0.08 0.01 0.03 0.00 1.21 0.00 0.00 56.30 57.63 1fbm h ASN 63 Cb 0.61 -0.07 -0.04 0.00 -1.12 0.00 0.00 38.32 37.69 1fbm h ASN 63 CO 0.04 0.28 0.51 0.71 -1.29 0.00 0.00 177.43 177.68 1fbm h THR 64 N 0.51 1.14 -0.12 2.81 1.35 -1.36 -2.30 112.91 114.93 1fbm h THR 64 Ca 0.19 -0.34 -0.16 0.00 -0.55 0.00 0.00 66.41 65.55 1fbm h THR 64 Cb 0.04 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 66.53 1fbm h THR 64 CO -0.10 0.18 -0.60 0.58 -0.25 0.00 0.00 175.52 175.32 1fbm h VAL 65 N 0.98 1.35 -0.55 6.82 2.07 -1.29 -3.00 116.25 122.63 1fbm h VAL 65 Ca 0.30 -1.92 0.00 0.00 0.82 0.00 0.00 66.70 65.90 1fbm h VAL 65 Cb 0.01 1.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1fbm h VAL 65 CO -0.08 0.58 0.34 0.24 0.02 0.00 0.00 177.57 178.67 1fbm h MET 66 N 0.30 0.73 -1.20 1.57 2.07 -0.77 -2.12 114.93 115.52 1fbm h MET 66 Ca -0.01 -0.05 -0.66 0.00 -2.07 0.00 0.00 59.70 56.91 1fbm h MET 66 Cb 1.14 -0.16 -0.27 0.00 -1.87 0.00 0.00 31.60 30.43 1fbm h MET 66 CO 0.10 0.50 0.86 -0.85 1.07 0.00 0.00 176.91 178.59 1fbm n GLU 67 N -4.44 2.62 -3.48 1.72 0.28 -1.10 -4.89 120.64 111.34 1fbm n GLU 67 Ca 0.05 -3.16 -0.42 0.00 -0.16 0.00 0.00 57.16 53.47 1fbm n GLU 67 Cb 0.06 -2.23 -0.08 0.00 1.43 0.00 0.00 31.44 30.63 1fbm n GLU 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1fbm h ASP 69 N 8.59 0.28 -0.57 0.00 3.32 -1.90 -0.33 116.42 125.82 1fbm h ASP 69 Ca -0.25 0.02 0.06 0.00 0.02 0.00 0.00 57.03 56.87 1fbm h ASP 69 Cb 1.09 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.57 1fbm h ASP 69 CO 0.87 0.15 0.38 0.00 -1.72 0.00 0.00 179.24 178.92 1fbm h ALA 70 N 1.66 1.82 0.00 3.45 0.00 -1.98 -0.73 119.26 123.48 1fbm h ALA 70 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1fbm h ALA 70 Cb 0.92 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1fbm h ALA 70 CO -0.09 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.26