#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fie n LEU 26 N 0.00 0.00 -4.68 1.20 7.94 -1.26 -5.14 117.00 115.06 3fie n LEU 26 Ca 0.00 0.00 -0.48 0.00 -1.11 0.00 0.00 56.01 54.42 3fie n LEU 26 Cb 0.00 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 43.90 3fie n LEU 26 CO 0.00 0.00 1.45 0.35 -1.11 0.00 0.00 177.39 178.08 3fie n THR 27 N 0.00 0.51 -1.81 1.96 -2.24 -1.26 -4.97 114.28 106.48 3fie n THR 27 Ca 0.00 -0.09 -0.32 0.00 -2.27 0.00 0.00 64.05 61.37 3fie n THR 27 Cb 0.00 -1.81 0.03 0.00 -2.10 0.00 0.00 70.33 66.44 3fie n THR 27 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3fie s SER 28 N 3.73 5.62 0.00 3.42 0.01 -1.26 -5.08 113.70 120.14 3fie s SER 28 Ca 0.92 1.70 0.00 0.00 1.31 0.00 0.00 55.95 59.87 3fie s SER 28 Cb -0.71 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.01 3fie s SER 28 CO 0.51 -1.28 0.00 0.59 0.41 0.00 0.00 173.24 173.47 3fie n ASN 29 N -2.59 1.08 -4.87 2.44 3.02 -1.26 -5.15 115.26 107.93 3fie n ASN 29 Ca 0.08 -0.29 -0.37 0.00 -0.03 0.00 0.00 54.58 53.96 3fie n ASN 29 Cb 0.53 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.64 3fie n ASN 29 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fie s ARG 30 N 0.12 3.61 0.00 3.52 1.70 -1.26 -5.04 118.95 121.60 3fie s ARG 30 Ca 0.00 0.06 -0.35 0.00 -0.47 0.00 0.00 55.73 54.97 3fie s ARG 30 Cb 0.00 -3.19 -0.13 0.00 -0.57 0.00 0.00 34.95 31.06 3fie s ARG 30 CO 0.00 0.74 1.72 0.54 -1.08 0.00 0.00 175.30 177.22 3fie n ARG 31 N 1.84 2.01 -2.54 3.89 3.00 -1.26 -4.32 116.66 119.28 3fie n ARG 31 Ca -0.17 0.73 -0.03 0.00 -0.01 0.00 0.00 57.85 58.37 3fie n ARG 31 Cb 0.54 -2.52 -0.02 0.00 0.00 0.00 0.00 32.46 30.45 3fie n ARG 31 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 3fie n LEU 32 N 5.06 -5.53 -4.48 0.55 7.94 -1.26 -4.97 117.00 114.32 3fie n LEU 32 Ca 0.21 2.19 -0.40 0.00 -1.11 0.00 0.00 56.01 56.89 3fie n LEU 32 Cb 0.27 -2.88 -0.11 0.00 0.53 0.00 0.00 43.42 41.24 3fie n LEU 32 CO 0.69 -3.33 -0.15 -1.58 -1.11 0.00 0.00 177.39 171.91 3fie s GLN 33 N -0.49 3.34 0.44 1.96 2.00 -1.26 -5.08 119.66 120.56 3fie s GLN 33 Ca -0.14 -0.74 0.03 0.00 -2.00 0.00 0.00 55.36 52.51 3fie s GLN 33 Cb 0.01 -3.73 -0.03 0.00 0.80 0.00 0.00 33.01 30.06 3fie s GLN 33 CO 0.37 -0.48 0.07 -0.65 -0.50 0.00 0.00 175.29 174.09 3fie s GLN 34 N 1.67 2.00 -0.22 1.67 -0.21 -1.26 -5.16 119.66 118.14 3fie s GLN 34 Ca 0.05 -2.22 -0.14 0.00 0.02 0.00 0.00 55.36 53.07 3fie s GLN 34 Cb -0.18 -1.04 0.07 0.00 1.00 0.00 0.00 33.01 32.86 3fie s GLN 34 CO 0.09 -0.37 0.56 0.95 -2.12 0.00 0.00 175.29 174.39 3fie s THR 35 N -3.06 -0.01 -1.26 -0.19 -4.23 -1.26 -5.04 115.64 100.58 3fie s THR 35 Ca 0.20 0.04 0.11 0.00 -1.18 0.00 0.00 61.69 60.85 3fie s THR 35 Cb 0.03 -0.81 0.16 0.00 1.34 0.00 0.00 72.50 73.22 3fie s THR 35 CO 0.11 0.01 1.30 0.00 -0.54 0.00 0.00 174.62 175.50 3fie n GLN 36 N 4.01 0.10 -3.07 3.99 3.00 -1.26 -4.65 117.38 119.50 3fie n GLN 36 Ca -0.20 0.23 -0.40 0.00 -0.01 0.00 0.00 57.00 56.62 3fie n GLN 36 Cb 0.57 -1.50 -0.05 0.00 0.00 0.00 0.00 30.24 29.26 3fie n GLN 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3fie s ALA 37 N -2.74 3.35 0.33 -1.58 0.00 -1.26 -5.06 121.76 114.80 3fie s ALA 37 Ca 0.09 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.15 3fie s ALA 37 Cb 0.07 -2.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 3fie s ALA 37 CO 0.18 -0.11 0.52 -0.65 0.00 0.00 0.00 175.76 175.70 3fie s GLN 38 N 0.83 3.49 -0.02 0.00 -0.21 -1.26 -5.04 119.66 117.44 3fie s GLN 38 Ca 0.36 -0.36 -0.30 0.00 0.02 0.00 0.00 55.36 55.08 3fie s GLN 38 Cb -0.17 -2.69 -0.06 0.00 1.00 0.00 0.00 33.01 31.09 3fie s GLN 38 CO 0.17 0.19 1.50 0.08 -2.12 0.00 0.00 175.29 175.11 3fie s VAL 39 N -2.25 3.62 -0.35 1.09 1.01 -1.26 -4.95 120.40 117.31 3fie s VAL 39 Ca 0.39 0.94 -0.00 0.00 0.00 0.00 0.00 61.98 63.31 3fie s VAL 39 Cb -0.10 -3.60 0.13 0.00 0.00 0.00 0.00 36.38 32.82 3fie s VAL 39 CO 0.35 -0.03 0.20 -0.62 0.00 0.00 0.00 175.10 175.00 3fie s ASP 40 N 2.37 3.10 0.15 3.32 2.15 -1.26 -5.13 116.67 121.37 3fie s ASP 40 Ca 0.67 -2.11 -0.21 0.00 0.43 0.00 0.00 52.55 51.34 3fie s ASP 40 Cb -0.32 -0.44 -0.07 0.00 -0.30 0.00 0.00 42.92 41.78 3fie s ASP 40 CO 0.27 -0.32 0.67 -1.61 -0.17 0.00 0.00 175.17 174.01 3fie s GLU 41 N 1.15 4.30 0.05 4.34 0.41 -1.26 -4.99 118.70 122.69 3fie s GLU 41 Ca 0.17 0.87 -0.19 0.00 -0.41 0.00 0.00 54.97 55.41 3fie s GLU 41 Cb -0.22 -3.12 -0.14 0.00 -1.78 0.00 0.00 34.13 28.87 3fie s GLU 41 CO -0.04 0.54 1.35 0.28 -0.49 0.00 0.00 175.26 176.90 3fie h VAL 42 N 3.19 1.34 -2.88 2.63 2.07 -2.05 -3.44 116.25 117.11 3fie h VAL 42 Ca -0.48 -1.34 -0.66 0.00 0.82 0.00 0.00 66.70 65.03 3fie h VAL 42 Cb 1.20 1.84 -0.08 0.00 -1.52 0.00 0.00 31.29 32.73 3fie h VAL 42 CO 0.65 0.40 -0.52 -0.69 0.02 0.00 0.00 177.57 177.42 3fie s VAL 43 N -4.29 5.15 0.40 2.57 1.01 -1.26 -5.11 120.40 118.87 3fie s VAL 43 Ca -0.14 -0.06 0.05 0.00 0.00 0.00 0.00 61.98 61.82 3fie s VAL 43 Cb 0.06 -3.29 -0.06 0.00 0.00 0.00 0.00 36.38 33.09 3fie s VAL 43 CO 0.77 0.50 0.04 -1.81 0.00 0.00 0.00 175.10 174.59 3fie s ASP 44 N -1.34 3.35 0.22 3.32 1.01 -1.26 -5.11 116.67 116.86 3fie s ASP 44 Ca 0.19 -1.46 -0.30 0.00 0.71 0.00 0.00 52.55 51.68 3fie s ASP 44 Cb -0.12 -0.02 -0.10 0.00 1.01 0.00 0.00 42.92 43.69 3fie s ASP 44 CO 0.09 -0.63 1.43 -0.63 0.21 0.00 0.00 175.17 175.64 3fie s ILE 45 N -2.98 2.78 0.29 0.77 1.01 -1.26 -4.96 121.20 116.86 3fie s ILE 45 Ca 0.29 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.60 3fie s ILE 45 Cb 0.07 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 3fie s ILE 45 CO 0.14 0.09 0.28 -0.04 0.00 0.00 0.00 174.94 175.41 3fie s MET 46 N -0.06 1.62 0.51 2.79 -1.94 -1.26 -5.00 119.30 115.96 3fie s MET 46 Ca 0.60 -1.84 0.16 0.00 -1.71 0.00 0.00 55.69 52.90 3fie s MET 46 Cb -0.41 0.33 1.23 0.00 2.01 0.00 0.00 34.83 38.00 3fie s MET 46 CO 0.40 -0.60 2.13 0.07 -0.01 0.00 0.00 175.02 177.01 3fie h ARG 47 N 2.27 0.07 -0.24 2.03 -0.00 -2.01 -1.37 114.38 115.14 3fie h ARG 47 Ca -0.29 -0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.58 3fie h ARG 47 Cb 1.24 -0.01 -0.01 0.00 -0.00 0.00 0.00 29.97 31.18 3fie h ARG 47 CO 0.41 0.04 -0.34 -0.24 -0.00 0.00 0.00 179.97 179.85 3fie h VAL 48 N 0.07 1.29 0.00 0.08 3.04 -1.98 -3.34 116.25 115.41 3fie h VAL 48 Ca 0.04 -1.44 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 3fie h VAL 48 Cb 0.07 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.82 3fie h VAL 48 CO -0.01 0.45 -0.59 -0.46 -1.01 0.00 0.00 177.57 175.96 3fie n ASN 49 N -4.07 0.74 -0.27 3.17 0.23 -1.04 -4.74 115.26 109.28 3fie n ASN 49 Ca -0.01 -0.64 0.07 0.00 -0.53 0.00 0.00 54.58 53.47 3fie n ASN 49 Cb 0.46 1.06 0.18 0.00 -2.08 0.00 0.00 39.78 39.41 3fie n ASN 49 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 3fie h VAL 50 N 0.00 0.30 0.00 3.53 3.04 -1.38 0.39 116.25 122.13 3fie h VAL 50 Ca 0.00 -0.04 -0.00 0.00 -1.01 0.00 0.00 66.70 65.65 3fie h VAL 50 Cb 0.26 0.18 -0.00 0.00 -2.01 0.00 0.00 31.29 29.73 3fie h VAL 50 CO 0.00 0.02 -0.01 0.44 -1.01 0.00 0.00 177.57 177.00 3fie h ASP 51 N 0.10 0.00 1.18 3.17 5.19 -1.85 0.10 116.42 124.31 3fie h ASP 51 Ca 0.45 0.00 -0.17 0.00 -0.62 0.00 0.00 57.03 56.69 3fie h ASP 51 Cb 0.81 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.30 3fie h ASP 51 CO -0.70 0.01 -0.83 0.50 -3.12 0.00 0.00 179.24 175.11 3fie h LYS 52 N 0.00 0.00 0.00 3.56 1.63 -0.59 -2.49 116.57 118.68 3fie h LYS 52 Ca -0.00 0.00 -0.21 0.00 -0.85 0.00 0.00 60.65 59.59 3fie h LYS 52 Cb 0.03 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.62 3fie h LYS 52 CO 0.00 0.81 -1.21 -0.39 -3.45 0.00 0.00 179.45 175.21 3fie h VAL 53 N 0.00 1.11 -0.00 2.00 -1.51 -0.17 -3.27 116.25 114.41 3fie h VAL 53 Ca -0.01 -2.77 0.00 0.00 -1.23 0.00 0.00 66.70 62.69 3fie h VAL 53 Cb 1.63 2.51 0.00 0.00 -2.13 0.00 0.00 31.29 33.30 3fie h VAL 53 CO 0.11 0.63 -0.25 0.18 -1.23 0.00 0.00 177.57 177.01 3fie n LEU 54 N -3.16 0.50 -4.65 4.19 4.77 0.24 -4.89 117.00 114.01 3fie n LEU 54 Ca -0.07 0.04 -0.48 0.00 -0.03 0.00 0.00 56.01 55.48 3fie n LEU 54 Cb 0.93 -0.25 -0.05 0.00 -2.33 0.00 0.00 43.42 41.72 3fie n LEU 54 CO 0.45 0.10 1.16 1.21 -1.33 0.00 0.00 177.39 178.98 3fie n GLU 55 N -1.18 1.90 -3.87 3.23 2.13 -0.94 -4.91 120.64 117.00 3fie n GLU 55 Ca 0.10 0.69 -0.09 0.00 0.66 0.00 0.00 57.16 58.52 3fie n GLU 55 Cb 0.32 -2.43 -0.00 0.00 0.27 0.00 0.00 31.44 29.59 3fie n GLU 55 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 3fie s ARG 56 N 1.17 1.98 0.00 5.31 1.70 -1.26 -5.05 118.95 122.80 3fie s ARG 56 Ca 0.82 -1.29 0.24 0.00 -0.47 0.00 0.00 55.73 55.03 3fie s ARG 56 Cb -0.75 0.59 0.20 0.00 -0.57 0.00 0.00 34.95 34.42 3fie s ARG 56 CO 0.42 -0.91 1.27 -0.25 -1.08 0.00 0.00 175.30 174.75