#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d56 n VAL 2 N 0.00 0.84 -0.06 0.00 3.14 -1.26 -4.82 118.33 116.17 2d56 n VAL 2 Ca 0.00 -0.30 -0.08 0.00 -2.96 0.00 0.00 64.34 61.00 2d56 n VAL 2 Cb 0.00 -1.16 -0.06 0.00 -1.06 0.00 0.00 33.84 31.55 2d56 n VAL 2 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 2d56 n ASP 3 N -3.09 2.88 -4.56 6.55 5.75 -1.26 -4.87 116.55 117.95 2d56 n ASP 3 Ca -0.27 -0.06 -0.28 0.00 -0.01 0.00 0.00 54.79 54.17 2d56 n ASP 3 Cb 0.76 -0.04 -0.05 0.00 -1.03 0.00 0.00 41.12 40.77 2d56 n ASP 3 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 2d56 s PHE 4 N -2.26 1.84 0.38 2.11 5.36 -1.26 -4.93 117.98 119.21 2d56 s PHE 4 Ca -0.16 0.55 0.06 0.00 -0.96 0.00 0.00 56.93 56.42 2d56 s PHE 4 Cb 0.04 -4.09 0.06 0.00 -0.34 0.00 0.00 43.02 38.70 2d56 s PHE 4 CO 0.33 -1.78 0.48 -1.13 -1.46 0.00 0.00 175.22 171.65 2d56 n SER 5 N 13.62 1.53 0.00 6.13 3.41 -1.26 -4.89 113.62 132.16 2d56 n SER 5 Ca 0.39 -2.05 0.00 0.00 -0.26 0.00 0.00 58.87 56.95 2d56 n SER 5 Cb 0.47 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2d56 n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2d56 n SER 6 N -2.44 0.00 -2.45 4.04 3.41 -1.26 -4.98 113.62 109.94 2d56 n SER 6 Ca 0.08 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.41 2d56 n SER 6 Cb 0.40 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.35 2d56 n SER 6 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d56 h ALA 8 N 2.59 1.00 -0.18 0.00 0.00 -1.96 -3.22 119.26 117.49 2d56 h ALA 8 Ca 0.44 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.39 2d56 h ALA 8 Cb 0.61 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.34 2d56 h ALA 8 CO 1.07 0.01 -0.22 0.00 0.00 0.00 0.00 179.25 180.11 2d56 h ARG 9 N 0.00 -0.25 -5.78 0.00 2.47 -2.03 -3.46 114.38 105.34 2d56 h ARG 9 Ca -0.00 0.02 -0.38 0.00 -1.26 0.00 0.00 59.98 58.36 2d56 h ARG 9 Cb 0.55 0.06 0.15 0.00 -1.65 0.00 0.00 29.97 29.07 2d56 h ARG 9 CO 0.00 -0.16 -0.70 -0.12 0.56 0.00 0.00 179.97 179.55 2d56 n MET 10 N -5.36 -7.60 0.20 0.04 1.56 -1.22 -4.89 117.12 99.86 2d56 n MET 10 Ca -0.02 0.83 0.07 0.00 -0.27 0.00 0.00 57.70 58.31 2d56 n MET 10 Cb 0.27 -5.87 0.39 0.00 2.15 0.00 0.00 33.22 30.17 2d56 n MET 10 CO 0.00 0.00 0.00 0.38 -0.73 0.00 0.00 175.97 175.62 2d56 h ASP 11 N -2.48 0.00 -3.59 6.12 2.03 -1.91 -3.46 116.42 113.14 2d56 h ASP 11 Ca -0.57 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.18 2d56 h ASP 11 Cb 1.36 0.00 0.20 0.00 -0.83 0.00 0.00 39.33 40.06 2d56 h ASP 11 CO 0.54 0.33 -0.23 1.33 -1.03 0.00 0.00 179.24 180.18 2d56 n VAL 12 N -3.56 1.26 -0.29 4.15 0.24 -1.26 -4.83 118.33 114.04 2d56 n VAL 12 Ca -0.00 -0.27 0.30 0.00 -2.04 0.00 0.00 64.34 62.33 2d56 n VAL 12 Cb 0.46 -0.84 0.68 0.00 -1.47 0.00 0.00 33.84 32.67 2d56 n VAL 12 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 2d56 h PRO 13 N -0.94 0.11 0.00 7.34 0.11 -2.04 -3.42 132.00 133.16 2d56 h PRO 13 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2d56 h PRO 13 Cb 1.31 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2d56 h PRO 13 CO 0.41 0.07 0.00 0.41 -0.21 0.00 0.00 178.00 178.68 2d56 n GLY 14 N -1.67 0.00 0.65 -0.55 0.00 -1.26 -5.05 105.19 97.30 2d56 n GLY 14 Ca 0.24 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.26 2d56 n GLY 14 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2d56 n LEU 15 N 0.00 0.14 0.01 0.99 -0.00 -1.26 -4.87 117.00 112.00 2d56 n LEU 15 Ca 0.00 -1.15 0.22 0.00 -0.00 0.00 0.00 56.01 55.07 2d56 n LEU 15 Cb 0.00 0.00 0.72 0.00 -0.00 0.00 0.00 43.42 44.14 2d56 n LEU 15 CO 0.00 0.33 1.20 0.77 -0.00 0.00 0.00 177.39 179.69 2d56 h SER 16 N 0.15 0.00 0.06 1.45 4.64 -1.95 0.44 113.55 118.34 2d56 h SER 16 Ca -0.04 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2d56 h SER 16 Cb 1.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.55 2d56 h SER 16 CO 0.01 0.00 -0.03 0.50 -0.87 0.00 0.00 176.83 176.44 2d56 h LYS 17 N 0.00 -0.08 0.00 4.77 1.63 -1.98 -2.94 116.57 117.97 2d56 h LYS 17 Ca 0.26 0.01 -0.11 0.00 -0.85 0.00 0.00 60.65 59.95 2d56 h LYS 17 Cb 1.14 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.78 2d56 h LYS 17 CO -0.00 0.44 -0.53 0.28 -3.45 0.00 0.00 179.45 176.19 2d56 h VAL 18 N -0.67 1.31 -0.28 2.00 2.07 -1.67 -1.50 116.25 117.51 2d56 h VAL 18 Ca -0.01 -1.85 -0.05 0.00 0.82 0.00 0.00 66.70 65.62 2d56 h VAL 18 Cb 0.56 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 2d56 h VAL 18 CO 0.01 0.52 -0.04 0.00 0.02 0.00 0.00 177.57 178.08 2d56 h ALA 19 N 1.47 1.41 0.00 1.67 0.00 -0.21 -0.66 119.26 122.95 2d56 h ALA 19 Ca -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2d56 h ALA 19 Cb 0.97 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2d56 h ALA 19 CO 0.07 0.41 -1.09 0.00 0.00 0.00 0.00 179.25 178.64 2d56 n GLN 20 N -4.28 0.61 0.05 0.00 10.64 -1.11 -2.57 117.38 120.72 2d56 n GLN 20 Ca 0.01 0.11 -0.09 0.00 -1.83 0.00 0.00 57.00 55.20 2d56 n GLN 20 Cb 0.25 -1.81 0.05 0.00 -0.86 0.00 0.00 30.24 27.87 2d56 n GLN 20 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 2d56 h GLY 21 N 3.98 0.41 0.98 2.61 0.00 -0.61 -1.59 103.07 108.86 2d56 h GLY 21 Ca -0.01 -0.57 -0.35 0.00 0.00 0.00 0.00 47.33 46.40 2d56 h GLY 21 CO 0.00 0.51 -1.71 0.17 0.00 0.00 0.00 176.54 175.51 2d56 h LEU 22 N 0.26 0.62 -0.84 3.11 8.10 -1.26 -2.76 115.31 122.55 2d56 h LEU 22 Ca -0.02 -0.89 -0.05 0.00 0.11 0.00 0.00 57.88 57.02 2d56 h LEU 22 Cb 1.26 -0.20 -0.03 0.00 -0.44 0.00 0.00 40.66 41.24 2d56 h LEU 22 CO 0.12 1.75 0.28 0.00 -4.11 0.00 0.00 178.44 176.47 2d56 h ILE 24 N 1.10 1.45 0.02 0.00 6.09 -1.41 -2.42 117.51 122.34 2d56 h ILE 24 Ca 0.25 -1.38 -0.00 0.00 -1.37 0.00 0.00 64.86 62.36 2d56 h ILE 24 Cb 0.24 2.33 0.00 0.00 0.47 0.00 0.00 36.82 39.86 2d56 h ILE 24 CO -0.02 0.37 -0.01 0.77 -3.07 0.00 0.00 178.15 176.19 2d56 h SER 25 N -0.49 -0.02 -0.90 2.19 4.64 -1.42 0.11 113.55 117.66 2d56 h SER 25 Ca 0.00 -0.15 0.10 0.00 -0.47 0.00 0.00 61.79 61.27 2d56 h SER 25 Cb 0.62 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.64 2d56 h SER 25 CO 0.01 0.14 0.58 0.28 -0.87 0.00 0.00 176.83 176.97 2d56 h SER 26 N -0.17 0.82 0.78 4.97 0.02 -0.79 0.79 113.55 119.96 2d56 h SER 26 Ca -0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2d56 h SER 26 Cb 0.17 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.56 2d56 h SER 26 CO 0.00 0.48 -0.24 0.00 -1.14 0.00 0.00 176.83 175.94 2d56 h LYS 28 N 0.00 0.00 -0.40 0.00 1.63 0.16 -3.23 116.57 114.73 2d56 h LYS 28 Ca 0.00 0.00 0.12 0.00 -0.85 0.00 0.00 60.65 59.92 2d56 h LYS 28 Cb 0.51 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.13 2d56 h LYS 28 CO 0.00 0.45 0.30 0.35 -3.45 0.00 0.00 179.45 177.10 2d56 h PHE 29 N 0.00 0.00 0.00 1.91 3.57 -1.43 0.21 116.94 121.20 2d56 h PHE 29 Ca -0.10 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.40 2d56 h PHE 29 Cb 1.56 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.30 2d56 h PHE 29 CO 0.00 0.00 -0.26 -0.56 -2.23 0.00 0.00 178.31 175.26 2d56 h GLN 30 N 0.00 0.00 -2.73 1.11 3.07 -1.78 -3.47 115.11 111.30 2d56 h GLN 30 Ca 0.19 0.00 -0.41 0.00 0.09 0.00 0.00 58.65 58.52 2d56 h GLN 30 Cb 0.79 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.31 2d56 h GLN 30 CO -0.00 0.00 -0.51 -1.71 0.09 0.00 0.00 178.83 176.70 2d56 n ASN 31 N -2.50 -5.81 -0.85 0.06 4.05 0.73 -4.78 115.26 106.15 2d56 n ASN 31 Ca 0.04 0.07 -0.02 0.00 0.45 0.00 0.00 54.58 55.12 2d56 n ASN 31 Cb 0.47 -4.88 -0.02 0.00 1.23 0.00 0.00 39.78 36.58 2d56 n ASN 31 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2d56 s GLY 33 N -0.88 -0.96 -0.24 0.00 0.00 -1.22 -1.38 107.32 102.64 2d56 s GLY 33 Ca 0.06 1.91 -0.10 0.00 0.00 0.00 0.00 44.72 46.60 2d56 s GLY 33 CO -0.03 3.38 0.15 -1.08 0.00 0.00 0.00 173.10 175.52 2d56 s THR 34 N 2.86 5.22 0.08 0.90 -1.32 -1.08 -3.58 115.64 118.73 2d56 s THR 34 Ca 0.19 0.13 -0.30 0.00 -1.21 0.00 0.00 61.69 60.50 2d56 s THR 34 Cb -0.15 -3.44 -0.05 0.00 -1.51 0.00 0.00 72.50 67.36 2d56 s THR 34 CO -0.21 0.34 0.97 -0.83 -2.21 0.00 0.00 174.62 172.68 2d56 s GLY 35 N 1.13 2.98 -0.05 6.08 0.00 -1.24 -2.45 107.32 113.77 2d56 s GLY 35 Ca 0.07 0.57 -0.07 0.00 0.00 0.00 0.00 44.72 45.29 2d56 s GLY 35 CO 0.05 1.52 0.18 0.30 0.00 0.00 0.00 173.10 175.15 2d56 s HIS 36 N 0.27 -0.14 -0.82 1.90 3.76 -0.65 -4.77 115.29 114.84 2d56 s HIS 36 Ca 0.48 0.32 -0.26 0.00 -0.15 0.00 0.00 55.06 55.45 2d56 s HIS 36 Cb -0.23 0.04 0.04 0.00 1.11 0.00 0.00 32.58 33.54 2d56 s HIS 36 CO 0.29 -0.17 1.34 0.00 -0.85 0.00 0.00 174.74 175.35 2d56 s GLU 38 N 5.53 4.22 -0.08 0.00 2.56 -0.93 -4.41 118.70 125.58 2d56 s GLU 38 Ca 0.39 0.10 0.02 0.00 0.00 0.00 0.00 54.97 55.47 2d56 s GLU 38 Cb -0.06 -3.41 0.02 0.00 2.00 0.00 0.00 34.13 32.68 2d56 s GLU 38 CO 0.08 0.27 -0.12 -1.59 -0.56 0.00 0.00 175.26 173.34 2d56 s LYS 39 N 0.37 1.77 0.00 4.30 0.00 -1.26 -0.38 119.74 124.53 2d56 s LYS 39 Ca 0.17 -0.41 0.00 0.00 0.00 0.00 0.00 55.97 55.73 2d56 s LYS 39 Cb -0.13 -1.54 0.00 0.00 0.00 0.00 0.00 37.83 36.16 2d56 s LYS 39 CO 0.04 -0.05 0.00 0.54 0.00 0.00 0.00 175.35 175.88 2d56 n ARG 40 N 4.12 0.00 -1.36 1.78 5.12 -1.25 -4.85 116.66 120.23 2d56 n ARG 40 Ca -0.20 0.00 -0.24 0.00 -1.93 0.00 0.00 57.85 55.48 2d56 n ARG 40 Cb 0.51 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.77 2d56 n ARG 40 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2d56 n GLY 41 N 3.99 4.26 2.25 -0.13 0.00 -1.26 -4.68 105.19 109.63 2d56 n GLY 41 Ca 0.00 -1.72 -0.10 0.00 0.00 0.00 0.00 46.02 44.20 2d56 n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2d56 n GLY 42 N 0.84 -0.00 2.60 -0.02 0.00 -1.26 -5.02 105.19 102.33 2d56 n GLY 42 Ca 0.45 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 2d56 n GLY 42 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2d56 s ARG 43 N -4.72 0.10 0.46 1.61 3.00 -1.26 -5.14 118.95 112.99 2d56 s ARG 43 Ca 0.05 -0.15 -0.22 0.00 -1.00 0.00 0.00 55.73 54.41 2d56 s ARG 43 Cb -0.02 -1.75 -0.08 0.00 0.00 0.00 0.00 34.95 33.09 2d56 s ARG 43 CO 0.07 -0.72 1.06 -1.25 0.00 0.00 0.00 175.30 174.46 2d56 s PRO 44 N 2.12 3.88 0.28 5.12 0.04 -1.26 -3.79 135.00 141.40 2d56 s PRO 44 Ca 0.03 1.47 0.03 0.00 0.04 0.00 0.00 61.00 62.56 2d56 s PRO 44 Cb -0.16 -2.26 -0.03 0.00 0.04 0.00 0.00 34.50 32.09 2d56 s PRO 44 CO -0.13 -0.38 0.26 -0.08 0.04 0.00 0.00 177.00 176.70 2d56 s THR 45 N -1.82 0.00 -0.65 1.26 -1.32 0.48 -4.93 115.64 108.66 2d56 s THR 45 Ca 0.64 -1.94 0.02 0.00 -1.21 0.00 0.00 61.69 59.20 2d56 s THR 45 Cb -0.20 -2.50 0.16 0.00 -1.51 0.00 0.00 72.50 68.45 2d56 s THR 45 CO 0.24 0.00 0.44 0.00 -2.21 0.00 0.00 174.62 173.10 2d56 s VAL 47 N -0.73 4.69 -0.31 0.00 -7.23 -0.91 -4.79 120.40 111.12 2d56 s VAL 47 Ca 0.21 2.02 -0.02 0.00 -1.81 0.00 0.00 61.98 62.38 2d56 s VAL 47 Cb -0.16 -4.30 0.05 0.00 0.56 0.00 0.00 36.38 32.53 2d56 s VAL 47 CO -0.07 -0.13 0.02 0.00 -0.31 0.00 0.00 175.10 174.61 2d56 s ASP 49 N 1.29 -1.05 -0.15 0.00 1.01 -1.03 -4.56 116.67 112.18 2d56 s ASP 49 Ca -0.04 1.37 0.06 0.00 0.71 0.00 0.00 52.55 54.65 2d56 s ASP 49 Cb -0.20 2.15 0.18 0.00 1.01 0.00 0.00 42.92 46.07 2d56 s ASP 49 CO -0.01 -0.23 1.22 -1.14 0.21 0.00 0.00 175.17 175.22 2d56 n ARG 50 N 5.44 0.61 -3.34 8.23 0.63 -0.48 -2.64 116.66 125.11 2d56 n ARG 50 Ca -0.10 -1.07 -0.38 0.00 -0.92 0.00 0.00 57.85 55.38 2d56 n ARG 50 Cb 0.49 0.46 -0.06 0.00 0.45 0.00 0.00 32.46 33.81 2d56 n ARG 50 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2d56 n GLY 52 N 1.84 3.46 3.92 0.00 0.00 -1.26 -5.05 105.19 108.10 2d56 n GLY 52 Ca -0.11 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2d56 n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86