#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d56 s VAL 2 N 0.00 -0.17 -0.10 0.00 -7.23 -1.26 -5.12 120.40 106.52 2d56 s VAL 2 Ca 0.00 -1.04 -0.31 0.00 -1.81 0.00 0.00 61.98 58.83 2d56 s VAL 2 Cb 0.00 -0.92 0.12 0.00 0.56 0.00 0.00 36.38 36.14 2d56 s VAL 2 CO 0.00 -0.70 1.00 -0.62 -0.31 0.00 0.00 175.10 174.48 2d56 s ASP 3 N 1.66 -0.30 0.40 4.85 2.15 -1.26 -5.18 116.67 118.98 2d56 s ASP 3 Ca 0.14 0.11 0.08 0.00 0.43 0.00 0.00 52.55 53.30 2d56 s ASP 3 Cb -0.17 0.30 -0.03 0.00 -0.30 0.00 0.00 42.92 42.72 2d56 s ASP 3 CO -0.15 -0.44 0.32 0.72 -0.17 0.00 0.00 175.17 175.45 2d56 s PHE 4 N -2.38 2.72 -0.30 -5.34 -0.71 -1.26 -5.14 117.98 105.58 2d56 s PHE 4 Ca 0.04 -0.47 -0.21 0.00 -1.04 0.00 0.00 56.93 55.26 2d56 s PHE 4 Cb -0.01 -2.05 0.19 0.00 -1.21 0.00 0.00 43.02 39.94 2d56 s PHE 4 CO -0.05 0.00 1.28 -1.54 -1.34 0.00 0.00 175.22 173.57 2d56 s SER 5 N -4.05 -0.15 -0.08 1.98 1.04 -1.26 -5.07 113.70 106.10 2d56 s SER 5 Ca 0.45 0.26 -0.05 0.00 0.48 0.00 0.00 55.95 57.10 2d56 s SER 5 Cb -0.02 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 2d56 s SER 5 CO 0.26 -0.04 -0.11 -1.20 0.98 0.00 0.00 173.24 173.13 2d56 n SER 6 N 2.45 0.65 -2.47 7.02 7.64 -1.26 -4.78 113.62 122.87 2d56 n SER 6 Ca -0.14 0.11 -0.29 0.00 1.01 0.00 0.00 58.87 59.56 2d56 n SER 6 Cb 0.57 -0.27 0.01 0.00 -1.01 0.00 0.00 64.21 63.51 2d56 n SER 6 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d56 n ALA 8 N -0.55 5.89 -0.05 0.00 0.00 -1.26 -4.13 120.51 120.41 2d56 n ALA 8 Ca 0.43 -2.70 -0.05 0.00 0.00 0.00 0.00 53.44 51.13 2d56 n ALA 8 Cb 0.64 -1.72 -0.09 0.00 0.00 0.00 0.00 19.45 18.28 2d56 n ALA 8 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2d56 n ARG 9 N 0.06 2.12 -0.25 0.00 0.00 -1.26 -4.47 116.66 112.86 2d56 n ARG 9 Ca 0.45 -0.01 0.06 0.00 -0.00 0.00 0.00 57.85 58.35 2d56 n ARG 9 Cb 0.56 -1.28 0.19 0.00 -0.00 0.00 0.00 32.46 31.92 2d56 n ARG 9 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.63 177.51 2d56 n MET 10 N -2.39 2.14 -0.99 2.89 1.56 -1.26 -4.88 117.12 114.19 2d56 n MET 10 Ca -0.17 -1.50 0.00 0.00 -0.27 0.00 0.00 57.70 55.75 2d56 n MET 10 Cb 0.84 -1.42 0.00 0.00 2.15 0.00 0.00 33.22 34.79 2d56 n MET 10 CO 0.00 0.00 0.00 -0.25 -0.73 0.00 0.00 175.97 174.99 2d56 n ASP 11 N 0.63 -4.58 -3.03 6.12 9.92 -1.26 -4.30 116.55 120.06 2d56 n ASP 11 Ca 0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.40 2d56 n ASP 11 Cb 0.41 -2.24 0.00 0.00 -0.64 0.00 0.00 41.12 38.66 2d56 n ASP 11 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 2d56 n VAL 12 N -2.39 -1.82 0.31 2.53 0.24 -1.26 -4.79 118.33 111.15 2d56 n VAL 12 Ca 0.00 0.44 0.13 0.00 -2.04 0.00 0.00 64.34 62.86 2d56 n VAL 12 Cb 0.28 -2.79 0.58 0.00 -1.47 0.00 0.00 33.84 30.44 2d56 n VAL 12 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 2d56 h PRO 13 N 3.55 0.00 0.00 7.34 0.13 -1.98 -3.45 132.00 137.58 2d56 h PRO 13 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2d56 h PRO 13 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2d56 h PRO 13 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 2d56 n GLY 14 N -0.44 1.24 0.03 1.56 0.00 -1.26 -4.95 105.19 101.36 2d56 n GLY 14 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 -0.03 0.99 -0.00 -1.26 -4.60 117.00 112.11 2d56 n LEU 15 Ca 0.00 0.00 0.23 0.00 -0.00 0.00 0.00 56.01 56.24 2d56 n LEU 15 Cb 0.00 0.13 0.72 0.00 -0.00 0.00 0.00 43.42 44.27 2d56 n LEU 15 CO 0.00 0.13 1.21 0.77 -0.00 0.00 0.00 177.39 179.50 2d56 h SER 16 N 0.00 0.00 -0.13 1.45 4.64 -1.92 0.16 113.55 117.74 2d56 h SER 16 Ca -0.15 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.02 2d56 h SER 16 Cb 1.33 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.43 2d56 h SER 16 CO 0.01 0.00 -0.50 0.11 -0.87 0.00 0.00 176.83 175.58 2d56 h LYS 17 N 0.00 0.57 -0.02 4.77 1.57 -1.94 -2.93 116.57 118.58 2d56 h LYS 17 Ca 0.29 -0.44 -0.14 0.00 -1.87 0.00 0.00 60.65 58.48 2d56 h LYS 17 Cb 1.23 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 33.60 2d56 h LYS 17 CO -0.00 1.06 -0.65 0.28 -0.57 0.00 0.00 179.45 179.57 2d56 h VAL 18 N 0.20 1.44 -0.03 0.50 2.07 -1.27 -0.56 116.25 118.60 2d56 h VAL 18 Ca -0.03 -2.15 -0.07 0.00 0.82 0.00 0.00 66.70 65.27 2d56 h VAL 18 Cb 1.13 2.14 -0.01 0.00 -1.52 0.00 0.00 31.29 33.04 2d56 h VAL 18 CO 0.11 0.62 -0.31 0.00 0.02 0.00 0.00 177.57 178.01 2d56 h ALA 19 N 1.28 1.45 0.00 1.67 0.00 -0.80 -1.07 119.26 121.78 2d56 h ALA 19 Ca -0.01 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 2d56 h ALA 19 Cb 1.15 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 2d56 h ALA 19 CO 0.09 0.41 -1.30 0.00 0.00 0.00 0.00 179.25 178.45 2d56 n GLN 20 N -4.16 0.62 0.12 0.00 10.64 -1.11 -2.58 117.38 120.91 2d56 n GLN 20 Ca -0.02 0.12 -0.02 0.00 -1.83 0.00 0.00 57.00 55.25 2d56 n GLN 20 Cb 0.36 -1.78 0.16 0.00 -0.86 0.00 0.00 30.24 28.12 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 3.90 0.08 0.60 2.61 0.00 -0.52 -1.56 103.07 108.18 2d56 h GLY 21 Ca -0.08 -0.10 -0.30 0.00 0.00 0.00 0.00 47.33 46.86 2d56 h GLY 21 CO 0.02 0.09 -1.53 0.17 0.00 0.00 0.00 176.54 175.28 2d56 h LEU 22 N 0.05 0.41 -1.21 3.11 8.10 -1.33 -2.56 115.31 121.88 2d56 h LEU 22 Ca -0.01 -0.87 0.01 0.00 0.11 0.00 0.00 57.88 57.12 2d56 h LEU 22 Cb 1.08 -0.13 -0.04 0.00 -0.44 0.00 0.00 40.66 41.13 2d56 h LEU 22 CO 0.08 1.67 0.52 0.00 -4.11 0.00 0.00 178.44 176.61 2d56 h ILE 24 N 1.08 1.48 0.14 0.00 -0.00 -1.41 -2.64 117.51 116.14 2d56 h ILE 24 Ca 0.29 -2.09 -0.01 0.00 -0.00 0.00 0.00 64.86 63.06 2d56 h ILE 24 Cb -0.12 2.72 0.00 0.00 -0.00 0.00 0.00 36.82 39.43 2d56 h ILE 24 CO -0.06 0.59 -0.07 0.28 -0.00 0.00 0.00 178.15 178.90 2d56 h SER 25 N -0.27 -0.15 -0.09 2.19 0.02 -1.21 0.14 113.55 114.18 2d56 h SER 25 Ca -0.07 -0.07 0.02 0.00 -0.84 0.00 0.00 61.79 60.83 2d56 h SER 25 Cb 1.24 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.81 2d56 h SER 25 CO 0.10 -0.03 -0.02 0.77 -1.14 0.00 0.00 176.83 176.51 2d56 h SER 26 N -0.27 -0.07 0.81 3.07 4.64 -0.83 -1.42 113.55 119.48 2d56 h SER 26 Ca -0.02 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2d56 h SER 26 Cb 0.21 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 2d56 h SER 26 CO 0.03 -0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 2d56 h LYS 28 N 0.00 0.00 -0.40 0.00 1.63 0.26 -3.27 116.57 114.80 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 0.41 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.02 2d56 h LYS 28 CO 0.00 0.25 0.32 0.74 -3.45 0.00 0.00 179.45 177.32 2d56 h PHE 29 N 0.00 0.00 0.00 1.91 -1.00 -0.94 0.34 116.94 117.25 2d56 h PHE 29 Ca -0.06 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.72 2d56 h PHE 29 Cb 1.34 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.90 2d56 h PHE 29 CO 0.00 0.00 0.00 -0.56 -1.61 0.00 0.00 178.31 176.14 2d56 h GLN 30 N 0.00 0.00 -1.77 1.51 3.07 -1.74 -3.47 115.11 112.71 2d56 h GLN 30 Ca 0.19 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.61 2d56 h GLN 30 Cb 0.84 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.34 2d56 h GLN 30 CO -0.00 0.00 -0.37 -1.71 0.09 0.00 0.00 178.83 176.83 2d56 n ASN 31 N -2.64 -4.83 -0.89 0.06 2.85 0.12 -4.80 115.26 105.13 2d56 n ASN 31 Ca 0.04 0.12 -0.03 0.00 -0.11 0.00 0.00 54.58 54.61 2d56 n ASN 31 Cb 0.42 -3.88 -0.03 0.00 1.24 0.00 0.00 39.78 37.53 2d56 n ASN 31 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2d56 s GLY 33 N -0.87 -0.95 -0.18 0.00 0.00 -1.23 -1.37 107.32 102.73 2d56 s GLY 33 Ca 0.05 1.93 -0.14 0.00 0.00 0.00 0.00 44.72 46.56 2d56 s GLY 33 CO -0.03 3.37 0.32 -1.08 0.00 0.00 0.00 173.10 175.68 2d56 s THR 34 N 2.86 5.28 -0.12 0.90 -1.32 -1.08 -2.93 115.64 119.24 2d56 s THR 34 Ca 0.18 0.57 -0.28 0.00 -1.21 0.00 0.00 61.69 60.96 2d56 s THR 34 Cb -0.15 -3.65 -0.02 0.00 -1.51 0.00 0.00 72.50 67.17 2d56 s THR 34 CO -0.20 0.34 0.92 -0.83 -2.21 0.00 0.00 174.62 172.64 2d56 s GLY 35 N 0.70 2.33 -0.02 6.08 0.00 -1.24 -2.54 107.32 112.62 2d56 s GLY 35 Ca 0.17 0.25 0.00 0.00 0.00 0.00 0.00 44.72 45.14 2d56 s GLY 35 CO 0.05 1.76 0.00 0.30 0.00 0.00 0.00 173.10 175.21 2d56 s HIS 36 N 1.89 0.17 -0.90 1.90 3.76 -0.59 -4.65 115.29 116.86 2d56 s HIS 36 Ca 0.44 0.03 -0.22 0.00 -0.15 0.00 0.00 55.06 55.16 2d56 s HIS 36 Cb -0.18 -0.23 0.08 0.00 1.11 0.00 0.00 32.58 33.36 2d56 s HIS 36 CO 0.17 -0.07 1.23 0.00 -0.85 0.00 0.00 174.74 175.22 2d56 s GLU 38 N 3.95 3.93 -0.17 0.00 8.01 -0.14 -4.71 118.70 129.57 2d56 s GLU 38 Ca 0.36 0.70 -0.00 0.00 0.01 0.00 0.00 54.97 56.04 2d56 s GLU 38 Cb -0.05 -3.77 0.04 0.00 -4.31 0.00 0.00 34.13 26.04 2d56 s GLU 38 CO -0.05 -0.87 -0.06 0.15 0.01 0.00 0.00 175.26 174.45 2d56 s LYS 39 N 3.38 1.53 0.00 1.61 1.02 -1.26 -0.36 119.74 125.66 2d56 s LYS 39 Ca 0.38 -0.57 0.00 0.00 0.02 0.00 0.00 55.97 55.81 2d56 s LYS 39 Cb -0.13 -2.07 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 2d56 s LYS 39 CO 0.16 -0.43 0.00 0.54 -0.92 0.00 0.00 175.35 174.70 2d56 n ARG 40 N 4.84 0.00 -0.92 1.68 1.74 -1.26 -4.76 116.66 117.99 2d56 n ARG 40 Ca -0.12 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.78 2d56 n ARG 40 Cb 0.48 0.00 0.04 0.00 -1.02 0.00 0.00 32.46 31.96 2d56 n ARG 40 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2d56 n GLY 41 N 3.08 4.20 1.81 -0.13 0.00 -1.26 -4.70 105.19 108.19 2d56 n GLY 41 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 0.25 0.55 2.65 -0.02 0.00 -1.26 -5.04 105.19 102.32 2d56 n GLY 42 Ca 0.32 -0.81 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 2d56 n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d56 s ARG 43 N -4.02 1.14 0.61 1.61 0.52 -1.26 -5.12 118.95 112.43 2d56 s ARG 43 Ca 0.00 -1.90 -0.19 0.00 -0.52 0.00 0.00 55.73 53.11 2d56 s ARG 43 Cb 0.00 -2.10 -0.03 0.00 0.52 0.00 0.00 34.95 33.34 2d56 s ARG 43 CO 0.00 -1.18 1.31 -2.14 0.02 0.00 0.00 175.30 173.31 2d56 s PRO 44 N 0.45 2.78 -0.03 3.54 0.02 -1.25 -4.19 135.00 136.31 2d56 s PRO 44 Ca 0.19 2.12 -0.02 0.00 0.02 0.00 0.00 61.00 63.30 2d56 s PRO 44 Cb -0.22 -2.00 0.01 0.00 0.02 0.00 0.00 34.50 32.32 2d56 s PRO 44 CO -0.01 -1.43 0.08 0.99 -0.33 0.00 0.00 177.00 176.30 2d56 s THR 45 N -1.37 -0.01 -1.16 0.99 2.01 0.51 -4.89 115.64 111.73 2d56 s THR 45 Ca 0.78 0.04 -0.10 0.00 0.31 0.00 0.00 61.69 62.73 2d56 s THR 45 Cb -0.38 -0.13 0.24 0.00 0.01 0.00 0.00 72.50 72.24 2d56 s THR 45 CO 0.42 0.02 1.31 0.00 -0.69 0.00 0.00 174.62 175.68 2d56 s VAL 47 N -0.38 4.57 -0.26 0.00 -7.23 -0.96 -4.84 120.40 111.30 2d56 s VAL 47 Ca 0.36 2.06 0.02 0.00 -1.81 0.00 0.00 61.98 62.60 2d56 s VAL 47 Cb -0.05 -4.32 0.07 0.00 0.56 0.00 0.00 36.38 32.64 2d56 s VAL 47 CO -0.03 0.28 -0.03 0.00 -0.31 0.00 0.00 175.10 175.01 2d56 s ASP 49 N 1.28 -0.85 -0.13 0.00 1.11 -1.05 -4.57 116.67 112.45 2d56 s ASP 49 Ca -0.02 1.13 0.05 0.00 0.18 0.00 0.00 52.55 53.89 2d56 s ASP 49 Cb -0.19 1.93 0.16 0.00 1.07 0.00 0.00 42.92 45.89 2d56 s ASP 49 CO -0.08 -0.24 1.19 -1.14 1.18 0.00 0.00 175.17 176.08 2d56 n ARG 50 N 5.42 0.53 -2.95 8.23 0.63 -0.47 -2.63 116.66 125.43 2d56 n ARG 50 Ca -0.08 -1.06 -0.44 0.00 -0.92 0.00 0.00 57.85 55.36 2d56 n ARG 50 Cb 0.50 0.47 -0.00 0.00 0.45 0.00 0.00 32.46 33.87 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 4.14 -0.27 0.00 0.00 0.00 -1.26 -5.06 105.19 102.74 2d56 n GLY 52 Ca 0.36 -0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.31 2d56 n GLY 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19