#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 3.45 0.52 0.00 1.01 -1.26 -4.85 120.40 119.26 2d56 s VAL 2 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 61.98 62.49 2d56 s VAL 2 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.34 2d56 s VAL 2 CO 0.00 -0.57 0.00 0.47 0.00 0.00 0.00 175.10 175.00 2d56 n ASP 3 N -3.22 -8.12 -4.90 3.32 8.00 -1.26 -4.88 116.55 105.49 2d56 n ASP 3 Ca 0.09 1.14 -0.34 0.00 0.71 0.00 0.00 54.79 56.39 2d56 n ASP 3 Cb 0.53 -4.62 -0.05 0.00 -0.02 0.00 0.00 41.12 36.96 2d56 n ASP 3 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2d56 s PHE 4 N -3.57 3.56 -0.42 1.24 -0.12 -1.26 -5.04 117.98 112.36 2d56 s PHE 4 Ca 0.00 0.41 0.00 0.00 -0.05 0.00 0.00 56.93 57.29 2d56 s PHE 4 Cb 0.00 -1.86 0.22 0.00 -0.63 0.00 0.00 43.02 40.74 2d56 s PHE 4 CO 0.00 0.68 0.96 -1.13 -0.05 0.00 0.00 175.22 175.68 2d56 n SER 5 N 1.28 -2.32 -3.00 1.98 3.41 -1.26 -5.06 113.62 108.65 2d56 n SER 5 Ca -0.14 -2.01 -0.27 0.00 -0.26 0.00 0.00 58.87 56.19 2d56 n SER 5 Cb 0.53 1.22 -0.04 0.00 -0.26 0.00 0.00 64.21 65.66 2d56 n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2d56 n SER 6 N 2.49 4.33 -2.20 4.04 2.88 -1.26 -4.84 113.62 119.05 2d56 n SER 6 Ca 0.12 -3.65 -0.26 0.00 -1.33 0.00 0.00 58.87 53.76 2d56 n SER 6 Cb 0.62 -0.57 0.14 0.00 -0.75 0.00 0.00 64.21 63.65 2d56 n SER 6 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2d56 n ALA 8 N -0.96 1.23 -2.28 0.00 0.00 -1.26 -4.49 120.51 112.74 2d56 n ALA 8 Ca 0.57 -0.69 0.04 0.00 0.00 0.00 0.00 53.44 53.37 2d56 n ALA 8 Cb 1.30 -0.78 0.04 0.00 0.00 0.00 0.00 19.45 20.01 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 -3.24 0.23 -0.12 0.00 1.85 -1.26 -4.69 116.66 109.42 2d56 n ARG 9 Ca -0.23 -2.03 -0.12 0.00 -1.00 0.00 0.00 57.85 54.47 2d56 n ARG 9 Cb 1.05 -0.31 -0.02 0.00 -1.05 0.00 0.00 32.46 32.13 2d56 n ARG 9 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 177.63 178.14 2d56 h MET 10 N 0.83 0.81 0.00 2.89 2.86 -1.79 -3.42 114.93 117.11 2d56 h MET 10 Ca -0.16 -0.38 -0.05 0.00 -2.06 0.00 0.00 59.70 57.05 2d56 h MET 10 Cb 1.69 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 33.30 2d56 h MET 10 CO 0.07 1.01 -0.09 -3.47 1.06 0.00 0.00 176.91 175.49 2d56 n ASP 11 N -4.23 -0.41 -4.61 1.22 2.03 -1.26 -5.12 116.55 104.16 2d56 n ASP 11 Ca -0.02 -1.09 -0.43 0.00 0.52 0.00 0.00 54.79 53.77 2d56 n ASP 11 Cb 0.45 0.17 -0.02 0.00 -0.72 0.00 0.00 41.12 41.00 2d56 n ASP 11 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2d56 s VAL 12 N 0.02 4.20 -0.11 5.18 1.01 -1.26 -4.89 120.40 124.55 2d56 s VAL 12 Ca 0.02 1.28 0.14 0.00 0.00 0.00 0.00 61.98 63.42 2d56 s VAL 12 Cb 0.09 -4.45 0.04 0.00 0.00 0.00 0.00 36.38 32.05 2d56 s VAL 12 CO -0.02 -0.80 1.44 1.55 0.00 0.00 0.00 175.10 177.26 2d56 h PRO 13 N 9.28 0.00 0.00 2.72 0.13 -1.98 -3.46 132.00 138.69 2d56 h PRO 13 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2d56 h PRO 13 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2d56 h PRO 13 CO 1.09 0.55 0.00 0.41 -0.23 0.00 0.00 178.00 179.83 2d56 n GLY 14 N 1.19 0.00 0.00 1.56 0.00 -1.26 -5.01 105.19 101.67 2d56 n GLY 14 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.32 0.99 -0.00 -1.26 -4.98 117.00 111.43 2d56 n LEU 15 Ca 0.00 0.00 0.36 0.00 -0.00 0.00 0.00 56.01 56.37 2d56 n LEU 15 Cb 0.00 0.00 0.73 0.00 -0.00 0.00 0.00 43.42 44.15 2d56 n LEU 15 CO 0.00 0.00 1.33 -1.28 -0.00 0.00 0.00 177.39 177.44 2d56 h SER 16 N 0.00 0.00 -0.38 1.45 0.87 -1.92 0.41 113.55 113.99 2d56 h SER 16 Ca 0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2d56 h SER 16 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2d56 h SER 16 CO 0.00 0.00 0.17 0.50 -0.53 0.00 0.00 176.83 176.97 2d56 h LYS 17 N 0.00 0.56 -0.05 2.24 3.64 -1.89 -1.98 116.57 119.09 2d56 h LYS 17 Ca 0.57 -0.09 -0.17 0.00 -1.27 0.00 0.00 60.65 59.68 2d56 h LYS 17 Cb 2.43 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 34.14 2d56 h LYS 17 CO -0.01 0.51 -0.73 0.28 -2.27 0.00 0.00 179.45 177.24 2d56 h VAL 18 N 0.47 1.42 0.00 2.00 2.07 -0.64 -1.90 116.25 119.66 2d56 h VAL 18 Ca 0.13 -2.23 -0.02 0.00 0.82 0.00 0.00 66.70 65.40 2d56 h VAL 18 Cb 0.15 2.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.10 2d56 h VAL 18 CO -0.01 0.66 -0.11 0.00 0.02 0.00 0.00 177.57 178.13 2d56 h ALA 19 N 1.04 1.41 0.00 1.67 0.00 -1.00 -0.10 119.26 122.27 2d56 h ALA 19 Ca -0.03 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 2d56 h ALA 19 Cb 1.30 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 2d56 h ALA 19 CO 0.12 0.13 -1.60 0.94 0.00 0.00 0.00 179.25 178.84 2d56 n GLN 20 N -3.81 0.63 0.11 0.00 -0.06 -0.77 -2.44 117.38 111.05 2d56 n GLN 20 Ca -0.02 0.16 -0.03 0.00 -2.00 0.00 0.00 57.00 55.11 2d56 n GLN 20 Cb 0.21 -1.75 0.16 0.00 -4.06 0.00 0.00 30.24 24.81 2d56 n GLN 20 CO 0.00 0.00 0.00 0.78 -0.20 0.00 0.00 177.06 177.64 2d56 h GLY 21 N 3.77 0.17 0.90 1.69 0.00 -0.46 -1.26 103.07 107.87 2d56 h GLY 21 Ca -0.20 -0.20 -0.35 0.00 0.00 0.00 0.00 47.33 46.58 2d56 h GLY 21 CO 0.04 0.18 -1.77 0.17 0.00 0.00 0.00 176.54 175.15 2d56 h LEU 22 N 0.12 0.60 -1.19 3.11 8.10 -1.18 -2.71 115.31 122.16 2d56 h LEU 22 Ca -0.00 -0.93 -0.05 0.00 0.11 0.00 0.00 57.88 57.01 2d56 h LEU 22 Cb 1.03 -0.19 -0.02 0.00 -0.44 0.00 0.00 40.66 41.04 2d56 h LEU 22 CO 0.08 1.79 0.02 0.00 -4.11 0.00 0.00 178.44 176.22 2d56 h ILE 24 N 0.56 1.56 -0.14 0.00 6.09 -1.35 -2.50 117.51 121.72 2d56 h ILE 24 Ca 0.12 -2.11 -0.02 0.00 -1.37 0.00 0.00 64.86 61.47 2d56 h ILE 24 Cb 0.33 2.90 -0.00 0.00 0.47 0.00 0.00 36.82 40.51 2d56 h ILE 24 CO 0.01 0.58 -0.01 -1.28 -3.07 0.00 0.00 178.15 174.38 2d56 h SER 25 N -0.49 0.25 -0.41 2.19 0.87 -1.39 0.14 113.55 114.71 2d56 h SER 25 Ca -0.05 -0.32 -0.01 0.00 -1.23 0.00 0.00 61.79 60.18 2d56 h SER 25 Cb 1.15 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.02 2d56 h SER 25 CO 0.07 0.51 0.23 0.28 -0.53 0.00 0.00 176.83 177.39 2d56 h SER 26 N -0.01 0.51 1.47 6.23 0.02 -0.79 -1.65 113.55 119.33 2d56 h SER 26 Ca 0.04 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2d56 h SER 26 Cb 0.39 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2d56 h SER 26 CO 0.01 0.44 0.00 0.00 -1.14 0.00 0.00 176.83 176.14 2d56 h LYS 28 N 0.00 0.00 -0.96 0.00 3.11 -0.18 -3.17 116.57 115.37 2d56 h LYS 28 Ca 0.00 0.00 0.12 0.00 -2.81 0.00 0.00 60.65 57.96 2d56 h LYS 28 Cb 0.74 0.00 -0.08 0.00 -1.00 0.00 0.00 32.23 31.89 2d56 h LYS 28 CO 0.00 0.29 0.61 0.74 -2.81 0.00 0.00 179.45 178.28 2d56 h PHE 29 N 0.00 1.05 0.00 1.91 0.04 -1.22 0.21 116.94 118.94 2d56 h PHE 29 Ca -0.03 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2d56 h PHE 29 Cb 1.28 -0.33 0.00 0.00 2.20 0.00 0.00 35.95 39.09 2d56 h PHE 29 CO 0.00 0.42 0.00 -0.56 -0.60 0.00 0.00 178.31 177.57 2d56 h GLN 30 N 0.92 0.00 -2.22 1.51 3.07 -1.75 -3.46 115.11 113.18 2d56 h GLN 30 Ca 0.47 0.00 -0.32 0.00 0.09 0.00 0.00 58.65 58.89 2d56 h GLN 30 Cb 0.52 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.06 2d56 h GLN 30 CO -0.24 0.00 -0.41 -1.71 0.09 0.00 0.00 178.83 176.56 2d56 n ASN 31 N -2.38 -4.84 -0.83 0.06 4.05 0.73 -4.82 115.26 107.23 2d56 n ASN 31 Ca 0.02 0.01 -0.03 0.00 0.45 0.00 0.00 54.58 55.04 2d56 n ASN 31 Cb 0.27 -3.94 -0.03 0.00 1.23 0.00 0.00 39.78 37.31 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 -0.76 -0.91 -0.25 0.00 0.00 -1.20 -1.44 107.32 102.77 2d56 s GLY 33 Ca 0.04 2.00 -0.10 0.00 0.00 0.00 0.00 44.72 46.66 2d56 s GLY 33 CO -0.02 3.34 0.14 -1.08 0.00 0.00 0.00 173.10 175.48 2d56 s THR 34 N 2.87 5.09 0.05 0.90 -1.32 -1.08 -2.61 115.64 119.55 2d56 s THR 34 Ca 0.14 0.09 -0.30 0.00 -1.21 0.00 0.00 61.69 60.42 2d56 s THR 34 Cb -0.14 -3.39 -0.04 0.00 -1.51 0.00 0.00 72.50 67.42 2d56 s THR 34 CO -0.20 0.33 0.98 -0.83 -2.21 0.00 0.00 174.62 172.68 2d56 s GLY 35 N 1.31 2.94 -0.01 6.08 0.00 -1.23 -2.46 107.32 113.95 2d56 s GLY 35 Ca 0.07 0.57 -0.02 0.00 0.00 0.00 0.00 44.72 45.34 2d56 s GLY 35 CO 0.06 1.59 0.04 0.30 0.00 0.00 0.00 173.10 175.09 2d56 s HIS 36 N 0.53 0.01 -1.05 1.90 3.76 -0.63 -4.60 115.29 115.21 2d56 s HIS 36 Ca 0.50 -0.01 -0.22 0.00 -0.15 0.00 0.00 55.06 55.18 2d56 s HIS 36 Cb -0.22 -0.02 0.05 0.00 1.11 0.00 0.00 32.58 33.50 2d56 s HIS 36 CO 0.29 -0.07 1.48 0.00 -0.85 0.00 0.00 174.74 175.59 2d56 s GLU 38 N 4.90 2.50 -0.11 0.00 -6.30 -0.08 -4.81 118.70 114.80 2d56 s GLU 38 Ca 0.47 -0.47 -0.06 0.00 -2.50 0.00 0.00 54.97 52.40 2d56 s GLU 38 Cb 0.00 -2.35 0.04 0.00 0.00 0.00 0.00 34.13 31.83 2d56 s GLU 38 CO -0.08 -0.87 0.26 0.21 0.02 0.00 0.00 175.26 174.80 2d56 s LYS 39 N -4.95 0.24 0.00 4.30 2.20 -1.26 -0.57 119.74 119.70 2d56 s LYS 39 Ca 0.57 0.50 0.00 0.00 -0.36 0.00 0.00 55.97 56.68 2d56 s LYS 39 Cb -0.10 -0.05 0.00 0.00 -1.51 0.00 0.00 37.83 36.16 2d56 s LYS 39 CO 0.41 -0.13 0.00 0.54 -0.36 0.00 0.00 175.35 175.81 2d56 n ARG 40 N 3.92 0.00 -0.94 4.03 5.12 -1.18 -4.85 116.66 122.75 2d56 n ARG 40 Ca -0.22 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.52 2d56 n ARG 40 Cb 0.54 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.88 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 4.30 4.25 1.82 -0.13 0.00 -1.26 -4.69 105.19 109.48 2d56 n GLY 41 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.81 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 0.27 0.51 2.92 -0.02 0.00 -1.26 -5.06 105.19 102.55 2d56 n GLY 42 Ca 0.33 -0.83 -0.12 0.00 0.00 0.00 0.00 46.02 45.40 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 -3.57 0.19 0.72 1.61 0.52 -1.26 -5.14 118.95 112.01 2d56 s ARG 43 Ca 0.00 -0.21 -0.13 0.00 -0.52 0.00 0.00 55.73 54.87 2d56 s ARG 43 Cb 0.00 -0.09 0.03 0.00 0.52 0.00 0.00 34.95 35.41 2d56 s ARG 43 CO 0.00 0.02 1.10 -1.25 0.02 0.00 0.00 175.30 175.19 2d56 s PRO 44 N -0.42 2.52 -0.16 3.54 0.04 -1.26 -3.12 135.00 136.15 2d56 s PRO 44 Ca -0.03 1.29 -0.14 0.00 0.04 0.00 0.00 61.00 62.15 2d56 s PRO 44 Cb -0.03 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2d56 s PRO 44 CO -0.00 -1.46 0.41 0.99 0.04 0.00 0.00 177.00 176.99 2d56 s THR 45 N -2.61 -0.00 -1.05 1.26 2.01 0.26 -4.91 115.64 110.59 2d56 s THR 45 Ca 0.64 0.01 -0.12 0.00 0.31 0.00 0.00 61.69 62.53 2d56 s THR 45 Cb -0.19 -0.58 0.23 0.00 0.01 0.00 0.00 72.50 71.97 2d56 s THR 45 CO 0.49 0.00 1.11 0.00 -0.69 0.00 0.00 174.62 175.53 2d56 s VAL 47 N 0.08 4.54 -0.35 0.00 -7.23 -0.98 -4.81 120.40 111.65 2d56 s VAL 47 Ca 0.31 1.79 -0.03 0.00 -1.81 0.00 0.00 61.98 62.24 2d56 s VAL 47 Cb -0.08 -4.39 0.07 0.00 0.56 0.00 0.00 36.38 32.54 2d56 s VAL 47 CO -0.07 -0.42 0.10 0.00 -0.31 0.00 0.00 175.10 174.40 2d56 s ASP 49 N 1.50 -0.68 -0.17 0.00 2.15 -1.03 -4.53 116.67 113.91 2d56 s ASP 49 Ca 0.01 1.14 0.06 0.00 0.43 0.00 0.00 52.55 54.19 2d56 s ASP 49 Cb -0.21 1.79 0.20 0.00 -0.30 0.00 0.00 42.92 44.40 2d56 s ASP 49 CO -0.02 -0.24 1.25 -1.14 -0.17 0.00 0.00 175.17 174.86 2d56 n ARG 50 N 5.42 0.67 -1.80 4.34 0.63 -0.52 -2.62 116.66 122.78 2d56 n ARG 50 Ca -0.09 -1.08 -0.34 0.00 -0.92 0.00 0.00 57.85 55.43 2d56 n ARG 50 Cb 0.49 0.46 -0.03 0.00 0.45 0.00 0.00 32.46 33.84 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 1.03 0.78 3.99 0.00 0.00 -1.26 -5.05 105.19 104.68 2d56 n GLY 52 Ca 0.54 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2d56 n GLY 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19