#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 1.32 -0.22 0.00 1.01 -1.26 -5.04 120.40 116.20 2d56 s VAL 2 Ca 0.00 -0.62 -0.17 0.00 0.00 0.00 0.00 61.98 61.19 2d56 s VAL 2 Cb 0.00 -1.16 -0.12 0.00 0.00 0.00 0.00 36.38 35.10 2d56 s VAL 2 CO 0.00 0.39 -0.14 -0.67 0.00 0.00 0.00 175.10 174.68 2d56 n ASP 3 N 3.45 1.90 -2.65 3.32 -0.08 -1.26 -4.99 116.55 116.24 2d56 n ASP 3 Ca -0.20 0.40 -0.21 0.00 -1.51 0.00 0.00 54.79 53.27 2d56 n ASP 3 Cb 0.53 -0.87 0.01 0.00 2.34 0.00 0.00 41.12 43.13 2d56 n ASP 3 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 2d56 n PHE 4 N -4.39 -1.45 -3.63 -0.67 -0.00 -1.26 -4.95 117.46 101.12 2d56 n PHE 4 Ca -0.35 0.25 -0.39 0.00 -0.00 0.00 0.00 57.45 56.95 2d56 n PHE 4 Cb 0.69 -4.19 -0.09 0.00 -0.00 0.00 0.00 39.48 35.88 2d56 n PHE 4 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2d56 s SER 5 N -2.38 5.57 -0.11 -2.13 0.15 -1.26 -4.88 113.70 108.66 2d56 s SER 5 Ca 0.15 -2.10 0.17 0.00 0.70 0.00 0.00 55.95 54.86 2d56 s SER 5 Cb -0.06 -1.95 -0.24 0.00 -1.71 0.00 0.00 66.02 62.06 2d56 s SER 5 CO 0.18 -0.61 0.38 -0.24 1.20 0.00 0.00 173.24 174.15 2d56 n SER 6 N 4.61 0.37 -1.48 5.45 2.88 -1.26 -4.94 113.62 119.25 2d56 n SER 6 Ca -0.03 0.17 -0.17 0.00 -1.33 0.00 0.00 58.87 57.51 2d56 n SER 6 Cb 0.41 0.64 -0.06 0.00 -0.75 0.00 0.00 64.21 64.45 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 0.61 -0.44 0.00 0.00 0.00 -1.26 -3.95 120.51 115.48 2d56 n ALA 8 Ca -0.18 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2d56 n ALA 8 Cb 0.59 -1.62 0.00 0.00 0.00 0.00 0.00 19.45 18.42 2d56 n ALA 8 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2d56 n ARG 9 N -2.35 0.00 -3.02 0.00 3.00 -0.94 -5.03 116.66 108.31 2d56 n ARG 9 Ca -0.16 0.00 -0.12 0.00 -0.00 0.00 0.00 57.85 57.56 2d56 n ARG 9 Cb 0.55 0.00 0.06 0.00 0.00 0.00 0.00 32.46 33.07 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 0.00 -4.66 -1.36 -0.14 0.00 0.96 -4.96 117.12 106.96 2d56 n MET 10 Ca 0.00 0.57 -0.06 0.00 -0.00 0.00 0.00 57.70 58.21 2d56 n MET 10 Cb 0.00 -4.77 0.11 0.00 0.00 0.00 0.00 33.22 28.56 2d56 n MET 10 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 175.97 175.57 2d56 n ASP 11 N -2.25 2.84 -4.74 6.12 5.68 -1.26 -5.08 116.55 117.87 2d56 n ASP 11 Ca -0.15 -3.56 -0.33 0.00 -0.50 0.00 0.00 54.79 50.24 2d56 n ASP 11 Cb 0.60 -0.44 0.09 0.00 -1.14 0.00 0.00 41.12 40.23 2d56 n ASP 11 CO 0.00 0.00 0.00 0.68 -1.33 0.00 0.00 177.20 176.55 2d56 s VAL 12 N -3.51 2.64 0.21 2.12 -7.23 -1.26 -4.95 120.40 108.42 2d56 s VAL 12 Ca 0.42 0.29 -0.05 0.00 -1.81 0.00 0.00 61.98 60.83 2d56 s VAL 12 Cb 0.38 -2.79 0.03 0.00 0.56 0.00 0.00 36.38 34.56 2d56 s VAL 12 CO -0.04 -0.19 1.61 1.55 -0.31 0.00 0.00 175.10 177.73 2d56 h PRO 13 N -0.40 0.77 0.00 4.82 0.13 -2.02 -3.47 132.00 131.82 2d56 h PRO 13 Ca -0.47 -0.32 0.00 0.00 -0.87 0.00 0.00 66.00 64.34 2d56 h PRO 13 Cb 1.27 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2d56 h PRO 13 CO 0.50 0.94 0.00 0.41 -0.23 0.00 0.00 178.00 179.62 2d56 n GLY 14 N -0.19 0.56 1.51 1.56 0.00 -1.26 -4.99 105.19 102.39 2d56 n GLY 14 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 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 5.05 0.19 0.99 -0.00 -1.26 -4.52 117.00 117.45 2d56 n LEU 15 Ca 0.00 -3.48 0.06 0.00 -0.00 0.00 0.00 56.01 52.59 2d56 n LEU 15 Cb 0.00 -0.69 0.31 0.00 -0.00 0.00 0.00 43.42 43.04 2d56 n LEU 15 CO 0.00 1.01 0.67 0.77 -0.00 0.00 0.00 177.39 179.84 2d56 h SER 16 N 1.52 0.00 0.19 1.45 4.64 -1.94 -1.74 113.55 117.67 2d56 h SER 16 Ca 0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.59 2d56 h SER 16 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 2d56 h SER 16 CO 0.58 0.36 -0.09 0.11 -0.87 0.00 0.00 176.83 176.92 2d56 h LYS 17 N 0.00 -0.24 -0.26 4.77 1.57 -1.98 0.67 116.57 121.10 2d56 h LYS 17 Ca -0.00 0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.63 2d56 h LYS 17 Cb 0.95 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2d56 h LYS 17 CO 0.05 0.07 -0.46 0.28 -0.57 0.00 0.00 179.45 178.82 2d56 h VAL 18 N -0.56 1.30 0.00 0.50 2.07 -1.90 0.14 116.25 117.79 2d56 h VAL 18 Ca -0.03 -1.66 -0.03 0.00 0.82 0.00 0.00 66.70 65.81 2d56 h VAL 18 Cb 0.42 1.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2d56 h VAL 18 CO 0.04 0.53 -0.13 0.00 0.02 0.00 0.00 177.57 178.03 2d56 h ALA 19 N 0.66 1.20 0.00 1.67 0.00 -1.35 -1.39 119.26 120.04 2d56 h ALA 19 Ca 0.02 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2d56 h ALA 19 Cb 1.06 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2d56 h ALA 19 CO 0.10 0.17 -1.47 0.94 0.00 0.00 0.00 179.25 178.99 2d56 n GLN 20 N -3.54 0.63 0.07 0.00 7.27 0.23 -2.45 117.38 119.58 2d56 n GLN 20 Ca -0.01 0.09 -0.07 0.00 0.07 0.00 0.00 57.00 57.08 2d56 n GLN 20 Cb 0.28 -1.74 0.08 0.00 2.41 0.00 0.00 30.24 31.27 2d56 n GLN 20 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2d56 h GLY 21 N 3.88 0.31 0.78 1.69 0.00 0.11 -1.55 103.07 108.29 2d56 h GLY 21 Ca -0.11 -0.42 -0.32 0.00 0.00 0.00 0.00 47.33 46.48 2d56 h GLY 21 CO 0.02 0.37 -1.63 0.17 0.00 0.00 0.00 176.54 175.47 2d56 h LEU 22 N 0.20 0.53 -1.25 3.11 8.10 -1.42 -2.72 115.31 121.86 2d56 h LEU 22 Ca -0.02 -0.91 -0.03 0.00 0.11 0.00 0.00 57.88 57.04 2d56 h LEU 22 Cb 1.20 -0.17 -0.02 0.00 -0.44 0.00 0.00 40.66 41.23 2d56 h LEU 22 CO 0.11 1.73 0.21 0.00 -4.11 0.00 0.00 178.44 176.38 2d56 h ILE 24 N 0.73 1.53 0.24 0.00 -0.00 -1.40 -2.59 117.51 116.02 2d56 h ILE 24 Ca 0.18 -1.96 -0.01 0.00 -0.00 0.00 0.00 64.86 63.07 2d56 h ILE 24 Cb 0.13 2.74 0.00 0.00 -0.00 0.00 0.00 36.82 39.69 2d56 h ILE 24 CO -0.02 0.54 -0.12 0.77 -0.00 0.00 0.00 178.15 179.32 2d56 h SER 25 N -0.45 -0.28 -0.45 2.19 4.64 -1.31 0.17 113.55 118.06 2d56 h SER 25 Ca -0.04 -0.09 0.06 0.00 -0.47 0.00 0.00 61.79 61.26 2d56 h SER 25 Cb 1.04 0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 63.15 2d56 h SER 25 CO 0.06 -0.08 0.16 0.77 -0.87 0.00 0.00 176.83 176.86 2d56 h SER 26 N -0.46 0.16 0.73 4.97 4.64 -0.85 -0.33 113.55 122.41 2d56 h SER 26 Ca -0.03 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2d56 h SER 26 Cb 0.35 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2d56 h SER 26 CO 0.06 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.14 2d56 h LYS 28 N 0.00 0.00 -0.61 0.00 3.64 0.11 -3.22 116.57 116.49 2d56 h LYS 28 Ca 0.00 0.00 0.18 0.00 -1.27 0.00 0.00 60.65 59.56 2d56 h LYS 28 Cb 0.37 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2d56 h LYS 28 CO 0.00 0.33 0.59 0.35 -2.27 0.00 0.00 179.45 178.45 2d56 h PHE 29 N 0.00 0.00 0.00 1.91 3.57 -1.28 0.95 116.94 122.08 2d56 h PHE 29 Ca -0.12 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.38 2d56 h PHE 29 Cb 1.52 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.26 2d56 h PHE 29 CO 0.00 0.00 -0.30 0.00 -2.23 0.00 0.00 178.31 175.78 2d56 n GLN 30 N -3.78 0.25 -2.58 1.11 10.64 -1.25 -4.94 117.38 116.83 2d56 n GLN 30 Ca 0.12 0.14 -0.18 0.00 -1.83 0.00 0.00 57.00 55.25 2d56 n GLN 30 Cb 0.82 -1.72 0.01 0.00 -0.86 0.00 0.00 30.24 28.49 2d56 n GLN 30 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2d56 n ASN 31 N -2.13 -5.22 -0.92 2.61 3.02 0.33 -4.82 115.26 108.13 2d56 n ASN 31 Ca 0.05 -0.12 -0.06 0.00 -0.03 0.00 0.00 54.58 54.42 2d56 n ASN 31 Cb 0.43 -4.20 -0.06 0.00 -0.61 0.00 0.00 39.78 35.34 2d56 n ASN 31 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2d56 s GLY 33 N -0.84 -0.89 -0.15 0.00 0.00 -1.21 -1.39 107.32 102.82 2d56 s GLY 33 Ca 0.00 2.03 -0.08 0.00 0.00 0.00 0.00 44.72 46.68 2d56 s GLY 33 CO 0.00 3.31 0.11 -1.08 0.00 0.00 0.00 173.10 175.44 2d56 s THR 34 N 2.87 5.25 0.05 0.90 -1.32 -1.07 -2.98 115.64 119.34 2d56 s THR 34 Ca 0.13 0.12 -0.30 0.00 -1.21 0.00 0.00 61.69 60.43 2d56 s THR 34 Cb -0.14 -3.33 -0.04 0.00 -1.51 0.00 0.00 72.50 67.48 2d56 s THR 34 CO -0.20 0.53 0.98 -0.83 -2.21 0.00 0.00 174.62 172.89 2d56 s GLY 35 N -0.32 2.94 -0.02 6.08 0.00 -1.25 -2.46 107.32 112.29 2d56 s GLY 35 Ca 0.11 0.57 -0.02 0.00 0.00 0.00 0.00 44.72 45.37 2d56 s GLY 35 CO 0.01 1.59 0.06 -1.58 0.00 0.00 0.00 173.10 173.18 2d56 s HIS 36 N 0.54 -0.06 -1.03 1.90 2.46 -0.64 -4.71 115.29 113.75 2d56 s HIS 36 Ca 0.50 0.15 -0.23 0.00 0.47 0.00 0.00 55.06 55.95 2d56 s HIS 36 Cb -0.22 0.02 0.05 0.00 -0.13 0.00 0.00 32.58 32.30 2d56 s HIS 36 CO 0.29 -0.03 1.46 0.00 -2.47 0.00 0.00 174.74 173.99 2d56 s GLU 38 N 4.97 3.05 0.25 0.00 -6.30 0.03 -4.77 118.70 115.93 2d56 s GLU 38 Ca 0.46 -1.05 0.10 0.00 -2.50 0.00 0.00 54.97 51.99 2d56 s GLU 38 Cb 0.00 -4.07 -0.05 0.00 0.00 0.00 0.00 34.13 30.01 2d56 s GLU 38 CO -0.09 -1.01 -0.18 -1.59 0.02 0.00 0.00 175.26 172.41 2d56 s LYS 39 N 2.04 1.54 0.00 4.30 -2.85 -1.26 -0.42 119.74 123.09 2d56 s LYS 39 Ca 0.09 -1.70 0.00 0.00 -1.00 0.00 0.00 55.97 53.36 2d56 s LYS 39 Cb -0.21 -1.51 0.00 0.00 -2.06 0.00 0.00 37.83 34.05 2d56 s LYS 39 CO 0.10 0.27 0.00 0.54 0.10 0.00 0.00 175.35 176.36 2d56 n ARG 40 N -0.53 0.00 -0.91 1.78 5.12 -1.26 -4.93 116.66 115.94 2d56 n ARG 40 Ca -0.06 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.68 2d56 n ARG 40 Cb 0.60 0.00 0.04 0.00 -1.16 0.00 0.00 32.46 31.95 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 0.68 4.17 1.55 -0.13 0.00 -1.26 -4.70 105.19 105.50 2d56 n GLY 41 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 0.22 0.73 2.83 -0.02 0.00 -1.26 -5.05 105.19 102.63 2d56 n GLY 42 Ca 0.32 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.47 1.03 -0.84 1.61 6.06 -1.26 -5.07 118.95 117.01 2d56 s ARG 43 Ca 0.00 -1.45 -0.25 0.00 -2.50 0.00 0.00 55.73 51.53 2d56 s ARG 43 Cb 0.00 -2.44 -0.05 0.00 0.06 0.00 0.00 34.95 32.53 2d56 s ARG 43 CO 0.00 -0.99 1.96 -1.25 -2.50 0.00 0.00 175.30 172.52 2d56 s PRO 44 N 1.24 2.52 0.23 5.12 0.04 -1.26 -4.00 135.00 138.89 2d56 s PRO 44 Ca 0.11 -0.07 -0.18 0.00 0.04 0.00 0.00 61.00 60.89 2d56 s PRO 44 Cb -0.19 -4.92 -0.08 0.00 0.04 0.00 0.00 34.50 29.35 2d56 s PRO 44 CO -0.17 -3.30 0.70 0.99 0.04 0.00 0.00 177.00 175.25 2d56 s THR 45 N 10.12 4.63 -0.76 1.26 2.01 0.44 -4.89 115.64 128.46 2d56 s THR 45 Ca 0.71 1.16 -0.11 0.00 0.31 0.00 0.00 61.69 63.76 2d56 s THR 45 Cb -0.08 -3.80 0.20 0.00 0.01 0.00 0.00 72.50 68.82 2d56 s THR 45 CO 0.04 0.15 0.67 0.00 -0.69 0.00 0.00 174.62 174.79 2d56 s VAL 47 N 0.22 4.07 -0.22 0.00 -7.23 -0.95 -4.86 120.40 111.44 2d56 s VAL 47 Ca 0.16 2.08 -0.01 0.00 -1.81 0.00 0.00 61.98 62.40 2d56 s VAL 47 Cb -0.14 -4.31 0.06 0.00 0.56 0.00 0.00 36.38 32.54 2d56 s VAL 47 CO -0.07 0.48 -0.02 0.00 -0.31 0.00 0.00 175.10 175.19 2d56 s ASP 49 N 1.59 -1.20 -0.11 0.00 -4.77 -1.03 -4.61 116.67 106.53 2d56 s ASP 49 Ca -0.04 1.40 0.04 0.00 -3.30 0.00 0.00 52.55 50.65 2d56 s ASP 49 Cb -0.18 2.27 0.14 0.00 -1.09 0.00 0.00 42.92 44.05 2d56 s ASP 49 CO -0.07 -0.23 1.17 -1.14 0.70 0.00 0.00 175.17 175.60 2d56 n ARG 50 N 5.44 0.46 -3.10 2.11 0.63 -0.49 -2.61 116.66 119.11 2d56 n ARG 50 Ca -0.09 -1.06 -0.40 0.00 -0.92 0.00 0.00 57.85 55.38 2d56 n ARG 50 Cb 0.50 0.47 -0.06 0.00 0.45 0.00 0.00 32.46 33.82 2d56 n ARG 50 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2d56 s GLY 52 N 1.20 0.51 0.00 0.00 0.00 -1.26 -5.06 107.32 102.71 2d56 s GLY 52 Ca 0.29 -1.33 0.15 0.00 0.00 0.00 0.00 44.72 43.83 2d56 s GLY 52 CO 0.10 2.23 0.97 -2.13 0.00 0.00 0.00 173.10 174.28