#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 0.00 -3.59 0.00 3.14 -1.26 -5.10 118.33 111.52 2d56 n VAL 2 Ca 0.00 -0.99 -0.41 0.00 -2.96 0.00 0.00 64.34 59.98 2d56 n VAL 2 Cb 0.00 0.92 -0.10 0.00 -1.06 0.00 0.00 33.84 33.60 2d56 n VAL 2 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2d56 s ASP 3 N -0.97 5.71 -0.01 6.55 2.15 -1.26 -4.88 116.67 123.97 2d56 s ASP 3 Ca 0.11 -1.26 -0.01 0.00 0.43 0.00 0.00 52.55 51.82 2d56 s ASP 3 Cb 0.36 -2.01 -0.01 0.00 -0.30 0.00 0.00 42.92 40.96 2d56 s ASP 3 CO -0.10 -0.47 -0.03 2.22 -0.17 0.00 0.00 175.17 176.61 2d56 n PHE 4 N 4.97 0.00 -4.09 -5.34 -1.74 -1.26 -5.12 117.46 104.88 2d56 n PHE 4 Ca -0.11 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.64 2d56 n PHE 4 Cb 0.44 -0.08 -0.05 0.00 1.52 0.00 0.00 39.48 41.31 2d56 n PHE 4 CO 0.00 0.00 0.00 -1.12 -0.56 0.00 0.00 176.76 175.08 2d56 s SER 5 N -5.36 0.73 -0.03 5.98 0.01 -1.26 -5.10 113.70 108.68 2d56 s SER 5 Ca -0.03 -1.40 -0.05 0.00 1.31 0.00 0.00 55.95 55.77 2d56 s SER 5 Cb 0.01 0.63 -0.03 0.00 0.21 0.00 0.00 66.02 66.85 2d56 s SER 5 CO 0.04 -1.24 -0.11 -1.54 0.41 0.00 0.00 173.24 170.80 2d56 n SER 6 N -1.19 1.05 -2.22 2.44 3.41 -1.26 -4.72 113.62 111.12 2d56 n SER 6 Ca 0.01 0.16 -0.30 0.00 -0.26 0.00 0.00 58.87 58.48 2d56 n SER 6 Cb 0.62 -0.38 0.08 0.00 -0.26 0.00 0.00 64.21 64.28 2d56 n SER 6 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d56 n ALA 8 N -0.70 5.63 -0.04 0.00 0.00 -1.26 -4.17 120.51 119.97 2d56 n ALA 8 Ca 0.56 -2.79 -0.05 0.00 0.00 0.00 0.00 53.44 51.16 2d56 n ALA 8 Cb 0.75 -1.53 -0.05 0.00 0.00 0.00 0.00 19.45 18.61 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 -0.80 1.77 -3.09 0.00 3.00 -1.26 -5.02 116.66 111.26 2d56 n ARG 9 Ca 0.54 0.02 -0.23 0.00 -0.00 0.00 0.00 57.85 58.18 2d56 n ARG 9 Cb 1.11 -1.20 0.04 0.00 0.00 0.00 0.00 32.46 32.41 2d56 n ARG 9 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.63 176.30 2d56 n MET 10 N -2.48 -5.33 -0.84 -0.14 2.81 -1.26 -4.89 117.12 104.99 2d56 n MET 10 Ca -0.14 0.91 -0.06 0.00 -1.81 0.00 0.00 57.70 56.59 2d56 n MET 10 Cb 0.73 -5.79 0.20 0.00 -0.71 0.00 0.00 33.22 27.64 2d56 n MET 10 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 2d56 n ASP 11 N -2.58 2.71 -2.72 7.83 5.75 -1.26 -4.63 116.55 121.65 2d56 n ASP 11 Ca -0.10 -3.72 -0.08 0.00 -0.01 0.00 0.00 54.79 50.88 2d56 n ASP 11 Cb 0.61 -0.66 0.10 0.00 -1.03 0.00 0.00 41.12 40.15 2d56 n ASP 11 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 2d56 n VAL 12 N -1.08 0.01 -1.04 2.12 0.24 -1.26 -5.03 118.33 112.28 2d56 n VAL 12 Ca 0.36 -1.55 -0.25 0.00 -2.04 0.00 0.00 64.34 60.86 2d56 n VAL 12 Cb 1.10 1.23 -0.07 0.00 -1.47 0.00 0.00 33.84 34.63 2d56 n VAL 12 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2d56 n PRO 13 N -0.11 2.66 0.00 7.34 -0.04 -1.26 -3.79 135.00 139.79 2d56 n PRO 13 Ca 0.02 -1.55 0.00 0.00 -0.04 0.00 0.00 63.50 61.93 2d56 n PRO 13 Cb 0.77 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2d56 n PRO 13 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2d56 n GLY 14 N 3.21 0.24 0.00 0.55 0.00 -1.26 -4.98 105.19 102.95 2d56 n GLY 14 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.59 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 -1.08 0.00 -0.41 0.99 -0.00 -1.25 -4.96 117.00 110.28 2d56 n LEU 15 Ca 0.00 0.00 0.40 0.00 -0.00 0.00 0.00 56.01 56.41 2d56 n LEU 15 Cb 0.00 0.00 0.76 0.00 -0.00 0.00 0.00 43.42 44.18 2d56 n LEU 15 CO 0.00 0.00 1.37 -1.28 -0.00 0.00 0.00 177.39 177.48 2d56 h SER 16 N 0.00 0.00 -0.13 1.45 0.87 -1.94 0.42 113.55 114.22 2d56 h SER 16 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2d56 h SER 16 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2d56 h SER 16 CO 0.00 0.00 0.03 0.50 -0.53 0.00 0.00 176.83 176.83 2d56 h LYS 17 N 0.00 0.20 -0.03 2.24 3.64 -1.93 -1.21 116.57 119.48 2d56 h LYS 17 Ca 0.66 -0.05 -0.17 0.00 -1.27 0.00 0.00 60.65 59.82 2d56 h LYS 17 Cb 2.71 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 34.49 2d56 h LYS 17 CO -0.01 0.36 -0.74 0.28 -2.27 0.00 0.00 179.45 177.07 2d56 h VAL 18 N 0.01 1.44 0.00 2.00 2.07 -0.68 -1.82 116.25 119.28 2d56 h VAL 18 Ca 0.04 -2.31 -0.02 0.00 0.82 0.00 0.00 66.70 65.23 2d56 h VAL 18 Cb 0.25 2.24 -0.00 0.00 -1.52 0.00 0.00 31.29 32.26 2d56 h VAL 18 CO 0.00 0.68 -0.10 0.00 0.02 0.00 0.00 177.57 178.17 2d56 h ALA 19 N 1.09 1.08 0.00 1.67 0.00 -0.83 -2.13 119.26 120.14 2d56 h ALA 19 Ca -0.02 -0.09 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 2d56 h ALA 19 Cb 1.31 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 2d56 h ALA 19 CO 0.11 0.12 -1.62 0.00 0.00 0.00 0.00 179.25 177.87 2d56 n GLN 20 N -3.32 0.64 -0.04 0.00 10.64 -0.47 -2.35 117.38 122.47 2d56 n GLN 20 Ca -0.01 0.10 -0.06 0.00 -1.83 0.00 0.00 57.00 55.21 2d56 n GLN 20 Cb 0.30 -1.71 0.13 0.00 -0.86 0.00 0.00 30.24 28.10 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 3.84 0.70 0.86 2.61 0.00 -0.70 0.15 103.07 110.54 2d56 h GLY 21 Ca -0.18 -0.59 -0.35 0.00 0.00 0.00 0.00 47.33 46.21 2d56 h GLY 21 CO 0.03 0.54 -1.74 0.17 0.00 0.00 0.00 176.54 175.55 2d56 h LEU 22 N 0.57 0.59 -1.22 3.11 8.10 -1.57 -2.76 115.31 122.13 2d56 h LEU 22 Ca 0.08 -0.93 -0.04 0.00 0.11 0.00 0.00 57.88 57.10 2d56 h LEU 22 Cb 0.71 -0.19 -0.02 0.00 -0.44 0.00 0.00 40.66 40.72 2d56 h LEU 22 CO 0.05 1.78 0.12 0.00 -4.11 0.00 0.00 178.44 176.29 2d56 h ILE 24 N 0.65 1.45 -0.56 0.00 -0.00 -0.82 -2.61 117.51 115.61 2d56 h ILE 24 Ca 0.15 -1.98 -0.01 0.00 -0.00 0.00 0.00 64.86 63.02 2d56 h ILE 24 Cb 0.22 2.56 -0.03 0.00 -0.00 0.00 0.00 36.82 39.57 2d56 h ILE 24 CO -0.01 0.57 0.32 0.77 -0.00 0.00 0.00 178.15 179.81 2d56 h SER 25 N -0.17 0.69 -0.51 2.19 4.64 -1.27 0.18 113.55 119.29 2d56 h SER 25 Ca -0.05 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.18 2d56 h SER 25 Cb 1.19 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 2d56 h SER 25 CO 0.10 0.56 0.30 -1.28 -0.87 0.00 0.00 176.83 175.64 2d56 h SER 26 N 0.76 0.63 0.64 4.97 0.87 -0.94 -1.33 113.55 119.15 2d56 h SER 26 Ca 0.20 -0.07 -0.11 0.00 -1.23 0.00 0.00 61.79 60.58 2d56 h SER 26 Cb 0.01 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 61.80 2d56 h SER 26 CO -0.03 0.52 -0.51 0.00 -0.53 0.00 0.00 176.83 176.27 2d56 h LYS 28 N 0.00 0.00 -0.53 0.00 1.63 0.20 -3.16 116.57 114.71 2d56 h LYS 28 Ca -0.01 0.00 0.15 0.00 -0.85 0.00 0.00 60.65 59.95 2d56 h LYS 28 Cb 0.97 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.58 2d56 h LYS 28 CO 0.07 0.02 0.57 0.74 -3.45 0.00 0.00 179.45 177.40 2d56 h PHE 29 N 0.00 0.00 0.00 1.91 0.04 -1.04 0.71 116.94 118.56 2d56 h PHE 29 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2d56 h PHE 29 Cb 0.81 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.96 2d56 h PHE 29 CO 0.00 0.00 -0.85 0.00 -0.60 0.00 0.00 178.31 176.86 2d56 n GLN 30 N -3.64 0.04 -2.60 1.51 10.64 -1.22 -4.97 117.38 117.13 2d56 n GLN 30 Ca 0.10 -0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 55.12 2d56 n GLN 30 Cb 0.78 -1.51 0.01 0.00 -0.86 0.00 0.00 30.24 28.66 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 -1.55 -4.61 -1.05 2.61 4.13 0.25 -4.84 115.26 110.20 2d56 n ASN 31 Ca 0.04 -0.13 -0.05 0.00 1.68 0.00 0.00 54.58 56.12 2d56 n ASN 31 Cb 0.34 -3.58 -0.04 0.00 -1.54 0.00 0.00 39.78 34.97 2d56 n ASN 31 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2d56 s GLY 33 N -0.82 -0.85 -0.09 0.00 0.00 -1.19 -1.48 107.32 102.89 2d56 s GLY 33 Ca 0.01 2.12 -0.09 0.00 0.00 0.00 0.00 44.72 46.76 2d56 s GLY 33 CO -0.01 3.27 0.20 -1.08 0.00 0.00 0.00 173.10 175.48 2d56 s THR 34 N 2.87 5.39 -0.37 0.90 -1.32 -1.07 -1.76 115.64 120.28 2d56 s THR 34 Ca 0.09 0.35 -0.29 0.00 -1.21 0.00 0.00 61.69 60.62 2d56 s THR 34 Cb -0.13 -3.48 0.02 0.00 -1.51 0.00 0.00 72.50 67.40 2d56 s THR 34 CO -0.20 0.60 1.11 -0.83 -2.21 0.00 0.00 174.62 173.09 2d56 s GLY 35 N -1.07 1.46 -0.09 6.08 0.00 -1.23 -2.55 107.32 109.92 2d56 s GLY 35 Ca 0.17 -0.19 0.04 0.00 0.00 0.00 0.00 44.72 44.74 2d56 s GLY 35 CO 0.07 2.34 -0.22 0.30 0.00 0.00 0.00 173.10 175.58 2d56 s HIS 36 N 3.96 2.38 -0.84 1.90 3.76 -0.96 -4.61 115.29 120.88 2d56 s HIS 36 Ca 0.47 -0.95 -0.26 0.00 -0.15 0.00 0.00 55.06 54.18 2d56 s HIS 36 Cb -0.11 -1.60 0.04 0.00 1.11 0.00 0.00 32.58 32.02 2d56 s HIS 36 CO 0.21 -0.38 1.34 0.00 -0.85 0.00 0.00 174.74 175.06 2d56 s GLU 38 N 5.46 4.20 -0.23 0.00 0.41 -0.85 -4.54 118.70 123.15 2d56 s GLU 38 Ca 0.39 0.31 -0.07 0.00 -0.41 0.00 0.00 54.97 55.19 2d56 s GLU 38 Cb -0.05 -3.38 0.11 0.00 -1.78 0.00 0.00 34.13 29.03 2d56 s GLU 38 CO 0.06 0.32 0.48 -1.59 -0.49 0.00 0.00 175.26 174.04 2d56 s LYS 39 N 0.15 0.40 0.00 1.61 -2.85 -1.26 -0.54 119.74 117.24 2d56 s LYS 39 Ca 0.22 1.07 0.00 0.00 -1.00 0.00 0.00 55.97 56.26 2d56 s LYS 39 Cb -0.15 0.37 0.00 0.00 -2.06 0.00 0.00 37.83 35.99 2d56 s LYS 39 CO 0.09 -0.31 0.00 0.54 0.10 0.00 0.00 175.35 175.77 2d56 n ARG 40 N 5.40 0.00 -1.11 1.78 1.74 -1.26 -4.75 116.66 118.46 2d56 n ARG 40 Ca -0.08 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.79 2d56 n ARG 40 Cb 0.49 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.94 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 2.88 4.25 1.97 -0.13 0.00 -1.26 -4.68 105.19 108.22 2d56 n GLY 41 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.60 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 0.49 0.40 2.88 -0.02 0.00 -1.26 -5.03 105.19 102.65 2d56 n GLY 42 Ca 0.38 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 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 -3.73 1.81 0.62 1.61 3.52 -1.26 -5.11 118.95 116.41 2d56 s ARG 43 Ca 0.00 -2.50 -0.17 0.00 -0.13 0.00 0.00 55.73 52.94 2d56 s ARG 43 Cb 0.00 -3.05 -0.02 0.00 -1.56 0.00 0.00 34.95 30.32 2d56 s ARG 43 CO 0.00 -1.13 1.12 -1.25 -0.81 0.00 0.00 175.30 173.23 2d56 s PRO 44 N -0.18 2.98 0.30 5.12 0.04 -1.25 -4.10 135.00 137.91 2d56 s PRO 44 Ca 0.18 1.49 -0.20 0.00 0.04 0.00 0.00 61.00 62.51 2d56 s PRO 44 Cb -0.24 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.36 2d56 s PRO 44 CO -0.01 -1.12 0.73 -0.08 0.04 0.00 0.00 177.00 176.56 2d56 s THR 45 N -2.11 0.00 -0.24 1.26 -1.32 0.29 -4.94 115.64 108.58 2d56 s THR 45 Ca 0.69 -1.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.18 2d56 s THR 45 Cb -0.22 -2.17 0.06 0.00 -1.51 0.00 0.00 72.50 68.66 2d56 s THR 45 CO 0.36 0.00 -0.03 0.00 -2.21 0.00 0.00 174.62 172.74 2d56 s VAL 47 N 1.41 5.34 -0.37 0.00 -7.23 -1.04 -4.88 120.40 113.63 2d56 s VAL 47 Ca -0.04 -0.21 0.00 0.00 -1.81 0.00 0.00 61.98 59.93 2d56 s VAL 47 Cb -0.19 -3.61 0.10 0.00 0.56 0.00 0.00 36.38 33.24 2d56 s VAL 47 CO -0.08 0.16 0.12 0.00 -0.31 0.00 0.00 175.10 174.99 2d56 s ASP 49 N 1.37 1.04 -0.34 0.00 2.15 -1.06 -4.56 116.67 115.28 2d56 s ASP 49 Ca 0.08 -0.26 0.12 0.00 0.43 0.00 0.00 52.55 52.92 2d56 s ASP 49 Cb -0.21 0.71 0.39 0.00 -0.30 0.00 0.00 42.92 43.51 2d56 s ASP 49 CO -0.06 -0.34 1.48 -1.14 -0.17 0.00 0.00 175.17 174.94 2d56 n ARG 50 N 5.33 1.29 -3.00 4.34 3.00 -0.55 -2.59 116.66 124.48 2d56 n ARG 50 Ca -0.03 -1.31 -0.44 0.00 -0.00 0.00 0.00 57.85 56.07 2d56 n ARG 50 Cb 0.49 0.31 0.00 0.00 0.00 0.00 0.00 32.46 33.26 2d56 n ARG 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2d56 n GLY 52 N 2.46 1.84 0.00 0.00 0.00 -1.26 -5.07 105.19 103.15 2d56 n GLY 52 Ca 0.29 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2d56 n GLY 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19