#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 0.04 0.42 0.00 1.01 -1.26 -5.14 120.40 115.48 2d56 s VAL 2 Ca 0.00 -0.36 -0.26 0.00 0.00 0.00 0.00 61.98 61.35 2d56 s VAL 2 Cb 0.00 -0.13 -0.09 0.00 0.00 0.00 0.00 36.38 36.16 2d56 s VAL 2 CO 0.00 -0.20 1.43 -1.81 0.00 0.00 0.00 175.10 174.52 2d56 s ASP 3 N -0.59 6.10 0.64 3.32 1.01 -1.26 -4.73 116.67 121.17 2d56 s ASP 3 Ca -0.06 2.93 0.00 0.00 0.71 0.00 0.00 52.55 56.12 2d56 s ASP 3 Cb -0.04 -2.66 0.00 0.00 1.01 0.00 0.00 42.92 41.23 2d56 s ASP 3 CO -0.00 -1.02 0.00 0.49 0.21 0.00 0.00 175.17 174.84 2d56 n PHE 4 N 0.09 -3.98 -3.37 4.23 3.72 -1.26 -4.68 117.46 112.21 2d56 n PHE 4 Ca 0.03 2.19 -0.45 0.00 -0.05 0.00 0.00 57.45 59.17 2d56 n PHE 4 Cb 0.41 -3.62 -0.04 0.00 -0.94 0.00 0.00 39.48 35.29 2d56 n PHE 4 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2d56 s SER 5 N -7.35 6.38 -0.35 4.37 1.04 -1.26 -4.88 113.70 111.64 2d56 s SER 5 Ca 0.00 -2.34 0.06 0.00 0.48 0.00 0.00 55.95 54.16 2d56 s SER 5 Cb 0.00 -2.17 0.65 0.00 0.10 0.00 0.00 66.02 64.60 2d56 s SER 5 CO 0.00 -0.67 1.77 -1.20 0.98 0.00 0.00 173.24 174.13 2d56 n SER 6 N 4.44 4.16 -2.18 7.02 7.64 -1.26 -4.87 113.62 128.57 2d56 n SER 6 Ca 0.02 -3.28 -0.18 0.00 1.01 0.00 0.00 58.87 56.44 2d56 n SER 6 Cb 0.43 -0.77 -0.03 0.00 -1.01 0.00 0.00 64.21 62.84 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 -1.24 -0.66 0.15 0.00 0.00 -1.26 -4.29 120.51 113.20 2d56 n ALA 8 Ca -0.21 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2d56 n ALA 8 Cb 0.65 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.85 2d56 n ALA 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2d56 n ARG 9 N -2.48 0.00 -2.11 0.00 1.74 -0.63 -4.98 116.66 108.19 2d56 n ARG 9 Ca -0.11 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.81 2d56 n ARG 9 Cb 0.52 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.94 2d56 n ARG 9 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 2d56 n MET 10 N -3.11 -1.80 0.01 5.56 1.56 0.69 -4.81 117.12 115.22 2d56 n MET 10 Ca 0.00 0.81 0.11 0.00 -0.27 0.00 0.00 57.70 58.35 2d56 n MET 10 Cb 0.00 -5.33 -0.07 0.00 2.15 0.00 0.00 33.22 29.97 2d56 n MET 10 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 2d56 n ASP 11 N -1.53 0.50 -3.55 6.12 -0.08 -1.26 -4.57 116.55 112.18 2d56 n ASP 11 Ca -0.18 -0.26 -0.30 0.00 -1.51 0.00 0.00 54.79 52.55 2d56 n ASP 11 Cb 0.60 1.22 -0.06 0.00 2.34 0.00 0.00 41.12 45.21 2d56 n ASP 11 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 2d56 n VAL 12 N -2.02 2.91 -1.05 5.18 0.24 -1.26 -4.96 118.33 117.36 2d56 n VAL 12 Ca 0.00 -5.35 -0.28 0.00 -2.04 0.00 0.00 64.34 56.67 2d56 n VAL 12 Cb 0.47 -2.10 -0.05 0.00 -1.47 0.00 0.00 33.84 30.69 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 0.98 2.83 0.13 7.34 -0.04 -1.26 -3.34 135.00 141.63 2d56 n PRO 13 Ca 0.29 -1.71 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 2d56 n PRO 13 Cb 0.39 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.34 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 3.42 -0.45 0.07 0.55 0.00 -1.26 -4.95 105.19 102.58 2d56 n GLY 14 Ca 0.60 0.04 -0.02 0.00 0.00 0.00 0.00 46.02 46.64 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 -3.27 0.03 0.08 0.99 -0.00 -1.25 -4.30 117.00 109.28 2d56 n LEU 15 Ca 0.00 0.01 0.19 0.00 -0.00 0.00 0.00 56.01 56.22 2d56 n LEU 15 Cb 0.00 0.31 0.74 0.00 -0.00 0.00 0.00 43.42 44.48 2d56 n LEU 15 CO 0.00 0.32 1.17 -1.28 -0.00 0.00 0.00 177.39 177.60 2d56 h SER 16 N 0.00 0.00 -0.02 1.45 0.87 -1.92 0.56 113.55 114.50 2d56 h SER 16 Ca -0.35 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.09 2d56 h SER 16 Cb 1.80 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.76 2d56 h SER 16 CO 0.02 0.00 -0.45 0.50 -0.53 0.00 0.00 176.83 176.37 2d56 h LYS 17 N 0.00 0.34 -0.01 2.24 1.63 -1.83 -2.84 116.57 116.09 2d56 h LYS 17 Ca 0.19 -0.34 -0.16 0.00 -0.85 0.00 0.00 60.65 59.49 2d56 h LYS 17 Cb 0.90 0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.60 2d56 h LYS 17 CO -0.00 1.02 -0.75 0.28 -3.45 0.00 0.00 179.45 176.55 2d56 h VAL 18 N -0.21 1.50 0.00 2.00 2.07 -1.40 -1.58 116.25 118.62 2d56 h VAL 18 Ca -0.05 -2.45 -0.07 0.00 0.82 0.00 0.00 66.70 64.95 2d56 h VAL 18 Cb 1.16 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 33.25 2d56 h VAL 18 CO 0.09 0.71 -0.31 0.00 0.02 0.00 0.00 177.57 178.08 2d56 h ALA 19 N 1.18 1.22 0.00 1.67 0.00 -0.00 -1.60 119.26 121.73 2d56 h ALA 19 Ca -0.02 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 2d56 h ALA 19 Cb 1.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2d56 h ALA 19 CO 0.10 0.39 -1.30 0.94 0.00 0.00 0.00 179.25 179.38 2d56 n GLN 20 N -3.78 0.62 0.09 0.00 7.27 -1.07 -2.59 117.38 117.91 2d56 n GLN 20 Ca -0.01 0.17 -0.05 0.00 0.07 0.00 0.00 57.00 57.17 2d56 n GLN 20 Cb 0.40 -1.80 0.12 0.00 2.41 0.00 0.00 30.24 31.37 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 3.84 0.24 0.82 1.69 0.00 -0.78 -0.61 103.07 108.27 2d56 h GLY 21 Ca -0.10 -0.31 -0.30 0.00 0.00 0.00 0.00 47.33 46.62 2d56 h GLY 21 CO 0.03 0.27 -1.43 0.17 0.00 0.00 0.00 176.54 175.58 2d56 h LEU 22 N 0.16 0.56 -0.89 3.11 8.10 -1.42 -2.75 115.31 122.18 2d56 h LEU 22 Ca -0.01 -0.91 -0.07 0.00 0.11 0.00 0.00 57.88 57.00 2d56 h LEU 22 Cb 1.13 -0.18 -0.02 0.00 -0.44 0.00 0.00 40.66 41.15 2d56 h LEU 22 CO 0.10 1.65 0.07 0.00 -4.11 0.00 0.00 178.44 176.15 2d56 h ILE 24 N 0.84 1.40 0.06 0.00 6.09 -1.22 -2.54 117.51 122.13 2d56 h ILE 24 Ca 0.17 -1.40 -0.00 0.00 -1.37 0.00 0.00 64.86 62.26 2d56 h ILE 24 Cb 0.40 2.15 0.00 0.00 0.47 0.00 0.00 36.82 39.84 2d56 h ILE 24 CO 0.01 0.39 -0.03 -1.28 -3.07 0.00 0.00 178.15 174.17 2d56 h SER 25 N -0.26 -0.06 -0.86 2.19 0.87 -1.42 0.16 113.55 114.17 2d56 h SER 25 Ca 0.01 -0.32 0.14 0.00 -1.23 0.00 0.00 61.79 60.38 2d56 h SER 25 Cb 0.69 0.02 -0.09 0.00 -0.44 0.00 0.00 62.40 62.58 2d56 h SER 25 CO 0.03 0.30 0.46 0.28 -0.53 0.00 0.00 176.83 177.36 2d56 h SER 26 N -0.43 0.58 1.01 6.23 0.02 -0.78 0.15 113.55 120.32 2d56 h SER 26 Ca -0.01 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 2d56 h SER 26 Cb 0.38 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.91 2d56 h SER 26 CO 0.01 0.26 -0.32 0.00 -1.14 0.00 0.00 176.83 175.64 2d56 h LYS 28 N 0.00 0.00 -1.01 0.00 1.57 0.22 -3.27 116.57 114.08 2d56 h LYS 28 Ca 0.00 0.00 0.24 0.00 -1.87 0.00 0.00 60.65 59.02 2d56 h LYS 28 Cb 0.66 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.85 2d56 h LYS 28 CO 0.00 0.47 0.61 0.74 -0.57 0.00 0.00 179.45 180.70 2d56 h PHE 29 N 0.00 0.99 0.00 -1.35 -1.00 -1.43 0.80 116.94 114.94 2d56 h PHE 29 Ca -0.00 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2d56 h PHE 29 Cb 1.22 -0.29 0.00 0.00 3.61 0.00 0.00 35.95 40.50 2d56 h PHE 29 CO 0.00 0.09 0.00 -0.56 -1.61 0.00 0.00 178.31 176.23 2d56 h GLN 30 N 0.59 0.00 -2.70 1.51 3.07 -1.81 -3.47 115.11 112.30 2d56 h GLN 30 Ca 0.63 0.00 -0.31 0.00 0.09 0.00 0.00 58.65 59.06 2d56 h GLN 30 Cb 1.21 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.78 2d56 h GLN 30 CO -0.45 0.00 -0.42 -1.71 0.09 0.00 0.00 178.83 176.34 2d56 n ASN 31 N -2.81 -4.82 -0.86 0.06 2.85 0.28 -4.83 115.26 105.12 2d56 n ASN 31 Ca 0.02 -0.09 -0.05 0.00 -0.11 0.00 0.00 54.58 54.36 2d56 n ASN 31 Cb 0.36 -3.84 -0.05 0.00 1.24 0.00 0.00 39.78 37.50 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 -0.73 -0.98 -0.21 0.00 0.00 -1.24 -1.35 107.32 102.80 2d56 s GLY 33 Ca 0.01 1.87 -0.13 0.00 0.00 0.00 0.00 44.72 46.47 2d56 s GLY 33 CO -0.00 3.41 0.25 -1.08 0.00 0.00 0.00 173.10 175.68 2d56 s THR 34 N 2.86 5.31 0.12 0.90 -1.32 -1.08 -3.28 115.64 119.15 2d56 s THR 34 Ca 0.20 0.40 -0.30 0.00 -1.21 0.00 0.00 61.69 60.78 2d56 s THR 34 Cb -0.15 -3.59 -0.06 0.00 -1.51 0.00 0.00 72.50 67.20 2d56 s THR 34 CO -0.21 0.33 0.96 -0.83 -2.21 0.00 0.00 174.62 172.67 2d56 s GLY 35 N 0.90 3.01 -0.13 6.08 0.00 -1.24 -2.47 107.32 113.46 2d56 s GLY 35 Ca 0.12 0.59 -0.10 0.00 0.00 0.00 0.00 44.72 45.33 2d56 s GLY 35 CO 0.05 1.44 0.34 0.30 0.00 0.00 0.00 173.10 175.23 2d56 s HIS 36 N -0.10 -0.41 -0.67 1.90 3.76 -0.66 -4.49 115.29 114.62 2d56 s HIS 36 Ca 0.47 0.97 -0.28 0.00 -0.15 0.00 0.00 55.06 56.07 2d56 s HIS 36 Cb -0.24 0.14 0.03 0.00 1.11 0.00 0.00 32.58 33.63 2d56 s HIS 36 CO 0.30 -0.22 1.25 0.00 -0.85 0.00 0.00 174.74 175.21 2d56 s GLU 38 N 5.41 3.61 -0.23 0.00 2.12 -0.13 -4.58 118.70 124.89 2d56 s GLU 38 Ca 0.39 -0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.36 2d56 s GLU 38 Cb -0.08 -3.03 0.05 0.00 0.26 0.00 0.00 34.13 31.33 2d56 s GLU 38 CO 0.20 0.42 -0.13 0.21 -0.54 0.00 0.00 175.26 175.42 2d56 s LYS 39 N -0.07 2.36 0.00 4.30 2.20 -1.25 -0.31 119.74 126.97 2d56 s LYS 39 Ca 0.05 -1.17 0.00 0.00 -0.36 0.00 0.00 55.97 54.49 2d56 s LYS 39 Cb -0.12 -2.76 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 2d56 s LYS 39 CO 0.02 -0.48 0.00 0.54 -0.36 0.00 0.00 175.35 175.07 2d56 n ARG 40 N 4.51 0.00 -0.51 4.03 1.74 -1.25 -4.67 116.66 120.50 2d56 n ARG 40 Ca -0.16 0.00 -0.00 0.00 -0.77 0.00 0.00 57.85 56.92 2d56 n ARG 40 Cb 0.44 -0.06 0.18 0.00 -1.02 0.00 0.00 32.46 32.01 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 2.60 2.51 0.00 -0.13 0.00 -1.26 -4.75 105.19 104.16 2d56 n GLY 41 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 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 0.17 1.91 2.78 -0.02 0.00 -1.26 -5.10 105.19 103.66 2d56 n GLY 42 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.80 0.89 -1.03 1.61 3.52 -1.26 -5.08 118.95 116.80 2d56 s ARG 43 Ca 0.00 -0.60 -0.23 0.00 -0.13 0.00 0.00 55.73 54.77 2d56 s ARG 43 Cb 0.00 -2.22 0.00 0.00 -1.56 0.00 0.00 34.95 31.17 2d56 s ARG 43 CO 0.00 -0.66 1.72 -1.25 -0.81 0.00 0.00 175.30 174.30 2d56 s PRO 44 N 1.73 3.13 0.58 5.12 0.04 -1.25 -3.89 135.00 140.45 2d56 s PRO 44 Ca -0.01 -0.91 -0.05 0.00 0.04 0.00 0.00 61.00 60.06 2d56 s PRO 44 Cb -0.18 -5.26 0.01 0.00 0.04 0.00 0.00 34.50 29.12 2d56 s PRO 44 CO -0.09 -2.85 0.88 -0.08 0.04 0.00 0.00 177.00 174.91 2d56 s THR 45 N 7.46 3.69 -0.65 1.26 -1.32 0.58 -4.77 115.64 121.89 2d56 s THR 45 Ca 0.58 -0.03 -0.02 0.00 -1.21 0.00 0.00 61.69 61.01 2d56 s THR 45 Cb -0.02 -3.46 0.17 0.00 -1.51 0.00 0.00 72.50 67.68 2d56 s THR 45 CO -0.02 -0.46 0.47 0.00 -2.21 0.00 0.00 174.62 172.40 2d56 s VAL 47 N -0.25 4.47 -0.23 0.00 -7.23 -0.88 -4.78 120.40 111.50 2d56 s VAL 47 Ca 0.18 2.07 0.02 0.00 -1.81 0.00 0.00 61.98 62.44 2d56 s VAL 47 Cb -0.19 -4.32 0.05 0.00 0.56 0.00 0.00 36.38 32.48 2d56 s VAL 47 CO -0.04 0.33 -0.13 0.00 -0.31 0.00 0.00 175.10 174.95 2d56 s ASP 49 N 1.21 -1.21 -0.30 0.00 1.01 -1.03 -4.59 116.67 111.76 2d56 s ASP 49 Ca -0.04 1.29 0.12 0.00 0.71 0.00 0.00 52.55 54.62 2d56 s ASP 49 Cb -0.18 2.23 0.36 0.00 1.01 0.00 0.00 42.92 46.34 2d56 s ASP 49 CO -0.07 -0.24 1.47 -1.14 0.21 0.00 0.00 175.17 175.40 2d56 n ARG 50 N 5.44 1.22 -3.09 8.23 3.00 -0.46 -2.64 116.66 128.36 2d56 n ARG 50 Ca -0.08 -1.15 -0.45 0.00 -0.00 0.00 0.00 57.85 56.17 2d56 n ARG 50 Cb 0.50 0.42 -0.02 0.00 0.00 0.00 0.00 32.46 33.36 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 4.70 -2.96 3.80 0.00 0.00 -1.26 -5.06 105.19 104.41 2d56 n GLY 52 Ca 0.22 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.27 2d56 n GLY 52 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19