#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a92 h ARG 13 N 0.00 0.81 -0.60 1.61 3.08 -2.05 -1.85 114.38 115.38 1a92 h ARG 13 Ca 0.00 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 1a92 h ARG 13 Cb 0.00 -0.18 -0.03 0.00 0.08 0.00 0.00 29.97 29.84 1a92 h ARG 13 CO 0.00 0.54 0.23 1.49 -1.07 0.00 0.00 179.97 181.16 1a92 h GLU 14 N 0.84 0.88 -0.22 0.04 4.57 -2.05 0.96 114.58 119.59 1a92 h GLU 14 Ca 0.23 -0.14 -0.08 0.00 -1.18 0.00 0.00 59.36 58.19 1a92 h GLU 14 Cb -0.08 -0.15 -0.00 0.00 -0.16 0.00 0.00 28.75 28.36 1a92 h GLU 14 CO -0.05 0.72 -0.19 0.22 -1.18 0.00 0.00 179.01 178.53 1a92 h ASP 15 N 0.86 0.55 -0.96 1.04 3.58 -1.79 -1.22 116.42 118.48 1a92 h ASP 15 Ca 0.20 -0.46 -0.00 0.00 0.42 0.00 0.00 57.03 57.20 1a92 h ASP 15 Cb 0.18 -0.15 -0.05 0.00 1.72 0.00 0.00 39.33 41.03 1a92 h ASP 15 CO -0.02 0.89 0.60 0.40 -2.88 0.00 0.00 179.24 178.23 1a92 h ILE 16 N 0.21 1.26 -0.52 2.25 1.08 -1.09 -0.24 117.51 120.46 1a92 h ILE 16 Ca 0.04 -0.53 -0.09 0.00 -0.39 0.00 0.00 64.86 63.89 1a92 h ILE 16 Cb 0.72 -0.12 -0.02 0.00 -3.07 0.00 0.00 36.82 34.33 1a92 h ILE 16 CO 0.05 0.26 -0.02 0.25 -0.69 0.00 0.00 178.15 178.00 1a92 h LEU 17 N 1.32 0.87 -0.48 1.44 5.85 -0.70 0.21 115.31 123.82 1a92 h LEU 17 Ca 0.35 -0.24 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1a92 h LEU 17 Cb -0.09 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 1a92 h LEU 17 CO -0.07 0.95 0.16 -0.33 -0.34 0.00 0.00 178.44 178.81 1a92 h GLU 18 N 0.83 0.74 -0.47 1.25 5.08 -0.58 0.73 114.58 122.15 1a92 h GLU 18 Ca 0.15 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1a92 h GLU 18 Cb 0.52 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 1a92 h GLU 18 CO 0.03 0.69 0.23 1.96 -1.00 0.00 0.00 179.01 180.92 1a92 h GLN 19 N 0.64 0.68 -0.08 2.33 4.20 -0.70 -0.92 115.11 121.26 1a92 h GLN 19 Ca 0.16 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1a92 h GLN 19 Cb 0.25 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.91 1a92 h GLN 19 CO -0.01 0.57 0.00 2.35 -0.67 0.00 0.00 178.83 181.08 1a92 h TRP 20 N 0.62 0.14 -0.62 2.96 7.01 -0.69 -0.74 115.95 124.64 1a92 h TRP 20 Ca 0.16 -0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.05 1a92 h TRP 20 Cb 0.11 -0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.11 1a92 h TRP 20 CO -0.01 0.39 0.03 0.28 -2.79 0.00 0.00 178.44 176.35 1a92 h VAL 21 N -0.15 1.26 -0.30 2.65 2.07 -0.85 -0.69 116.25 120.24 1a92 h VAL 21 Ca 0.02 -1.12 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 1a92 h VAL 21 Cb 0.34 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1a92 h VAL 21 CO 0.00 0.41 0.07 0.28 0.02 0.00 0.00 177.57 178.35 1a92 h SER 22 N 0.99 0.46 -0.64 0.57 0.02 -1.17 -0.55 113.55 113.24 1a92 h SER 22 Ca 0.18 -0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 1a92 h SER 22 Cb 0.52 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1a92 h SER 22 CO 0.03 0.58 0.28 1.23 -1.14 0.00 0.00 176.83 177.80 1a92 h GLY 23 N 0.33 1.04 1.66 -3.77 0.00 -0.92 -0.30 103.07 101.10 1a92 h GLY 23 Ca 0.09 -0.53 -0.14 0.00 0.00 0.00 0.00 47.33 46.75 1a92 h GLY 23 CO 0.00 0.50 -0.53 3.21 0.00 0.00 0.00 176.54 179.72 1a92 h ARG 24 N 0.96 0.36 0.01 4.80 3.08 -0.92 0.25 114.38 122.92 1a92 h ARG 24 Ca 0.23 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1a92 h ARG 24 Cb 0.16 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1a92 h ARG 24 CO -0.02 0.80 -0.00 -0.22 -1.07 0.00 0.00 179.97 179.46 1a92 h LYS 25 N 0.28 -0.01 -0.89 0.04 3.64 -0.49 -1.65 116.57 117.49 1a92 h LYS 25 Ca 0.01 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1a92 h LYS 25 Cb 1.03 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.81 1a92 h LYS 25 CO 0.09 0.24 0.51 -0.22 -2.27 0.00 0.00 179.45 177.80 1a92 h LYS 26 N -0.26 1.22 -0.03 1.90 1.63 -0.93 -1.86 116.57 118.24 1a92 h LYS 26 Ca -0.00 -0.12 0.02 0.00 -0.85 0.00 0.00 60.65 59.69 1a92 h LYS 26 Cb 0.25 -0.25 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 1a92 h LYS 26 CO 0.00 0.87 -0.06 1.25 -3.45 0.00 0.00 179.45 178.06 1a92 h LEU 27 N 1.23 -0.19 -1.24 5.20 5.85 -0.29 0.75 115.31 126.63 1a92 h LEU 27 Ca 0.32 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.04 1a92 h LEU 27 Cb -0.02 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1a92 h LEU 27 CO -0.06 -0.09 0.20 -0.33 -0.34 0.00 0.00 178.44 177.82 1a92 h GLU 28 N -0.10 0.73 -0.36 1.25 5.08 -1.05 -0.19 114.58 119.92 1a92 h GLU 28 Ca 0.04 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 1a92 h GLU 28 Cb 0.15 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1a92 h GLU 28 CO -0.09 0.60 -0.05 0.93 -1.00 0.00 0.00 179.01 179.41 1a92 h GLU 29 N 0.72 0.67 -0.62 2.33 5.08 -0.73 -0.97 114.58 121.06 1a92 h GLU 29 Ca 0.17 -0.24 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 1a92 h GLU 29 Cb 0.15 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1a92 h GLU 29 CO -0.02 0.81 0.07 -0.07 -1.00 0.00 0.00 179.01 178.81 1a92 h LEU 30 N 0.48 1.00 -0.90 1.33 3.38 -0.47 -0.69 115.31 119.43 1a92 h LEU 30 Ca 0.10 -0.24 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 1a92 h LEU 30 Cb 0.54 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1a92 h LEU 30 CO 0.03 1.01 -0.24 -0.33 0.09 0.00 0.00 178.44 179.00 1a92 h GLU 31 N 0.97 0.54 -0.15 1.13 5.08 -0.85 -0.36 114.58 120.93 1a92 h GLU 31 Ca 0.19 -0.20 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 1a92 h GLU 31 Cb 0.46 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1a92 h GLU 31 CO 0.02 0.73 -0.15 -0.09 -1.00 0.00 0.00 179.01 178.52 1a92 h ARG 32 N 0.47 0.36 -0.84 2.33 2.43 -0.85 -1.69 114.38 116.59 1a92 h ARG 32 Ca 0.07 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1a92 h ARG 32 Cb 0.67 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.19 1a92 h ARG 32 CO 0.05 0.74 0.54 -0.44 -1.51 0.00 0.00 179.97 179.35 1a92 h ASP 33 N -0.01 0.99 -0.38 -3.80 3.32 -1.00 -1.24 116.42 114.30 1a92 h ASP 33 Ca 0.02 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1a92 h ASP 33 Cb 0.68 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 1a92 h ASP 33 CO 0.04 0.74 0.18 0.25 -1.72 0.00 0.00 179.24 178.72 1a92 h LEU 34 N 1.15 0.50 -0.43 1.55 5.85 -1.01 0.18 115.31 123.09 1a92 h LEU 34 Ca 0.31 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1a92 h LEU 34 Cb -0.10 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1a92 h LEU 34 CO -0.06 0.49 0.26 0.03 -0.34 0.00 0.00 178.44 178.82 1a92 h ARG 35 N 0.47 0.58 -0.07 1.25 3.08 -0.95 0.12 114.38 118.86 1a92 h ARG 35 Ca 0.13 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1a92 h ARG 35 Cb 0.13 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 1a92 h ARG 35 CO -0.02 0.42 0.02 0.87 -1.07 0.00 0.00 179.97 180.19 1a92 h LYS 36 N 0.57 0.11 -0.52 0.04 1.57 -1.00 -2.66 116.57 114.67 1a92 h LYS 36 Ca 0.15 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1a92 h LYS 36 Cb -0.01 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1a92 h LYS 36 CO -0.03 0.30 0.22 1.25 -0.57 0.00 0.00 179.45 180.63 1a92 h LEU 37 N -0.11 0.70 -0.60 2.94 5.85 -0.89 -2.01 115.31 121.19 1a92 h LEU 37 Ca 0.02 -0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.66 1a92 h LEU 37 Cb 0.24 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 1a92 h LEU 37 CO 0.00 0.66 0.27 0.11 -0.34 0.00 0.00 178.44 179.15 1a92 h LYS 38 N 0.70 0.48 -0.34 1.25 1.57 -0.94 0.83 116.57 120.12 1a92 h LYS 38 Ca 0.17 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.85 1a92 h LYS 38 Cb 0.17 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1a92 h LYS 38 CO -0.02 0.32 -0.12 0.87 -0.57 0.00 0.00 179.45 179.93 1a92 h LYS 39 N 0.50 0.59 -0.38 3.15 1.57 -1.21 -0.27 116.57 120.52 1a92 h LYS 39 Ca 0.29 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1a92 h LYS 39 Cb 0.28 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1a92 h LYS 39 CO -0.24 0.70 -0.03 -0.22 -0.57 0.00 0.00 179.45 179.09 1a92 h LYS 40 N 0.54 0.69 -0.38 3.15 3.64 -0.52 -1.10 116.57 122.59 1a92 h LYS 40 Ca 0.10 -0.23 -0.13 0.00 -1.27 0.00 0.00 60.65 59.11 1a92 h LYS 40 Cb 0.53 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1a92 h LYS 40 CO 0.03 0.80 -0.29 0.82 -2.27 0.00 0.00 179.45 178.55 1a92 h ILE 41 N 0.51 1.28 -0.53 2.00 1.08 -0.66 -1.24 117.51 119.94 1a92 h ILE 41 Ca 0.10 -1.45 0.00 0.00 -0.39 0.00 0.00 64.86 63.13 1a92 h ILE 41 Cb 0.51 1.37 -0.03 0.00 -3.07 0.00 0.00 36.82 35.60 1a92 h ILE 41 CO 0.02 0.48 0.34 0.50 -0.69 0.00 0.00 178.15 178.81 1a92 h LYS 42 N 0.67 0.70 -0.58 2.37 3.64 -0.94 0.15 116.57 122.58 1a92 h LYS 42 Ca 0.07 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 1a92 h LYS 42 Cb 0.87 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 1a92 h LYS 42 CO 0.08 0.48 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.47 1a92 h LYS 43 N 0.72 1.06 -0.59 1.90 3.64 -1.13 -0.88 116.57 121.29 1a92 h LYS 43 Ca 0.19 -0.36 0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1a92 h LYS 43 Cb -0.07 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 31.62 1a92 h LYS 43 CO -0.04 1.06 0.32 1.25 -2.27 0.00 0.00 179.45 179.77 1a92 h LEU 44 N 0.96 0.48 -0.87 5.20 5.85 -0.67 -0.36 115.31 125.90 1a92 h LEU 44 Ca 0.16 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.80 1a92 h LEU 44 Cb 0.61 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.56 1a92 h LEU 44 CO 0.04 0.33 -0.35 -0.33 -0.34 0.00 0.00 178.44 177.79 1a92 h GLU 45 N 0.62 0.42 -0.19 1.25 5.08 -0.58 -0.71 114.58 120.47 1a92 h GLU 45 Ca 0.26 -0.19 -0.22 0.00 -1.00 0.00 0.00 59.36 58.22 1a92 h GLU 45 Cb 0.13 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1a92 h GLU 45 CO -0.16 0.72 -0.73 0.93 -1.00 0.00 0.00 179.01 178.77 1a92 h GLU 46 N 0.36 0.82 0.00 2.33 5.08 -0.63 -2.90 114.58 119.63 1a92 h GLU 46 Ca 0.04 -0.63 -0.02 0.00 -1.00 0.00 0.00 59.36 57.75 1a92 h GLU 46 Cb 0.78 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 1a92 h GLU 46 CO 0.06 1.24 -0.09 -0.44 -1.00 0.00 0.00 179.01 178.78 1a92 h ASP 47 N 0.58 0.00 -2.26 1.42 3.32 -0.99 -3.35 116.42 115.14 1a92 h ASP 47 Ca -0.04 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.43 1a92 h ASP 47 Cb 1.35 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 40.50 1a92 h ASP 47 CO 0.15 0.09 -0.90 0.59 -1.72 0.00 0.00 179.24 177.46 1a92 n ASN 48 N -3.18 1.19 0.08 6.45 3.02 -0.28 -4.97 115.26 117.58 1a92 n ASN 48 Ca 0.01 -2.86 0.20 0.00 -0.03 0.00 0.00 54.58 51.91 1a92 n ASN 48 Cb 0.43 -0.64 0.75 0.00 -0.61 0.00 0.00 39.78 39.70 1a92 n ASN 48 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1a92 h PRO 49 N 4.57 0.00 0.00 3.52 0.11 -1.66 -0.64 132.00 137.90 1a92 h PRO 49 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1a92 h PRO 49 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1a92 h PRO 49 CO 0.56 0.00 0.00 0.11 -0.21 0.00 0.00 178.00 178.46 1a92 h TRP 50 N 0.00 0.00 0.00 0.65 5.08 -1.93 -0.29 115.95 119.45 1a92 h TRP 50 Ca 0.20 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.15 1a92 h TRP 50 Cb 1.03 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.19 1a92 h TRP 50 CO 0.00 0.00 -0.09 -0.07 -1.28 0.00 0.00 178.44 177.00 1a92 h LEU 51 N 0.00 0.00 -1.25 0.11 3.38 -1.43 -1.18 115.31 114.94 1a92 h LEU 51 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1a92 h LEU 51 Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1a92 h LEU 51 CO 0.00 0.09 0.47 1.23 0.09 0.00 0.00 178.44 180.32 1a92 h GLY 52 N 0.73 1.04 1.50 0.83 0.00 -1.24 -0.38 103.07 105.54 1a92 h GLY 52 Ca -0.00 -0.40 -0.11 0.00 0.00 0.00 0.00 47.33 46.82 1a92 h GLY 52 CO 0.01 0.39 -0.26 3.43 0.00 0.00 0.00 176.54 180.11 1a92 h ASN 53 N 1.00 0.59 0.11 0.19 2.35 -1.38 -1.37 115.58 117.07 1a92 h ASN 53 Ca 0.27 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1a92 h ASN 53 Cb -0.09 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.12 1a92 h ASN 53 CO -0.06 0.83 -0.06 0.40 -1.65 0.00 0.00 177.43 176.90 1a92 h ILE 54 N 0.51 1.03 0.00 2.81 1.08 -1.15 -1.97 117.51 119.81 1a92 h ILE 54 Ca 0.07 -0.59 -0.01 0.00 -0.39 0.00 0.00 64.86 63.94 1a92 h ILE 54 Cb 0.72 1.40 -0.00 0.00 -3.07 0.00 0.00 36.82 35.87 1a92 h ILE 54 CO 0.05 0.14 -0.05 0.07 -0.69 0.00 0.00 178.15 177.68 1a92 h LYS 55 N -0.43 0.00 -0.34 2.37 2.10 -1.00 -1.07 116.57 118.21 1a92 h LYS 55 Ca -0.02 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.52 1a92 h LYS 55 Cb 0.35 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.67 1a92 h LYS 55 CO 0.03 0.05 -0.25 0.78 -2.00 0.00 0.00 179.45 178.05 1a92 h GLY 56 N 0.91 0.84 1.23 0.07 0.00 -0.88 0.12 103.07 105.36 1a92 h GLY 56 Ca -0.00 -0.81 -0.17 0.00 0.00 0.00 0.00 47.33 46.35 1a92 h GLY 56 CO 0.01 0.74 -0.50 -2.22 0.00 0.00 0.00 176.54 174.56 1a92 h ILE 57 N 0.55 1.28 0.00 2.60 2.04 -0.48 -3.23 117.51 120.27 1a92 h ILE 57 Ca 0.06 -1.69 0.00 0.00 1.00 0.00 0.00 64.86 64.24 1a92 h ILE 57 Cb 0.82 1.58 0.00 0.00 -0.74 0.00 0.00 36.82 38.48 1a92 h ILE 57 CO 0.07 0.55 -0.61 0.16 0.00 0.00 0.00 178.15 178.32 1a92 h ILE 58 N 0.64 0.00 0.00 -0.67 3.07 -1.33 -3.29 117.51 115.93 1a92 h ILE 58 Ca 0.03 -0.88 0.00 0.00 1.55 0.00 0.00 64.86 65.56 1a92 h ILE 58 Cb 1.09 1.55 0.00 0.00 -0.27 0.00 0.00 36.82 39.19 1a92 h ILE 58 CO 0.11 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.82 1a92 n GLY 59 N 1.19 -1.10 0.26 0.16 0.00 0.42 -4.33 105.19 101.79 1a92 n GLY 59 Ca 0.02 -0.09 0.03 0.00 0.00 0.00 0.00 46.02 45.98 1a92 n GLY 59 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1a92 n LYS 60 N -1.39 -0.10 0.00 1.61 4.81 -1.24 -5.06 118.16 116.79 1a92 n LYS 60 Ca 0.08 1.10 0.12 0.00 -0.87 0.00 0.00 58.31 58.74 1a92 n LYS 60 Cb 0.21 -1.65 0.10 0.00 0.02 0.00 0.00 35.03 33.71 1a92 n LYS 60 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23