#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xhm n SER 8 N 0.00 3.05 0.16 0.00 3.41 -1.26 -4.08 113.62 114.90 1xhm n SER 8 Ca 0.00 -2.46 0.12 0.00 -0.26 0.00 0.00 58.87 56.27 1xhm n SER 8 Cb 0.00 -0.59 0.56 0.00 -0.26 0.00 0.00 64.21 63.92 1xhm n SER 8 CO 0.00 0.00 0.00 0.40 -0.16 0.00 0.00 175.04 175.28 1xhm h ILE 9 N 1.31 0.00 -0.96 -1.33 2.04 -2.05 -2.88 117.51 113.63 1xhm h ILE 9 Ca 0.07 -0.14 0.11 0.00 1.00 0.00 0.00 64.86 65.91 1xhm h ILE 9 Cb 1.29 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 38.07 1xhm h ILE 9 CO 0.27 0.00 0.60 0.00 0.00 0.00 0.00 178.15 179.02 1xhm h ALA 10 N 2.13 1.43 0.00 1.87 0.00 -2.01 0.14 119.26 122.83 1xhm h ALA 10 Ca 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1xhm h ALA 10 Cb 0.20 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1xhm h ALA 10 CO 0.00 0.21 -1.31 0.94 0.00 0.00 0.00 179.25 179.09 1xhm n GLN 11 N -4.64 0.62 0.04 0.00 7.27 -1.09 -3.02 117.38 116.56 1xhm n GLN 11 Ca 0.18 0.03 -0.05 0.00 0.07 0.00 0.00 57.00 57.22 1xhm n GLN 11 Cb 0.33 -1.73 0.15 0.00 2.41 0.00 0.00 30.24 31.40 1xhm n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1xhm h ALA 12 N 2.00 0.95 0.16 1.69 0.00 -1.30 0.64 119.26 123.39 1xhm h ALA 12 Ca -0.00 -0.44 -0.29 0.00 0.00 0.00 0.00 54.91 54.18 1xhm h ALA 12 Cb 1.00 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1xhm h ALA 12 CO 0.00 0.63 -1.30 0.07 0.00 0.00 0.00 179.25 178.65 1xhm h ARG 13 N 0.34 0.33 -0.28 0.00 -0.00 -0.88 -3.11 114.38 110.78 1xhm h ARG 13 Ca 0.03 -0.56 -0.01 0.00 -0.00 0.00 0.00 59.98 59.43 1xhm h ARG 13 Cb 0.89 0.21 -0.01 0.00 -0.00 0.00 0.00 29.97 31.05 1xhm h ARG 13 CO 0.07 1.27 0.13 0.87 -0.00 0.00 0.00 179.97 182.31 1xhm h LYS 14 N 0.09 0.41 0.36 0.08 1.79 -1.42 -1.10 116.57 116.79 1xhm h LYS 14 Ca -0.16 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.24 1xhm h LYS 14 Cb 2.02 -0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 32.56 1xhm h LYS 14 CO 0.22 0.41 -0.52 1.25 -1.08 0.00 0.00 179.45 179.73 1xhm h LEU 15 N 0.32 -1.47 -0.25 2.94 5.85 -0.94 -0.56 115.31 121.20 1xhm h LEU 15 Ca 0.10 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1xhm h LEU 15 Cb 0.14 0.51 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 1xhm h LEU 15 CO -0.01 -0.63 0.16 0.58 -0.34 0.00 0.00 178.44 178.20 1xhm h VAL 16 N -0.92 1.07 -0.79 1.05 2.07 -1.54 0.52 116.25 117.71 1xhm h VAL 16 Ca -0.04 -0.12 0.12 0.00 0.82 0.00 0.00 66.70 67.47 1xhm h VAL 16 Cb 0.83 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 1xhm h VAL 16 CO -0.15 0.06 0.52 -0.08 0.02 0.00 0.00 177.57 177.94 1xhm h GLU 17 N 0.33 0.61 0.18 1.57 4.81 -1.09 0.30 114.58 121.29 1xhm h GLU 17 Ca 0.09 -0.04 -0.30 0.00 -0.13 0.00 0.00 59.36 58.98 1xhm h GLU 17 Cb -0.04 -0.14 0.02 0.00 0.63 0.00 0.00 28.75 29.23 1xhm h GLU 17 CO -0.02 0.41 -1.35 0.37 -0.73 0.00 0.00 179.01 177.68 1xhm h GLN 18 N 0.63 0.39 0.00 1.92 5.75 -0.43 -2.57 115.11 120.80 1xhm h GLN 18 Ca 0.38 -0.66 -0.07 0.00 -0.15 0.00 0.00 58.65 58.14 1xhm h GLN 18 Cb 0.59 0.25 -0.01 0.00 1.07 0.00 0.00 27.48 29.37 1xhm h GLN 18 CO -0.14 1.31 -0.35 -0.07 -2.65 0.00 0.00 178.83 176.93 1xhm h LEU 19 N 0.11 0.00 -0.03 -2.39 3.38 0.13 -1.08 115.31 115.42 1xhm h LEU 19 Ca -0.19 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.52 1xhm h LEU 19 Cb 2.06 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.83 1xhm h LEU 19 CO 0.23 0.35 -1.05 0.11 0.09 0.00 0.00 178.44 178.18 1xhm h LYS 20 N 0.00 0.59 -0.71 1.13 1.57 -0.52 -1.97 116.57 116.67 1xhm h LYS 20 Ca -0.00 -0.67 -0.02 0.00 -1.87 0.00 0.00 60.65 58.09 1xhm h LYS 20 Cb 0.67 0.20 -0.03 0.00 0.08 0.00 0.00 32.23 33.14 1xhm h LYS 20 CO 0.05 1.27 0.35 1.98 -0.57 0.00 0.00 179.45 182.53 1xhm h MET 21 N 0.32 1.00 0.02 3.15 4.05 -0.97 -2.09 114.93 120.41 1xhm h MET 21 Ca -0.12 -0.13 -0.26 0.00 -0.28 0.00 0.00 59.70 58.90 1xhm h MET 21 Cb 1.70 -0.19 -0.04 0.00 -0.80 0.00 0.00 31.60 32.28 1xhm h MET 21 CO 0.20 0.76 -1.42 0.93 0.23 0.00 0.00 176.91 177.61 1xhm h GLU 22 N 1.00 0.04 -0.57 0.39 5.08 -1.26 -3.33 114.58 115.93 1xhm h GLU 22 Ca 0.25 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1xhm h GLU 22 Cb 0.08 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1xhm h GLU 22 CO -0.03 0.78 0.14 0.00 -1.00 0.00 0.00 179.01 178.89 1xhm h ALA 23 N 0.92 1.17 -1.39 3.43 0.00 -1.15 -3.34 119.26 118.89 1xhm h ALA 23 Ca -0.18 -0.21 -0.71 0.00 0.00 0.00 0.00 54.91 53.81 1xhm h ALA 23 Cb 1.92 -0.23 -0.14 0.00 0.00 0.00 0.00 17.79 19.34 1xhm h ALA 23 CO 0.11 0.56 1.62 1.21 0.00 0.00 0.00 179.25 182.75 1xhm s ASN 24 N -6.56 6.94 0.10 0.00 3.84 -0.80 -4.89 114.94 113.56 1xhm s ASN 24 Ca -0.10 -2.67 -0.16 0.00 0.21 0.00 0.00 52.86 50.14 1xhm s ASN 24 Cb 0.15 -2.47 0.03 0.00 -0.55 0.00 0.00 41.25 38.41 1xhm s ASN 24 CO 0.81 -0.95 0.37 0.27 -2.79 0.00 0.00 177.10 174.81 1xhm s ILE 25 N 2.73 0.08 -0.07 -5.21 -4.36 -1.26 -4.97 121.20 108.13 1xhm s ILE 25 Ca 0.46 -0.62 -0.14 0.00 -0.26 0.00 0.00 60.65 60.09 1xhm s ILE 25 Cb -0.00 -1.13 -0.05 0.00 1.25 0.00 0.00 42.46 42.52 1xhm s ILE 25 CO 0.02 -0.34 0.34 -1.81 0.24 0.00 0.00 174.94 173.38 1xhm s ASP 26 N -2.62 6.63 -0.14 4.36 1.01 -1.26 -5.07 116.67 119.58 1xhm s ASP 26 Ca 0.01 0.75 0.00 0.00 0.71 0.00 0.00 52.55 54.02 1xhm s ASP 26 Cb 0.02 -2.21 -0.01 0.00 1.01 0.00 0.00 42.92 41.73 1xhm s ASP 26 CO -0.10 0.24 -0.15 -0.13 0.21 0.00 0.00 175.17 175.25 1xhm s ARG 27 N -0.48 3.28 0.25 8.23 0.52 -1.26 -5.10 118.95 124.40 1xhm s ARG 27 Ca 0.21 -0.73 -0.30 0.00 -0.52 0.00 0.00 55.73 54.39 1xhm s ARG 27 Cb -0.15 -2.59 -0.09 0.00 0.52 0.00 0.00 34.95 32.64 1xhm s ARG 27 CO 0.09 0.13 1.06 0.42 0.02 0.00 0.00 175.30 177.02 1xhm s ILE 28 N 0.53 3.69 0.28 1.52 1.09 -1.26 -4.97 121.20 122.08 1xhm s ILE 28 Ca -0.10 1.67 -0.30 0.00 -1.10 0.00 0.00 60.65 60.82 1xhm s ILE 28 Cb -0.16 -4.06 -0.12 0.00 -1.06 0.00 0.00 42.46 37.06 1xhm s ILE 28 CO 0.04 0.38 1.61 0.29 -0.10 0.00 0.00 174.94 177.16 1xhm n LYS 29 N 1.43 2.70 -0.34 2.79 4.76 -1.26 -4.83 118.16 123.41 1xhm n LYS 29 Ca -0.01 0.96 0.22 0.00 -2.87 0.00 0.00 58.31 56.61 1xhm n LYS 29 Cb 0.46 -2.75 0.47 0.00 -1.84 0.00 0.00 35.03 31.36 1xhm n LYS 29 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1xhm h VAL 30 N 3.40 0.46 -0.52 -0.18 2.07 -1.99 0.03 116.25 119.50 1xhm h VAL 30 Ca -0.47 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.00 1xhm h VAL 30 Cb 1.22 -0.01 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 1xhm h VAL 30 CO 0.81 0.08 0.11 0.77 0.02 0.00 0.00 177.57 179.36 1xhm h SER 31 N 0.43 0.00 -0.44 0.57 4.64 -1.99 0.14 113.55 116.90 1xhm h SER 31 Ca 0.66 0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 62.00 1xhm h SER 31 Cb 1.51 0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 63.71 1xhm h SER 31 CO -0.43 0.03 -0.00 0.50 -0.87 0.00 0.00 176.83 176.05 1xhm h LYS 32 N 0.24 0.78 -0.42 4.77 3.64 -1.35 -1.30 116.57 122.92 1xhm h LYS 32 Ca 0.26 -0.25 0.04 0.00 -1.27 0.00 0.00 60.65 59.43 1xhm h LYS 32 Cb 0.36 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 1xhm h LYS 32 CO -0.34 0.85 0.20 0.00 -2.27 0.00 0.00 179.45 177.88 1xhm h ALA 33 N 0.90 0.53 -0.50 5.00 0.00 -0.94 0.98 119.26 125.23 1xhm h ALA 33 Ca 0.12 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1xhm h ALA 33 Cb 0.50 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1xhm h ALA 33 CO 0.02 -0.16 0.15 0.00 0.00 0.00 0.00 179.25 179.26 1xhm h ALA 34 N 1.23 1.32 -0.32 0.00 0.00 -0.66 -0.80 119.26 120.03 1xhm h ALA 34 Ca 0.18 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1xhm h ALA 34 Cb 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1xhm h ALA 34 CO -0.14 0.49 0.13 0.00 0.00 0.00 0.00 179.25 179.73 1xhm h ALA 35 N 1.44 0.42 -0.18 0.00 0.00 0.03 -1.84 119.26 119.13 1xhm h ALA 35 Ca 0.17 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1xhm h ALA 35 Cb 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1xhm h ALA 35 CO -0.01 0.02 -0.31 -0.44 0.00 0.00 0.00 179.25 178.52 1xhm h ASP 36 N 0.38 0.36 -0.15 0.00 3.32 -0.44 -0.30 116.42 119.57 1xhm h ASP 36 Ca 0.11 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 1xhm h ASP 36 Cb 0.19 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1xhm h ASP 36 CO -0.01 0.65 -0.01 -0.07 -1.72 0.00 0.00 179.24 178.09 1xhm h LEU 37 N 0.31 0.28 -0.67 1.55 3.38 -0.92 -1.81 115.31 117.42 1xhm h LEU 37 Ca 0.04 -0.32 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 1xhm h LEU 37 Cb 0.70 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1xhm h LEU 37 CO 0.05 0.53 0.17 0.24 0.09 0.00 0.00 178.44 179.53 1xhm h MET 38 N 0.01 1.07 -0.45 1.13 2.86 -1.20 -2.09 114.93 116.27 1xhm h MET 38 Ca 0.04 -0.25 0.08 0.00 -2.06 0.00 0.00 59.70 57.51 1xhm h MET 38 Cb 0.40 -0.14 -0.07 0.00 0.06 0.00 0.00 31.60 31.85 1xhm h MET 38 CO 0.01 0.95 0.05 0.00 1.06 0.00 0.00 176.91 178.99 1xhm h ALA 39 N 1.07 0.46 -0.44 6.32 0.00 -0.91 0.81 119.26 126.57 1xhm h ALA 39 Ca 0.21 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.20 1xhm h ALA 39 Cb 0.36 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1xhm h ALA 39 CO 0.00 -0.35 0.16 -0.92 0.00 0.00 0.00 179.25 178.15 1xhm h TYR 40 N 0.18 0.68 0.53 0.00 3.20 -1.07 -0.82 116.97 119.66 1xhm h TYR 40 Ca 0.22 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 1xhm h TYR 40 Cb 0.30 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 1xhm h TYR 40 CO -0.24 0.60 -0.35 0.00 -1.64 0.00 0.00 178.16 176.52 1xhm h GLU 42 N -0.85 1.20 0.00 0.00 5.08 -0.85 0.15 114.58 119.31 1xhm h GLU 42 Ca -0.06 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1xhm h GLU 42 Cb 0.70 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1xhm h GLU 42 CO 0.04 0.82 0.00 0.00 -1.00 0.00 0.00 179.01 178.88 1xhm n ALA 43 N -2.37 1.75 -0.18 3.43 0.00 -0.32 -3.23 120.51 119.59 1xhm n ALA 43 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1xhm n ALA 43 Cb 0.04 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1xhm n ALA 43 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1xhm n HIS 44 N -1.97 0.00 -0.22 0.00 8.25 -0.56 -4.73 115.22 115.99 1xhm n HIS 44 Ca 0.03 -0.04 0.05 0.00 -0.26 0.00 0.00 57.72 57.50 1xhm n HIS 44 Cb 0.23 -0.00 0.31 0.00 1.12 0.00 0.00 29.99 31.65 1xhm n HIS 44 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1xhm h ALA 45 N 0.00 1.62 0.00 -1.41 0.00 -0.70 -1.36 119.26 117.41 1xhm h ALA 45 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1xhm h ALA 45 Cb 0.14 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1xhm h ALA 45 CO 0.00 0.27 0.00 0.36 0.00 0.00 0.00 179.25 179.88 1xhm n LYS 46 N -4.47 0.06 -0.06 0.00 2.85 -1.26 -1.54 118.16 113.74 1xhm n LYS 46 Ca 0.11 0.56 0.05 0.00 -1.05 0.00 0.00 58.31 57.98 1xhm n LYS 46 Cb 0.19 -1.71 0.08 0.00 -0.65 0.00 0.00 35.03 32.94 1xhm n LYS 46 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1xhm n GLU 47 N -1.85 2.33 -3.55 -1.58 1.02 -0.52 -4.86 120.64 111.62 1xhm n GLU 47 Ca -0.01 -2.02 -0.41 0.00 -0.02 0.00 0.00 57.16 54.70 1xhm n GLU 47 Cb 0.02 -1.25 -0.06 0.00 -0.02 0.00 0.00 31.44 30.12 1xhm n GLU 47 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1xhm s ASP 48 N -1.77 5.87 0.20 1.62 -1.08 -0.59 -4.93 116.67 116.00 1xhm s ASP 48 Ca 0.16 -2.77 0.11 0.00 -0.52 0.00 0.00 52.55 49.52 1xhm s ASP 48 Cb 0.13 -2.00 0.58 0.00 -1.46 0.00 0.00 42.92 40.17 1xhm s ASP 48 CO 0.03 -0.46 1.26 -0.81 0.52 0.00 0.00 175.17 175.70 1xhm n PRO 49 N 3.71 0.07 -0.09 4.34 -0.04 -1.26 0.29 135.00 142.02 1xhm n PRO 49 Ca 0.10 0.52 0.02 0.00 -0.04 0.00 0.00 63.50 64.10 1xhm n PRO 49 Cb 0.42 -1.86 0.06 0.00 -0.04 0.00 0.00 33.50 32.08 1xhm n PRO 49 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xhm n LEU 50 N -1.86 1.03 0.14 1.53 4.77 -1.26 -4.18 117.00 117.17 1xhm n LEU 50 Ca -0.01 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.45 1xhm n LEU 50 Cb 0.14 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1xhm n LEU 50 CO 0.05 0.21 0.00 0.18 -1.33 0.00 0.00 177.39 176.50 1xhm n LEU 51 N -0.06 -1.82 -0.74 2.23 4.77 0.11 -5.25 117.00 116.23 1xhm n LEU 51 Ca 0.04 0.51 0.09 0.00 -0.03 0.00 0.00 56.01 56.62 1xhm n LEU 51 Cb 0.21 1.85 0.08 0.00 -2.33 0.00 0.00 43.42 43.22 1xhm n LEU 51 CO 0.04 -0.24 0.54 0.41 -1.33 0.00 0.00 177.39 176.81