#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ci9 s LYS 7 N 0.00 3.22 0.29 -0.52 1.02 -1.26 -5.07 119.74 117.42 3ci9 s LYS 7 Ca 0.00 -0.48 0.00 0.00 0.02 0.00 0.00 55.97 55.52 3ci9 s LYS 7 Cb 0.00 -2.81 0.00 0.00 -0.52 0.00 0.00 37.83 34.50 3ci9 s LYS 7 CO 0.00 0.51 0.04 -2.37 -0.92 0.00 0.00 175.35 172.61 3ci9 n THR 8 N 2.72 0.00 -0.26 2.17 5.66 -1.26 -5.00 114.28 118.31 3ci9 n THR 8 Ca -0.18 -1.33 0.01 0.00 -3.05 0.00 0.00 64.05 59.50 3ci9 n THR 8 Cb 0.53 0.18 0.14 0.00 -1.55 0.00 0.00 70.33 69.63 3ci9 n THR 8 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 3ci9 h VAL 9 N 1.05 0.91 -0.58 1.08 2.07 -2.00 -1.83 116.25 116.95 3ci9 h VAL 9 Ca -0.23 -0.25 0.06 0.00 0.82 0.00 0.00 66.70 67.10 3ci9 h VAL 9 Cb 0.72 0.13 -0.09 0.00 -1.52 0.00 0.00 31.29 30.54 3ci9 h VAL 9 CO 0.38 0.13 -0.50 1.56 0.02 0.00 0.00 177.57 179.16 3ci9 h GLN 10 N 0.72 -0.18 -0.96 1.57 4.20 -1.98 0.67 115.11 119.14 3ci9 h GLN 10 Ca 0.36 0.01 0.30 0.00 0.06 0.00 0.00 58.65 59.38 3ci9 h GLN 10 Cb 0.31 0.04 -0.17 0.00 0.30 0.00 0.00 27.48 27.96 3ci9 h GLN 10 CO -0.23 -0.12 0.24 -0.44 -0.67 0.00 0.00 178.83 177.60 3ci9 h ASP 11 N -0.19 -0.10 -0.68 1.46 5.19 -1.72 0.82 116.42 121.19 3ci9 h ASP 11 Ca 0.10 0.25 -0.02 0.00 -0.62 0.00 0.00 57.03 56.73 3ci9 h ASP 11 Cb 0.44 0.36 -0.03 0.00 0.18 0.00 0.00 39.33 40.28 3ci9 h ASP 11 CO -0.65 -0.31 0.36 0.25 -3.12 0.00 0.00 179.24 175.77 3ci9 h LEU 12 N 0.08 0.88 -0.55 1.55 5.85 0.45 -2.44 115.31 121.13 3ci9 h LEU 12 Ca 0.65 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.29 3ci9 h LEU 12 Cb 1.46 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.27 3ci9 h LEU 12 CO -0.80 0.73 -0.10 0.35 -0.34 0.00 0.00 178.44 178.28 3ci9 n THR 13 N -4.35 0.00 0.40 1.05 -2.24 0.28 -2.54 114.28 106.88 3ci9 n THR 13 Ca 0.07 -0.14 0.11 0.00 -2.27 0.00 0.00 64.05 61.82 3ci9 n THR 13 Cb 0.12 0.23 -0.03 0.00 -2.10 0.00 0.00 70.33 68.55 3ci9 n THR 13 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3ci9 n SER 14 N -0.46 0.55 0.07 3.42 7.64 -0.56 -2.95 113.62 121.33 3ci9 n SER 14 Ca 0.16 -0.13 -0.17 0.00 1.01 0.00 0.00 58.87 59.74 3ci9 n SER 14 Cb 0.31 1.00 -0.09 0.00 -1.01 0.00 0.00 64.21 64.42 3ci9 n SER 14 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3ci9 h VAL 15 N 0.00 1.35 0.00 0.44 2.07 -1.36 -2.92 116.25 115.83 3ci9 h VAL 15 Ca 0.00 -2.44 -0.10 0.00 0.82 0.00 0.00 66.70 64.98 3ci9 h VAL 15 Cb 0.81 2.51 -0.01 0.00 -1.52 0.00 0.00 31.29 33.08 3ci9 h VAL 15 CO 0.00 0.74 -0.46 0.58 0.02 0.00 0.00 177.57 178.45 3ci9 h VAL 16 N 0.28 0.81 0.09 2.57 2.07 -1.62 -1.50 116.25 118.96 3ci9 h VAL 16 Ca -0.12 -2.06 -0.27 0.00 0.82 0.00 0.00 66.70 65.08 3ci9 h VAL 16 Cb 1.72 2.34 -0.01 0.00 -1.52 0.00 0.00 31.29 33.82 3ci9 h VAL 16 CO 0.19 0.45 -1.25 -0.61 0.02 0.00 0.00 177.57 176.37 3ci9 h GLN 17 N 0.00 0.20 -0.13 1.57 4.15 -1.65 -2.70 115.11 116.56 3ci9 h GLN 17 Ca -0.00 -0.34 -0.06 0.00 0.77 0.00 0.00 58.65 59.01 3ci9 h GLN 17 Cb 1.30 0.13 -0.00 0.00 0.21 0.00 0.00 27.48 29.11 3ci9 h GLN 17 CO 0.06 1.13 -0.17 1.15 -1.93 0.00 0.00 178.83 179.07 3ci9 h THR 18 N 0.05 1.36 -0.05 2.39 2.02 -1.41 -1.72 112.91 115.56 3ci9 h THR 18 Ca -0.13 -1.38 0.04 0.00 0.77 0.00 0.00 66.41 65.71 3ci9 h THR 18 Cb 1.94 1.98 -0.05 0.00 -1.74 0.00 0.00 68.15 70.28 3ci9 h THR 18 CO 0.18 0.40 -0.22 -0.07 0.37 0.00 0.00 175.52 176.17 3ci9 h LEU 19 N -0.07 -0.67 -1.16 2.58 3.38 -1.34 0.09 115.31 118.13 3ci9 h LEU 19 Ca 0.01 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3ci9 h LEU 19 Cb 0.72 0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 3ci9 h LEU 19 CO 0.04 -0.28 0.12 -0.07 0.09 0.00 0.00 178.44 178.33 3ci9 h LEU 20 N -0.33 0.65 0.89 1.67 -0.00 -1.50 -1.94 115.31 114.75 3ci9 h LEU 20 Ca 0.08 -0.10 -0.04 0.00 -0.00 0.00 0.00 57.88 57.81 3ci9 h LEU 20 Cb 0.43 -0.17 0.01 0.00 -0.00 0.00 0.00 40.66 40.93 3ci9 h LEU 20 CO -0.24 0.65 -0.43 -0.61 -0.00 0.00 0.00 178.44 177.81 3ci9 h GLN 21 N 0.69 -1.16 -0.14 1.13 -0.00 -0.66 -0.61 115.11 114.37 3ci9 h GLN 21 Ca 0.16 0.08 0.04 0.00 -0.00 0.00 0.00 58.65 58.92 3ci9 h GLN 21 Cb 0.25 0.26 -0.01 0.00 0.00 0.00 0.00 27.48 27.99 3ci9 h GLN 21 CO -0.00 -0.77 0.28 1.96 0.00 0.00 0.00 178.83 180.30 3ci9 h GLN 22 N -1.29 0.00 0.00 1.69 4.20 -0.88 0.41 115.11 119.25 3ci9 h GLN 22 Ca -0.12 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.42 3ci9 h GLN 22 Cb 0.92 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.67 3ci9 h GLN 22 CO 0.20 0.00 -1.12 0.52 -0.67 0.00 0.00 178.83 177.76 3ci9 h MET 23 N 0.00 0.00 0.14 1.46 2.86 -0.95 -2.44 114.93 115.99 3ci9 h MET 23 Ca 0.07 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.41 3ci9 h MET 23 Cb 0.62 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.30 3ci9 h MET 23 CO -0.00 0.49 -1.27 0.37 1.06 0.00 0.00 176.91 177.56 3ci9 h GLN 24 N 0.00 0.51 -0.58 1.72 4.15 0.11 -3.13 115.11 117.89 3ci9 h GLN 24 Ca -0.11 -0.73 0.04 0.00 0.77 0.00 0.00 58.65 58.62 3ci9 h GLN 24 Cb 1.61 0.25 -0.04 0.00 0.21 0.00 0.00 27.48 29.51 3ci9 h GLN 24 CO 0.07 1.33 0.33 -0.44 -1.93 0.00 0.00 178.83 178.19 3ci9 h ASP 25 N 0.20 0.52 -0.86 -0.69 5.19 -0.43 0.10 116.42 120.46 3ci9 h ASP 25 Ca -0.18 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.23 3ci9 h ASP 25 Cb 1.95 -0.09 -0.04 0.00 0.18 0.00 0.00 39.33 41.32 3ci9 h ASP 25 CO 0.23 0.36 0.47 0.50 -3.12 0.00 0.00 179.24 177.68 3ci9 h LYS 26 N 0.65 1.19 0.07 3.56 1.63 -1.50 -2.01 116.57 120.16 3ci9 h LYS 26 Ca 0.24 -0.14 -0.26 0.00 -0.85 0.00 0.00 60.65 59.65 3ci9 h LYS 26 Cb 0.08 -0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 31.46 3ci9 h LYS 26 CO -0.13 0.87 -1.29 0.74 -3.45 0.00 0.00 179.45 176.19 3ci9 h PHE 27 N 1.20 0.26 0.00 1.91 0.05 -1.39 -2.85 116.94 116.11 3ci9 h PHE 27 Ca 0.30 -0.19 -0.10 0.00 3.82 0.00 0.00 57.97 61.81 3ci9 h PHE 27 Cb 0.02 -0.01 -0.01 0.00 2.00 0.00 0.00 35.95 37.95 3ci9 h PHE 27 CO 0.01 1.18 -0.47 0.37 -0.18 0.00 0.00 178.31 179.22 3ci9 h GLN 28 N 0.04 0.00 -0.16 1.51 5.75 -0.96 -1.03 115.11 120.25 3ci9 h GLN 28 Ca -0.14 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.34 3ci9 h GLN 28 Cb 1.92 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.46 3ci9 h GLN 28 CO 0.15 0.47 0.04 1.15 -2.65 0.00 0.00 178.83 177.98 3ci9 h THR 29 N 0.00 1.21 -0.58 2.39 2.02 -1.38 0.14 112.91 116.70 3ci9 h THR 29 Ca -0.00 -0.66 -0.05 0.00 0.77 0.00 0.00 66.41 66.47 3ci9 h THR 29 Cb 0.87 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 3ci9 h THR 29 CO 0.06 0.20 0.17 0.40 0.37 0.00 0.00 175.52 176.72 3ci9 h ILE 30 N 0.07 1.23 -0.34 3.11 2.04 -1.25 -1.93 117.51 120.44 3ci9 h ILE 30 Ca 0.05 -0.79 -0.10 0.00 1.00 0.00 0.00 64.86 65.03 3ci9 h ILE 30 Cb 0.27 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 3ci9 h ILE 30 CO 0.00 0.30 -0.19 0.28 0.00 0.00 0.00 178.15 178.54 3ci9 h SER 31 N 0.85 0.63 -0.55 1.72 0.02 -0.86 -2.34 113.55 113.03 3ci9 h SER 31 Ca 0.19 -0.21 -0.05 0.00 -0.84 0.00 0.00 61.79 60.88 3ci9 h SER 31 Cb 0.26 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3ci9 h SER 31 CO -0.01 0.83 0.13 0.44 -1.14 0.00 0.00 176.83 177.08 3ci9 h ASP 32 N 0.57 0.83 -0.10 3.07 3.45 -0.22 0.82 116.42 124.85 3ci9 h ASP 32 Ca 0.09 -0.24 -0.07 0.00 0.43 0.00 0.00 57.03 57.24 3ci9 h ASP 32 Cb 0.64 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 39.18 3ci9 h ASP 32 CO 0.05 0.85 -0.13 1.56 -1.57 0.00 0.00 179.24 180.00 3ci9 h GLN 33 N 0.78 0.44 -0.18 3.56 4.20 -1.20 0.14 115.11 122.85 3ci9 h GLN 33 Ca 0.17 -0.12 -0.06 0.00 0.06 0.00 0.00 58.65 58.70 3ci9 h GLN 33 Cb 0.35 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 3ci9 h GLN 33 CO 0.00 0.57 -0.11 0.82 -0.67 0.00 0.00 178.83 179.45 3ci9 h ILE 34 N 0.41 1.32 -0.44 2.54 2.04 -1.05 -1.97 117.51 120.36 3ci9 h ILE 34 Ca 0.08 -1.19 -0.02 0.00 1.00 0.00 0.00 64.86 64.73 3ci9 h ILE 34 Cb 0.48 1.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 3ci9 h ILE 34 CO 0.03 0.36 0.21 0.40 0.00 0.00 0.00 178.15 179.14 3ci9 h ILE 35 N 0.07 1.16 -0.37 -0.67 2.04 -0.41 -1.14 117.51 118.19 3ci9 h ILE 35 Ca 0.04 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3ci9 h ILE 35 Cb 0.61 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 3ci9 h ILE 35 CO 0.03 0.18 0.19 1.23 0.00 0.00 0.00 178.15 179.79 3ci9 h GLY 36 N 0.74 0.56 1.09 5.37 0.00 -0.45 -1.35 103.07 109.02 3ci9 h GLY 36 Ca 0.16 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.20 3ci9 h GLY 36 CO -0.02 0.25 0.47 3.21 0.00 0.00 0.00 176.54 180.46 3ci9 h ARG 37 N 0.47 1.20 -0.49 4.80 3.08 -0.52 -2.24 114.38 120.68 3ci9 h ARG 37 Ca 0.13 -0.14 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 3ci9 h ARG 37 Cb 0.08 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 3ci9 h ARG 37 CO -0.02 0.87 -0.03 0.82 -1.07 0.00 0.00 179.97 180.54 3ci9 h ILE 38 N 1.20 1.25 -0.71 2.04 2.04 -0.94 -2.45 117.51 119.95 3ci9 h ILE 38 Ca 0.30 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 3ci9 h ILE 38 Cb 0.02 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3ci9 h ILE 38 CO -0.05 0.38 0.38 0.44 0.00 0.00 0.00 178.15 179.30 3ci9 h ASP 39 N 0.77 0.89 -0.48 1.72 3.32 -0.66 -0.06 116.42 121.92 3ci9 h ASP 39 Ca 0.14 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.03 3ci9 h ASP 39 Cb 0.51 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3ci9 h ASP 39 CO 0.03 0.73 0.05 0.44 -1.72 0.00 0.00 179.24 178.77 3ci9 h ASP 40 N 0.98 0.78 -0.03 6.45 3.32 -1.32 -2.38 116.42 124.23 3ci9 h ASP 40 Ca 0.25 -0.28 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 3ci9 h ASP 40 Cb 0.04 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3ci9 h ASP 40 CO -0.04 0.86 -0.04 0.24 -1.72 0.00 0.00 179.24 178.54 3ci9 h MET 41 N 0.67 0.19 0.00 3.56 2.86 -1.09 -1.58 114.93 119.55 3ci9 h MET 41 Ca 0.14 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.70 3ci9 h MET 41 Cb 0.43 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 3ci9 h MET 41 CO 0.01 0.25 -0.23 1.03 1.06 0.00 0.00 176.91 179.03 3ci9 h SER 42 N 0.19 0.00 0.13 1.22 0.87 -0.58 -1.73 113.55 113.65 3ci9 h SER 42 Ca 0.04 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.39 3ci9 h SER 42 Cb 0.20 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.19 3ci9 h SER 42 CO 0.01 0.23 -0.93 -1.28 -0.53 0.00 0.00 176.83 174.33 3ci9 h SER 43 N 0.00 0.59 -0.28 6.23 0.87 -0.82 -1.12 113.55 119.02 3ci9 h SER 43 Ca -0.00 -0.90 -0.00 0.00 -1.23 0.00 0.00 61.79 59.66 3ci9 h SER 43 Cb 0.90 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.66 3ci9 h SER 43 CO 0.03 1.44 0.17 0.03 -0.53 0.00 0.00 176.83 177.97 3ci9 h ARG 44 N -0.16 0.38 -0.59 2.24 3.08 -1.35 0.33 114.38 118.32 3ci9 h ARG 44 Ca -0.15 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.86 3ci9 h ARG 44 Cb 1.70 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 31.64 3ci9 h ARG 44 CO 0.18 0.30 0.36 0.82 -1.07 0.00 0.00 179.97 180.55 3ci9 h ILE 45 N 0.36 1.17 0.31 2.04 2.04 -1.37 -1.49 117.51 120.57 3ci9 h ILE 45 Ca 0.10 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 3ci9 h ILE 45 Cb 0.01 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 3ci9 h ILE 45 CO -0.02 0.17 -0.15 0.44 0.00 0.00 0.00 178.15 178.60 3ci9 h ASP 46 N 0.81 -0.35 0.00 1.72 3.45 -0.01 -1.78 116.42 120.26 3ci9 h ASP 46 Ca 0.21 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.65 3ci9 h ASP 46 Cb -0.03 0.09 0.00 0.00 -0.56 0.00 0.00 39.33 38.83 3ci9 h ASP 46 CO -0.04 -0.21 0.00 0.47 -1.57 0.00 0.00 179.24 177.89 3ci9 n ASP 47 N -5.25 0.20 -0.02 6.45 8.00 0.10 -2.55 116.55 123.49 3ci9 n ASP 47 Ca -0.10 -1.37 -0.02 0.00 0.71 0.00 0.00 54.79 54.01 3ci9 n ASP 47 Cb 0.20 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.16 3ci9 n ASP 47 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3ci9 n LEU 48 N -0.31 0.11 -0.15 0.64 4.77 -0.64 -5.03 117.00 116.39 3ci9 n LEU 48 Ca 0.00 -0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.13 3ci9 n LEU 48 Cb 0.05 0.09 0.81 0.00 -2.33 0.00 0.00 43.42 42.05 3ci9 n LEU 48 CO 0.00 0.12 1.03 -0.62 -1.33 0.00 0.00 177.39 176.60