#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ci9 h GLN 10 N 0.00 0.10 -0.01 5.55 3.07 -2.06 -3.25 115.11 118.51 3ci9 h GLN 10 Ca 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 58.65 58.58 3ci9 h GLN 10 Cb 0.00 0.06 -0.00 0.00 0.08 0.00 0.00 27.48 27.62 3ci9 h GLN 10 CO 0.00 1.05 0.02 -0.44 0.09 0.00 0.00 178.83 179.55 3ci9 h ASP 11 N 0.03 0.00 0.47 0.06 5.19 -2.05 0.13 116.42 120.25 3ci9 h ASP 11 Ca -0.05 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.34 3ci9 h ASP 11 Cb 1.79 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.30 3ci9 h ASP 11 CO 0.15 0.00 -0.23 0.25 -3.12 0.00 0.00 179.24 176.29 3ci9 h LEU 12 N 0.00 -0.54 -2.11 1.55 6.46 -1.99 -2.83 115.31 115.85 3ci9 h LEU 12 Ca 0.00 -0.07 0.03 0.00 -0.12 0.00 0.00 57.88 57.73 3ci9 h LEU 12 Cb 0.04 0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 40.10 3ci9 h LEU 12 CO -0.00 -0.24 0.08 0.00 -0.62 0.00 0.00 178.44 177.66 3ci9 h THR 13 N -0.83 0.81 0.20 1.05 1.03 -0.85 -1.55 112.91 112.77 3ci9 h THR 13 Ca -0.06 0.00 -0.34 0.00 -0.01 0.00 0.00 66.41 65.99 3ci9 h THR 13 Cb 0.57 0.94 0.02 0.00 -1.07 0.00 0.00 68.15 68.61 3ci9 h THR 13 CO 0.11 0.00 -1.66 0.28 -0.01 0.00 0.00 175.52 174.23 3ci9 h SER 14 N 0.00 0.67 0.29 0.00 0.02 -1.42 -2.15 113.55 110.96 3ci9 h SER 14 Ca 0.05 -0.93 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 3ci9 h SER 14 Cb 0.22 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3ci9 h SER 14 CO -0.00 1.76 0.00 0.58 -1.14 0.00 0.00 176.83 178.03 3ci9 h VAL 15 N 0.09 0.00 0.11 2.27 2.07 -1.05 0.51 116.25 120.25 3ci9 h VAL 15 Ca -0.32 -0.14 -0.34 0.00 0.82 0.00 0.00 66.70 66.72 3ci9 h VAL 15 Cb 2.10 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.93 3ci9 h VAL 15 CO 0.20 0.00 -1.84 0.58 0.02 0.00 0.00 177.57 176.53 3ci9 h VAL 16 N 0.00 0.71 -0.59 2.57 2.07 -1.43 -3.08 116.25 116.50 3ci9 h VAL 16 Ca 0.00 -2.33 0.02 0.00 0.82 0.00 0.00 66.70 65.21 3ci9 h VAL 16 Cb 0.15 2.49 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 3ci9 h VAL 16 CO 0.00 0.80 0.39 -0.61 0.02 0.00 0.00 177.57 178.17 3ci9 h GLN 17 N -0.11 0.72 0.16 1.57 4.15 -0.47 -1.65 115.11 119.48 3ci9 h GLN 17 Ca -0.40 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 58.97 3ci9 h GLN 17 Cb 1.91 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 29.44 3ci9 h GLN 17 CO 0.05 0.47 -0.08 1.15 -1.93 0.00 0.00 178.83 178.49 3ci9 h THR 18 N 0.74 0.13 -1.09 2.39 2.02 -0.19 -1.78 112.91 115.12 3ci9 h THR 18 Ca 0.23 -0.92 0.31 0.00 0.77 0.00 0.00 66.41 66.80 3ci9 h THR 18 Cb 0.01 0.24 -0.11 0.00 -1.74 0.00 0.00 68.15 66.54 3ci9 h THR 18 CO -0.06 0.04 0.69 -0.07 0.37 0.00 0.00 175.52 176.49 3ci9 h LEU 19 N -1.04 0.43 0.15 2.58 3.38 -1.47 0.20 115.31 119.53 3ci9 h LEU 19 Ca -0.02 0.11 -0.29 0.00 0.09 0.00 0.00 57.88 57.76 3ci9 h LEU 19 Cb 0.23 0.05 0.02 0.00 0.09 0.00 0.00 40.66 41.05 3ci9 h LEU 19 CO 0.04 0.01 -1.30 -0.07 0.09 0.00 0.00 178.44 177.21 3ci9 h LEU 20 N 0.34 0.60 -0.44 1.67 3.38 -1.38 -3.04 115.31 116.43 3ci9 h LEU 20 Ca 0.66 -0.63 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3ci9 h LEU 20 Cb 1.73 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.28 3ci9 h LEU 20 CO -0.37 1.48 0.00 0.00 0.09 0.00 0.00 178.44 179.64 3ci9 n GLN 21 N -3.63 0.15 -0.02 1.13 6.02 0.55 -1.96 117.38 119.62 3ci9 n GLN 21 Ca -0.11 0.34 -0.22 0.00 -0.01 0.00 0.00 57.00 57.00 3ci9 n GLN 21 Cb 1.03 -1.77 -0.13 0.00 1.02 0.00 0.00 30.24 30.39 3ci9 n GLN 21 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 3ci9 h GLN 22 N 0.00 0.20 -0.26 -1.09 4.20 -1.15 -3.10 115.11 113.90 3ci9 h GLN 22 Ca 0.00 -0.34 -0.01 0.00 0.06 0.00 0.00 58.65 58.37 3ci9 h GLN 22 Cb 0.39 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 3ci9 h GLN 22 CO 0.00 1.16 0.13 1.98 -0.67 0.00 0.00 178.83 181.43 3ci9 h MET 23 N -0.27 0.35 0.00 1.46 4.05 -1.38 -1.79 114.93 117.34 3ci9 h MET 23 Ca -0.39 -0.03 -0.16 0.00 -0.28 0.00 0.00 59.70 58.85 3ci9 h MET 23 Cb 1.80 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 32.50 3ci9 h MET 23 CO 0.01 0.27 -0.88 0.37 0.23 0.00 0.00 176.91 176.91 3ci9 h GLN 24 N 0.36 0.00 -0.40 0.39 4.15 -1.53 -2.89 115.11 115.19 3ci9 h GLN 24 Ca 0.09 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.38 3ci9 h GLN 24 Cb 0.03 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 3ci9 h GLN 24 CO -0.01 0.61 -0.29 -0.44 -1.93 0.00 0.00 178.83 176.76 3ci9 h ASP 25 N 0.00 0.91 -0.65 -0.69 3.32 -1.30 0.23 116.42 118.25 3ci9 h ASP 25 Ca -0.05 -0.37 -0.04 0.00 0.02 0.00 0.00 57.03 56.59 3ci9 h ASP 25 Cb 1.57 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.84 3ci9 h ASP 25 CO 0.08 1.13 0.25 0.50 -1.72 0.00 0.00 179.24 179.48 3ci9 h LYS 26 N 0.74 0.99 0.10 3.56 3.64 -1.41 0.12 116.57 124.32 3ci9 h LYS 26 Ca 0.08 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.28 3ci9 h LYS 26 Cb 0.85 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 3ci9 h LYS 26 CO 0.07 0.84 -0.13 0.35 -2.27 0.00 0.00 179.45 178.32 3ci9 h PHE 27 N 0.93 -0.33 -0.38 1.91 -0.00 -1.24 -2.35 116.94 115.48 3ci9 h PHE 27 Ca 0.22 0.00 0.04 0.00 -0.00 0.00 0.00 57.97 58.23 3ci9 h PHE 27 Cb 0.23 0.13 -0.04 0.00 -0.00 0.00 0.00 35.95 36.28 3ci9 h PHE 27 CO 0.02 -0.20 0.16 1.96 -0.00 0.00 0.00 178.31 180.25 3ci9 h GLN 28 N -0.27 0.33 -0.41 1.11 1.08 -0.61 -1.04 115.11 115.30 3ci9 h GLN 28 Ca 0.01 -0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.28 3ci9 h GLN 28 Cb 0.27 -0.07 -0.09 0.00 -0.05 0.00 0.00 27.48 27.54 3ci9 h GLN 28 CO -0.05 0.22 -0.21 1.15 -0.95 0.00 0.00 178.83 178.99 3ci9 h THR 29 N 0.34 0.39 -0.47 -0.54 2.02 -0.50 0.77 112.91 114.92 3ci9 h THR 29 Ca 0.17 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 3ci9 h THR 29 Cb 0.11 0.39 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 3ci9 h THR 29 CO -0.14 0.00 -0.14 0.40 0.37 0.00 0.00 175.52 176.01 3ci9 h ILE 30 N -0.13 1.27 0.83 3.11 2.04 -1.22 -2.19 117.51 121.22 3ci9 h ILE 30 Ca 0.20 -1.27 -0.04 0.00 1.00 0.00 0.00 64.86 64.74 3ci9 h ILE 30 Cb 0.44 1.12 0.01 0.00 -0.74 0.00 0.00 36.82 37.65 3ci9 h ILE 30 CO -0.49 0.44 -0.40 0.28 0.00 0.00 0.00 178.15 177.98 3ci9 h SER 31 N 0.77 -0.94 -0.95 1.72 0.02 -0.20 -0.43 113.55 113.53 3ci9 h SER 31 Ca 0.12 0.03 0.26 0.00 -0.84 0.00 0.00 61.79 61.36 3ci9 h SER 31 Cb 0.69 0.24 -0.05 0.00 0.14 0.00 0.00 62.40 63.43 3ci9 h SER 31 CO 0.05 -0.63 0.67 0.44 -1.14 0.00 0.00 176.83 176.22 3ci9 h ASP 32 N -1.20 0.13 -0.35 3.07 3.32 0.45 0.56 116.42 122.40 3ci9 h ASP 32 Ca -0.11 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 56.86 3ci9 h ASP 32 Cb 0.85 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 3ci9 h ASP 32 CO 0.19 0.04 -0.17 -0.61 -1.72 0.00 0.00 179.24 176.97 3ci9 h GLN 33 N 0.13 0.74 0.05 3.56 4.15 -1.02 -2.58 115.11 120.14 3ci9 h GLN 33 Ca 0.47 -0.32 -0.00 0.00 0.77 0.00 0.00 58.65 59.57 3ci9 h GLN 33 Cb 1.66 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 29.32 3ci9 h GLN 33 CO -0.07 0.93 -0.02 0.82 -1.93 0.00 0.00 178.83 178.55 3ci9 h ILE 34 N 0.52 1.24 -0.60 2.39 2.04 0.17 -3.02 117.51 120.26 3ci9 h ILE 34 Ca 0.08 -1.02 0.07 0.00 1.00 0.00 0.00 64.86 64.99 3ci9 h ILE 34 Cb 0.70 1.91 -0.04 0.00 -0.74 0.00 0.00 36.82 38.66 3ci9 h ILE 34 CO 0.05 0.25 0.40 0.40 0.00 0.00 0.00 178.15 179.25 3ci9 h ILE 35 N -0.52 0.99 -0.61 -0.67 2.04 -0.87 -0.58 117.51 117.28 3ci9 h ILE 35 Ca -0.01 -0.19 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 3ci9 h ILE 35 Cb 0.47 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3ci9 h ILE 35 CO 0.01 0.10 0.16 1.23 0.00 0.00 0.00 178.15 179.65 3ci9 h GLY 36 N 0.56 1.04 0.97 5.37 0.00 -1.45 0.45 103.07 110.00 3ci9 h GLY 36 Ca 0.26 -0.64 -0.06 0.00 0.00 0.00 0.00 47.33 46.89 3ci9 h GLY 36 CO -0.08 0.60 0.04 3.21 0.00 0.00 0.00 176.54 180.31 3ci9 h ARG 37 N 0.88 0.77 -0.74 4.80 3.08 -1.02 -2.17 114.38 119.98 3ci9 h ARG 37 Ca 0.19 -0.23 -0.06 0.00 0.07 0.00 0.00 59.98 59.96 3ci9 h ARG 37 Cb 0.33 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3ci9 h ARG 37 CO -0.00 0.81 0.23 0.82 -1.07 0.00 0.00 179.97 180.76 3ci9 h ILE 38 N 0.63 1.26 -0.52 2.04 2.04 -1.09 -0.44 117.51 121.43 3ci9 h ILE 38 Ca 0.13 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 3ci9 h ILE 38 Cb 0.44 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 3ci9 h ILE 38 CO 0.02 0.36 0.18 0.44 0.00 0.00 0.00 178.15 179.14 3ci9 h ASP 39 N 1.10 0.69 0.43 1.72 3.32 -0.66 0.22 116.42 123.24 3ci9 h ASP 39 Ca 0.24 -0.09 -0.22 0.00 0.02 0.00 0.00 57.03 56.98 3ci9 h ASP 39 Cb 0.30 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 3ci9 h ASP 39 CO -0.01 0.64 -0.92 -0.78 -1.72 0.00 0.00 179.24 176.46 3ci9 h ASP 40 N 0.74 0.43 -0.44 6.45 -0.00 -0.92 -2.66 116.42 120.02 3ci9 h ASP 40 Ca 0.18 -0.34 -0.07 0.00 -0.00 0.00 0.00 57.03 56.79 3ci9 h ASP 40 Cb 0.19 -0.13 -0.02 0.00 -0.00 0.00 0.00 39.33 39.37 3ci9 h ASP 40 CO -0.01 1.15 0.01 0.24 -0.00 0.00 0.00 179.24 180.62 3ci9 h MET 41 N 0.18 0.77 -0.94 0.28 2.86 -0.54 -2.10 114.93 115.45 3ci9 h MET 41 Ca -0.07 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 3ci9 h MET 41 Cb 1.55 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 33.10 3ci9 h MET 41 CO 0.15 0.83 0.59 0.77 1.06 0.00 0.00 176.91 180.32 3ci9 h SER 42 N 0.62 1.10 -0.19 1.22 0.02 -0.59 0.14 113.55 115.87 3ci9 h SER 42 Ca 0.13 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 3ci9 h SER 42 Cb 0.48 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.71 3ci9 h SER 42 CO 0.02 0.82 -0.03 -1.28 -1.14 0.00 0.00 176.83 175.22 3ci9 h SER 43 N 1.28 -0.15 -0.50 3.07 0.87 -1.10 0.63 113.55 117.66 3ci9 h SER 43 Ca 0.34 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.92 3ci9 h SER 43 Cb -0.10 0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 3ci9 h SER 43 CO -0.07 -0.05 0.16 0.03 -0.53 0.00 0.00 176.83 176.37 3ci9 h ARG 44 N 0.02 0.77 -0.88 2.24 3.08 -0.81 -2.51 114.38 116.30 3ci9 h ARG 44 Ca 0.09 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3ci9 h ARG 44 Cb 0.13 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.03 3ci9 h ARG 44 CO -0.19 0.72 0.57 0.82 -1.07 0.00 0.00 179.97 180.82 3ci9 h ILE 45 N 0.67 1.23 -0.23 2.04 2.04 -0.53 -0.07 117.51 122.66 3ci9 h ILE 45 Ca 0.16 -0.45 0.05 0.00 1.00 0.00 0.00 64.86 65.62 3ci9 h ILE 45 Cb 0.27 -0.05 -0.05 0.00 -0.74 0.00 0.00 36.82 36.25 3ci9 h ILE 45 CO -0.01 0.23 -0.07 0.44 0.00 0.00 0.00 178.15 178.74 3ci9 h ASP 46 N 1.20 -0.25 -0.57 1.72 3.32 -0.59 -0.41 116.42 120.83 3ci9 h ASP 46 Ca 0.32 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.40 3ci9 h ASP 46 Cb -0.11 0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.57 3ci9 h ASP 46 CO -0.07 -0.09 0.20 0.44 -1.72 0.00 0.00 179.24 178.00 3ci9 h ASP 47 N -0.02 0.85 -0.30 6.45 3.45 -0.98 -0.12 116.42 125.75 3ci9 h ASP 47 Ca 0.11 -0.13 -0.02 0.00 0.43 0.00 0.00 57.03 57.42 3ci9 h ASP 47 Cb 0.19 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 38.73 3ci9 h ASP 47 CO -0.25 0.79 0.11 -0.07 -1.57 0.00 0.00 179.24 178.25 3ci9 h LEU 48 N 0.89 0.42 -1.01 1.55 3.38 -0.46 0.48 115.31 120.56 3ci9 h LEU 48 Ca 0.20 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 3ci9 h LEU 48 Cb 0.24 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3ci9 h LEU 48 CO -0.01 0.48 -0.10 -0.33 0.09 0.00 0.00 178.44 178.57 3ci9 h GLU 49 N 0.33 0.60 -0.40 1.13 5.08 -0.77 -2.28 114.58 118.26 3ci9 h GLU 49 Ca 0.10 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 3ci9 h GLU 49 Cb 0.20 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3ci9 h GLU 49 CO -0.01 0.69 -0.06 0.87 -1.00 0.00 0.00 179.01 179.51 3ci9 h LYS 50 N 0.55 0.75 0.33 2.33 1.57 -0.73 -2.61 116.57 118.77 3ci9 h LYS 50 Ca 0.10 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 3ci9 h LYS 50 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.76 3ci9 h LYS 50 CO 0.03 0.87 -0.16 -0.97 -0.57 0.00 0.00 179.45 178.64 3ci9 h ASN 51 N 0.57 -0.38 -0.71 0.86 -0.00 -0.65 -3.06 115.58 112.21 3ci9 h ASN 51 Ca 0.11 -0.11 0.01 0.00 -0.00 0.00 0.00 56.30 56.31 3ci9 h ASN 51 Cb 0.57 0.10 -0.04 0.00 -0.00 0.00 0.00 38.32 38.95 3ci9 h ASN 51 CO 0.03 -0.11 0.47 0.16 -0.00 0.00 0.00 177.43 177.98 3ci9 h ILE 52 N -0.66 1.17 0.00 2.57 3.07 -1.50 -3.51 117.51 118.64 3ci9 h ILE 52 Ca -0.05 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.04 3ci9 h ILE 52 Cb 0.47 0.15 0.00 0.00 -0.27 0.00 0.00 36.82 37.16 3ci9 h ILE 52 CO 0.08 0.17 0.00 0.00 -1.05 0.00 0.00 178.15 177.35