#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iij h GLN 2 N 0.00 -0.06 0.22 3.44 7.50 -2.07 -1.96 115.11 122.18 1iij h GLN 2 Ca 0.00 0.00 -0.33 0.00 0.50 0.00 0.00 58.65 58.83 1iij h GLN 2 Cb 0.00 0.01 0.04 0.00 0.05 0.00 0.00 27.48 27.58 1iij h GLN 2 CO 0.00 0.06 -1.42 -0.09 -1.50 0.00 0.00 178.83 175.87 1iij h ARG 3 N -0.16 0.57 -0.93 1.46 9.65 -2.06 -3.40 114.38 119.51 1iij h ARG 3 Ca -0.01 -0.91 -0.01 0.00 -1.10 0.00 0.00 59.98 57.95 1iij h ARG 3 Cb 0.14 0.33 -0.04 0.00 -1.39 0.00 0.00 29.97 29.01 1iij h ARG 3 CO 0.01 1.43 0.54 0.00 2.80 0.00 0.00 179.97 184.75 1iij h ALA 4 N 0.19 1.19 0.62 2.80 0.00 -2.00 -2.76 119.26 119.30 1iij h ALA 4 Ca -0.24 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1iij h ALA 4 Cb 2.11 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 19.53 1iij h ALA 4 CO 0.27 0.67 -0.30 1.03 0.00 0.00 0.00 179.25 180.92 1iij h SER 5 N 1.29 -0.71 -0.66 0.00 0.87 -1.58 -1.35 113.55 111.40 1iij h SER 5 Ca 0.33 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.89 1iij h SER 5 Cb -0.02 0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.09 1iij h SER 5 CO -0.06 -0.46 0.39 1.55 -0.53 0.00 0.00 176.83 177.72 1iij h PRO 6 N -0.90 0.92 -0.48 2.24 0.13 -1.78 -1.66 132.00 130.47 1iij h PRO 6 Ca -0.09 -0.08 -0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1iij h PRO 6 Cb 0.67 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 31.58 1iij h PRO 6 CO 0.14 0.66 0.29 0.28 -0.23 0.00 0.00 178.00 179.14 1iij h VAL 7 N 0.93 1.15 -0.58 1.56 2.07 -1.58 -1.33 116.25 118.48 1iij h VAL 7 Ca 0.24 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.46 1iij h VAL 7 Cb -0.01 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1iij h VAL 7 CO -0.04 0.15 0.34 0.74 0.02 0.00 0.00 177.57 178.78 1iij h THR 8 N 0.64 1.04 -0.68 2.57 2.02 -1.10 -1.55 112.91 115.85 1iij h THR 8 Ca 0.17 -0.23 0.06 0.00 0.77 0.00 0.00 66.41 67.18 1iij h THR 8 Cb -0.01 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 66.66 1iij h THR 8 CO -0.03 0.12 0.38 0.15 0.37 0.00 0.00 175.52 176.51 1iij h PHE 9 N 0.67 0.69 -0.27 3.16 3.57 -1.24 -1.27 116.94 122.25 1iij h PHE 9 Ca 0.24 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.77 1iij h PHE 9 Cb 0.05 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 1iij h PHE 9 CO -0.06 0.32 0.17 0.82 -2.23 0.00 0.00 178.31 177.33 1iij h ILE 10 N 0.69 1.08 0.04 1.41 2.04 -1.10 -0.62 117.51 121.05 1iij h ILE 10 Ca 0.31 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 66.01 1iij h ILE 10 Cb 0.20 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1iij h ILE 10 CO -0.19 0.08 -0.18 0.40 0.00 0.00 0.00 178.15 178.26 1iij h ILE 11 N 0.35 0.57 -0.99 -0.67 2.04 -1.21 -2.00 117.51 115.61 1iij h ILE 11 Ca 0.10 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.04 1iij h ILE 11 Cb -0.01 0.57 -0.07 0.00 -0.74 0.00 0.00 36.82 36.57 1iij h ILE 11 CO -0.02 0.00 0.63 0.00 0.00 0.00 0.00 178.15 178.76 1iij h ALA 12 N 0.56 1.40 0.03 1.87 0.00 -1.26 -2.98 119.26 118.89 1iij h ALA 12 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1iij h ALA 12 Cb 0.37 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1iij h ALA 12 CO -0.14 0.35 -0.01 1.15 0.00 0.00 0.00 179.25 180.60 1iij h THR 13 N 1.09 1.09 -0.67 0.00 2.02 -0.99 -2.26 112.91 113.20 1iij h THR 13 Ca 0.45 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 67.24 1iij h THR 13 Cb 0.27 1.35 -0.03 0.00 -1.74 0.00 0.00 68.15 68.00 1iij h THR 13 CO -0.20 0.10 0.41 1.62 0.37 0.00 0.00 175.52 177.81 1iij h VAL 14 N -0.21 1.19 -0.56 3.16 3.04 -1.39 -1.17 116.25 120.31 1iij h VAL 14 Ca -0.00 -0.43 -0.06 0.00 -1.01 0.00 0.00 66.70 65.20 1iij h VAL 14 Cb 0.19 0.26 -0.02 0.00 -2.01 0.00 0.00 31.29 29.71 1iij h VAL 14 CO 0.01 0.20 0.11 -0.37 -1.01 0.00 0.00 177.57 176.51 1iij h VAL 15 N 0.92 1.25 -0.36 1.51 -1.51 -1.62 -1.75 116.25 114.69 1iij h VAL 15 Ca 0.24 -0.93 0.02 0.00 -1.23 0.00 0.00 66.70 64.81 1iij h VAL 15 Cb -0.03 0.77 -0.03 0.00 -2.13 0.00 0.00 31.29 29.87 1iij h VAL 15 CO -0.05 0.34 0.19 1.23 -1.23 0.00 0.00 177.57 178.05 1iij h GLY 16 N 0.81 0.49 0.99 5.19 0.00 -1.34 -1.14 103.07 108.07 1iij h GLY 16 Ca 0.17 -0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1iij h GLY 16 CO 0.01 0.11 0.20 -2.08 0.00 0.00 0.00 176.54 174.77 1iij h VAL 17 N 0.38 1.10 -0.33 4.60 2.07 -1.27 -1.42 116.25 121.38 1iij h VAL 17 Ca 0.15 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 67.49 1iij h VAL 17 Cb 0.05 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 1iij h VAL 17 CO -0.10 0.10 0.10 0.25 0.02 0.00 0.00 177.57 177.95 1iij h LEU 18 N 0.42 0.09 -0.79 2.57 5.85 -1.30 -1.40 115.31 120.76 1iij h LEU 18 Ca 0.12 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.90 1iij h LEU 18 Cb -0.01 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1iij h LEU 18 CO -0.02 0.09 0.51 -0.07 -0.34 0.00 0.00 178.44 178.60 1iij h LEU 19 N 0.24 0.85 0.06 2.25 3.38 -1.24 -2.50 115.31 118.35 1iij h LEU 19 Ca 0.15 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1iij h LEU 19 Cb 0.14 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1iij h LEU 19 CO -0.17 0.60 -0.03 0.15 0.09 0.00 0.00 178.44 179.08 1iij h PHE 20 N 1.00 -0.07 -0.67 1.13 3.57 -1.13 -1.03 116.94 119.74 1iij h PHE 20 Ca 0.31 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.77 1iij h PHE 20 Cb -0.03 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1iij h PHE 20 CO -0.03 -0.04 0.28 1.37 -2.23 0.00 0.00 178.31 177.67 1iij h LEU 21 N -0.09 0.89 0.35 0.59 8.10 -1.28 -1.69 115.31 122.17 1iij h LEU 21 Ca -0.01 -0.12 -0.02 0.00 0.11 0.00 0.00 57.88 57.85 1iij h LEU 21 Cb 0.07 -0.23 0.00 0.00 -0.44 0.00 0.00 40.66 40.07 1iij h LEU 21 CO 0.01 0.79 -0.17 0.40 -4.11 0.00 0.00 178.44 175.36 1iij h ILE 22 N 0.96 0.00 0.11 0.15 2.04 -1.51 -1.93 117.51 117.33 1iij h ILE 22 Ca 0.23 -0.60 -0.19 0.00 1.00 0.00 0.00 64.86 65.30 1iij h ILE 22 Cb 0.16 0.00 0.02 0.00 -0.74 0.00 0.00 36.82 36.26 1iij h ILE 22 CO -0.02 0.00 -0.80 -0.07 0.00 0.00 0.00 178.15 177.26 1iij h LEU 23 N -1.06 0.51 0.00 1.44 3.38 -1.28 -2.28 115.31 116.01 1iij h LEU 23 Ca -0.05 -0.90 -0.03 0.00 0.09 0.00 0.00 57.88 56.99 1iij h LEU 23 Cb 0.36 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1iij h LEU 23 CO 0.08 1.37 -0.26 0.58 0.09 0.00 0.00 178.44 180.30 1iij h VAL 24 N -0.27 0.80 0.24 1.22 2.07 -1.49 -3.36 116.25 115.47 1iij h VAL 24 Ca -0.13 -1.67 -0.01 0.00 0.82 0.00 0.00 66.70 65.70 1iij h VAL 24 Cb 1.59 1.59 0.00 0.00 -1.52 0.00 0.00 31.29 32.95 1iij h VAL 24 CO 0.15 0.27 -0.12 0.58 0.02 0.00 0.00 177.57 178.48 1iij h VAL 25 N -1.00 0.49 0.11 2.57 2.07 -1.43 -2.04 116.25 117.02 1iij h VAL 25 Ca -0.05 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.54 1iij h VAL 25 Cb 0.63 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1iij h VAL 25 CO -0.03 0.13 -0.05 0.58 0.02 0.00 0.00 177.57 178.21 1iij h VAL 26 N -0.97 0.00 -0.56 2.57 2.07 -1.34 -0.15 116.25 117.86 1iij h VAL 26 Ca -0.03 -0.15 -0.65 0.00 0.82 0.00 0.00 66.70 66.69 1iij h VAL 26 Cb 0.46 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.17 1iij h VAL 26 CO 0.06 0.00 2.63 1.33 0.02 0.00 0.00 177.57 181.60 1iij n VAL 27 N -2.81 4.52 0.00 2.57 0.24 -0.86 -2.17 118.33 119.81 1iij n VAL 27 Ca -0.02 -3.25 0.00 0.00 -2.04 0.00 0.00 64.34 59.04 1iij n VAL 27 Cb 0.06 -2.26 0.00 0.00 -1.47 0.00 0.00 33.84 30.17 1iij n VAL 27 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1iij n GLY 28 N 2.50 -2.23 0.15 7.63 0.00 -1.23 -4.71 105.19 107.29 1iij n GLY 28 Ca 0.67 0.71 -0.13 0.00 0.00 0.00 0.00 46.02 47.27 1iij n GLY 28 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1iij h ILE 29 N 0.00 0.88 -0.53 -0.61 5.03 -1.26 -2.73 117.51 118.29 1iij h ILE 29 Ca 0.00 -0.80 -0.12 0.00 -0.12 0.00 0.00 64.86 63.82 1iij h ILE 29 Cb 0.00 1.32 -0.02 0.00 -3.03 0.00 0.00 36.82 35.10 1iij h ILE 29 CO 0.00 0.17 -0.15 0.25 -0.68 0.00 0.00 178.15 177.74 1iij h LEU 30 N -0.69 1.04 -1.08 1.44 5.85 -1.07 -1.83 115.31 118.96 1iij h LEU 30 Ca -0.03 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.36 1iij h LEU 30 Cb 0.49 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 1iij h LEU 30 CO 0.05 1.17 0.62 0.40 -0.34 0.00 0.00 178.44 180.34 1iij h ILE 31 N 0.90 1.17 -0.81 4.05 1.08 -1.60 -0.06 117.51 122.24 1iij h ILE 31 Ca 0.13 -0.41 0.02 0.00 -0.39 0.00 0.00 64.86 64.21 1iij h ILE 31 Cb 0.73 -0.13 -0.04 0.00 -3.07 0.00 0.00 36.82 34.30 1iij h ILE 31 CO 0.06 0.22 0.53 0.50 -0.69 0.00 0.00 178.15 178.76 1iij h LYS 32 N 1.20 1.02 -0.50 2.37 1.63 -1.35 -3.11 116.57 117.83 1iij h LYS 32 Ca 0.37 -0.06 0.01 0.00 -0.85 0.00 0.00 60.65 60.12 1iij h LYS 32 Cb -0.01 -0.23 -0.03 0.00 -0.60 0.00 0.00 32.23 31.37 1iij h LYS 32 CO -0.11 0.67 0.32 -0.09 -3.45 0.00 0.00 179.45 176.80 1iij h ARG 33 N 1.05 0.64 -3.68 1.90 2.43 -1.09 -3.37 114.38 112.26 1iij h ARG 33 Ca 0.31 -0.04 -0.72 0.00 -0.81 0.00 0.00 59.98 58.72 1iij h ARG 33 Cb -0.05 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.28 1iij h ARG 33 CO -0.09 0.42 2.84 0.54 -1.51 0.00 0.00 179.97 182.17 1iij n ARG 34 N -4.75 3.26 0.00 0.20 1.74 -0.06 -5.11 116.66 111.94 1iij n ARG 34 Ca 0.02 -2.89 0.00 0.00 -0.77 0.00 0.00 57.85 54.22 1iij n ARG 34 Cb 0.03 -3.10 0.00 0.00 -1.02 0.00 0.00 32.46 28.37 1iij n ARG 34 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00