#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ozj s THR 8 N 0.00 2.94 0.00 4.37 2.01 -1.26 -5.08 115.64 118.63 1ozj s THR 8 Ca 0.00 -3.33 0.00 0.00 0.31 0.00 0.00 61.69 58.67 1ozj s THR 8 Cb 0.00 -2.99 0.00 0.00 0.01 0.00 0.00 72.50 69.52 1ozj s THR 8 CO 0.00 -0.84 0.00 -0.81 -0.69 0.00 0.00 174.62 172.28 1ozj n PRO 9 N 3.09 0.00 -0.20 4.92 -0.04 -1.26 -4.61 135.00 136.90 1ozj n PRO 9 Ca 0.07 0.00 0.19 0.00 -0.04 0.00 0.00 63.50 63.72 1ozj n PRO 9 Cb 0.34 0.00 0.54 0.00 -0.04 0.00 0.00 33.50 34.34 1ozj n PRO 9 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1ozj h PRO 10 N 0.00 0.34 -0.86 0.54 0.13 -1.99 0.43 132.00 130.59 1ozj h PRO 10 Ca 0.00 -0.02 0.19 0.00 -0.87 0.00 0.00 66.00 65.30 1ozj h PRO 10 Cb 0.00 -0.08 -0.11 0.00 0.13 0.00 0.00 31.00 30.94 1ozj h PRO 10 CO 0.00 0.22 0.37 0.97 -0.23 0.00 0.00 178.00 179.33 1ozj h ILE 11 N 0.35 0.55 -0.45 -3.56 6.09 -1.99 0.97 117.51 119.47 1ozj h ILE 11 Ca 0.42 -0.15 -0.10 0.00 -1.37 0.00 0.00 64.86 63.66 1ozj h ILE 11 Cb 1.12 0.07 -0.02 0.00 0.47 0.00 0.00 36.82 38.46 1ozj h ILE 11 CO -0.13 0.08 -0.14 0.58 -3.07 0.00 0.00 178.15 175.47 1ozj h VAL 12 N 0.44 1.26 -0.24 2.19 2.07 -1.19 0.11 116.25 120.89 1ozj h VAL 12 Ca 0.51 -1.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.74 1ozj h VAL 12 Cb 0.89 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1ozj h VAL 12 CO -0.48 0.42 -0.06 0.11 0.02 0.00 0.00 177.57 177.59 1ozj h LYS 13 N 0.75 0.46 0.21 1.57 1.79 -0.28 0.65 116.57 121.71 1ozj h LYS 13 Ca 0.12 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 1ozj h LYS 13 Cb 0.65 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.26 1ozj h LYS 13 CO 0.05 0.69 -0.18 0.00 -1.08 0.00 0.00 179.45 178.93 1ozj h ARG 14 N 0.19 -0.39 -0.23 3.15 3.08 0.92 -2.23 114.38 118.88 1ozj h ARG 14 Ca 0.06 0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1ozj h ARG 14 Cb 0.52 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 1ozj h ARG 14 CO 0.02 -0.26 0.04 -0.07 -1.07 0.00 0.00 179.97 178.63 1ozj h LEU 15 N -0.41 0.29 -1.42 3.04 3.38 -0.94 -0.77 115.31 118.49 1ozj h LEU 15 Ca -0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1ozj h LEU 15 Cb 0.37 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1ozj h LEU 15 CO -0.03 0.32 0.10 -0.07 0.09 0.00 0.00 178.44 178.85 1ozj h LEU 16 N 0.32 0.44 -1.59 1.67 3.38 -0.49 -2.61 115.31 116.44 1ozj h LEU 16 Ca 0.08 -0.05 0.20 0.00 0.09 0.00 0.00 57.88 58.20 1ozj h LEU 16 Cb 0.16 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 1ozj h LEU 16 CO -0.00 0.44 0.58 1.23 0.09 0.00 0.00 178.44 180.77 1ozj h GLY 17 N 0.69 0.73 -5.80 0.83 0.00 -0.54 -2.07 103.07 96.91 1ozj h GLY 17 Ca 0.12 -0.16 -0.71 0.00 0.00 0.00 0.00 47.33 46.57 1ozj h GLY 17 CO -0.01 0.00 3.05 0.79 0.00 0.00 0.00 176.54 180.37 1ozj n TRP 18 N -4.48 3.06 -1.17 5.60 7.02 -0.98 -4.39 117.44 122.10 1ozj n TRP 18 Ca 0.18 -2.96 0.00 0.00 -1.02 0.00 0.00 57.50 53.70 1ozj n TRP 18 Cb 0.70 -2.36 0.00 0.00 -2.42 0.00 0.00 31.31 27.23 1ozj n TRP 18 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 1ozj n LYS 19 N 4.64 0.00 0.28 -0.99 3.00 -1.21 -4.65 118.16 119.22 1ozj n LYS 19 Ca 0.57 0.39 -0.15 0.00 -0.00 0.00 0.00 58.31 59.12 1ozj n LYS 19 Cb 0.33 -0.97 -0.08 0.00 0.00 0.00 0.00 35.03 34.31 1ozj n LYS 19 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.40 178.97 1ozj h LYS 20 N 0.00 -0.84 0.00 1.64 2.10 -1.58 -3.43 116.57 114.47 1ozj h LYS 20 Ca 0.00 0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.71 1ozj h LYS 20 Cb 0.00 0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 1ozj h LYS 20 CO 0.00 -0.56 0.00 0.41 -2.00 0.00 0.00 179.45 177.30 1ozj n GLY 21 N -1.47 -1.05 1.35 0.07 0.00 -1.26 -4.82 105.19 98.02 1ozj n GLY 21 Ca -0.10 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1ozj n GLY 21 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ozj n GLU 22 N 0.00 0.00 0.00 1.61 4.71 -1.26 -4.58 120.64 121.12 1ozj n GLU 22 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1ozj n GLU 22 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1ozj n GLU 22 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1ozj n GLN 23 N -0.26 0.00 -1.31 3.49 1.13 -1.26 -4.97 117.38 114.20 1ozj n GLN 23 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 1ozj n GLN 23 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 1ozj n GLN 23 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1ozj n ASN 24 N -2.08 -1.74 0.00 1.08 2.85 -1.26 -3.87 115.26 110.24 1ozj n ASN 24 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1ozj n ASN 24 Cb 0.00 -0.87 0.00 0.00 1.24 0.00 0.00 39.78 40.15 1ozj n ASN 24 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ozj n GLY 25 N -0.58 0.00 0.20 8.20 0.00 -1.26 0.20 105.19 111.94 1ozj n GLY 25 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 1ozj n GLY 25 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1ozj h GLN 26 N 0.00 0.61 -0.93 1.61 5.75 -2.00 -2.45 115.11 117.70 1ozj h GLN 26 Ca 0.00 -0.07 0.08 0.00 -0.15 0.00 0.00 58.65 58.51 1ozj h GLN 26 Cb 0.00 -0.12 -0.06 0.00 1.07 0.00 0.00 27.48 28.37 1ozj h GLN 26 CO 0.00 0.49 0.60 1.49 -2.65 0.00 0.00 178.83 178.76 1ozj h GLU 27 N 0.58 0.98 -0.47 1.69 4.57 0.21 -1.49 114.58 120.65 1ozj h GLU 27 Ca 0.16 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.32 1ozj h GLU 27 Cb 0.05 -0.22 -0.04 0.00 -0.16 0.00 0.00 28.75 28.38 1ozj h GLU 27 CO -0.03 0.65 0.23 1.49 -1.18 0.00 0.00 179.01 180.17 1ozj h GLU 28 N 1.01 0.44 0.00 1.92 4.57 -0.94 -1.36 114.58 120.22 1ozj h GLU 28 Ca 0.41 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.52 1ozj h GLU 28 Cb 0.27 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 1ozj h GLU 28 CO -0.17 0.29 -0.21 -0.22 -1.18 0.00 0.00 179.01 177.52 1ozj h LYS 29 N 0.45 0.00 0.22 1.92 1.63 -1.12 -3.01 116.57 116.67 1ozj h LYS 29 Ca 0.20 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.99 1ozj h LYS 29 Cb 0.12 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.75 1ozj h LYS 29 CO -0.15 0.21 -0.11 2.35 -3.45 0.00 0.00 179.45 178.31 1ozj h TRP 30 N 0.00 -0.28 -0.84 1.91 7.01 -0.50 -2.38 115.95 120.87 1ozj h TRP 30 Ca -0.00 -0.01 0.19 0.00 2.11 0.00 0.00 58.89 61.18 1ozj h TRP 30 Cb 0.61 0.09 -0.06 0.00 -2.10 0.00 0.00 29.16 27.70 1ozj h TRP 30 CO 0.00 0.07 0.56 0.00 -2.79 0.00 0.00 178.44 176.28 1ozj h GLU 32 N 0.37 0.64 -0.52 0.00 4.81 -1.39 -0.54 114.58 117.95 1ozj h GLU 32 Ca 0.42 -0.21 0.01 0.00 -0.13 0.00 0.00 59.36 59.45 1ozj h GLU 32 Cb 1.09 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 1ozj h GLU 32 CO -0.14 0.76 0.33 0.87 -0.73 0.00 0.00 179.01 180.11 1ozj h LYS 33 N 0.45 0.65 -0.97 1.92 1.79 -0.15 0.20 116.57 120.46 1ozj h LYS 33 Ca 0.10 -0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.54 1ozj h LYS 33 Cb 0.48 -0.15 -0.05 0.00 -1.58 0.00 0.00 32.23 30.94 1ozj h LYS 33 CO 0.02 0.43 0.63 0.00 -1.08 0.00 0.00 179.45 179.45 1ozj h ALA 34 N 1.21 1.28 -0.06 3.86 0.00 -0.31 -0.15 119.26 125.08 1ozj h ALA 34 Ca 0.20 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.82 1ozj h ALA 34 Cb -0.04 -0.39 0.01 0.00 0.00 0.00 0.00 17.79 17.37 1ozj h ALA 34 CO -0.06 0.65 -0.80 0.28 0.00 0.00 0.00 179.25 179.32 1ozj h VAL 35 N 1.32 1.32 -0.73 0.00 2.07 -0.69 -2.63 116.25 116.91 1ozj h VAL 35 Ca 0.35 -2.07 0.07 0.00 0.82 0.00 0.00 66.70 65.88 1ozj h VAL 35 Cb -0.13 2.28 -0.06 0.00 -1.52 0.00 0.00 31.29 31.86 1ozj h VAL 35 CO -0.07 0.63 0.40 0.11 0.02 0.00 0.00 177.57 178.66 1ozj h LYS 36 N 0.29 0.70 -0.23 1.57 1.79 -0.26 0.95 116.57 121.38 1ozj h LYS 36 Ca -0.08 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 1ozj h LYS 36 Cb 1.46 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 31.94 1ozj h LYS 36 CO 0.16 0.46 0.05 1.03 -1.08 0.00 0.00 179.45 180.08 1ozj h SER 37 N 0.72 0.35 -0.33 0.86 0.87 -1.04 -2.20 113.55 112.78 1ozj h SER 37 Ca 0.34 -0.23 -0.02 0.00 -1.23 0.00 0.00 61.79 60.65 1ozj h SER 37 Cb 0.26 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 1ozj h SER 37 CO -0.21 0.49 0.14 0.25 -0.53 0.00 0.00 176.83 176.97 1ozj h LEU 38 N 0.19 0.45 -0.31 2.23 5.85 -1.02 -3.02 115.31 119.67 1ozj h LEU 38 Ca 0.07 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.67 1ozj h LEU 38 Cb 0.28 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1ozj h LEU 38 CO 0.00 0.48 0.10 0.58 -0.34 0.00 0.00 178.44 179.26 1ozj h VAL 39 N 0.39 0.90 -0.66 1.05 2.07 -0.79 -2.22 116.25 117.00 1ozj h VAL 39 Ca 0.11 -0.08 0.12 0.00 0.82 0.00 0.00 66.70 67.67 1ozj h VAL 39 Cb 0.16 0.65 -0.09 0.00 -1.52 0.00 0.00 31.29 30.49 1ozj h VAL 39 CO -0.01 0.04 0.20 0.50 0.02 0.00 0.00 177.57 178.32 1ozj h LYS 40 N 0.24 0.33 -0.16 1.57 3.64 -1.32 0.38 116.57 121.24 1ozj h LYS 40 Ca 0.14 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.35 1ozj h LYS 40 Cb 0.12 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1ozj h LYS 40 CO -0.15 0.22 -0.54 0.87 -2.27 0.00 0.00 179.45 177.58 1ozj h LYS 41 N 0.34 0.46 0.00 1.90 1.57 -1.35 -2.87 116.57 116.61 1ozj h LYS 41 Ca 0.35 -0.28 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1ozj h LYS 41 Cb 0.51 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1ozj h LYS 41 CO -0.40 0.88 -0.25 -0.07 -0.57 0.00 0.00 179.45 179.05 1ozj h LEU 42 N 0.35 0.00 -0.10 2.94 3.38 -0.83 -2.95 115.31 118.10 1ozj h LEU 42 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1ozj h LEU 42 Cb 1.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1ozj h LEU 42 CO 0.10 0.25 -0.02 0.50 0.09 0.00 0.00 178.44 179.35 1ozj h LYS 43 N 0.00 0.19 0.00 1.13 3.64 -0.77 0.57 116.57 121.32 1ozj h LYS 43 Ca -0.00 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1ozj h LYS 43 Cb 0.97 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1ozj h LYS 43 CO 0.03 0.50 -0.05 0.87 -2.27 0.00 0.00 179.45 178.54 1ozj h LYS 44 N -0.14 0.00 -0.18 1.90 1.57 -1.39 -2.28 116.57 116.05 1ozj h LYS 44 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1ozj h LYS 44 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1ozj h LYS 44 CO 0.01 0.05 0.00 0.25 -0.57 0.00 0.00 179.45 179.19 1ozj n THR 45 N -3.33 1.56 -3.85 -0.16 -2.24 -1.12 -5.00 114.28 100.15 1ozj n THR 45 Ca -0.02 -1.52 -0.30 0.00 -2.27 0.00 0.00 64.05 59.95 1ozj n THR 45 Cb 0.20 0.13 0.02 0.00 -2.10 0.00 0.00 70.33 68.57 1ozj n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ozj n GLY 46 N -0.41 -0.49 0.59 3.38 0.00 0.13 -4.88 105.19 103.52 1ozj n GLY 46 Ca 0.13 0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.40 1ozj n GLY 46 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ozj n GLN 47 N -4.50 1.22 -0.05 1.61 6.02 0.18 -4.76 117.38 117.10 1ozj n GLN 47 Ca 0.04 -1.36 -0.05 0.00 -0.01 0.00 0.00 57.00 55.62 1ozj n GLN 47 Cb 0.52 -1.29 -0.04 0.00 1.02 0.00 0.00 30.24 30.46 1ozj n GLN 47 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1ozj h LEU 48 N 2.91 -0.69 -1.11 1.08 3.38 -1.88 -1.70 115.31 117.30 1ozj h LEU 48 Ca 0.00 0.09 0.26 0.00 0.09 0.00 0.00 57.88 58.32 1ozj h LEU 48 Cb 0.63 0.28 -0.12 0.00 0.09 0.00 0.00 40.66 41.55 1ozj h LEU 48 CO 0.00 -0.15 0.62 0.44 0.09 0.00 0.00 178.44 179.44 1ozj h ASP 49 N -0.14 0.59 -0.10 -0.43 3.32 -1.93 0.98 116.42 118.71 1ozj h ASP 49 Ca 0.03 0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 1ozj h ASP 49 Cb 0.22 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1ozj h ASP 49 CO -0.22 0.07 -0.02 -0.33 -1.72 0.00 0.00 179.24 177.03 1ozj h GLU 50 N 0.50 0.31 -0.03 3.56 4.39 -1.66 0.48 114.58 122.12 1ozj h GLU 50 Ca 0.64 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 60.25 1ozj h GLU 50 Cb 1.37 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1ozj h GLU 50 CO -0.44 0.35 -0.15 1.25 -1.16 0.00 0.00 179.01 178.86 1ozj h LEU 51 N 0.30 0.19 -0.42 1.33 6.46 0.16 -2.44 115.31 120.90 1ozj h LEU 51 Ca 0.07 -0.66 0.09 0.00 -0.12 0.00 0.00 57.88 57.26 1ozj h LEU 51 Cb 0.24 -0.06 -0.08 0.00 -0.73 0.00 0.00 40.66 40.03 1ozj h LEU 51 CO 0.01 0.82 -0.15 -0.08 -0.62 0.00 0.00 178.44 178.41 1ozj h GLU 52 N -0.42 -0.06 0.09 1.25 4.81 -0.70 -1.24 114.58 118.31 1ozj h GLU 52 Ca -0.01 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1ozj h GLU 52 Cb 0.81 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.18 1ozj h GLU 52 CO 0.03 -0.04 -0.33 -0.22 -0.73 0.00 0.00 179.01 177.72 1ozj h LYS 53 N -0.06 -0.46 -0.83 1.92 3.64 -0.90 -0.56 116.57 119.32 1ozj h LYS 53 Ca 0.20 0.03 0.11 0.00 -1.27 0.00 0.00 60.65 59.73 1ozj h LYS 53 Cb 0.37 0.10 -0.08 0.00 -0.41 0.00 0.00 32.23 32.22 1ozj h LYS 53 CO -0.46 -0.31 0.46 0.00 -2.27 0.00 0.00 179.45 176.87 1ozj h ALA 54 N -0.94 1.20 -0.32 5.00 0.00 -1.18 0.32 119.26 123.34 1ozj h ALA 54 Ca -0.01 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1ozj h ALA 54 Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ozj h ALA 54 CO -0.17 0.03 -0.14 0.82 0.00 0.00 0.00 179.25 179.79 1ozj h ILE 55 N 0.73 1.29 -0.00 0.00 1.08 -1.06 0.26 117.51 119.81 1ozj h ILE 55 Ca 0.42 -1.24 -0.20 0.00 -0.39 0.00 0.00 64.86 63.45 1ozj h ILE 55 Cb 0.46 1.42 0.02 0.00 -3.07 0.00 0.00 36.82 35.65 1ozj h ILE 55 CO -0.29 0.40 -0.79 0.71 -0.69 0.00 0.00 178.15 177.49 1ozj h THR 56 N 0.42 1.36 0.00 -0.27 1.35 -0.65 -3.32 112.91 111.80 1ozj h THR 56 Ca 0.07 -2.15 -0.09 0.00 -0.55 0.00 0.00 66.41 63.70 1ozj h THR 56 Cb 0.66 2.50 -0.01 0.00 -1.73 0.00 0.00 68.15 69.57 1ozj h THR 56 CO 0.04 0.64 -1.01 0.71 -0.25 0.00 0.00 175.52 175.66 1ozj h THR 57 N 0.11 0.34 -1.40 6.82 1.35 -0.48 -3.48 112.91 116.18 1ozj h THR 57 Ca -0.10 -1.61 -0.40 0.00 -0.55 0.00 0.00 66.41 63.75 1ozj h THR 57 Cb 1.48 1.91 -0.12 0.00 -1.73 0.00 0.00 68.15 69.69 1ozj h THR 57 CO 0.16 0.20 -0.40 0.00 -0.25 0.00 0.00 175.52 175.22 1ozj n GLN 58 N -2.89 -1.41 -2.50 4.72 6.02 0.93 -4.92 117.38 117.33 1ozj n GLN 58 Ca -0.03 1.13 -0.43 0.00 -0.01 0.00 0.00 57.00 57.66 1ozj n GLN 58 Cb 0.70 -5.53 -0.02 0.00 1.02 0.00 0.00 30.24 26.41 1ozj n GLN 58 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1ozj s ASN 59 N -2.62 6.85 0.59 1.08 2.47 -1.25 -4.90 114.94 117.16 1ozj s ASN 59 Ca 0.00 1.33 0.34 0.00 0.42 0.00 0.00 52.86 54.95 1ozj s ASN 59 Cb 0.00 -2.54 1.84 0.00 -1.45 0.00 0.00 41.25 39.10 1ozj s ASN 59 CO 0.00 -0.90 2.21 0.58 -3.72 0.00 0.00 177.10 175.27 1ozj h VAL 60 N 5.72 0.34 0.00 -5.21 2.07 -1.91 -2.32 116.25 114.94 1ozj h VAL 60 Ca -0.24 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1ozj h VAL 60 Cb 1.09 1.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 1ozj h VAL 60 CO 1.01 0.04 0.00 0.59 0.02 0.00 0.00 177.57 179.23 1ozj n ASN 61 N -3.50 0.00 -4.72 0.57 4.13 -1.26 -4.82 115.26 105.66 1ozj n ASN 61 Ca -0.02 -1.54 -0.30 0.00 1.68 0.00 0.00 54.58 54.40 1ozj n ASN 61 Cb 0.15 0.00 0.14 0.00 -1.54 0.00 0.00 39.78 38.53 1ozj n ASN 61 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1ozj s THR 62 N -2.00 2.63 0.91 3.41 -4.23 -0.87 -5.02 115.64 110.47 1ozj s THR 62 Ca 0.09 0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 60.67 1ozj s THR 62 Cb 0.04 -2.69 0.15 0.00 1.34 0.00 0.00 72.50 71.34 1ozj s THR 62 CO 0.07 -0.27 1.20 -0.54 -0.54 0.00 0.00 174.62 174.54 1ozj s LYS 63 N -4.94 1.11 0.22 3.99 1.02 -1.26 -5.00 119.74 114.89 1ozj s LYS 63 Ca 0.63 0.02 -0.30 0.00 0.02 0.00 0.00 55.97 56.35 1ozj s LYS 63 Cb -0.18 -1.86 -0.09 0.00 -0.52 0.00 0.00 37.83 35.18 1ozj s LYS 63 CO 0.57 -2.16 1.23 0.00 -0.92 0.00 0.00 175.35 174.06 1ozj s ILE 65 N -0.26 4.21 -0.10 0.00 1.01 -1.26 -5.02 121.20 119.79 1ozj s ILE 65 Ca 0.52 -1.36 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 1ozj s ILE 65 Cb -0.34 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.52 1ozj s ILE 65 CO 0.39 -0.47 0.27 -0.89 0.00 0.00 0.00 174.94 174.24 1ozj s THR 66 N 1.43 5.30 -0.00 2.92 2.01 -1.26 -0.20 115.64 125.83 1ozj s THR 66 Ca 0.03 0.50 0.05 0.00 0.31 0.00 0.00 61.69 62.57 1ozj s THR 66 Cb -0.22 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.70 1ozj s THR 66 CO 0.02 0.53 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.70 1ozj s ILE 67 N -0.50 1.21 0.38 1.82 1.09 0.22 -4.90 121.20 120.51 1ozj s ILE 67 Ca 0.18 -0.71 -0.27 0.00 -1.10 0.00 0.00 60.65 58.75 1ozj s ILE 67 Cb -0.14 -1.02 -0.11 0.00 -1.06 0.00 0.00 42.46 40.13 1ozj s ILE 67 CO 0.06 0.30 1.25 -2.65 -0.10 0.00 0.00 174.94 173.80 1ozj n PRO 68 N 2.58 1.95 -3.64 2.79 -0.02 -1.26 0.31 135.00 137.70 1ozj n PRO 68 Ca -0.15 0.69 -0.36 0.00 -2.02 0.00 0.00 63.50 61.66 1ozj n PRO 68 Cb 0.55 -2.32 -0.06 0.00 -0.02 0.00 0.00 33.50 31.66 1ozj n PRO 68 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1ozj s ARG 69 N -2.03 3.72 0.56 -0.52 1.70 -0.89 -4.72 118.95 116.78 1ozj s ARG 69 Ca 0.59 0.14 -0.01 0.00 -0.47 0.00 0.00 55.73 55.98 1ozj s ARG 69 Cb -0.54 -3.11 0.03 0.00 -0.57 0.00 0.00 34.95 30.75 1ozj s ARG 69 CO 0.60 0.65 0.81 -1.54 -1.08 0.00 0.00 175.30 174.74 1ozj s SER 70 N -1.44 5.33 0.22 -2.89 1.04 -1.26 -4.96 113.70 109.73 1ozj s SER 70 Ca 0.26 0.21 -0.12 0.00 0.48 0.00 0.00 55.95 56.78 1ozj s SER 70 Cb -0.14 -1.13 0.27 0.00 0.10 0.00 0.00 66.02 65.12 1ozj s SER 70 CO 0.14 -1.14 1.63 -0.07 0.98 0.00 0.00 173.24 174.79 1ozj h LEU 71 N -0.02 -0.52 -1.60 2.42 -0.00 -1.98 -1.60 115.31 112.01 1ozj h LEU 71 Ca -0.44 0.19 0.00 0.00 -0.00 0.00 0.00 57.88 57.63 1ozj h LEU 71 Cb 1.29 0.37 0.00 0.00 -0.00 0.00 0.00 40.66 42.32 1ozj h LEU 71 CO 0.56 -0.19 0.00 -0.90 -0.00 0.00 0.00 178.44 177.90 1ozj n ASP 72 N -5.40 2.45 0.00 -0.43 5.75 -1.26 -4.94 116.55 112.72 1ozj n ASP 72 Ca 0.09 -1.81 0.00 0.00 -0.01 0.00 0.00 54.79 53.05 1ozj n ASP 72 Cb 0.35 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1ozj n ASP 72 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ozj n GLY 73 N 1.30 2.54 3.90 6.12 0.00 -0.60 -5.02 105.19 113.42 1ozj n GLY 73 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1ozj n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ozj s ARG 74 N -0.08 3.06 -0.04 1.61 0.52 -1.26 -4.42 118.95 118.34 1ozj s ARG 74 Ca 0.00 0.27 0.02 0.00 -0.52 0.00 0.00 55.73 55.50 1ozj s ARG 74 Cb 0.00 -2.18 0.01 0.00 0.52 0.00 0.00 34.95 33.31 1ozj s ARG 74 CO 0.00 -0.74 -0.08 -1.17 0.02 0.00 0.00 175.30 173.34 1ozj s LEU 75 N -5.11 1.61 -0.17 2.53 2.96 0.50 -4.57 118.68 116.43 1ozj s LEU 75 Ca 0.55 -0.18 -0.07 0.00 -0.22 0.00 0.00 54.13 54.21 1ozj s LEU 75 Cb -0.11 -0.54 -0.04 0.00 0.50 0.00 0.00 46.19 46.00 1ozj s LEU 75 CO 0.48 0.02 0.07 -1.58 -1.32 0.00 0.00 176.35 174.02 1ozj s GLN 76 N 0.52 3.89 -0.13 1.98 0.74 -1.26 -1.32 119.66 124.08 1ozj s GLN 76 Ca -0.08 -0.32 -0.00 0.00 0.05 0.00 0.00 55.36 55.00 1ozj s GLN 76 Cb -0.12 -3.20 0.03 0.00 1.10 0.00 0.00 33.01 30.82 1ozj s GLN 76 CO 0.01 0.34 -0.08 0.08 -0.55 0.00 0.00 175.29 175.10 1ozj s VAL 77 N 0.17 1.09 0.00 1.34 1.01 -0.29 -5.00 120.40 118.73 1ozj s VAL 77 Ca 0.05 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1ozj s VAL 77 Cb -0.12 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.13 1ozj s VAL 77 CO 0.00 0.34 0.00 -0.24 0.00 0.00 0.00 175.10 175.20 1ozj n SER 78 N 4.92 0.00 -0.36 3.32 2.88 -1.26 -1.67 113.62 121.44 1ozj n SER 78 Ca -0.13 0.00 0.04 0.00 -1.33 0.00 0.00 58.87 57.46 1ozj n SER 78 Cb 0.50 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 64.00 1ozj n SER 78 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1ozj n HIS 79 N 6.80 0.04 -3.96 0.66 -0.00 -1.26 -5.01 115.22 112.49 1ozj n HIS 79 Ca 0.00 -0.05 -0.28 0.00 -0.00 0.00 0.00 57.72 57.39 1ozj n HIS 79 Cb 0.00 -0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 29.95 1ozj n HIS 79 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.34 177.37 1ozj s ARG 80 N -0.75 3.34 0.16 -0.41 1.81 -0.67 -5.11 118.95 117.32 1ozj s ARG 80 Ca 0.11 -0.59 0.10 0.00 -1.72 0.00 0.00 55.73 53.63 1ozj s ARG 80 Cb 0.07 -2.94 -0.04 0.00 -0.45 0.00 0.00 34.95 31.60 1ozj s ARG 80 CO 0.11 0.55 -0.23 0.15 -0.68 0.00 0.00 175.30 175.19 1ozj s LYS 81 N -2.95 1.39 0.00 3.54 1.02 -1.26 -1.14 119.74 120.34 1ozj s LYS 81 Ca 0.34 -1.41 0.00 0.00 0.02 0.00 0.00 55.97 54.92 1ozj s LYS 81 Cb -0.12 -1.71 0.00 0.00 -0.52 0.00 0.00 37.83 35.49 1ozj s LYS 81 CO 0.27 0.38 0.00 0.41 -0.92 0.00 0.00 175.35 175.49 1ozj n GLY 82 N 0.55 0.35 3.71 -3.33 0.00 -0.43 -4.94 105.19 101.10 1ozj n GLY 82 Ca -0.15 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 1ozj n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ozj s LEU 83 N 0.00 4.37 0.11 0.99 1.43 -1.26 -0.37 118.68 123.96 1ozj s LEU 83 Ca 0.00 1.79 -0.27 0.00 -1.03 0.00 0.00 54.13 54.63 1ozj s LEU 83 Cb 0.00 -3.57 -0.08 0.00 0.03 0.00 0.00 46.19 42.56 1ozj s LEU 83 CO 0.00 -0.33 1.45 -0.65 0.23 0.00 0.00 176.35 177.05 1ozj h PRO 84 N 6.77 -0.23 -0.93 1.29 0.11 -1.91 0.04 132.00 137.13 1ozj h PRO 84 Ca -0.41 0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.77 1ozj h PRO 84 Cb 1.22 0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.32 1ozj h PRO 84 CO 0.77 -0.16 0.61 1.12 -0.21 0.00 0.00 178.00 180.13 1ozj h HIS 85 N -0.24 1.09 -0.50 0.65 2.07 -1.93 -1.69 115.15 114.60 1ozj h HIS 85 Ca 0.08 0.03 -0.02 0.00 -2.85 0.00 0.00 60.37 57.61 1ozj h HIS 85 Cb 0.45 -0.36 -0.02 0.00 2.57 0.00 0.00 27.41 30.05 1ozj h HIS 85 CO -0.79 0.58 0.25 0.28 -3.07 0.00 0.00 177.93 175.19 1ozj h VAL 86 N 1.09 1.19 -0.65 6.12 2.07 -1.72 -1.00 116.25 123.36 1ozj h VAL 86 Ca 0.39 -0.53 -0.06 0.00 0.82 0.00 0.00 66.70 67.33 1ozj h VAL 86 Cb 0.15 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1ozj h VAL 86 CO -0.14 0.21 0.19 0.40 0.02 0.00 0.00 177.57 178.25 1ozj h ILE 87 N 0.67 1.25 0.00 4.57 2.04 -0.15 -1.93 117.51 123.95 1ozj h ILE 87 Ca 0.17 -0.88 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 1ozj h ILE 87 Cb 0.11 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1ozj h ILE 87 CO -0.02 0.34 -0.61 1.88 0.00 0.00 0.00 178.15 179.73 1ozj h TYR 88 N 0.95 0.00 0.05 1.37 -1.99 -1.28 -2.40 116.97 113.67 1ozj h TYR 88 Ca 0.21 0.00 -0.24 0.00 2.00 0.00 0.00 58.73 60.69 1ozj h TYR 88 Cb 0.32 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.05 1ozj h TYR 88 CO 0.02 0.20 -1.05 0.00 -0.00 0.00 0.00 178.16 177.33 1ozj h ARG 90 N 0.17 0.02 0.04 0.00 2.43 -1.39 0.14 114.38 115.80 1ozj h ARG 90 Ca -0.10 -0.01 -0.23 0.00 -0.81 0.00 0.00 59.98 58.83 1ozj h ARG 90 Cb 1.72 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.27 1ozj h ARG 90 CO 0.18 0.62 -1.01 1.25 -1.51 0.00 0.00 179.97 179.50 1ozj h LEU 91 N 0.01 0.33 0.00 3.80 6.46 -1.36 -3.06 115.31 121.49 1ozj h LEU 91 Ca -0.01 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.45 1ozj h LEU 91 Cb 1.08 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.91 1ozj h LEU 91 CO 0.08 1.15 -0.42 0.79 -0.62 0.00 0.00 178.44 179.43 1ozj n TRP 92 N -3.60 0.00 0.00 1.25 8.01 -0.93 -4.70 117.44 117.47 1ozj n TRP 92 Ca -0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.14 1ozj n TRP 92 Cb 0.89 -0.02 0.00 0.00 -2.01 0.00 0.00 31.31 30.17 1ozj n TRP 92 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.69 177.22 1ozj n ARG 93 N -1.22 0.00 -3.63 -0.99 5.12 0.33 -4.93 116.66 111.35 1ozj n ARG 93 Ca 0.01 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.54 1ozj n ARG 93 Cb 0.10 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.32 1ozj n ARG 93 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1ozj s TRP 94 N -0.16 3.49 -0.32 -1.55 0.51 -0.22 -4.90 118.94 115.78 1ozj s TRP 94 Ca 0.00 -2.48 0.22 0.00 -2.12 0.00 0.00 56.10 51.72 1ozj s TRP 94 Cb 0.00 -3.35 1.08 0.00 -0.81 0.00 0.00 33.47 30.38 1ozj s TRP 94 CO 0.00 -0.89 1.66 -0.35 -0.51 0.00 0.00 176.95 176.86 1ozj n PRO 95 N 3.77 0.15 0.14 4.98 -0.04 -1.15 -0.87 135.00 141.98 1ozj n PRO 95 Ca 0.07 0.56 0.02 0.00 -0.04 0.00 0.00 63.50 64.11 1ozj n PRO 95 Cb 0.40 -1.92 0.11 0.00 -0.04 0.00 0.00 33.50 32.06 1ozj n PRO 95 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1ozj h ASP 96 N 0.00 0.00 -0.99 3.54 1.82 -1.91 -3.47 116.42 115.42 1ozj h ASP 96 Ca 0.00 0.00 -0.77 0.00 -0.39 0.00 0.00 57.03 55.87 1ozj h ASP 96 Cb 0.13 0.00 0.05 0.00 0.68 0.00 0.00 39.33 40.19 1ozj h ASP 96 CO 0.00 0.56 0.02 -0.11 -1.61 0.00 0.00 179.24 178.10 1ozj n LEU 97 N -3.39 -0.09 -0.05 2.28 7.94 -0.05 -4.95 117.00 118.70 1ozj n LEU 97 Ca 0.01 1.15 -0.06 0.00 -1.11 0.00 0.00 56.01 55.99 1ozj n LEU 97 Cb 0.69 -0.91 -0.02 0.00 0.53 0.00 0.00 43.42 43.70 1ozj n LEU 97 CO 0.40 -1.96 -0.46 1.57 -1.11 0.00 0.00 177.39 175.84 1ozj n HIS 98 N 1.38 0.00 -4.36 1.96 -0.00 -1.26 -5.00 115.22 107.95 1ozj n HIS 98 Ca 0.20 0.00 -0.18 0.00 -0.00 0.00 0.00 57.72 57.74 1ozj n HIS 98 Cb 0.09 -0.34 -0.10 0.00 -0.00 0.00 0.00 29.99 29.64 1ozj n HIS 98 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1ozj s SER 99 N -5.79 1.61 0.00 0.26 1.04 -1.26 -5.02 113.70 104.54 1ozj s SER 99 Ca -0.20 -1.36 0.04 0.00 0.48 0.00 0.00 55.95 54.92 1ozj s SER 99 Cb 0.03 0.07 0.18 0.00 0.10 0.00 0.00 66.02 66.40 1ozj s SER 99 CO 0.29 -0.67 1.07 0.00 0.98 0.00 0.00 173.24 174.91 1ozj n HIS 100 N -0.52 0.00 0.09 5.02 1.44 -1.26 -1.94 115.22 118.05 1ozj n HIS 100 Ca -0.01 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.67 1ozj n HIS 100 Cb 0.66 -0.43 -0.06 0.00 0.12 0.00 0.00 29.99 30.28 1ozj n HIS 100 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1ozj h HIS 101 N 0.00 0.00 0.00 -1.40 3.86 -1.99 -3.06 115.15 112.56 1ozj h HIS 101 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1ozj h HIS 101 Cb 0.06 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.53 1ozj h HIS 101 CO 0.00 0.77 0.00 0.39 0.86 0.00 0.00 177.93 179.95 1ozj n GLU 102 N -3.27 0.71 -4.48 2.45 1.02 -0.82 -4.75 120.64 111.50 1ozj n GLU 102 Ca -0.00 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 1ozj n GLU 102 Cb 0.85 -1.02 -0.10 0.00 -0.02 0.00 0.00 31.44 31.15 1ozj n GLU 102 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1ozj s LEU 103 N -0.95 2.62 -0.29 -4.62 1.02 -1.16 -0.22 118.68 115.07 1ozj s LEU 103 Ca 0.00 -1.17 -0.16 0.00 0.02 0.00 0.00 54.13 52.83 1ozj s LEU 103 Cb 0.00 -0.87 0.16 0.00 0.02 0.00 0.00 46.19 45.50 1ozj s LEU 103 CO 0.00 -0.22 1.00 -0.60 0.02 0.00 0.00 176.35 176.55 1ozj s ARG 104 N -3.64 0.32 0.73 1.70 3.52 -0.41 -4.82 118.95 116.34 1ozj s ARG 104 Ca 0.31 0.65 -0.13 0.00 -0.13 0.00 0.00 55.73 56.43 1ozj s ARG 104 Cb 0.02 0.23 0.04 0.00 -1.56 0.00 0.00 34.95 33.68 1ozj s ARG 104 CO 0.14 -0.08 1.11 0.00 -0.81 0.00 0.00 175.30 175.66 1ozj s ALA 105 N 1.83 2.29 -0.13 6.12 0.00 -1.26 0.01 121.76 130.63 1ozj s ALA 105 Ca -0.06 0.44 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 1ozj s ALA 105 Cb -0.05 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 1ozj s ALA 105 CO -0.16 -1.62 0.28 -1.64 0.00 0.00 0.00 175.76 172.62 1ozj s MET 106 N -4.48 4.06 -0.38 0.00 1.00 -0.36 -4.81 119.30 114.33 1ozj s MET 106 Ca 0.65 0.10 -0.28 0.00 0.00 0.00 0.00 55.69 56.15 1ozj s MET 106 Cb -0.20 -3.35 -0.07 0.00 0.00 0.00 0.00 34.83 31.21 1ozj s MET 106 CO 0.49 0.41 2.32 0.39 0.00 0.00 0.00 175.02 178.63 1ozj n GLU 107 N 3.01 1.38 0.00 2.03 4.71 -1.26 -0.74 120.64 129.76 1ozj n GLU 107 Ca -0.14 0.26 0.00 0.00 -0.01 0.00 0.00 57.16 57.27 1ozj n GLU 107 Cb 0.52 -3.15 0.00 0.00 -1.01 0.00 0.00 31.44 27.80 1ozj n GLU 107 CO 0.00 0.00 0.00 1.47 0.09 0.00 0.00 177.13 178.69 1ozj n LEU 108 N 13.19 0.00 -4.62 -4.62 -0.00 -1.26 -5.09 117.00 114.60 1ozj n LEU 108 Ca 0.36 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.94 1ozj n LEU 108 Cb 0.44 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.84 1ozj n LEU 108 CO 0.71 0.00 1.07 0.00 -0.00 0.00 0.00 177.39 179.17 1ozj h GLU 110 N 9.19 0.69 -0.65 0.00 5.08 -1.99 -3.34 114.58 123.56 1ozj h GLU 110 Ca -0.24 -0.39 -0.39 0.00 -1.00 0.00 0.00 59.36 57.34 1ozj h GLU 110 Cb 1.08 0.03 -0.23 0.00 0.50 0.00 0.00 28.75 30.13 1ozj h GLU 110 CO 1.08 1.01 0.12 1.19 -1.00 0.00 0.00 179.01 181.40 1ozj n PHE 111 N -4.24 2.09 -1.16 4.33 3.01 -1.26 -4.99 117.46 115.24 1ozj n PHE 111 Ca -0.04 -2.00 -0.36 0.00 1.01 0.00 0.00 57.45 56.06 1ozj n PHE 111 Cb 0.50 -0.73 0.06 0.00 -0.01 0.00 0.00 39.48 39.30 1ozj n PHE 111 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ozj n ALA 112 N -1.04 -2.49 -0.18 4.37 0.00 -1.26 -1.65 120.51 118.26 1ozj n ALA 112 Ca 0.45 -0.32 -0.03 0.00 0.00 0.00 0.00 53.44 53.54 1ozj n ALA 112 Cb 1.09 -1.67 0.07 0.00 0.00 0.00 0.00 19.45 18.94 1ozj n ALA 112 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1ozj h PHE 113 N -0.55 0.50 0.00 0.00 3.57 -1.91 -2.53 116.94 116.01 1ozj h PHE 113 Ca -0.44 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.08 1ozj h PHE 113 Cb 1.35 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.95 1ozj h PHE 113 CO 0.31 0.22 0.00 0.09 -2.23 0.00 0.00 178.31 176.71 1ozj n ASN 114 N -4.89 0.25 -1.22 0.41 4.13 -1.26 -1.93 115.26 110.75 1ozj n ASN 114 Ca 0.06 0.61 0.10 0.00 1.68 0.00 0.00 54.58 57.02 1ozj n ASN 114 Cb 0.16 -0.64 0.28 0.00 -1.54 0.00 0.00 39.78 38.05 1ozj n ASN 114 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1ozj n MET 115 N -1.83 2.65 -1.26 3.52 2.81 -0.95 -5.01 117.12 117.05 1ozj n MET 115 Ca -0.00 -2.31 -0.04 0.00 -1.81 0.00 0.00 57.70 53.54 1ozj n MET 115 Cb 0.04 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 31.00 1ozj n MET 115 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1ozj n LYS 116 N 1.26 -0.23 -4.56 0.03 5.02 -0.81 -4.97 118.16 113.89 1ozj n LYS 116 Ca 0.21 0.20 -0.26 0.00 -2.02 0.00 0.00 58.31 56.45 1ozj n LYS 116 Cb 0.58 -0.28 -0.11 0.00 -0.02 0.00 0.00 35.03 35.21 1ozj n LYS 116 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ozj s LYS 117 N -0.33 1.86 0.66 1.97 1.02 -1.26 -5.01 119.74 118.65 1ozj s LYS 117 Ca 0.04 -2.05 0.33 0.00 0.02 0.00 0.00 55.97 54.31 1ozj s LYS 117 Cb -0.00 -1.35 1.79 0.00 -0.52 0.00 0.00 37.83 37.75 1ozj s LYS 117 CO 0.10 -0.11 2.01 -0.44 -0.92 0.00 0.00 175.35 175.98 1ozj h ASP 118 N 1.88 0.00 -4.15 2.83 5.19 -1.96 -3.42 116.42 116.79 1ozj h ASP 118 Ca -0.43 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.39 1ozj h ASP 118 Cb 1.24 0.00 -0.23 0.00 0.18 0.00 0.00 39.33 40.53 1ozj h ASP 118 CO 0.76 0.00 -0.84 -1.61 -3.12 0.00 0.00 179.24 174.43 1ozj s GLU 119 N -4.09 1.26 -0.09 3.56 0.41 -1.26 -2.08 118.70 116.40 1ozj s GLU 119 Ca -0.04 -1.15 0.03 0.00 -0.41 0.00 0.00 54.97 53.41 1ozj s GLU 119 Cb 0.10 -1.54 0.00 0.00 -1.78 0.00 0.00 34.13 30.91 1ozj s GLU 119 CO 0.30 0.37 -0.21 0.08 -0.49 0.00 0.00 175.26 175.31 1ozj s VAL 120 N -1.05 1.81 -0.12 2.63 1.01 0.15 -4.82 120.40 120.01 1ozj s VAL 120 Ca 0.08 -0.87 -0.26 0.00 0.00 0.00 0.00 61.98 60.93 1ozj s VAL 120 Cb -0.10 -1.58 -0.02 0.00 0.00 0.00 0.00 36.38 34.68 1ozj s VAL 120 CO 0.04 0.50 0.87 0.00 0.00 0.00 0.00 175.10 176.51 1ozj n VAL 122 N 4.42 2.25 -2.03 0.00 0.24 0.72 -4.66 118.33 119.27 1ozj n VAL 122 Ca 0.05 -2.21 -0.43 0.00 -2.04 0.00 0.00 64.34 59.71 1ozj n VAL 122 Cb 0.49 -0.27 -0.03 0.00 -1.47 0.00 0.00 33.84 32.57 1ozj n VAL 122 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 1ozj s ASN 123 N -2.34 6.04 0.46 -1.34 3.84 -1.25 -4.84 114.94 115.52 1ozj s ASN 123 Ca 0.40 1.41 0.31 0.00 0.21 0.00 0.00 52.86 55.19 1ozj s ASN 123 Cb 0.34 -2.53 1.65 0.00 -0.55 0.00 0.00 41.25 40.16 1ozj s ASN 123 CO 0.05 -1.57 1.96 1.55 -2.79 0.00 0.00 177.10 176.30 1ozj h PRO 124 N 12.22 0.00 -0.67 0.43 0.13 -1.92 -2.13 132.00 140.06 1ozj h PRO 124 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1ozj h PRO 124 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1ozj h PRO 124 CO 1.02 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.45 1ozj n TYR 125 N -2.62 1.57 0.09 1.56 4.02 -1.26 -3.74 117.16 116.77 1ozj n TYR 125 Ca -0.02 -0.55 0.05 0.00 -0.01 0.00 0.00 57.90 57.37 1ozj n TYR 125 Cb 0.08 -0.39 0.10 0.00 -0.02 0.00 0.00 39.34 39.11 1ozj n TYR 125 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1ozj n HIS 126 N 0.55 0.25 -4.26 -0.72 8.25 -0.80 -4.52 115.22 113.97 1ozj n HIS 126 Ca 0.22 -0.28 -0.21 0.00 -0.26 0.00 0.00 57.72 57.19 1ozj n HIS 126 Cb 0.95 -0.02 -0.12 0.00 1.12 0.00 0.00 29.99 31.93 1ozj n HIS 126 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1ozj s TYR 127 N -0.95 1.59 0.10 4.41 1.51 -1.25 -1.22 117.35 121.54 1ozj s TYR 127 Ca 0.18 -0.48 0.09 0.00 -1.01 0.00 0.00 57.07 55.85 1ozj s TYR 127 Cb 0.10 -0.84 -0.04 0.00 -0.11 0.00 0.00 41.96 41.08 1ozj s TYR 127 CO 0.14 0.19 -0.24 -0.65 -1.11 0.00 0.00 175.55 173.88 1ozj s GLN 128 N -2.31 1.36 0.19 -0.62 -0.21 0.10 -4.93 119.66 113.24 1ozj s GLN 128 Ca 0.08 -1.21 -0.13 0.00 0.02 0.00 0.00 55.36 54.11 1ozj s GLN 128 Cb -0.07 -1.70 -0.07 0.00 1.00 0.00 0.00 33.01 32.16 1ozj s GLN 128 CO 0.04 0.41 0.58 0.50 -2.12 0.00 0.00 175.29 174.70 1ozj s ARG 129 N -1.81 3.95 0.10 2.91 3.52 -1.26 -1.28 118.95 125.08 1ozj s ARG 129 Ca 0.11 0.47 0.07 0.00 -0.13 0.00 0.00 55.73 56.24 1ozj s ARG 129 Cb -0.10 -2.80 -0.03 0.00 -1.56 0.00 0.00 34.95 30.46 1ozj s ARG 129 CO 0.04 0.40 -0.17 0.14 -0.81 0.00 0.00 175.30 174.90 1ozj s VAL 130 N -1.62 1.43 -1.03 7.11 -7.23 0.69 -4.94 120.40 114.81 1ozj s VAL 130 Ca 0.42 -1.51 0.06 0.00 -1.81 0.00 0.00 61.98 59.13 1ozj s VAL 130 Cb -0.14 -1.39 0.27 0.00 0.56 0.00 0.00 36.38 35.69 1ozj s VAL 130 CO 0.20 -0.21 0.99 -0.62 -0.31 0.00 0.00 175.10 175.15 1ozj n GLU 131 N 1.00 2.18 -0.38 4.82 4.71 -1.26 -4.62 120.64 127.10 1ozj n GLU 131 Ca -0.19 -1.06 0.00 0.00 -0.01 0.00 0.00 57.16 55.90 1ozj n GLU 131 Cb 0.55 -1.64 0.00 0.00 -1.01 0.00 0.00 31.44 29.34 1ozj n GLU 131 CO 0.00 0.00 0.00 -2.37 0.09 0.00 0.00 177.13 174.85