#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fbx n SER 2 N 0.00 0.00 -4.49 3.54 2.88 -1.26 -5.16 113.62 109.13 1fbx n SER 2 Ca 0.00 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.31 1fbx n SER 2 Cb 0.00 0.20 -0.11 0.00 -0.75 0.00 0.00 64.21 63.55 1fbx n SER 2 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1fbx s LEU 3 N -3.20 2.52 0.25 2.46 1.43 -1.26 -4.78 118.68 116.10 1fbx s LEU 3 Ca 0.00 -1.28 0.08 0.00 -1.03 0.00 0.00 54.13 51.90 1fbx s LEU 3 Cb 0.00 -0.67 -0.04 0.00 0.03 0.00 0.00 46.19 45.51 1fbx s LEU 3 CO 0.00 -0.42 0.10 -0.94 0.23 0.00 0.00 176.35 175.32 1fbx s SER 4 N -3.54 5.08 0.14 2.29 1.04 -1.26 -4.98 113.70 112.47 1fbx s SER 4 Ca 0.33 -0.41 -0.32 0.00 0.48 0.00 0.00 55.95 56.03 1fbx s SER 4 Cb 0.06 -1.16 -0.09 0.00 0.10 0.00 0.00 66.02 64.93 1fbx s SER 4 CO 0.15 -0.01 1.53 0.11 0.98 0.00 0.00 173.24 176.00 1fbx h LYS 5 N 1.78 -0.22 -0.37 4.02 1.57 -2.01 -0.81 116.57 120.52 1fbx h LYS 5 Ca -0.47 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.40 1fbx h LYS 5 Cb 1.24 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 33.54 1fbx h LYS 5 CO 0.60 -0.15 -0.02 0.93 -0.57 0.00 0.00 179.45 180.25 1fbx h GLU 6 N -0.23 0.08 -0.69 3.15 3.07 -1.97 -2.31 114.58 115.68 1fbx h GLU 6 Ca 0.11 -0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.98 1fbx h GLU 6 Cb 0.51 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 1fbx h GLU 6 CO -0.72 0.05 0.44 0.00 -1.40 0.00 0.00 179.01 177.38 1fbx h ALA 7 N 1.33 0.88 -0.07 3.43 0.00 -1.67 -1.55 119.26 121.61 1fbx h ALA 7 Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1fbx h ALA 7 Cb 0.26 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1fbx h ALA 7 CO -0.32 0.25 0.03 0.00 0.00 0.00 0.00 179.25 179.21 1fbx h ALA 8 N 1.27 0.08 0.37 0.00 0.00 -0.88 -0.36 119.26 119.74 1fbx h ALA 8 Ca 0.26 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1fbx h ALA 8 Cb -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1fbx h ALA 8 CO -0.08 -0.44 -0.49 -0.07 0.00 0.00 0.00 179.25 178.17 1fbx h LEU 9 N 0.07 -1.40 -0.52 0.00 3.38 -1.18 -0.88 115.31 114.78 1fbx h LEU 9 Ca 0.03 0.13 0.08 0.00 0.09 0.00 0.00 57.88 58.20 1fbx h LEU 9 Cb 0.00 0.48 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 1fbx h LEU 9 CO -0.02 -0.62 0.17 0.58 0.09 0.00 0.00 178.44 178.64 1fbx h VAL 10 N -0.90 0.79 0.04 1.22 2.07 -1.18 -0.50 116.25 117.78 1fbx h VAL 10 Ca -0.04 -0.11 0.02 0.00 0.82 0.00 0.00 66.70 67.39 1fbx h VAL 10 Cb 0.82 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1fbx h VAL 10 CO -0.14 0.06 -0.19 -0.74 0.02 0.00 0.00 177.57 176.59 1fbx h HIS 11 N 0.33 -0.49 0.22 1.57 -0.00 -0.75 0.16 115.15 116.20 1fbx h HIS 11 Ca 0.26 0.01 -0.00 0.00 -0.00 0.00 0.00 60.37 60.64 1fbx h HIS 11 Cb 0.30 0.21 -0.01 0.00 -0.00 0.00 0.00 27.41 27.91 1fbx h HIS 11 CO -0.18 -0.27 -0.18 0.93 -0.00 0.00 0.00 177.93 178.24 1fbx h GLU 12 N -0.32 -0.39 -0.74 5.26 5.08 -0.82 0.80 114.58 123.44 1fbx h GLU 12 Ca 0.05 0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.58 1fbx h GLU 12 Cb 0.37 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 29.57 1fbx h GLU 12 CO -0.15 -0.26 -0.20 0.00 -1.00 0.00 0.00 179.01 177.40 1fbx h ALA 13 N 0.34 0.46 -0.55 3.43 0.00 -0.83 0.52 119.26 122.63 1fbx h ALA 13 Ca -0.01 0.28 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 1fbx h ALA 13 Cb 0.36 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1fbx h ALA 13 CO -0.02 -0.43 -0.02 -0.07 0.00 0.00 0.00 179.25 178.72 1fbx h LEU 14 N -0.01 0.94 -0.28 0.00 3.38 -0.18 -2.85 115.31 116.31 1fbx h LEU 14 Ca 0.35 -0.26 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1fbx h LEU 14 Cb 0.55 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1fbx h LEU 14 CO -0.77 1.01 -0.10 0.58 0.09 0.00 0.00 178.44 179.25 1fbx h VAL 15 N 0.88 1.29 -0.33 1.22 2.07 0.18 0.05 116.25 121.61 1fbx h VAL 15 Ca 0.16 -1.15 0.06 0.00 0.82 0.00 0.00 66.70 66.59 1fbx h VAL 15 Cb 0.54 1.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 1fbx h VAL 15 CO 0.03 0.36 -0.00 0.00 0.02 0.00 0.00 177.57 177.98 1fbx h ALA 16 N 0.76 0.29 0.00 1.67 0.00 -0.09 -1.63 119.26 120.26 1fbx h ALA 16 Ca 0.07 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1fbx h ALA 16 Cb 0.59 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1fbx h ALA 16 CO 0.03 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.88 1fbx h ARG 17 N 0.09 0.00 0.00 0.00 -0.00 -1.48 -3.46 114.38 109.52 1fbx h ARG 17 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.64 1fbx h ARG 17 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.19 1fbx h ARG 17 CO -0.27 0.00 0.00 0.41 0.00 0.00 0.00 179.97 180.11 1fbx n GLY 18 N -0.05 0.81 0.57 0.04 0.00 -0.61 -4.99 105.19 100.96 1fbx n GLY 18 Ca 0.01 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.44 1fbx n GLY 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fbx n LEU 19 N 0.00 2.41 -4.78 0.99 4.77 -0.03 -5.02 117.00 115.34 1fbx n LEU 19 Ca 0.00 -1.39 -0.31 0.00 -0.03 0.00 0.00 56.01 54.28 1fbx n LEU 19 Cb 0.31 -0.10 0.09 0.00 -2.33 0.00 0.00 43.42 41.39 1fbx n LEU 19 CO 0.00 0.52 0.70 -1.61 -1.33 0.00 0.00 177.39 175.67 1fbx s GLU 20 N -1.01 2.32 0.31 3.23 0.41 -1.17 -4.82 118.70 117.96 1fbx s GLU 20 Ca 0.19 1.10 -0.29 0.00 -0.41 0.00 0.00 54.97 55.56 1fbx s GLU 20 Cb 0.11 -1.91 -0.10 0.00 -1.78 0.00 0.00 34.13 30.46 1fbx s GLU 20 CO 0.16 -1.58 1.22 0.99 -0.49 0.00 0.00 175.26 175.56 1fbx s THR 21 N -2.93 3.06 -0.22 3.63 2.01 -1.26 -4.87 115.64 115.05 1fbx s THR 21 Ca 0.61 1.07 -0.29 0.00 0.31 0.00 0.00 61.69 63.38 1fbx s THR 21 Cb -0.17 -3.68 -0.06 0.00 0.01 0.00 0.00 72.50 68.61 1fbx s THR 21 CO 0.56 0.25 2.21 -2.65 -0.69 0.00 0.00 174.62 174.30 1fbx n PRO 22 N 1.02 1.90 -4.65 4.92 -0.02 -1.26 -4.94 135.00 131.97 1fbx n PRO 22 Ca -0.00 0.53 -0.25 0.00 -2.02 0.00 0.00 63.50 61.75 1fbx n PRO 22 Cb 0.43 -3.16 -0.14 0.00 -0.02 0.00 0.00 33.50 30.61 1fbx n PRO 22 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1fbx s LEU 23 N 8.10 2.16 -0.07 2.45 1.02 -1.26 -5.13 118.68 125.95 1fbx s LEU 23 Ca 1.01 -0.52 -0.04 0.00 0.02 0.00 0.00 54.13 54.61 1fbx s LEU 23 Cb -0.39 -0.97 -0.04 0.00 0.02 0.00 0.00 46.19 44.81 1fbx s LEU 23 CO 0.37 0.16 0.09 -0.13 0.02 0.00 0.00 176.35 176.86 1fbx s ARG 24 N -1.16 3.21 0.20 1.70 0.52 -1.26 -5.05 118.95 117.11 1fbx s ARG 24 Ca 0.07 -0.31 -0.32 0.00 -0.52 0.00 0.00 55.73 54.65 1fbx s ARG 24 Cb -0.09 -2.98 -0.14 0.00 0.52 0.00 0.00 34.95 32.25 1fbx s ARG 24 CO 0.02 0.72 1.33 -2.30 0.02 0.00 0.00 175.30 175.08 1fbx n PRO 25 N 1.76 1.67 -0.35 3.54 -0.02 -1.26 -4.78 135.00 135.55 1fbx n PRO 25 Ca -0.17 0.59 0.24 0.00 -2.02 0.00 0.00 63.50 62.14 1fbx n PRO 25 Cb 0.54 -2.20 0.49 0.00 -0.02 0.00 0.00 33.50 32.31 1fbx n PRO 25 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1fbx h PRO 26 N 4.07 0.37 0.00 0.52 0.11 -2.05 -3.45 132.00 131.57 1fbx h PRO 26 Ca -0.44 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1fbx h PRO 26 Cb 1.30 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1fbx h PRO 26 CO 0.75 0.24 0.00 0.28 -0.21 0.00 0.00 178.00 179.06 1fbx n VAL 27 N -4.81 0.00 -4.72 3.15 0.31 -1.26 -4.88 118.33 106.11 1fbx n VAL 27 Ca 0.29 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.31 1fbx n VAL 27 Cb 0.95 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.75 1fbx n VAL 27 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1fbx s HIS 28 N 0.00 2.54 -0.93 3.52 -3.43 -1.26 -5.03 115.29 110.71 1fbx s HIS 28 Ca 0.00 -0.27 -0.24 0.00 -0.80 0.00 0.00 55.06 53.75 1fbx s HIS 28 Cb 0.00 -1.47 -0.20 0.00 -1.43 0.00 0.00 32.58 29.48 1fbx s HIS 28 CO 0.00 0.23 2.12 0.39 -2.00 0.00 0.00 174.74 175.48 1fbx n GLU 29 N 1.66 0.21 -2.95 -0.38 1.02 -1.26 -4.88 120.64 114.05 1fbx n GLU 29 Ca -0.16 -1.30 -0.42 0.00 -0.02 0.00 0.00 57.16 55.25 1fbx n GLU 29 Cb 0.52 -3.58 -0.05 0.00 -0.02 0.00 0.00 31.44 28.31 1fbx n GLU 29 CO 0.00 0.00 0.00 1.41 1.18 0.00 0.00 177.13 179.72 1fbx s MET 30 N 8.36 3.79 0.02 3.49 1.75 -1.26 -4.99 119.30 130.46 1fbx s MET 30 Ca 0.81 0.37 -0.37 0.00 -1.25 0.00 0.00 55.69 55.25 1fbx s MET 30 Cb -0.09 -3.79 -0.19 0.00 2.84 0.00 0.00 34.83 33.60 1fbx s MET 30 CO 0.16 -0.82 0.95 -3.47 -0.65 0.00 0.00 175.02 171.19 1fbx n ASP 31 N 6.39 -0.13 -0.19 1.11 2.03 -1.26 -4.75 116.55 119.74 1fbx n ASP 31 Ca 0.03 1.09 -0.00 0.00 0.52 0.00 0.00 54.79 56.43 1fbx n ASP 31 Cb 0.48 -0.87 0.23 0.00 -0.72 0.00 0.00 41.12 40.24 1fbx n ASP 31 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 1fbx h ASN 32 N 2.63 0.84 0.57 1.67 4.21 -2.00 -0.92 115.58 122.59 1fbx h ASN 32 Ca -0.46 -0.06 -0.03 0.00 1.21 0.00 0.00 56.30 56.96 1fbx h ASN 32 Cb 1.35 -0.21 -0.00 0.00 -1.12 0.00 0.00 38.32 38.33 1fbx h ASN 32 CO 0.60 0.66 -0.15 -0.33 -1.29 0.00 0.00 177.43 176.93 1fbx h GLU 33 N 0.95 0.00 0.06 0.81 5.08 -2.00 -2.29 114.58 117.20 1fbx h GLU 33 Ca 0.25 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.43 1fbx h GLU 33 Cb -0.00 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.27 1fbx h GLU 33 CO -0.04 0.15 -0.74 1.15 -1.00 0.00 0.00 179.01 178.53 1fbx h THR 34 N 0.00 1.45 -0.57 1.13 2.02 -1.55 -2.96 112.91 112.42 1fbx h THR 34 Ca -0.00 -2.28 -0.03 0.00 0.77 0.00 0.00 66.41 64.87 1fbx h THR 34 Cb 0.48 2.83 -0.03 0.00 -1.74 0.00 0.00 68.15 69.69 1fbx h THR 34 CO 0.02 0.66 0.23 0.03 0.37 0.00 0.00 175.52 176.83 1fbx h ARG 35 N -0.17 0.83 -0.57 6.66 3.08 -1.05 -1.78 114.38 121.37 1fbx h ARG 35 Ca -0.11 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 59.77 1fbx h ARG 35 Cb 1.49 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.37 1fbx h ARG 35 CO 0.14 0.68 0.17 0.87 -1.07 0.00 0.00 179.97 180.76 1fbx h LYS 36 N 0.82 0.89 0.00 0.04 1.57 -1.47 -1.75 116.57 116.67 1fbx h LYS 36 Ca 0.20 -0.20 -0.12 0.00 -1.87 0.00 0.00 60.65 58.66 1fbx h LYS 36 Cb 0.15 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 1fbx h LYS 36 CO -0.02 0.81 -0.59 0.66 -0.57 0.00 0.00 179.45 179.74 1fbx h SER 37 N 0.81 0.00 -0.33 0.86 4.64 -1.23 0.13 113.55 118.43 1fbx h SER 37 Ca 0.18 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.35 1fbx h SER 37 Cb 0.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1fbx h SER 37 CO -0.00 0.59 -0.39 -0.07 -0.87 0.00 0.00 176.83 176.08 1fbx h LEU 38 N 0.00 0.91 -0.13 5.97 3.38 -1.21 0.15 115.31 124.38 1fbx h LEU 38 Ca -0.01 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.46 1fbx h LEU 38 Cb 1.07 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1fbx h LEU 38 CO 0.08 1.21 0.00 0.40 0.09 0.00 0.00 178.44 180.22 1fbx h ILE 39 N 0.62 1.25 -0.46 1.22 2.04 -1.11 0.30 117.51 121.36 1fbx h ILE 39 Ca 0.04 -0.80 0.10 0.00 1.00 0.00 0.00 64.86 65.21 1fbx h ILE 39 Cb 0.98 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.56 1fbx h ILE 39 CO 0.09 0.23 0.32 0.00 0.00 0.00 0.00 178.15 178.79 1fbx h ALA 40 N 0.76 2.18 0.01 1.87 0.00 -0.67 0.15 119.26 123.56 1fbx h ALA 40 Ca 0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1fbx h ALA 40 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1fbx h ALA 40 CO 0.01 -0.30 -0.00 0.78 0.00 0.00 0.00 179.25 179.73 1fbx h GLY 41 N 0.19 -0.01 1.15 0.00 0.00 0.76 -2.22 103.07 102.93 1fbx h GLY 41 Ca 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.48 1fbx h GLY 41 CO -0.04 -0.00 0.13 0.45 0.00 0.00 0.00 176.54 177.08 1fbx h HIS 42 N -0.36 1.11 -0.78 5.60 -0.00 0.86 -2.60 115.15 118.97 1fbx h HIS 42 Ca -0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 60.37 60.22 1fbx h HIS 42 Cb 0.36 -0.31 -0.04 0.00 -0.00 0.00 0.00 27.41 27.42 1fbx h HIS 42 CO 0.05 0.92 0.44 0.52 -0.00 0.00 0.00 177.93 179.86 1fbx h MET 43 N 1.00 1.08 -0.36 2.45 2.86 -0.75 -1.31 114.93 119.90 1fbx h MET 43 Ca 0.20 -0.12 0.06 0.00 -2.06 0.00 0.00 59.70 57.79 1fbx h MET 43 Cb 0.39 -0.22 -0.06 0.00 0.06 0.00 0.00 31.60 31.77 1fbx h MET 43 CO 0.01 0.79 -0.01 1.15 1.06 0.00 0.00 176.91 179.91 1fbx h THR 44 N 1.08 0.73 -0.30 2.22 2.02 -1.20 0.16 112.91 117.62 1fbx h THR 44 Ca 0.28 -0.03 0.04 0.00 0.77 0.00 0.00 66.41 67.46 1fbx h THR 44 Cb 0.01 0.63 -0.04 0.00 -1.74 0.00 0.00 68.15 67.01 1fbx h THR 44 CO -0.05 0.02 0.08 -0.33 0.37 0.00 0.00 175.52 175.61 1fbx h GLU 45 N 0.09 0.19 -0.75 6.66 5.08 -0.98 -0.71 114.58 124.15 1fbx h GLU 45 Ca 0.17 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.57 1fbx h GLU 45 Cb 0.24 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.40 1fbx h GLU 45 CO -0.30 0.12 0.45 0.82 -1.00 0.00 0.00 179.01 179.11 1fbx h ILE 46 N 0.19 1.04 -0.15 3.13 2.04 -0.50 0.42 117.51 123.68 1fbx h ILE 46 Ca 0.14 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 1fbx h ILE 46 Cb 0.13 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1fbx h ILE 46 CO -0.17 0.15 -0.01 0.24 0.00 0.00 0.00 178.15 178.37 1fbx h MET 47 N 0.85 0.27 -0.31 2.37 2.86 -0.31 -1.02 114.93 119.64 1fbx h MET 47 Ca 0.32 -0.09 0.02 0.00 -2.06 0.00 0.00 59.70 57.89 1fbx h MET 47 Cb 0.13 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 1fbx h MET 47 CO -0.16 0.51 0.21 1.96 1.06 0.00 0.00 176.91 180.49 1fbx h GLN 48 N 0.00 0.35 -0.17 1.72 4.20 -0.74 0.28 115.11 120.75 1fbx h GLN 48 Ca 0.04 -0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.67 1fbx h GLN 48 Cb 0.40 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.08 1fbx h GLN 48 CO 0.01 0.23 -0.18 -0.07 -0.67 0.00 0.00 178.83 178.15 1fbx h LEU 49 N 0.36 0.28 -0.05 1.46 3.38 -0.41 -1.39 115.31 118.94 1fbx h LEU 49 Ca 0.12 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1fbx h LEU 49 Cb 0.04 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1fbx h LEU 49 CO -0.03 0.49 0.00 0.18 0.09 0.00 0.00 178.44 179.17 1fbx n LEU 50 N -4.21 0.08 -0.83 1.67 4.77 0.95 -4.88 117.00 114.54 1fbx n LEU 50 Ca -0.01 -0.03 -0.11 0.00 -0.03 0.00 0.00 56.01 55.83 1fbx n LEU 50 Cb 0.32 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1fbx n LEU 50 CO 0.39 0.02 -0.10 0.59 -1.33 0.00 0.00 177.39 176.95 1fbx n ASN 51 N -0.70 -4.30 -4.81 -1.43 3.02 -0.52 -5.00 115.26 101.51 1fbx n ASN 51 Ca 0.12 0.27 -0.33 0.00 -0.03 0.00 0.00 54.58 54.61 1fbx n ASN 51 Cb 0.07 -2.76 -0.04 0.00 -0.61 0.00 0.00 39.78 36.44 1fbx n ASN 51 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1fbx s LEU 52 N -2.47 3.83 -0.81 3.41 1.43 -1.08 -4.97 118.68 118.03 1fbx s LEU 52 Ca 0.00 1.80 -0.19 0.00 -1.03 0.00 0.00 54.13 54.71 1fbx s LEU 52 Cb 0.00 -4.55 0.12 0.00 0.03 0.00 0.00 46.19 41.79 1fbx s LEU 52 CO 0.00 -0.64 0.99 -0.62 0.23 0.00 0.00 176.35 176.32 1fbx s ASP 53 N -2.21 6.46 0.00 2.29 -1.08 -1.26 -4.59 116.67 116.27 1fbx s ASP 53 Ca 0.64 -1.76 0.10 0.00 -0.52 0.00 0.00 52.55 51.01 1fbx s ASP 53 Cb -0.13 -2.37 0.56 0.00 -1.46 0.00 0.00 42.92 39.52 1fbx s ASP 53 CO 0.20 -1.12 1.10 0.18 0.52 0.00 0.00 175.17 176.04 1fbx n LEU 54 N 6.57 0.00 0.05 -1.34 4.77 -1.26 -1.59 117.00 124.20 1fbx n LEU 54 Ca 0.11 0.10 0.12 0.00 -0.03 0.00 0.00 56.01 56.32 1fbx n LEU 54 Cb 0.47 -0.10 0.30 0.00 -2.33 0.00 0.00 43.42 41.76 1fbx n LEU 54 CO 0.53 -0.07 0.57 0.00 -1.33 0.00 0.00 177.39 177.09 1fbx n ALA 55 N -1.10 2.85 -1.77 -1.18 0.00 -1.26 -4.11 120.51 113.94 1fbx n ALA 55 Ca 0.07 -0.21 -0.41 0.00 0.00 0.00 0.00 53.44 52.89 1fbx n ALA 55 Cb 0.05 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.22 1fbx n ALA 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1fbx s ASP 56 N -3.83 6.77 0.57 0.00 2.15 -0.62 -4.88 116.67 116.82 1fbx s ASP 56 Ca 0.09 2.67 0.31 0.00 0.43 0.00 0.00 52.55 56.05 1fbx s ASP 56 Cb 0.15 -2.65 1.70 0.00 -0.30 0.00 0.00 42.92 41.82 1fbx s ASP 56 CO 0.66 -0.53 2.16 -2.24 -0.17 0.00 0.00 175.17 175.06 1fbx h ASP 57 N 3.36 0.00 1.22 -0.34 2.03 -1.90 -0.96 116.42 119.83 1fbx h ASP 57 Ca -0.49 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 55.75 1fbx h ASP 57 Cb 1.23 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.72 1fbx h ASP 57 CO 0.65 0.06 -0.81 -1.28 -1.03 0.00 0.00 179.24 176.83 1fbx h SER 58 N 0.00 0.00 -0.00 4.15 0.87 -1.95 -3.35 113.55 113.27 1fbx h SER 58 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1fbx h SER 58 Cb 0.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 1fbx h SER 58 CO 0.01 0.22 -0.73 0.18 -0.53 0.00 0.00 176.83 175.98 1fbx n LEU 59 N -2.91 1.13 0.27 2.23 4.77 -0.78 -4.71 117.00 117.00 1fbx n LEU 59 Ca -0.01 -0.57 -0.16 0.00 -0.03 0.00 0.00 56.01 55.23 1fbx n LEU 59 Cb 0.65 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.66 1fbx n LEU 59 CO 0.40 0.25 0.68 -0.03 -1.33 0.00 0.00 177.39 177.36 1fbx h MET 60 N 0.60 -0.67 -0.59 3.23 4.05 -1.35 -2.88 114.93 117.33 1fbx h MET 60 Ca 0.00 0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.47 1fbx h MET 60 Cb 0.49 0.15 0.00 0.00 -0.80 0.00 0.00 31.60 31.44 1fbx h MET 60 CO 0.00 -0.45 0.00 0.39 0.23 0.00 0.00 176.91 177.08 1fbx n GLU 61 N -5.41 2.11 0.51 0.39 -0.58 -1.26 -4.38 120.64 112.02 1fbx n GLU 61 Ca -0.11 -1.11 -0.20 0.00 -0.42 0.00 0.00 57.16 55.32 1fbx n GLU 61 Cb 0.31 -1.53 -0.09 0.00 -0.57 0.00 0.00 31.44 29.55 1fbx n GLU 61 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1fbx h THR 62 N 1.57 0.00 -1.07 2.62 2.02 -1.79 0.27 112.91 116.54 1fbx h THR 62 Ca 0.00 -0.02 0.32 0.00 0.77 0.00 0.00 66.41 67.48 1fbx h THR 62 Cb 0.75 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 67.03 1fbx h THR 62 CO 0.10 0.00 0.65 -0.65 0.37 0.00 0.00 175.52 175.99 1fbx h PRO 63 N -1.31 0.32 -0.27 6.66 0.11 -1.79 0.54 132.00 136.26 1fbx h PRO 63 Ca -0.13 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.85 1fbx h PRO 63 Cb 0.99 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 1fbx h PRO 63 CO 0.22 0.21 -0.25 1.25 -0.21 0.00 0.00 178.00 179.22 1fbx h HIS 64 N 0.33 0.78 -0.42 0.65 2.76 -1.72 -1.89 115.15 115.64 1fbx h HIS 64 Ca 0.71 -0.23 -0.07 0.00 -2.20 0.00 0.00 60.37 58.58 1fbx h HIS 64 Cb 1.75 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 30.52 1fbx h HIS 64 CO -0.01 0.95 -0.00 0.00 -1.30 0.00 0.00 177.93 177.57 1fbx h ARG 65 N 0.39 0.74 -0.42 5.26 3.08 0.36 -2.27 114.38 121.50 1fbx h ARG 65 Ca 0.05 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1fbx h ARG 65 Cb 0.81 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 1fbx h ARG 65 CO 0.06 0.82 0.27 0.82 -1.07 0.00 0.00 179.97 180.87 1fbx h ILE 66 N 0.57 1.12 -0.54 2.04 2.04 -0.59 0.91 117.51 123.05 1fbx h ILE 66 Ca 0.12 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.76 1fbx h ILE 66 Cb 0.49 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 1fbx h ILE 66 CO 0.02 0.12 0.31 0.00 0.00 0.00 0.00 178.15 178.60 1fbx h ALA 67 N 1.14 0.70 -0.06 1.87 0.00 -1.25 -0.71 119.26 120.95 1fbx h ALA 67 Ca 0.15 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1fbx h ALA 67 Cb -0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1fbx h ALA 67 CO -0.03 0.00 -0.60 -0.22 0.00 0.00 0.00 179.25 178.40 1fbx h LYS 68 N 0.60 0.20 0.13 0.00 3.64 -1.08 -2.62 116.57 117.45 1fbx h LYS 68 Ca 0.23 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1fbx h LYS 68 Cb 0.07 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1fbx h LYS 68 CO -0.12 0.74 -0.06 1.98 -2.27 0.00 0.00 179.45 179.71 1fbx h MET 69 N 0.15 -0.17 -0.11 1.90 4.05 -0.24 -0.44 114.93 120.07 1fbx h MET 69 Ca -0.01 0.01 0.04 0.00 -0.28 0.00 0.00 59.70 59.47 1fbx h MET 69 Cb 1.10 0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.89 1fbx h MET 69 CO 0.09 0.07 -0.19 1.88 0.23 0.00 0.00 176.91 178.99 1fbx h TYR 70 N -0.39 -0.49 0.17 1.39 -1.99 -1.12 0.50 116.97 115.04 1fbx h TYR 70 Ca -0.02 0.02 -0.24 0.00 2.00 0.00 0.00 58.73 60.50 1fbx h TYR 70 Cb 0.32 0.23 0.03 0.00 2.00 0.00 0.00 36.73 39.31 1fbx h TYR 70 CO -0.00 -0.26 -1.04 0.28 -0.00 0.00 0.00 178.16 177.13 1fbx h VAL 71 N -0.25 1.42 0.00 -2.88 2.07 -1.50 -2.35 116.25 112.76 1fbx h VAL 71 Ca 0.09 -2.55 -0.03 0.00 0.82 0.00 0.00 66.70 65.03 1fbx h VAL 71 Cb 0.38 3.08 -0.00 0.00 -1.52 0.00 0.00 31.29 33.22 1fbx h VAL 71 CO -0.26 0.74 -0.94 0.44 0.02 0.00 0.00 177.57 177.57 1fbx h ASP 72 N -0.14 0.00 0.00 0.57 3.32 -1.14 -3.34 116.42 115.69 1fbx h ASP 72 Ca -0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.87 1fbx h ASP 72 Cb 1.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.36 1fbx h ASP 72 CO 0.20 0.10 0.00 -0.62 -1.72 0.00 0.00 179.24 177.20 1fbx n GLU 73 N -2.77 0.00 0.25 3.56 1.02 0.08 -4.64 120.64 118.14 1fbx n GLU 73 Ca -0.01 0.00 0.17 0.00 -0.02 0.00 0.00 57.16 57.30 1fbx n GLU 73 Cb 0.60 0.00 0.81 0.00 -0.02 0.00 0.00 31.44 32.83 1fbx n GLU 73 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1fbx h ILE 74 N 0.00 0.15 -0.06 -3.67 3.07 -1.53 -0.78 117.51 114.69 1fbx h ILE 74 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1fbx h ILE 74 Cb 0.00 0.68 0.00 0.00 -0.27 0.00 0.00 36.82 37.23 1fbx h ILE 74 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 1fbx n PHE 75 N -3.21 0.08 0.22 0.16 3.72 -0.88 -2.81 117.46 114.73 1fbx n PHE 75 Ca 0.01 -0.29 0.12 0.00 -0.05 0.00 0.00 57.45 57.24 1fbx n PHE 75 Cb 0.44 -0.03 0.63 0.00 -0.94 0.00 0.00 39.48 39.58 1fbx n PHE 75 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1fbx h SER 76 N 0.59 0.00 0.00 4.37 4.64 -1.23 -0.29 113.55 121.62 1fbx h SER 76 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fbx h SER 76 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1fbx h SER 76 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1fbx n GLY 77 N -1.25 -0.89 0.12 -0.77 0.00 -0.07 -2.70 105.19 99.64 1fbx n GLY 77 Ca -0.02 -0.15 0.12 0.00 0.00 0.00 0.00 46.02 45.98 1fbx n GLY 77 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fbx h LEU 78 N 0.00 0.00 -8.11 0.99 3.38 -1.14 -3.43 115.31 107.00 1fbx h LEU 78 Ca 0.00 -0.07 -0.71 0.00 0.09 0.00 0.00 57.88 57.20 1fbx h LEU 78 Cb 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.46 1fbx h LEU 78 CO 0.00 0.03 -0.50 -0.62 0.09 0.00 0.00 178.44 177.44 1fbx s ASP 79 N -5.05 5.53 0.00 -0.43 -1.08 -1.10 -4.93 116.67 109.61 1fbx s ASP 79 Ca 0.06 -1.47 0.00 0.00 -0.52 0.00 0.00 52.55 50.61 1fbx s ASP 79 Cb 0.10 -1.95 0.00 0.00 -1.46 0.00 0.00 42.92 39.61 1fbx s ASP 79 CO 0.70 -0.49 0.24 -1.22 0.52 0.00 0.00 175.17 174.92 1fbx n TYR 80 N 4.87 0.00 1.59 -5.34 4.02 -1.26 -0.06 117.16 120.97 1fbx n TYR 80 Ca -0.10 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 57.94 1fbx n TYR 80 Cb 0.43 0.00 0.75 0.00 -0.02 0.00 0.00 39.34 40.50 1fbx n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fbx n ALA 81 N -0.71 2.64 0.07 -0.72 0.00 -1.26 -2.63 120.51 117.90 1fbx n ALA 81 Ca 0.00 -0.22 0.03 0.00 0.00 0.00 0.00 53.44 53.25 1fbx n ALA 81 Cb 0.00 -1.43 0.05 0.00 0.00 0.00 0.00 19.45 18.07 1fbx n ALA 81 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1fbx n ASN 82 N -1.00 1.96 -4.70 0.00 3.02 0.91 -4.98 115.26 110.47 1fbx n ASN 82 Ca 0.17 -1.62 -0.42 0.00 -0.03 0.00 0.00 54.58 52.68 1fbx n ASN 82 Cb 0.22 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.31 1fbx n ASN 82 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1fbx s PHE 83 N -0.73 2.66 0.48 3.10 5.36 -1.08 -4.90 117.98 122.87 1fbx s PHE 83 Ca 0.09 0.39 -0.23 0.00 -0.96 0.00 0.00 56.93 56.22 1fbx s PHE 83 Cb 0.05 -3.99 -0.08 0.00 -0.34 0.00 0.00 43.02 38.66 1fbx s PHE 83 CO 0.07 -3.87 1.24 -0.35 -1.46 0.00 0.00 175.22 170.86 1fbx n PRO 84 N 4.87 1.68 -2.06 10.12 -0.04 -1.26 -4.95 135.00 143.37 1fbx n PRO 84 Ca 0.15 0.61 -0.42 0.00 -0.04 0.00 0.00 63.50 63.80 1fbx n PRO 84 Cb 0.39 -2.39 -0.03 0.00 -0.04 0.00 0.00 33.50 31.43 1fbx n PRO 84 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1fbx s LYS 85 N -2.48 4.26 -0.20 0.54 1.02 -1.26 -4.96 119.74 116.66 1fbx s LYS 85 Ca 0.66 2.19 -0.07 0.00 0.02 0.00 0.00 55.97 58.77 1fbx s LYS 85 Cb -0.47 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.45 1fbx s LYS 85 CO 0.54 -0.57 0.07 0.42 -0.92 0.00 0.00 175.35 174.89 1fbx s ILE 86 N 1.66 4.68 -0.07 2.17 -1.09 -1.26 -5.01 121.20 122.27 1fbx s ILE 86 Ca 0.68 -0.07 0.04 0.00 -2.23 0.00 0.00 60.65 59.07 1fbx s ILE 86 Cb -0.39 -3.13 -0.02 0.00 -1.58 0.00 0.00 42.46 37.34 1fbx s ILE 86 CO 0.30 0.42 -0.19 0.42 -1.23 0.00 0.00 174.94 174.66 1fbx s THR 87 N 0.76 2.63 -0.03 2.92 -4.23 -1.26 -5.10 115.64 111.32 1fbx s THR 87 Ca 0.04 -0.86 -0.01 0.00 -1.18 0.00 0.00 61.69 59.68 1fbx s THR 87 Cb -0.13 -2.02 0.03 0.00 1.34 0.00 0.00 72.50 71.72 1fbx s THR 87 CO 0.02 0.57 0.04 -0.76 -0.54 0.00 0.00 174.62 173.95 1fbx s LEU 88 N -0.25 0.53 0.67 4.79 1.43 -1.26 -2.64 118.68 121.94 1fbx s LEU 88 Ca 0.00 0.05 -0.04 0.00 -1.03 0.00 0.00 54.13 53.11 1fbx s LEU 88 Cb -0.13 -0.13 0.06 0.00 0.03 0.00 0.00 46.19 46.02 1fbx s LEU 88 CO 0.03 -0.20 0.96 0.27 0.23 0.00 0.00 176.35 177.64 1fbx s ILE 89 N 1.73 2.36 0.41 -0.59 -4.36 0.02 -4.86 121.20 115.91 1fbx s ILE 89 Ca -0.01 -0.39 -0.22 0.00 -0.26 0.00 0.00 60.65 59.78 1fbx s ILE 89 Cb -0.12 -2.98 -0.11 0.00 1.25 0.00 0.00 42.46 40.50 1fbx s ILE 89 CO -0.03 0.00 0.95 -0.70 0.24 0.00 0.00 174.94 175.40 1fbx s GLU 90 N -5.13 4.31 -1.58 0.37 2.12 -1.26 -1.38 118.70 116.15 1fbx s GLU 90 Ca 0.60 1.16 -0.10 0.00 0.36 0.00 0.00 54.97 57.00 1fbx s GLU 90 Cb -0.10 -2.31 -0.06 0.00 0.26 0.00 0.00 34.13 31.92 1fbx s GLU 90 CO 0.43 0.04 2.86 -1.71 -0.54 0.00 0.00 175.26 176.34 1fbx n ASN 91 N -0.38 8.48 -0.05 -1.70 5.15 -0.38 -4.64 115.26 121.74 1fbx n ASN 91 Ca 0.06 -2.66 -0.11 0.00 -0.60 0.00 0.00 54.58 51.27 1fbx n ASN 91 Cb 0.53 -1.54 -0.05 0.00 -0.53 0.00 0.00 39.78 38.19 1fbx n ASN 91 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1fbx h LYS 92 N 4.99 0.26 0.00 1.20 1.57 -1.92 -1.80 116.57 120.87 1fbx h LYS 92 Ca 0.84 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.57 1fbx h LYS 92 Cb 0.30 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1fbx h LYS 92 CO 1.75 0.36 0.00 -1.33 -0.57 0.00 0.00 179.45 179.66 1fbx n MET 93 N -4.84 0.00 -3.89 3.15 0.00 -1.26 -4.80 117.12 105.48 1fbx n MET 93 Ca -0.04 0.19 -0.25 0.00 0.00 0.00 0.00 57.70 57.59 1fbx n MET 93 Cb 0.13 -1.50 -0.00 0.00 0.00 0.00 0.00 33.22 31.85 1fbx n MET 93 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1fbx n LYS 94 N -1.18 -3.98 -1.99 0.03 5.02 -0.68 -4.89 118.16 110.49 1fbx n LYS 94 Ca 0.00 0.49 -0.41 0.00 -2.02 0.00 0.00 58.31 56.36 1fbx n LYS 94 Cb 0.00 -4.85 -0.02 0.00 -0.02 0.00 0.00 35.03 30.14 1fbx n LYS 94 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1fbx s VAL 95 N -3.77 2.55 -0.01 -0.18 1.01 -1.26 -4.90 120.40 113.85 1fbx s VAL 95 Ca 0.10 0.50 0.01 0.00 0.00 0.00 0.00 61.98 62.59 1fbx s VAL 95 Cb -0.05 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 33.03 1fbx s VAL 95 CO 0.86 0.09 0.73 -0.90 0.00 0.00 0.00 175.10 175.89 1fbx n ASP 96 N 1.75 0.52 -4.72 3.32 5.75 -1.26 -4.58 116.55 117.33 1fbx n ASP 96 Ca 0.05 -1.52 -0.24 0.00 -0.01 0.00 0.00 54.79 53.06 1fbx n ASP 96 Cb 0.40 -0.07 -0.06 0.00 -1.03 0.00 0.00 41.12 40.36 1fbx n ASP 96 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1fbx s GLU 97 N -0.37 2.59 0.56 0.11 0.41 -1.26 -4.96 118.70 115.77 1fbx s GLU 97 Ca 0.02 -1.15 -0.19 0.00 -0.41 0.00 0.00 54.97 53.24 1fbx s GLU 97 Cb 0.02 -2.40 -0.05 0.00 -1.78 0.00 0.00 34.13 29.92 1fbx s GLU 97 CO 0.00 0.42 1.15 0.00 -0.49 0.00 0.00 175.26 176.34 1fbx s MET 98 N -3.43 3.23 -0.11 1.61 0.23 -1.26 -4.50 119.30 115.07 1fbx s MET 98 Ca 0.31 1.66 -0.01 0.00 -1.03 0.00 0.00 55.69 56.62 1fbx s MET 98 Cb -0.08 -1.98 -0.03 0.00 -1.53 0.00 0.00 34.83 31.21 1fbx s MET 98 CO 0.21 -0.96 -0.08 0.08 -2.03 0.00 0.00 175.02 172.25 1fbx s VAL 99 N -1.74 3.60 -0.02 5.16 1.01 0.20 -4.95 120.40 123.65 1fbx s VAL 99 Ca 0.74 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 62.27 1fbx s VAL 99 Cb -0.25 -2.51 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 1fbx s VAL 99 CO 0.29 0.55 -0.15 -0.89 0.00 0.00 0.00 175.10 174.90 1fbx s THR 100 N -0.22 1.24 -0.16 3.92 2.01 -1.26 -1.86 115.64 119.30 1fbx s THR 100 Ca 0.03 -0.65 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1fbx s THR 100 Cb -0.13 -1.04 0.00 0.00 0.01 0.00 0.00 72.50 71.34 1fbx s THR 100 CO 0.03 0.35 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.47 1fbx s VAL 101 N -0.22 2.62 0.18 3.82 1.01 0.84 -5.00 120.40 123.64 1fbx s VAL 101 Ca 0.03 -0.78 0.11 0.00 0.00 0.00 0.00 61.98 61.34 1fbx s VAL 101 Cb -0.08 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1fbx s VAL 101 CO 0.00 0.51 -0.24 0.00 0.00 0.00 0.00 175.10 175.38 1fbx s ARG 102 N 0.95 1.54 -1.14 2.72 1.70 -1.26 -1.14 118.95 122.31 1fbx s ARG 102 Ca -0.03 -1.46 -0.10 0.00 -0.47 0.00 0.00 55.73 53.67 1fbx s ARG 102 Cb -0.15 -1.88 -0.03 0.00 -0.57 0.00 0.00 34.95 32.32 1fbx s ARG 102 CO -0.02 0.41 0.83 -0.25 -1.08 0.00 0.00 175.30 175.20 1fbx n ASP 103 N 0.40 -4.77 -4.68 -2.89 8.00 -1.16 -4.94 116.55 106.50 1fbx n ASP 103 Ca -0.14 -0.84 -0.41 0.00 0.71 0.00 0.00 54.79 54.12 1fbx n ASP 103 Cb 0.55 -4.32 -0.04 0.00 -0.02 0.00 0.00 41.12 37.28 1fbx n ASP 103 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1fbx s ILE 104 N -3.47 4.92 0.05 0.53 1.01 -0.12 -4.84 121.20 119.28 1fbx s ILE 104 Ca 0.34 1.57 -0.31 0.00 0.00 0.00 0.00 60.65 62.25 1fbx s ILE 104 Cb -0.08 -4.11 -0.10 0.00 0.01 0.00 0.00 42.46 38.18 1fbx s ILE 104 CO 0.80 0.07 1.91 0.41 0.00 0.00 0.00 174.94 178.13 1fbx n THR 105 N 4.56 0.60 -3.89 2.92 -1.04 -1.26 -1.74 114.28 114.43 1fbx n THR 105 Ca 0.03 -0.11 -0.27 0.00 -2.04 0.00 0.00 64.05 61.66 1fbx n THR 105 Cb 0.49 -2.18 -0.17 0.00 -1.82 0.00 0.00 70.33 66.65 1fbx n THR 105 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1fbx s LEU 106 N 3.79 1.31 -0.03 -4.42 0.20 -0.99 -4.86 118.68 113.67 1fbx s LEU 106 Ca 0.87 -0.43 0.06 0.00 0.69 0.00 0.00 54.13 55.32 1fbx s LEU 106 Cb -0.49 -0.84 -0.01 0.00 -0.43 0.00 0.00 46.19 44.42 1fbx s LEU 106 CO 0.42 -0.15 -0.23 0.42 -0.29 0.00 0.00 176.35 176.52 1fbx s THR 107 N 1.70 1.83 0.00 3.68 -4.23 -1.26 -1.04 115.64 116.32 1fbx s THR 107 Ca 0.03 -0.97 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 1fbx s THR 107 Cb -0.14 -1.53 0.00 0.00 1.34 0.00 0.00 72.50 72.17 1fbx s THR 107 CO -0.08 0.52 0.00 -0.24 -0.54 0.00 0.00 174.62 174.28 1fbx n SER 108 N 2.73 0.00 -3.92 3.99 2.88 0.74 -4.53 113.62 115.51 1fbx n SER 108 Ca -0.16 -0.70 -0.19 0.00 -1.33 0.00 0.00 58.87 56.49 1fbx n SER 108 Cb 0.52 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.82 1fbx n SER 108 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1fbx s THR 109 N -2.28 0.51 0.06 2.46 2.01 -1.25 -0.04 115.64 117.10 1fbx s THR 109 Ca 0.00 -0.16 -0.31 0.00 0.31 0.00 0.00 61.69 61.53 1fbx s THR 109 Cb 0.00 -0.50 -0.06 0.00 0.01 0.00 0.00 72.50 71.95 1fbx s THR 109 CO 0.00 0.19 1.20 0.00 -0.69 0.00 0.00 174.62 175.33 1fbx n GLU 111 N 4.00 0.52 0.02 0.00 0.28 0.40 -0.13 120.64 125.74 1fbx n GLU 111 Ca 0.09 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.15 1fbx n GLU 111 Cb 0.46 -1.49 -0.10 0.00 1.43 0.00 0.00 31.44 31.75 1fbx n GLU 111 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1fbx n HIS 112 N -0.99 0.52 -1.32 -1.84 8.25 -1.26 -4.60 115.22 113.99 1fbx n HIS 112 Ca 0.12 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 1fbx n HIS 112 Cb 0.06 -0.84 0.00 0.00 1.12 0.00 0.00 29.99 30.32 1fbx n HIS 112 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1fbx n HIS 113 N -2.60 0.00 -1.99 4.41 8.25 -1.14 -5.01 115.22 117.13 1fbx n HIS 113 Ca -0.08 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.18 1fbx n HIS 113 Cb 0.71 0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.81 1fbx n HIS 113 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1fbx n PHE 114 N 0.00 -0.55 -3.20 4.41 3.01 0.82 -4.97 117.46 116.98 1fbx n PHE 114 Ca 0.00 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.25 1fbx n PHE 114 Cb 0.42 -3.62 0.00 0.00 -0.01 0.00 0.00 39.48 36.27 1fbx n PHE 114 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1fbx s VAL 115 N -2.85 3.99 0.33 -4.37 1.01 -1.25 -4.80 120.40 112.46 1fbx s VAL 115 Ca 0.00 -0.73 -0.29 0.00 0.00 0.00 0.00 61.98 60.96 1fbx s VAL 115 Cb 0.00 -3.43 -0.11 0.00 0.00 0.00 0.00 36.38 32.84 1fbx s VAL 115 CO 0.00 -0.24 1.42 -0.89 0.00 0.00 0.00 175.10 175.39 1fbx s THR 116 N -2.39 2.42 -0.32 3.92 2.01 -1.26 -1.33 115.64 118.69 1fbx s THR 116 Ca 0.47 0.40 0.03 0.00 0.31 0.00 0.00 61.69 62.90 1fbx s THR 116 Cb -0.10 -3.25 0.09 0.00 0.01 0.00 0.00 72.50 69.25 1fbx s THR 116 CO 0.35 0.09 0.02 -0.63 -0.69 0.00 0.00 174.62 173.75 1fbx s ILE 117 N -0.81 2.15 -0.23 1.82 1.01 0.95 -1.35 121.20 124.73 1fbx s ILE 117 Ca 0.53 -2.11 -0.09 0.00 0.00 0.00 0.00 60.65 58.98 1fbx s ILE 117 Cb -0.43 -2.52 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 1fbx s ILE 117 CO 0.54 -0.47 0.12 -0.62 0.00 0.00 0.00 174.94 174.52 1fbx s ASP 118 N 1.00 5.87 0.00 3.58 2.15 -0.04 -0.18 116.67 129.05 1fbx s ASP 118 Ca 0.06 0.07 0.00 0.00 0.43 0.00 0.00 52.55 53.11 1fbx s ASP 118 Cb -0.19 -2.05 0.00 0.00 -0.30 0.00 0.00 42.92 40.38 1fbx s ASP 118 CO -0.08 0.08 0.00 0.61 -0.17 0.00 0.00 175.17 175.61 1fbx n GLY 119 N 4.17 2.54 3.01 2.66 0.00 -0.20 0.12 105.19 117.48 1fbx n GLY 119 Ca -0.16 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 44.86 1fbx n GLY 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fbx s LYS 120 N -0.45 0.40 0.01 1.61 3.01 0.20 -2.35 119.74 122.18 1fbx s LYS 120 Ca 0.00 -0.57 0.05 0.00 -1.01 0.00 0.00 55.97 54.44 1fbx s LYS 120 Cb 0.00 -0.16 -0.02 0.00 -1.01 0.00 0.00 37.83 36.64 1fbx s LYS 120 CO 0.00 0.02 -0.15 0.00 0.51 0.00 0.00 175.35 175.73 1fbx s ALA 121 N -1.12 1.29 -0.14 5.17 0.00 -0.71 -0.53 121.76 125.72 1fbx s ALA 121 Ca -0.09 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.13 1fbx s ALA 121 Cb -0.08 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.77 1fbx s ALA 121 CO -0.00 0.29 -0.21 0.99 0.00 0.00 0.00 175.76 176.82 1fbx s THR 122 N -0.58 2.11 0.02 0.00 2.01 0.44 -0.95 115.64 118.70 1fbx s THR 122 Ca 0.05 -0.96 0.07 0.00 0.31 0.00 0.00 61.69 61.15 1fbx s THR 122 Cb -0.07 -1.84 -0.02 0.00 0.01 0.00 0.00 72.50 70.57 1fbx s THR 122 CO 0.00 0.55 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.58 1fbx s VAL 123 N 0.79 1.70 -0.05 3.82 1.01 -0.29 -0.88 120.40 126.50 1fbx s VAL 123 Ca -0.07 -1.10 -0.13 0.00 0.00 0.00 0.00 61.98 60.68 1fbx s VAL 123 Cb -0.16 -1.45 0.02 0.00 0.00 0.00 0.00 36.38 34.80 1fbx s VAL 123 CO -0.01 0.32 0.30 0.00 0.00 0.00 0.00 175.10 175.71 1fbx s ALA 124 N -0.68 -0.75 0.18 5.51 0.00 -0.49 -0.11 121.76 125.42 1fbx s ALA 124 Ca 0.08 0.49 -0.08 0.00 0.00 0.00 0.00 51.96 52.45 1fbx s ALA 124 Cb -0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1fbx s ALA 124 CO 0.01 -0.22 0.29 1.52 0.00 0.00 0.00 175.76 177.36 1fbx s TYR 125 N -0.81 0.53 -0.25 0.00 1.13 -0.78 0.15 117.35 117.33 1fbx s TYR 125 Ca -0.09 -0.87 -0.01 0.00 -1.41 0.00 0.00 57.07 54.69 1fbx s TYR 125 Cb -0.04 -0.11 0.04 0.00 -1.10 0.00 0.00 41.96 40.74 1fbx s TYR 125 CO 0.03 -0.75 -0.07 0.42 -2.51 0.00 0.00 175.55 172.66 1fbx s ILE 126 N -4.01 2.68 0.63 -3.49 1.01 -0.17 -0.63 121.20 117.22 1fbx s ILE 126 Ca 0.22 -1.20 -0.18 0.00 0.00 0.00 0.00 60.65 59.49 1fbx s ILE 126 Cb 0.03 -2.41 -0.03 0.00 0.01 0.00 0.00 42.46 40.06 1fbx s ILE 126 CO 0.04 0.13 0.98 -2.65 0.00 0.00 0.00 174.94 173.44 1fbx n PRO 127 N 4.61 0.82 0.00 2.79 -0.02 -1.26 -4.83 135.00 137.11 1fbx n PRO 127 Ca -0.16 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1fbx n PRO 127 Cb 0.46 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 1fbx n PRO 127 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1fbx n LYS 128 N -1.26 0.00 0.12 -0.52 4.81 -1.26 -4.79 118.16 115.26 1fbx n LYS 128 Ca 0.14 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.59 1fbx n LYS 128 Cb 0.48 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.52 1fbx n LYS 128 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1fbx h ASP 129 N 0.00 0.00 -4.00 3.14 3.32 -1.91 -3.43 116.42 113.54 1fbx h ASP 129 Ca 0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 1fbx h ASP 129 Cb 0.00 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.40 1fbx h ASP 129 CO 0.00 0.58 -0.72 -0.94 -1.72 0.00 0.00 179.24 176.43 1fbx s SER 130 N -6.42 1.79 -0.10 6.45 1.04 -1.26 -1.25 113.70 113.95 1fbx s SER 130 Ca 0.03 -0.97 0.03 0.00 0.48 0.00 0.00 55.95 55.53 1fbx s SER 130 Cb 0.08 -0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.19 1fbx s SER 130 CO 0.76 -0.30 -0.21 -0.69 0.98 0.00 0.00 173.24 173.79 1fbx s VAL 131 N -3.08 1.82 0.14 5.02 1.01 -0.48 -4.74 120.40 120.09 1fbx s VAL 131 Ca 0.15 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 1fbx s VAL 131 Cb 0.01 -1.59 -0.06 0.00 0.00 0.00 0.00 36.38 34.73 1fbx s VAL 131 CO 0.01 0.51 0.47 -0.51 0.00 0.00 0.00 175.10 175.58 1fbx s ILE 132 N 0.51 5.00 0.60 2.22 2.07 -1.26 -0.80 121.20 129.53 1fbx s ILE 132 Ca -0.16 0.51 -0.18 0.00 -1.41 0.00 0.00 60.65 59.41 1fbx s ILE 132 Cb -0.17 -3.66 -0.05 0.00 0.13 0.00 0.00 42.46 38.71 1fbx s ILE 132 CO 0.06 0.16 0.93 0.61 -1.91 0.00 0.00 174.94 174.79 1fbx n GLY 133 N 0.53 -0.41 0.23 1.50 0.00 -1.08 -4.90 105.19 101.06 1fbx n GLY 133 Ca -0.05 -0.14 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 1fbx n GLY 133 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fbx h LEU 134 N 0.46 0.70 -1.65 0.99 3.38 -1.96 -3.10 115.31 114.14 1fbx h LEU 134 Ca -0.48 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.13 1fbx h LEU 134 Cb 1.37 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1fbx h LEU 134 CO 0.51 1.05 -0.11 0.77 0.09 0.00 0.00 178.44 180.75 1fbx h SER 135 N 0.53 0.00 -0.26 -0.43 4.64 -2.01 -2.94 113.55 113.07 1fbx h SER 135 Ca 0.03 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.31 1fbx h SER 135 Cb 0.98 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.05 1fbx h SER 135 CO 0.09 0.11 0.03 0.11 -0.87 0.00 0.00 176.83 176.30 1fbx h LYS 136 N 0.00 0.55 -0.02 4.77 1.79 -1.91 0.05 116.57 121.80 1fbx h LYS 136 Ca -0.00 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.36 1fbx h LYS 136 Cb 0.48 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.04 1fbx h LYS 136 CO 0.01 0.55 0.01 0.82 -1.08 0.00 0.00 179.45 179.76 1fbx h ILE 137 N 0.53 1.10 0.16 1.86 2.04 -1.66 0.19 117.51 121.73 1fbx h ILE 137 Ca 0.12 -0.28 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1fbx h ILE 137 Cb 0.29 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 1fbx h ILE 137 CO 0.01 0.08 -0.37 0.78 0.00 0.00 0.00 178.15 178.64 1fbx h ASN 138 N -0.09 -1.08 -0.52 1.72 2.35 -1.57 -0.06 115.58 116.33 1fbx h ASN 138 Ca 0.01 0.12 0.10 0.00 -0.55 0.00 0.00 56.30 55.98 1fbx h ASN 138 Cb 0.12 0.40 -0.09 0.00 0.05 0.00 0.00 38.32 38.80 1fbx h ASN 138 CO -0.00 -0.46 -0.00 0.03 -1.65 0.00 0.00 177.43 175.34 1fbx h ARG 139 N -0.63 0.11 -0.61 0.81 3.08 -0.79 0.12 114.38 116.46 1fbx h ARG 139 Ca 0.02 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1fbx h ARG 139 Cb 0.64 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.64 1fbx h ARG 139 CO -0.19 0.07 0.35 0.82 -1.07 0.00 0.00 179.97 179.95 1fbx h ILE 140 N 0.12 1.19 -0.52 2.04 2.04 -0.31 -0.54 117.51 121.53 1fbx h ILE 140 Ca 0.26 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.71 1fbx h ILE 140 Cb 0.40 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 1fbx h ILE 140 CO -0.44 0.20 0.28 0.58 0.00 0.00 0.00 178.15 178.78 1fbx h VAL 141 N 0.83 1.00 -0.15 1.67 2.07 0.18 -1.62 116.25 120.23 1fbx h VAL 141 Ca 0.22 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 1fbx h VAL 141 Cb 0.01 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 1fbx h VAL 141 CO -0.04 0.10 -0.10 1.56 0.02 0.00 0.00 177.57 179.11 1fbx h GLN 142 N 0.56 0.23 0.76 1.57 1.08 -0.49 -1.58 115.11 117.25 1fbx h GLN 142 Ca 0.22 -0.05 -0.03 0.00 -1.45 0.00 0.00 58.65 57.34 1fbx h GLN 142 Cb 0.09 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 1fbx h GLN 142 CO -0.13 0.35 -0.50 0.35 -0.95 0.00 0.00 178.83 177.95 1fbx h PHE 143 N 0.23 -1.34 0.00 2.96 3.57 -0.10 -2.06 116.94 120.19 1fbx h PHE 143 Ca 0.05 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1fbx h PHE 143 Cb 0.33 0.49 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 1fbx h PHE 143 CO 0.00 -0.73 -0.19 0.74 -2.23 0.00 0.00 178.31 175.90 1fbx h PHE 144 N -1.19 0.00 -0.55 0.41 0.04 -1.48 -2.31 116.94 111.86 1fbx h PHE 144 Ca -0.10 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.66 1fbx h PHE 144 Cb 0.96 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.09 1fbx h PHE 144 CO -0.13 0.19 0.31 0.00 -0.60 0.00 0.00 178.31 178.08 1fbx h ALA 145 N 1.81 1.51 -0.57 2.45 0.00 -0.90 -3.28 119.26 120.27 1fbx h ALA 145 Ca -0.00 -0.08 -0.73 0.00 0.00 0.00 0.00 54.91 54.10 1fbx h ALA 145 Cb 0.60 -0.22 -0.10 0.00 0.00 0.00 0.00 17.79 18.07 1fbx h ALA 145 CO 0.03 0.41 2.47 1.04 0.00 0.00 0.00 179.25 183.20 1fbx n GLN 146 N -4.40 3.24 -3.68 0.00 1.13 -0.81 -4.32 117.38 108.54 1fbx n GLN 146 Ca 0.05 -3.13 -0.07 0.00 -1.94 0.00 0.00 57.00 51.91 1fbx n GLN 146 Cb 0.09 -3.14 -0.02 0.00 0.11 0.00 0.00 30.24 27.29 1fbx n GLN 146 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1fbx s ARG 147 N 1.99 1.32 0.04 -1.09 0.52 -1.12 -0.89 118.95 119.71 1fbx s ARG 147 Ca 0.44 -0.66 -0.30 0.00 -0.52 0.00 0.00 55.73 54.69 1fbx s ARG 147 Cb 0.10 0.49 -0.04 0.00 0.52 0.00 0.00 34.95 36.03 1fbx s ARG 147 CO -0.03 -0.60 0.98 -2.14 0.02 0.00 0.00 175.30 173.54 1fbx s PRO 148 N -3.53 4.60 0.32 3.54 0.02 -1.26 -3.95 135.00 134.74 1fbx s PRO 148 Ca 0.09 1.45 0.03 0.00 0.02 0.00 0.00 61.00 62.58 1fbx s PRO 148 Cb -0.03 -3.43 -0.04 0.00 0.02 0.00 0.00 34.50 31.02 1fbx s PRO 148 CO -0.01 0.02 0.12 -0.65 -0.33 0.00 0.00 177.00 176.15 1fbx s GLN 149 N 0.69 1.65 -0.04 5.54 -1.52 0.52 -4.64 119.66 121.86 1fbx s GLN 149 Ca 0.51 -1.95 0.03 0.00 -1.95 0.00 0.00 55.36 52.00 1fbx s GLN 149 Cb -0.22 -0.40 0.00 0.00 -0.22 0.00 0.00 33.01 32.17 1fbx s GLN 149 CO 0.29 -0.38 -0.13 0.08 -0.25 0.00 0.00 175.29 174.90 1fbx s VAL 150 N -3.48 1.13 0.20 1.09 1.01 -1.26 -0.45 120.40 118.64 1fbx s VAL 150 Ca 0.33 -0.53 -0.10 0.00 0.00 0.00 0.00 61.98 61.68 1fbx s VAL 150 Cb 0.06 -1.00 0.13 0.00 0.00 0.00 0.00 36.38 35.56 1fbx s VAL 150 CO 0.16 0.34 1.81 -0.61 0.00 0.00 0.00 175.10 176.80 1fbx h GLN 151 N 6.51 0.64 -0.95 2.72 4.15 -2.00 -1.91 115.11 124.28 1fbx h GLN 151 Ca -0.32 -0.04 0.19 0.00 0.77 0.00 0.00 58.65 59.25 1fbx h GLN 151 Cb 1.18 -0.15 -0.08 0.00 0.21 0.00 0.00 27.48 28.64 1fbx h GLN 151 CO 0.48 0.43 0.61 0.93 -1.93 0.00 0.00 178.83 179.34 1fbx h GLU 152 N 0.66 0.58 0.11 1.69 3.07 -1.99 -2.14 114.58 116.56 1fbx h GLU 152 Ca 0.28 -0.03 -0.25 0.00 -0.50 0.00 0.00 59.36 58.85 1fbx h GLU 152 Cb 0.15 -0.13 0.03 0.00 -0.84 0.00 0.00 28.75 27.96 1fbx h GLU 152 CO -0.17 0.38 -1.06 -0.09 -1.40 0.00 0.00 179.01 176.68 1fbx h ARG 153 N 0.60 0.52 -0.21 2.33 2.43 -1.80 -3.15 114.38 115.10 1fbx h ARG 153 Ca 0.51 -0.71 0.05 0.00 -0.81 0.00 0.00 59.98 59.02 1fbx h ARG 153 Cb 1.00 0.24 -0.05 0.00 -0.42 0.00 0.00 29.97 30.74 1fbx h ARG 153 CO -0.26 1.31 -0.12 1.25 -1.51 0.00 0.00 179.97 180.64 1fbx h LEU 154 N 0.07 -0.40 -0.77 3.80 5.85 -0.78 -0.49 115.31 122.60 1fbx h LEU 154 Ca -0.16 0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.73 1fbx h LEU 154 Cb 1.77 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 42.95 1fbx h LEU 154 CO 0.20 -0.16 0.43 0.74 -0.34 0.00 0.00 178.44 179.31 1fbx h THR 155 N -0.11 0.91 -0.05 1.05 2.02 -1.51 -2.07 112.91 113.15 1fbx h THR 155 Ca 0.12 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 1fbx h THR 155 Cb 0.28 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1fbx h THR 155 CO -0.28 0.13 0.02 1.56 0.37 0.00 0.00 175.52 177.33 1fbx h GLN 156 N 0.74 0.07 -0.67 6.66 1.08 -1.32 -2.75 115.11 118.91 1fbx h GLN 156 Ca 0.37 -0.01 0.04 0.00 -1.45 0.00 0.00 58.65 57.59 1fbx h GLN 156 Cb 0.32 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.69 1fbx h GLN 156 CO -0.24 0.20 0.41 1.96 -0.95 0.00 0.00 178.83 180.22 1fbx h GLN 157 N -0.08 0.77 -0.34 1.46 4.20 -0.64 -2.26 115.11 118.23 1fbx h GLN 157 Ca 0.02 -0.05 0.04 0.00 0.06 0.00 0.00 58.65 58.72 1fbx h GLN 157 Cb 0.16 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 1fbx h GLN 157 CO -0.00 0.51 0.13 0.82 -0.67 0.00 0.00 178.83 179.61 1fbx h ILE 158 N 0.79 0.92 0.33 2.54 2.04 -1.36 0.16 117.51 122.92 1fbx h ILE 158 Ca 0.28 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 66.03 1fbx h ILE 158 Cb 0.06 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1fbx h ILE 158 CO -0.12 0.05 -0.33 0.25 0.00 0.00 0.00 178.15 178.00 1fbx h LEU 159 N 0.28 -0.91 -0.50 1.44 5.85 -1.16 0.14 115.31 120.45 1fbx h LEU 159 Ca 0.15 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.04 1fbx h LEU 159 Cb 0.11 0.30 -0.09 0.00 0.37 0.00 0.00 40.66 41.36 1fbx h LEU 159 CO -0.15 -0.44 -0.06 0.40 -0.34 0.00 0.00 178.44 177.86 1fbx h ILE 160 N -0.66 0.56 -0.67 4.05 1.08 -1.35 0.43 117.51 120.95 1fbx h ILE 160 Ca -0.04 -0.02 0.08 0.00 -0.39 0.00 0.00 64.86 64.48 1fbx h ILE 160 Cb 0.57 0.49 -0.06 0.00 -3.07 0.00 0.00 36.82 34.76 1fbx h ILE 160 CO -0.04 0.01 0.34 0.00 -0.69 0.00 0.00 178.15 177.77 1fbx h ALA 161 N 1.47 0.90 -0.24 1.87 0.00 -0.53 0.76 119.26 123.49 1fbx h ALA 161 Ca 0.25 0.04 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 1fbx h ALA 161 Cb 0.38 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1fbx h ALA 161 CO -0.46 -0.02 -0.52 -0.07 0.00 0.00 0.00 179.25 178.18 1fbx h LEU 162 N 0.61 0.76 -0.17 0.00 3.38 0.92 -2.40 115.31 118.40 1fbx h LEU 162 Ca 0.32 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1fbx h LEU 162 Cb 0.28 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1fbx h LEU 162 CO -0.23 1.13 0.07 1.56 0.09 0.00 0.00 178.44 181.06 1fbx h GLN 163 N 0.54 0.26 -0.92 1.13 4.20 0.31 -1.59 115.11 119.04 1fbx h GLN 163 Ca 0.02 -0.05 0.05 0.00 0.06 0.00 0.00 58.65 58.73 1fbx h GLN 163 Cb 1.08 -0.04 -0.06 0.00 0.30 0.00 0.00 27.48 28.76 1fbx h GLN 163 CO 0.11 0.34 0.60 1.15 -0.67 0.00 0.00 178.83 180.36 1fbx h THR 164 N 0.13 1.12 0.00 -0.54 2.02 -0.83 0.04 112.91 114.84 1fbx h THR 164 Ca 0.06 -0.38 -0.17 0.00 0.77 0.00 0.00 66.41 66.69 1fbx h THR 164 Cb 0.18 -0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.48 1fbx h THR 164 CO -0.00 0.20 -0.90 -0.07 0.37 0.00 0.00 175.52 175.12 1fbx h LEU 165 N 1.11 0.00 -0.05 2.58 3.38 -1.35 -3.34 115.31 117.64 1fbx h LEU 165 Ca 0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1fbx h LEU 165 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1fbx h LEU 165 CO -0.13 0.74 -0.81 0.18 0.09 0.00 0.00 178.44 178.51 1fbx n LEU 166 N -3.22 0.89 -2.12 1.67 4.77 -0.60 -4.99 117.00 113.41 1fbx n LEU 166 Ca -0.02 -0.36 -0.15 0.00 -0.03 0.00 0.00 56.01 55.46 1fbx n LEU 166 Cb 0.85 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.89 1fbx n LEU 166 CO 0.44 0.22 0.01 0.61 -1.33 0.00 0.00 177.39 177.33 1fbx n GLY 167 N 1.49 -0.12 3.27 -0.72 0.00 -0.02 -4.69 105.19 104.40 1fbx n GLY 167 Ca 0.05 -0.17 -0.16 0.00 0.00 0.00 0.00 46.02 45.74 1fbx n GLY 167 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1fbx n THR 168 N -4.10 0.00 -0.32 2.61 -1.04 -1.12 -4.91 114.28 105.40 1fbx n THR 168 Ca -0.07 -1.93 0.00 0.00 -2.04 0.00 0.00 64.05 60.01 1fbx n THR 168 Cb 0.58 1.11 0.00 0.00 -1.82 0.00 0.00 70.33 70.20 1fbx n THR 168 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1fbx n ASN 169 N -1.66 0.39 -3.89 8.00 3.02 -1.26 -4.49 115.26 115.37 1fbx n ASN 169 Ca 0.03 -0.78 -0.42 0.00 -0.03 0.00 0.00 54.58 53.37 1fbx n ASN 169 Cb 0.58 0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.92 1fbx n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1fbx n ASN 170 N -0.16 4.19 -4.03 6.41 3.02 -1.26 -0.85 115.26 122.58 1fbx n ASN 170 Ca 0.00 -2.88 -0.15 0.00 -0.03 0.00 0.00 54.58 51.52 1fbx n ASN 170 Cb 0.08 -1.65 -0.13 0.00 -0.61 0.00 0.00 39.78 37.46 1fbx n ASN 170 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fbx s VAL 171 N 3.06 0.55 0.00 2.41 1.01 -1.22 -1.00 120.40 125.21 1fbx s VAL 171 Ca 0.47 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1fbx s VAL 171 Cb 0.12 -0.54 -0.00 0.00 0.00 0.00 0.00 36.38 35.95 1fbx s VAL 171 CO -0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 175.10 174.91 1fbx s ALA 172 N -0.78 0.14 -0.01 5.51 0.00 0.12 -1.15 121.76 125.60 1fbx s ALA 172 Ca -0.03 -0.14 -0.00 0.00 0.00 0.00 0.00 51.96 51.79 1fbx s ALA 172 Cb -0.06 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.06 1fbx s ALA 172 CO 0.00 0.01 0.01 0.08 0.00 0.00 0.00 175.76 175.87 1fbx s VAL 173 N -0.22 -0.02 -0.01 0.00 1.01 -0.35 -1.39 120.40 119.43 1fbx s VAL 173 Ca -0.01 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.06 1fbx s VAL 173 Cb -0.02 -0.04 -0.00 0.00 0.00 0.00 0.00 36.38 36.32 1fbx s VAL 173 CO -0.00 0.03 -0.06 -0.55 0.00 0.00 0.00 175.10 174.52 1fbx s SER 174 N 0.37 0.77 -0.06 3.32 0.15 -0.06 0.07 113.70 118.26 1fbx s SER 174 Ca -0.03 -0.12 0.01 0.00 0.70 0.00 0.00 55.95 56.51 1fbx s SER 174 Cb -0.04 -0.10 0.02 0.00 -1.71 0.00 0.00 66.02 64.18 1fbx s SER 174 CO -0.01 0.07 -0.07 -0.63 1.20 0.00 0.00 173.24 173.80 1fbx s ILE 175 N -0.10 0.77 -0.22 6.45 1.01 0.12 -0.42 121.20 128.81 1fbx s ILE 175 Ca 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.41 1fbx s ILE 175 Cb -0.03 -0.76 0.02 0.00 0.01 0.00 0.00 42.46 41.70 1fbx s ILE 175 CO -0.00 0.28 -0.09 -0.62 0.00 0.00 0.00 174.94 174.51 1fbx s ASP 176 N 0.95 4.02 0.11 3.58 2.15 0.31 -1.06 116.67 126.73 1fbx s ASP 176 Ca -0.10 -0.70 -0.06 0.00 0.43 0.00 0.00 52.55 52.12 1fbx s ASP 176 Cb -0.15 -1.64 -0.02 0.00 -0.30 0.00 0.00 42.92 40.82 1fbx s ASP 176 CO 0.00 -0.07 0.16 0.00 -0.17 0.00 0.00 175.17 175.10 1fbx s ALA 177 N 1.35 0.14 -0.13 3.66 0.00 -0.34 0.61 121.76 127.06 1fbx s ALA 177 Ca 0.03 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.04 1fbx s ALA 177 Cb -0.15 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 1fbx s ALA 177 CO -0.06 -0.52 -0.09 0.08 0.00 0.00 0.00 175.76 175.16 1fbx s VAL 178 N -3.93 3.42 -0.38 0.00 1.01 0.33 -1.13 120.40 119.72 1fbx s VAL 178 Ca 0.12 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 1fbx s VAL 178 Cb 0.05 -2.45 0.03 0.00 0.00 0.00 0.00 36.38 34.01 1fbx s VAL 178 CO -0.05 0.53 0.22 -1.00 0.00 0.00 0.00 175.10 174.79 1fbx s HIS 179 N 0.15 3.25 -1.12 5.22 3.76 -1.26 -0.86 115.29 124.42 1fbx s HIS 179 Ca -0.05 -0.97 0.06 0.00 -0.15 0.00 0.00 55.06 53.95 1fbx s HIS 179 Cb -0.14 -2.49 0.29 0.00 1.11 0.00 0.00 32.58 31.35 1fbx s HIS 179 CO 0.04 -0.66 1.16 0.66 -0.85 0.00 0.00 174.74 175.09 1fbx n TYR 180 N 5.01 0.00 1.64 1.40 4.02 -0.46 -0.52 117.16 128.26 1fbx n TYR 180 Ca -0.12 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 57.92 1fbx n TYR 180 Cb 0.46 -0.44 0.68 0.00 -0.02 0.00 0.00 39.34 40.01 1fbx n TYR 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fbx n VAL 182 N -0.43 1.02 -0.09 0.00 0.31 0.33 -4.44 118.33 115.02 1fbx n VAL 182 Ca 0.20 -0.58 -0.18 0.00 -0.01 0.00 0.00 64.34 63.77 1fbx n VAL 182 Cb 0.26 -0.73 -0.13 0.00 -0.91 0.00 0.00 33.84 32.33 1fbx n VAL 182 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1fbx n LYS 183 N -2.65 0.68 0.00 5.55 4.81 -1.03 -1.31 118.16 124.22 1fbx n LYS 183 Ca -0.26 0.17 0.13 0.00 -0.87 0.00 0.00 58.31 57.48 1fbx n LYS 183 Cb 0.95 -1.58 0.40 0.00 0.02 0.00 0.00 35.03 34.83 1fbx n LYS 183 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fbx n ALA 184 N -3.14 3.00 -3.73 3.14 0.00 0.48 -4.44 120.51 115.81 1fbx n ALA 184 Ca -0.41 -0.24 -0.03 0.00 0.00 0.00 0.00 53.44 52.77 1fbx n ALA 184 Cb 1.02 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 19.18 1fbx n ALA 184 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1fbx s ARG 185 N -3.01 1.07 7.44 0.00 3.03 -1.25 -5.00 118.95 121.23 1fbx s ARG 185 Ca 0.12 -0.59 0.00 0.00 2.03 0.00 0.00 55.73 57.29 1fbx s ARG 185 Cb 0.18 0.36 0.00 0.00 -1.03 0.00 0.00 34.95 34.46 1fbx s ARG 185 CO 0.63 -0.49 0.00 0.41 -1.13 0.00 0.00 175.30 174.72 1fbx n GLY 186 N -0.47 1.74 0.28 3.88 0.00 -1.26 -3.40 105.19 105.96 1fbx n GLY 186 Ca -0.06 -0.52 -0.06 0.00 0.00 0.00 0.00 46.02 45.38 1fbx n GLY 186 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1fbx h ILE 187 N 0.00 1.25 -3.00 -0.61 6.09 -1.85 -3.48 117.51 115.92 1fbx h ILE 187 Ca 0.00 -1.11 -0.15 0.00 -1.37 0.00 0.00 64.86 62.23 1fbx h ILE 187 Cb 0.00 0.96 0.06 0.00 0.47 0.00 0.00 36.82 38.31 1fbx h ILE 187 CO 0.00 0.39 -0.27 0.54 -3.07 0.00 0.00 178.15 175.73 1fbx n ARG 188 N -4.18 -3.01 -2.66 2.19 1.74 -0.43 -4.98 116.66 105.32 1fbx n ARG 188 Ca 0.02 0.32 -0.43 0.00 -0.77 0.00 0.00 57.85 56.99 1fbx n ARG 188 Cb 0.34 -3.82 -0.02 0.00 -1.02 0.00 0.00 32.46 27.94 1fbx n ARG 188 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1fbx s ASP 189 N -3.21 6.70 0.03 0.55 -1.08 -0.52 -4.87 116.67 114.28 1fbx s ASP 189 Ca 0.18 0.59 0.28 0.00 -0.52 0.00 0.00 52.55 53.08 1fbx s ASP 189 Cb -0.08 -2.52 0.99 0.00 -1.46 0.00 0.00 42.92 39.84 1fbx s ASP 189 CO 0.28 -1.08 1.77 0.00 0.52 0.00 0.00 175.17 176.67 1fbx n ALA 190 N 7.37 2.60 -0.06 3.66 0.00 -1.26 -4.01 120.51 128.81 1fbx n ALA 190 Ca 0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.34 1fbx n ALA 190 Cb 0.48 -1.38 -0.09 0.00 0.00 0.00 0.00 19.45 18.45 1fbx n ALA 190 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fbx n THR 191 N -1.63 0.80 -1.08 0.00 -2.24 -1.26 -5.05 114.28 103.81 1fbx n THR 191 Ca 0.06 -0.50 -0.32 0.00 -2.27 0.00 0.00 64.05 61.02 1fbx n THR 191 Cb 0.36 -0.66 0.12 0.00 -2.10 0.00 0.00 70.33 68.05 1fbx n THR 191 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1fbx s SER 192 N -4.44 3.73 0.07 3.42 1.04 -1.26 -5.06 113.70 111.20 1fbx s SER 192 Ca -0.06 2.15 -0.09 0.00 0.48 0.00 0.00 55.95 58.44 1fbx s SER 192 Cb 0.04 -2.56 -0.00 0.00 0.10 0.00 0.00 66.02 63.59 1fbx s SER 192 CO 0.49 -2.57 0.18 0.00 0.98 0.00 0.00 173.24 172.33 1fbx s ALA 193 N -2.50 -0.24 -0.06 5.32 0.00 -1.26 -4.80 121.76 118.22 1fbx s ALA 193 Ca 0.68 -0.54 0.05 0.00 0.00 0.00 0.00 51.96 52.14 1fbx s ALA 193 Cb -0.23 0.42 -0.01 0.00 0.00 0.00 0.00 23.12 23.30 1fbx s ALA 193 CO 0.53 -0.46 -0.22 0.99 0.00 0.00 0.00 175.76 176.60 1fbx s THR 194 N -3.49 1.83 -0.15 0.00 2.01 -0.28 -4.95 115.64 110.61 1fbx s THR 194 Ca 0.02 -0.93 0.02 0.00 0.31 0.00 0.00 61.69 61.11 1fbx s THR 194 Cb 0.03 -1.57 0.01 0.00 0.01 0.00 0.00 72.50 70.99 1fbx s THR 194 CO -0.09 0.51 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.26 1fbx s THR 195 N 0.03 2.15 0.07 -0.82 2.01 -1.26 -1.20 115.64 116.63 1fbx s THR 195 Ca -0.07 -0.94 0.08 0.00 0.31 0.00 0.00 61.69 61.07 1fbx s THR 195 Cb -0.14 -1.88 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 1fbx s THR 195 CO 0.04 0.54 -0.22 0.42 -0.69 0.00 0.00 174.62 174.71 1fbx s THR 196 N 0.90 1.79 -0.03 -0.82 -4.23 -0.22 -4.97 115.64 108.07 1fbx s THR 196 Ca -0.05 -1.38 -0.02 0.00 -1.18 0.00 0.00 61.69 59.07 1fbx s THR 196 Cb -0.15 -1.58 0.02 0.00 1.34 0.00 0.00 72.50 72.13 1fbx s THR 196 CO -0.04 0.14 0.07 0.42 -0.54 0.00 0.00 174.62 174.67 1fbx s THR 197 N -0.93 -0.02 -0.26 3.99 -4.23 -1.26 0.10 115.64 113.03 1fbx s THR 197 Ca 0.08 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.68 1fbx s THR 197 Cb -0.09 -0.11 0.04 0.00 1.34 0.00 0.00 72.50 73.67 1fbx s THR 197 CO 0.03 0.03 -0.08 -0.44 -0.54 0.00 0.00 174.62 173.63 1fbx s SER 198 N 0.49 4.38 -0.17 3.99 0.01 0.11 -4.99 113.70 117.53 1fbx s SER 198 Ca -0.04 -1.12 -0.07 0.00 1.31 0.00 0.00 55.95 56.03 1fbx s SER 198 Cb -0.05 -1.62 -0.04 0.00 0.21 0.00 0.00 66.02 64.51 1fbx s SER 198 CO -0.02 -0.17 0.07 -0.76 0.41 0.00 0.00 173.24 172.77 1fbx s LEU 199 N 1.23 3.88 0.11 2.44 1.43 -1.26 -1.21 118.68 125.30 1fbx s LEU 199 Ca -0.04 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.25 1fbx s LEU 199 Cb -0.18 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 1fbx s LEU 199 CO -0.05 0.21 -0.14 -0.83 0.23 0.00 0.00 176.35 175.78 1fbx s GLY 200 N 0.13 1.03 0.00 -3.19 0.00 -0.30 -4.65 107.32 100.33 1fbx s GLY 200 Ca 0.05 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.52 1fbx s GLY 200 CO 0.00 -1.30 0.00 0.61 0.00 0.00 0.00 173.10 172.41 1fbx n GLY 201 N 0.62 3.23 0.38 0.20 0.00 -0.03 -2.29 105.19 107.30 1fbx n GLY 201 Ca -0.16 -0.23 0.15 0.00 0.00 0.00 0.00 46.02 45.78 1fbx n GLY 201 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fbx h LEU 202 N 0.00 0.44 -2.72 0.99 3.38 -1.95 0.13 115.31 115.58 1fbx h LEU 202 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1fbx h LEU 202 Cb 0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1fbx h LEU 202 CO 0.00 0.22 0.06 -0.26 0.09 0.00 0.00 178.44 178.55 1fbx h PHE 203 N 0.47 0.00 0.00 1.13 0.04 -1.73 0.30 116.94 117.14 1fbx h PHE 203 Ca 0.40 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.92 1fbx h PHE 203 Cb 0.87 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.98 1fbx h PHE 203 CO -0.00 0.00 -1.82 1.17 -0.60 0.00 0.00 178.31 177.06 1fbx n LYS 204 N -3.22 0.54 -0.05 1.51 4.81 0.36 -4.01 118.16 118.10 1fbx n LYS 204 Ca -0.02 0.23 -0.13 0.00 -0.87 0.00 0.00 58.31 57.51 1fbx n LYS 204 Cb 0.13 -1.43 -0.08 0.00 0.02 0.00 0.00 35.03 33.68 1fbx n LYS 204 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1fbx h SER 205 N -0.97 0.33 -2.81 3.14 4.64 -1.27 -3.42 113.55 113.19 1fbx h SER 205 Ca -0.38 -0.50 -0.55 0.00 -0.47 0.00 0.00 61.79 59.89 1fbx h SER 205 Cb 1.32 -0.09 -0.08 0.00 -0.31 0.00 0.00 62.40 63.24 1fbx h SER 205 CO -0.23 0.77 1.01 -0.55 -0.87 0.00 0.00 176.83 176.95 1fbx s SER 206 N -6.10 6.31 0.23 4.97 0.15 0.10 -4.90 113.70 114.46 1fbx s SER 206 Ca -0.14 -0.17 -0.07 0.00 0.70 0.00 0.00 55.95 56.26 1fbx s SER 206 Cb 0.04 -2.55 0.37 0.00 -1.71 0.00 0.00 66.02 62.17 1fbx s SER 206 CO 0.74 -1.64 1.71 -0.61 1.20 0.00 0.00 173.24 174.64 1fbx h GLN 207 N 9.76 0.30 -0.35 5.44 5.75 -1.82 0.68 115.11 134.88 1fbx h GLN 207 Ca -0.26 -0.02 0.07 0.00 -0.15 0.00 0.00 58.65 58.29 1fbx h GLN 207 Cb 1.05 -0.07 -0.06 0.00 1.07 0.00 0.00 27.48 29.47 1fbx h GLN 207 CO 1.23 0.20 -0.07 -0.97 -2.65 0.00 0.00 178.83 176.56 1fbx h ASN 208 N 0.31 -0.30 -0.23 -0.69 -1.24 -1.92 -2.51 115.58 108.99 1fbx h ASN 208 Ca 0.36 0.10 -0.14 0.00 0.71 0.00 0.00 56.30 57.33 1fbx h ASN 208 Cb 0.55 0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.81 1fbx h ASN 208 CO -0.42 -0.10 -0.39 0.74 -1.29 0.00 0.00 177.43 175.96 1fbx h THR 209 N 0.01 1.31 -0.91 -3.57 2.02 -1.65 -2.94 112.91 107.19 1fbx h THR 209 Ca 0.17 -1.59 0.15 0.00 0.77 0.00 0.00 66.41 65.91 1fbx h THR 209 Cb 0.25 1.76 -0.10 0.00 -1.74 0.00 0.00 68.15 68.33 1fbx h THR 209 CO -0.35 0.50 0.51 -0.09 0.37 0.00 0.00 175.52 176.46 1fbx h ARG 210 N 0.39 0.69 0.00 6.66 2.43 -0.71 -1.85 114.38 121.99 1fbx h ARG 210 Ca 0.02 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.04 1fbx h ARG 210 Cb 0.98 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 30.36 1fbx h ARG 210 CO 0.09 0.46 -0.68 0.45 -1.51 0.00 0.00 179.97 178.78 1fbx h HIS 211 N 0.71 0.00 -0.26 2.20 3.86 -1.46 -1.76 115.15 118.45 1fbx h HIS 211 Ca 0.49 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.65 1fbx h HIS 211 Cb 0.68 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.14 1fbx h HIS 211 CO -0.06 0.44 -0.10 0.93 0.86 0.00 0.00 177.93 180.00 1fbx h GLU 212 N 0.00 0.41 0.32 2.45 5.08 -1.18 -1.45 114.58 120.22 1fbx h GLU 212 Ca -0.04 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1fbx h GLU 212 Cb 1.37 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1fbx h GLU 212 CO 0.05 0.52 -0.15 0.35 -1.00 0.00 0.00 179.01 178.78 1fbx h PHE 213 N 0.39 -0.40 0.00 4.33 3.57 -1.28 -3.13 116.94 120.43 1fbx h PHE 213 Ca 0.08 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1fbx h PHE 213 Cb 0.42 0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.29 1fbx h PHE 213 CO 0.01 -0.25 0.12 1.28 -2.23 0.00 0.00 178.31 177.25 1fbx n LEU 214 N -5.02 0.24 -0.06 0.59 4.77 -0.67 -1.64 117.00 115.20 1fbx n LEU 214 Ca -0.05 0.54 -0.09 0.00 -0.03 0.00 0.00 56.01 56.38 1fbx n LEU 214 Cb 0.17 -0.54 -0.08 0.00 -2.33 0.00 0.00 43.42 40.64 1fbx n LEU 214 CO 0.13 -0.62 0.19 -0.09 -1.33 0.00 0.00 177.39 175.67 1fbx h ARG 215 N 0.00 0.00 0.00 3.23 2.43 -1.28 -3.33 114.38 115.43 1fbx h ARG 215 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1fbx h ARG 215 Cb 0.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 1fbx h ARG 215 CO 0.00 0.58 0.00 0.00 -1.51 0.00 0.00 179.97 179.04 1fbx n ALA 216 N -2.73 1.44 -1.80 2.80 0.00 -0.65 -4.79 120.51 114.79 1fbx n ALA 216 Ca -0.07 -0.01 -0.35 0.00 0.00 0.00 0.00 53.44 53.02 1fbx n ALA 216 Cb 0.29 -1.19 -0.05 0.00 0.00 0.00 0.00 19.45 18.50 1fbx n ALA 216 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1fbx s VAL 217 N -3.07 4.06 0.00 0.00 1.01 -1.09 -4.28 120.40 117.03 1fbx s VAL 217 Ca 0.04 1.44 0.00 0.00 0.00 0.00 0.00 61.98 63.46 1fbx s VAL 217 Cb 0.07 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1fbx s VAL 217 CO 0.20 -0.12 0.00 -1.14 0.00 0.00 0.00 175.10 174.04 1fbx n ARG 218 N -0.30 0.00 -1.93 2.72 3.00 -1.26 -5.02 116.66 113.87 1fbx n ARG 218 Ca 0.06 0.04 -0.24 0.00 -0.00 0.00 0.00 57.85 57.70 1fbx n ARG 218 Cb 0.52 -0.57 -0.07 0.00 0.00 0.00 0.00 32.46 32.33 1fbx n ARG 218 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.63 176.62 1fbx s HIS 219 N -2.00 1.72 -0.78 -0.14 3.76 -1.26 -4.87 115.29 111.73 1fbx s HIS 219 Ca 0.00 1.00 -0.25 0.00 -0.15 0.00 0.00 55.06 55.65 1fbx s HIS 219 Cb 0.00 -3.82 -0.06 0.00 1.11 0.00 0.00 32.58 29.81 1fbx s HIS 219 CO 0.00 -1.16 2.08 -1.58 -0.85 0.00 0.00 174.74 173.23 1fbx s HIS 220 N 12.51 1.55 0.00 1.40 2.46 -1.26 -4.79 115.29 127.17 1fbx s HIS 220 Ca 0.73 1.07 0.00 0.00 0.47 0.00 0.00 55.06 57.32 1fbx s HIS 220 Cb -0.03 -3.87 0.00 0.00 -0.13 0.00 0.00 32.58 28.55 1fbx s HIS 220 CO 0.12 -1.89 0.00 0.09 -2.47 0.00 0.00 174.74 170.59