#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 -4.27 3.54 2.88 -1.26 -5.16 113.62 109.35 1fbx n SER 2 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 1fbx n SER 2 Cb 0.00 0.40 -0.10 0.00 -0.75 0.00 0.00 64.21 63.76 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 -4.38 2.40 0.43 2.46 1.43 -1.26 -4.72 118.68 115.05 1fbx s LEU 3 Ca 0.00 -1.08 0.04 0.00 -1.03 0.00 0.00 54.13 52.06 1fbx s LEU 3 Cb 0.00 -0.29 0.01 0.00 0.03 0.00 0.00 46.19 45.94 1fbx s LEU 3 CO 0.00 -0.40 0.61 -0.94 0.23 0.00 0.00 176.35 175.85 1fbx s SER 4 N -3.20 5.69 0.09 2.29 1.04 -1.26 -4.96 113.70 113.39 1fbx s SER 4 Ca 0.20 -0.11 -0.35 0.00 0.48 0.00 0.00 55.95 56.18 1fbx s SER 4 Cb 0.04 -1.06 -0.15 0.00 0.10 0.00 0.00 66.02 64.95 1fbx s SER 4 CO 0.03 -0.75 1.57 0.11 0.98 0.00 0.00 173.24 175.18 1fbx h LYS 5 N 0.52 -0.85 0.15 4.02 1.57 -2.02 -1.71 116.57 118.26 1fbx h LYS 5 Ca -0.43 0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.41 1fbx h LYS 5 Cb 1.27 0.19 -0.04 0.00 0.08 0.00 0.00 32.23 33.73 1fbx h LYS 5 CO 0.52 -0.57 -0.52 0.93 -0.57 0.00 0.00 179.45 179.23 1fbx h GLU 6 N -0.89 -0.74 -0.84 3.15 3.07 -1.98 -0.50 114.58 115.85 1fbx h GLU 6 Ca -0.04 0.05 0.14 0.00 -0.50 0.00 0.00 59.36 59.02 1fbx h GLU 6 Cb 0.81 0.17 -0.15 0.00 -0.84 0.00 0.00 28.75 28.74 1fbx h GLU 6 CO -0.13 -0.49 -0.34 0.00 -1.40 0.00 0.00 179.01 176.65 1fbx h ALA 7 N -0.59 0.18 -0.31 3.43 0.00 -1.91 0.78 119.26 120.85 1fbx h ALA 7 Ca -0.01 0.25 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1fbx h ALA 7 Cb 0.76 0.87 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 1fbx h ALA 7 CO -0.27 -0.59 0.14 0.00 0.00 0.00 0.00 179.25 178.53 1fbx h ALA 8 N 1.36 0.37 -0.60 0.00 0.00 -0.81 -0.60 119.26 118.98 1fbx h ALA 8 Ca 0.33 0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.28 1fbx h ALA 8 Cb 0.59 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 1fbx h ALA 8 CO -0.87 -0.25 0.37 -0.07 0.00 0.00 0.00 179.25 178.43 1fbx h LEU 9 N 0.30 0.60 0.36 0.00 3.38 0.71 -1.20 115.31 119.45 1fbx h LEU 9 Ca 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1fbx h LEU 9 Cb 0.06 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1fbx h LEU 9 CO -0.11 0.42 -0.18 0.58 0.09 0.00 0.00 178.44 179.25 1fbx h VAL 10 N 0.72 0.61 -0.57 1.22 2.07 -0.74 -2.20 116.25 117.36 1fbx h VAL 10 Ca 0.24 -0.50 0.11 0.00 0.82 0.00 0.00 66.70 67.38 1fbx h VAL 10 Cb 0.02 0.84 -0.09 0.00 -1.52 0.00 0.00 31.29 30.54 1fbx h VAL 10 CO -0.10 0.09 0.00 -0.74 0.02 0.00 0.00 177.57 176.84 1fbx h HIS 11 N -0.79 -0.04 0.26 1.57 -0.00 -1.00 -0.40 115.15 114.75 1fbx h HIS 11 Ca -0.05 0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 1fbx h HIS 11 Cb 0.52 0.10 -0.02 0.00 -0.00 0.00 0.00 27.41 28.02 1fbx h HIS 11 CO 0.01 -0.14 -0.27 0.93 -0.00 0.00 0.00 177.93 178.46 1fbx h GLU 12 N 0.12 -0.55 -0.97 5.26 5.08 -1.22 -1.43 114.58 120.88 1fbx h GLU 12 Ca 0.29 0.04 0.20 0.00 -1.00 0.00 0.00 59.36 58.89 1fbx h GLU 12 Cb 0.46 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.72 1fbx h GLU 12 CO -0.48 -0.37 0.55 0.00 -1.00 0.00 0.00 179.01 177.72 1fbx h ALA 13 N 0.06 1.61 0.24 3.43 0.00 -0.68 0.56 119.26 124.48 1fbx h ALA 13 Ca -0.01 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1fbx h ALA 13 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1fbx h ALA 13 CO -0.06 -0.14 -0.11 -0.07 0.00 0.00 0.00 179.25 178.86 1fbx h LEU 14 N 0.66 -0.27 -0.66 0.00 3.38 -0.71 -2.08 115.31 115.63 1fbx h LEU 14 Ca 0.58 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 58.43 1fbx h LEU 14 Cb 0.96 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.72 1fbx h LEU 14 CO -0.42 0.05 0.33 0.58 0.09 0.00 0.00 178.44 179.07 1fbx h VAL 15 N -0.61 0.90 -0.48 1.22 2.07 -0.04 0.30 116.25 119.61 1fbx h VAL 15 Ca -0.03 -0.20 0.09 0.00 0.82 0.00 0.00 66.70 67.38 1fbx h VAL 15 Cb 0.44 0.25 -0.08 0.00 -1.52 0.00 0.00 31.29 30.38 1fbx h VAL 15 CO 0.05 0.11 -0.02 0.00 0.02 0.00 0.00 177.57 177.73 1fbx h ALA 16 N 1.38 0.43 -0.01 1.67 0.00 0.15 0.26 119.26 123.15 1fbx h ALA 16 Ca 0.31 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.37 1fbx h ALA 16 Cb 0.27 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1fbx h ALA 16 CO -0.23 -0.40 -0.01 0.54 0.00 0.00 0.00 179.25 179.15 1fbx n ARG 17 N -5.24 1.30 -3.28 0.00 3.00 -0.72 -4.93 116.66 106.79 1fbx n ARG 17 Ca 0.05 -0.50 -0.16 0.00 -0.01 0.00 0.00 57.85 57.23 1fbx n ARG 17 Cb 0.26 -1.49 0.08 0.00 0.00 0.00 0.00 32.46 31.31 1fbx n ARG 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1fbx n GLY 18 N 1.11 -0.28 0.45 -0.13 0.00 0.93 -4.92 105.19 102.35 1fbx n GLY 18 Ca 0.21 0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.34 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 -3.83 1.95 -4.87 0.99 4.77 -0.36 -5.00 117.00 110.64 1fbx n LEU 19 Ca -0.23 -2.89 -0.31 0.00 -0.03 0.00 0.00 56.01 52.55 1fbx n LEU 19 Cb 0.64 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 41.35 1fbx n LEU 19 CO 0.54 0.83 0.44 -1.61 -1.33 0.00 0.00 177.39 176.25 1fbx s GLU 20 N -2.23 3.82 0.14 3.23 0.41 -1.25 -4.79 118.70 118.03 1fbx s GLU 20 Ca 0.29 0.51 -0.31 0.00 -0.41 0.00 0.00 54.97 55.04 1fbx s GLU 20 Cb 0.27 -2.40 -0.09 0.00 -1.78 0.00 0.00 34.13 30.14 1fbx s GLU 20 CO -0.03 0.00 1.48 0.99 -0.49 0.00 0.00 175.26 177.21 1fbx s THR 21 N -2.30 2.95 -0.58 3.63 2.01 -1.26 -4.84 115.64 115.26 1fbx s THR 21 Ca 0.52 0.69 -0.30 0.00 0.31 0.00 0.00 61.69 62.90 1fbx s THR 21 Cb -0.10 -3.44 -0.12 0.00 0.01 0.00 0.00 72.50 68.84 1fbx s THR 21 CO 0.29 0.05 2.42 -2.65 -0.69 0.00 0.00 174.62 174.04 1fbx n PRO 22 N 3.93 0.79 -4.56 4.92 -0.02 -1.26 -4.92 135.00 133.88 1fbx n PRO 22 Ca 0.13 0.10 -0.26 0.00 -2.02 0.00 0.00 63.50 61.45 1fbx n PRO 22 Cb 0.40 -2.60 -0.14 0.00 -0.02 0.00 0.00 33.50 31.14 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 9.74 2.21 0.04 2.45 1.02 -1.26 -5.15 118.68 127.74 1fbx s LEU 23 Ca 1.12 -0.59 0.03 0.00 0.02 0.00 0.00 54.13 54.71 1fbx s LEU 23 Cb -0.69 -1.00 -0.04 0.00 0.02 0.00 0.00 46.19 44.48 1fbx s LEU 23 CO 0.40 0.15 0.03 -0.13 0.02 0.00 0.00 176.35 176.81 1fbx s ARG 24 N -1.45 2.77 0.19 1.70 0.52 -1.26 -5.06 118.95 116.35 1fbx s ARG 24 Ca 0.08 -0.68 -0.33 0.00 -0.52 0.00 0.00 55.73 54.28 1fbx s ARG 24 Cb -0.09 -2.66 -0.14 0.00 0.52 0.00 0.00 34.95 32.58 1fbx s ARG 24 CO 0.03 0.59 1.54 -2.30 0.02 0.00 0.00 175.30 175.18 1fbx n PRO 25 N 0.91 2.15 -0.47 3.54 -0.02 -1.26 -4.79 135.00 135.07 1fbx n PRO 25 Ca -0.12 0.77 0.40 0.00 -2.02 0.00 0.00 63.50 62.54 1fbx n PRO 25 Cb 0.52 -2.52 0.73 0.00 -0.02 0.00 0.00 33.50 32.22 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 5.49 0.05 0.00 0.52 0.11 -2.05 -3.45 132.00 132.68 1fbx h PRO 26 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1fbx h PRO 26 Cb 1.26 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1fbx h PRO 26 CO 0.85 0.04 0.00 0.28 -0.21 0.00 0.00 178.00 178.96 1fbx n VAL 27 N -4.25 0.00 -4.42 3.15 0.31 -1.26 -4.83 118.33 107.03 1fbx n VAL 27 Ca 0.34 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.36 1fbx n VAL 27 Cb 1.49 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 34.31 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 2.67 -0.78 3.52 -3.43 -1.26 -5.04 115.29 110.97 1fbx s HIS 28 Ca 0.00 -0.19 -0.26 0.00 -0.80 0.00 0.00 55.06 53.82 1fbx s HIS 28 Cb 0.00 -1.46 -0.13 0.00 -1.43 0.00 0.00 32.58 29.56 1fbx s HIS 28 CO 0.00 0.35 2.39 -1.21 -2.00 0.00 0.00 174.74 174.27 1fbx s GLU 29 N -1.80 1.65 -0.26 -0.38 2.02 -1.26 -4.93 118.70 113.75 1fbx s GLU 29 Ca 0.18 0.49 -0.10 0.00 0.02 0.00 0.00 54.97 55.56 1fbx s GLU 29 Cb -0.11 -4.79 -0.05 0.00 0.10 0.00 0.00 34.13 29.29 1fbx s GLU 29 CO 0.09 -4.37 0.16 1.41 0.02 0.00 0.00 175.26 172.58 1fbx s MET 30 N 8.79 3.97 0.49 1.61 1.75 -1.26 -5.07 119.30 129.58 1fbx s MET 30 Ca 0.92 -0.31 -0.23 0.00 -1.25 0.00 0.00 55.69 54.82 1fbx s MET 30 Cb -0.13 -3.57 -0.08 0.00 2.84 0.00 0.00 34.83 33.89 1fbx s MET 30 CO 0.08 -0.07 1.12 -3.47 -0.65 0.00 0.00 175.02 172.03 1fbx n ASP 31 N 4.69 1.67 0.15 1.11 2.03 -1.26 -4.86 116.55 120.09 1fbx n ASP 31 Ca -0.15 0.98 -0.14 0.00 0.52 0.00 0.00 54.79 56.01 1fbx n ASP 31 Cb 0.52 -1.43 -0.08 0.00 -0.72 0.00 0.00 41.12 39.40 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 1.39 -0.30 -0.04 1.67 2.35 -1.99 -2.23 115.58 116.42 1fbx h ASN 32 Ca -0.47 -0.11 0.01 0.00 -0.55 0.00 0.00 56.30 55.18 1fbx h ASN 32 Cb 1.33 0.08 -0.00 0.00 0.05 0.00 0.00 38.32 39.77 1fbx h ASN 32 CO 0.56 -0.06 0.47 -0.33 -1.65 0.00 0.00 177.43 176.42 1fbx h GLU 33 N -0.53 0.00 0.22 0.81 5.08 -1.99 0.98 114.58 119.15 1fbx h GLU 33 Ca -0.04 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.99 1fbx h GLU 33 Cb 0.39 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.67 1fbx h GLU 33 CO 0.06 0.00 -1.54 1.15 -1.00 0.00 0.00 179.01 177.68 1fbx h THR 34 N 0.00 1.20 -0.18 1.13 2.02 -1.78 -2.78 112.91 112.52 1fbx h THR 34 Ca 0.02 -2.69 -0.03 0.00 0.77 0.00 0.00 66.41 64.49 1fbx h THR 34 Cb 0.96 2.95 -0.01 0.00 -1.74 0.00 0.00 68.15 70.31 1fbx h THR 34 CO -0.00 0.83 0.01 0.03 0.37 0.00 0.00 175.52 176.76 1fbx h ARG 35 N 0.13 0.31 -0.35 6.66 3.08 0.13 -0.76 114.38 123.57 1fbx h ARG 35 Ca -0.27 -0.09 0.07 0.00 0.07 0.00 0.00 59.98 59.76 1fbx h ARG 35 Cb 2.13 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 32.08 1fbx h ARG 35 CO 0.24 0.50 -0.11 0.87 -1.07 0.00 0.00 179.97 180.41 1fbx h LYS 36 N 0.08 -0.02 -0.77 0.04 1.57 -0.96 0.30 116.57 116.81 1fbx h LYS 36 Ca 0.05 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1fbx h LYS 36 Cb 0.35 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1fbx h LYS 36 CO 0.01 -0.02 0.36 0.66 -0.57 0.00 0.00 179.45 179.89 1fbx h SER 37 N -0.03 1.02 -0.62 0.86 4.64 -1.33 0.20 113.55 118.30 1fbx h SER 37 Ca 0.17 -0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.30 1fbx h SER 37 Cb 0.29 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 1fbx h SER 37 CO -0.38 0.88 0.22 -0.07 -0.87 0.00 0.00 176.83 176.61 1fbx h LEU 38 N 1.10 0.89 -0.46 5.97 3.38 -0.33 -1.62 115.31 124.23 1fbx h LEU 38 Ca 0.26 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1fbx h LEU 38 Cb 0.14 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1fbx h LEU 38 CO -0.03 0.84 0.13 0.40 0.09 0.00 0.00 178.44 179.88 1fbx h ILE 39 N 0.88 1.23 -0.42 1.22 2.04 -0.63 -2.75 117.51 119.08 1fbx h ILE 39 Ca 0.20 -0.77 0.08 0.00 1.00 0.00 0.00 64.86 65.37 1fbx h ILE 39 Cb 0.26 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 37.13 1fbx h ILE 39 CO -0.01 0.28 0.00 0.00 0.00 0.00 0.00 178.15 178.42 1fbx h ALA 40 N 0.99 0.39 0.04 1.87 0.00 -0.10 -0.92 119.26 121.53 1fbx h ALA 40 Ca 0.15 0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.20 1fbx h ALA 40 Cb 0.28 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1fbx h ALA 40 CO -0.00 -0.39 -0.23 0.78 0.00 0.00 0.00 179.25 179.40 1fbx h GLY 41 N 0.11 -0.37 1.40 0.00 0.00 -1.12 -0.00 103.07 103.09 1fbx h GLY 41 Ca 0.21 0.28 0.06 0.00 0.00 0.00 0.00 47.33 47.88 1fbx h GLY 41 CO -0.34 -0.20 0.24 0.45 0.00 0.00 0.00 176.54 176.68 1fbx h HIS 42 N -0.39 0.00 0.21 5.60 -0.00 -1.13 0.35 115.15 119.79 1fbx h HIS 42 Ca 0.05 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.41 1fbx h HIS 42 Cb 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.86 1fbx h HIS 42 CO -0.25 0.00 -0.10 0.52 -0.00 0.00 0.00 177.93 178.10 1fbx h MET 43 N 0.00 -0.27 -1.20 2.45 2.86 0.16 -1.09 114.93 117.85 1fbx h MET 43 Ca 0.10 0.02 0.36 0.00 -2.06 0.00 0.00 59.70 58.12 1fbx h MET 43 Cb 0.58 0.06 -0.11 0.00 0.06 0.00 0.00 31.60 32.19 1fbx h MET 43 CO -0.00 -0.02 0.78 1.15 1.06 0.00 0.00 176.91 179.87 1fbx h THR 44 N -1.02 0.32 0.82 2.22 2.02 0.34 1.01 112.91 118.61 1fbx h THR 44 Ca -0.03 -0.07 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 1fbx h THR 44 Cb 0.37 0.08 0.01 0.00 -1.74 0.00 0.00 68.15 66.87 1fbx h THR 44 CO 0.05 0.04 -0.40 -0.33 0.37 0.00 0.00 175.52 175.25 1fbx h GLU 45 N 0.21 -1.07 -0.40 6.66 4.39 -0.28 -2.34 114.58 121.75 1fbx h GLU 45 Ca 0.71 0.07 0.02 0.00 0.34 0.00 0.00 59.36 60.50 1fbx h GLU 45 Cb 2.10 0.24 -0.03 0.00 -0.10 0.00 0.00 28.75 30.97 1fbx h GLU 45 CO -0.33 -0.70 0.24 0.82 -1.16 0.00 0.00 179.01 177.87 1fbx h ILE 46 N -1.21 1.04 0.00 3.13 2.04 0.21 -1.33 117.51 121.39 1fbx h ILE 46 Ca -0.11 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 1fbx h ILE 46 Cb 0.86 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1fbx h ILE 46 CO 0.19 0.09 -0.01 0.24 0.00 0.00 0.00 178.15 178.66 1fbx h MET 47 N 0.48 0.00 0.00 2.37 2.86 -0.18 0.79 114.93 121.25 1fbx h MET 47 Ca 0.16 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.60 1fbx h MET 47 Cb 0.01 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.64 1fbx h MET 47 CO -0.08 0.01 -1.03 1.96 1.06 0.00 0.00 176.91 178.83 1fbx h GLN 48 N 0.00 0.00 0.00 1.72 4.20 -0.68 -2.32 115.11 118.04 1fbx h GLN 48 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1fbx h GLN 48 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1fbx h GLN 48 CO 0.00 0.82 0.00 -0.07 -0.67 0.00 0.00 178.83 178.91 1fbx h LEU 49 N 0.00 0.00 0.00 1.46 3.38 -0.48 -2.65 115.31 117.02 1fbx h LEU 49 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1fbx h LEU 49 Cb 1.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.48 1fbx h LEU 49 CO 0.11 0.00 -0.38 0.18 0.09 0.00 0.00 178.44 178.44 1fbx n LEU 50 N -2.66 0.64 0.00 1.67 4.77 -0.48 -4.93 117.00 116.00 1fbx n LEU 50 Ca 0.04 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1fbx n LEU 50 Cb 0.45 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1fbx n LEU 50 CO 0.31 -0.06 0.00 0.59 -1.33 0.00 0.00 177.39 176.90 1fbx n ASN 51 N -2.01 -2.03 -4.70 -1.43 3.02 -1.00 -5.03 115.26 102.08 1fbx n ASN 51 Ca 0.05 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 1fbx n ASN 51 Cb 0.41 -0.34 -0.03 0.00 -0.61 0.00 0.00 39.78 39.22 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 0.00 4.30 -0.55 3.41 1.43 -0.88 -4.93 118.68 121.46 1fbx s LEU 52 Ca 0.00 1.73 -0.26 0.00 -1.03 0.00 0.00 54.13 54.57 1fbx s LEU 52 Cb 0.00 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.60 1fbx s LEU 52 CO 0.00 -0.46 2.19 -0.62 0.23 0.00 0.00 176.35 177.69 1fbx s ASP 53 N 1.20 4.74 0.00 2.29 -1.08 -1.26 -4.63 116.67 117.93 1fbx s ASP 53 Ca 0.53 0.73 0.14 0.00 -0.52 0.00 0.00 52.55 53.43 1fbx s ASP 53 Cb -0.23 -2.51 0.68 0.00 -1.46 0.00 0.00 42.92 39.40 1fbx s ASP 53 CO 0.23 -2.72 1.41 0.18 0.52 0.00 0.00 175.17 174.79 1fbx n LEU 54 N 14.78 0.00 0.23 -1.34 4.77 -1.26 -2.70 117.00 131.47 1fbx n LEU 54 Ca 0.31 0.36 0.15 0.00 -0.03 0.00 0.00 56.01 56.79 1fbx n LEU 54 Cb 0.53 -0.36 0.49 0.00 -2.33 0.00 0.00 43.42 41.76 1fbx n LEU 54 CO 0.70 -0.19 0.91 0.00 -1.33 0.00 0.00 177.39 177.49 1fbx h ALA 55 N 2.61 1.00 -2.72 -1.18 0.00 -1.94 -3.31 119.26 113.72 1fbx h ALA 55 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 1fbx h ALA 55 Cb 0.17 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.03 1fbx h ALA 55 CO 0.00 0.00 0.92 0.34 0.00 0.00 0.00 179.25 180.51 1fbx s ASP 56 N -5.53 6.43 0.00 0.00 2.15 -1.10 -4.86 116.67 113.76 1fbx s ASP 56 Ca 0.04 2.85 0.00 0.00 0.43 0.00 0.00 52.55 55.87 1fbx s ASP 56 Cb 0.08 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1fbx s ASP 56 CO 0.56 -0.90 0.47 -0.90 -0.17 0.00 0.00 175.17 174.23 1fbx n ASP 57 N 3.04 0.00 0.00 -0.34 5.75 -1.26 -1.77 116.55 121.98 1fbx n ASP 57 Ca 0.11 0.06 0.00 0.00 -0.01 0.00 0.00 54.79 54.95 1fbx n ASP 57 Cb 0.37 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.40 1fbx n ASP 57 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1fbx n SER 58 N -0.97 3.73 0.04 -1.12 2.88 -1.26 -4.67 113.62 112.25 1fbx n SER 58 Ca 0.00 -0.04 0.11 0.00 -1.33 0.00 0.00 58.87 57.61 1fbx n SER 58 Cb 0.02 0.83 -0.06 0.00 -0.75 0.00 0.00 64.21 64.24 1fbx n SER 58 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1fbx n LEU 59 N -1.20 0.47 0.00 2.46 4.77 -0.74 -4.52 117.00 118.24 1fbx n LEU 59 Ca 0.00 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1fbx n LEU 59 Cb 0.00 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1fbx n LEU 59 CO 0.00 -0.04 0.47 0.80 -1.33 0.00 0.00 177.39 177.29 1fbx n MET 60 N -2.30 0.00 0.08 3.23 1.56 -0.73 -2.10 117.12 116.87 1fbx n MET 60 Ca -0.01 0.78 0.04 0.00 -0.27 0.00 0.00 57.70 58.25 1fbx n MET 60 Cb 0.52 -1.45 0.23 0.00 2.15 0.00 0.00 33.22 34.68 1fbx n MET 60 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1fbx n GLU 61 N -2.47 0.06 -0.09 2.12 -0.58 -1.26 -3.96 120.64 114.44 1fbx n GLU 61 Ca 0.00 0.49 -0.08 0.00 -0.42 0.00 0.00 57.16 57.15 1fbx n GLU 61 Cb 0.00 -1.84 -0.00 0.00 -0.57 0.00 0.00 31.44 29.02 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 0.00 1.00 -0.04 2.62 2.02 -1.68 -1.11 112.91 115.73 1fbx h THR 62 Ca 0.00 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1fbx h THR 62 Cb 0.32 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1fbx h THR 62 CO 0.00 0.07 -0.02 -0.65 0.37 0.00 0.00 175.52 175.28 1fbx h PRO 63 N 0.36 0.05 0.00 6.66 0.11 -1.79 0.13 132.00 137.53 1fbx h PRO 63 Ca 0.13 -0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.07 1fbx h PRO 63 Cb 0.03 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1fbx h PRO 63 CO -0.08 0.08 -0.81 1.25 -0.21 0.00 0.00 178.00 178.23 1fbx h HIS 64 N 0.05 0.04 0.05 0.65 2.76 -1.72 -0.72 115.15 116.27 1fbx h HIS 64 Ca 0.01 -0.02 -0.22 0.00 -2.20 0.00 0.00 60.37 57.95 1fbx h HIS 64 Cb 0.08 -0.00 0.02 0.00 1.55 0.00 0.00 27.41 29.05 1fbx h HIS 64 CO 0.00 0.82 -0.88 0.00 -1.30 0.00 0.00 177.93 176.58 1fbx h ARG 65 N 0.01 0.50 0.00 5.26 3.08 -0.17 -0.45 114.38 122.62 1fbx h ARG 65 Ca -0.01 -0.61 -0.05 0.00 0.07 0.00 0.00 59.98 59.38 1fbx h ARG 65 Cb 1.43 0.19 -0.01 0.00 0.08 0.00 0.00 29.97 31.66 1fbx h ARG 65 CO 0.11 1.24 -0.25 0.82 -1.07 0.00 0.00 179.97 180.81 1fbx h ILE 66 N 0.04 1.15 0.84 2.04 2.04 -0.81 0.96 117.51 123.77 1fbx h ILE 66 Ca -0.12 -0.87 -0.04 0.00 1.00 0.00 0.00 64.86 64.83 1fbx h ILE 66 Cb 1.59 1.47 0.01 0.00 -0.74 0.00 0.00 36.82 39.14 1fbx h ILE 66 CO 0.17 0.25 -0.40 0.00 0.00 0.00 0.00 178.15 178.16 1fbx h ALA 67 N 1.75 -1.13 -0.30 1.87 0.00 -0.89 -2.40 119.26 118.15 1fbx h ALA 67 Ca -0.00 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.68 1fbx h ALA 67 Cb 0.45 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 1fbx h ALA 67 CO 0.03 -1.10 0.12 -0.22 0.00 0.00 0.00 179.25 178.08 1fbx h LYS 68 N -1.21 0.25 -0.17 0.00 3.64 -0.64 -3.20 116.57 115.24 1fbx h LYS 68 Ca -0.12 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.30 1fbx h LYS 68 Cb 0.88 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.57 1fbx h LYS 68 CO 0.19 0.17 -0.35 1.98 -2.27 0.00 0.00 179.45 179.17 1fbx h MET 69 N 0.26 -0.38 0.02 1.90 4.05 -0.77 0.22 114.93 120.23 1fbx h MET 69 Ca 0.13 0.03 0.02 0.00 -0.28 0.00 0.00 59.70 59.60 1fbx h MET 69 Cb 0.09 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.94 1fbx h MET 69 CO -0.12 -0.25 -0.18 1.88 0.23 0.00 0.00 176.91 178.47 1fbx h TYR 70 N -0.40 -0.46 0.03 1.39 -1.99 -1.44 -0.97 116.97 113.13 1fbx h TYR 70 Ca 0.10 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.85 1fbx h TYR 70 Cb 0.56 0.20 0.00 0.00 2.00 0.00 0.00 36.73 39.50 1fbx h TYR 70 CO -0.45 -0.26 -0.02 0.28 -0.00 0.00 0.00 178.16 177.72 1fbx h VAL 71 N -0.30 1.31 0.00 -2.88 2.07 -1.52 -1.85 116.25 113.08 1fbx h VAL 71 Ca 0.05 -1.73 -0.12 0.00 0.82 0.00 0.00 66.70 65.71 1fbx h VAL 71 Cb 0.36 2.37 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 1fbx h VAL 71 CO -0.15 0.40 -0.57 0.44 0.02 0.00 0.00 177.57 177.71 1fbx h ASP 72 N -0.89 0.00 0.00 0.57 5.19 -0.67 -3.32 116.42 117.30 1fbx h ASP 72 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1fbx h ASP 72 Cb 0.70 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.21 1fbx h ASP 72 CO 0.01 0.57 0.00 -0.62 -3.12 0.00 0.00 179.24 176.08 1fbx n GLU 73 N -3.37 0.00 0.28 3.56 1.02 -0.49 -4.68 120.64 116.95 1fbx n GLU 73 Ca 0.01 0.00 0.19 0.00 -0.02 0.00 0.00 57.16 57.33 1fbx n GLU 73 Cb 0.70 0.00 0.99 0.00 -0.02 0.00 0.00 31.44 33.11 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 0.00 -0.07 -3.67 3.07 -1.43 -1.87 117.51 113.55 1fbx h ILE 74 Ca 0.00 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 66.39 1fbx h ILE 74 Cb 0.00 0.84 0.00 0.00 -0.27 0.00 0.00 36.82 37.39 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 -2.80 0.14 0.33 0.16 3.72 -0.70 -3.34 117.46 114.98 1fbx n PHE 75 Ca -0.02 -0.69 0.21 0.00 -0.05 0.00 0.00 57.45 56.89 1fbx n PHE 75 Cb 0.07 -0.10 1.14 0.00 -0.94 0.00 0.00 39.48 39.64 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 0.41 0.00 0.10 4.37 4.64 -1.32 -0.70 113.55 121.06 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 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1fbx h SER 76 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 1fbx n GLY 77 N -1.15 -0.61 0.10 -0.77 0.00 -0.49 -2.10 105.19 100.16 1fbx n GLY 77 Ca -0.03 -0.09 -0.05 0.00 0.00 0.00 0.00 46.02 45.85 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 0.03 -8.29 0.99 3.38 -1.24 -3.42 115.31 106.76 1fbx h LEU 78 Ca 0.00 -0.03 -0.74 0.00 0.09 0.00 0.00 57.88 57.20 1fbx h LEU 78 Cb 0.05 -0.01 -0.23 0.00 0.09 0.00 0.00 40.66 40.56 1fbx h LEU 78 CO 0.00 0.86 -0.32 -0.62 0.09 0.00 0.00 178.44 178.45 1fbx s ASP 79 N -6.79 6.15 0.00 -0.43 2.15 -0.89 -4.92 116.67 111.93 1fbx s ASP 79 Ca -0.00 -1.35 0.00 0.00 0.43 0.00 0.00 52.55 51.63 1fbx s ASP 79 Cb 0.11 -2.19 0.00 0.00 -0.30 0.00 0.00 42.92 40.54 1fbx s ASP 79 CO 0.80 -0.66 0.81 -1.22 -0.17 0.00 0.00 175.17 174.73 1fbx n TYR 80 N 5.21 0.00 0.33 -5.34 4.02 -1.26 0.53 117.16 120.65 1fbx n TYR 80 Ca -0.12 0.00 0.22 0.00 -0.01 0.00 0.00 57.90 57.98 1fbx n TYR 80 Cb 0.43 -0.32 1.15 0.00 -0.02 0.00 0.00 39.34 40.59 1fbx n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fbx h ALA 81 N 1.79 1.05 -0.02 -0.72 0.00 -1.91 -0.81 119.26 118.63 1fbx h ALA 81 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fbx h ALA 81 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fbx h ALA 81 CO 0.00 0.00 -0.20 0.09 0.00 0.00 0.00 179.25 179.14 1fbx n ASN 82 N -3.15 1.76 -4.59 0.00 3.02 0.19 -4.97 115.26 107.52 1fbx n ASN 82 Ca -0.03 -1.40 -0.42 0.00 -0.03 0.00 0.00 54.58 52.70 1fbx n ASN 82 Cb 0.09 0.16 0.01 0.00 -0.61 0.00 0.00 39.78 39.43 1fbx n ASN 82 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1fbx n PHE 83 N 0.09 1.00 -2.41 3.10 7.35 -0.31 -4.90 117.46 121.37 1fbx n PHE 83 Ca 0.14 0.59 -0.33 0.00 -0.76 0.00 0.00 57.45 57.08 1fbx n PHE 83 Cb 0.43 -2.20 -0.03 0.00 0.35 0.00 0.00 39.48 38.02 1fbx n PHE 83 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 1fbx s PRO 84 N -1.90 3.83 0.01 -7.13 0.04 -1.26 -4.99 135.00 123.61 1fbx s PRO 84 Ca 0.63 1.10 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 1fbx s PRO 84 Cb -0.58 -2.11 -0.07 0.00 0.04 0.00 0.00 34.50 31.78 1fbx s PRO 84 CO 0.57 -0.38 1.56 0.15 0.04 0.00 0.00 177.00 178.95 1fbx s LYS 85 N -3.80 4.22 -0.10 4.56 1.02 -1.26 -4.95 119.74 119.43 1fbx s LYS 85 Ca 0.62 2.16 -0.12 0.00 0.02 0.00 0.00 55.97 58.65 1fbx s LYS 85 Cb -0.12 -3.68 -0.05 0.00 -0.52 0.00 0.00 37.83 33.46 1fbx s LYS 85 CO 0.28 -0.71 0.27 0.42 -0.92 0.00 0.00 175.35 174.70 1fbx s ILE 86 N 2.89 5.29 -0.09 2.17 -1.09 -1.26 -5.00 121.20 124.11 1fbx s ILE 86 Ca 0.70 0.52 0.01 0.00 -2.23 0.00 0.00 60.65 59.65 1fbx s ILE 86 Cb -0.35 -3.58 0.02 0.00 -1.58 0.00 0.00 42.46 36.97 1fbx s ILE 86 CO 0.29 0.52 -0.11 0.42 -1.23 0.00 0.00 174.94 174.83 1fbx s THR 87 N -0.46 1.16 0.19 2.92 -4.23 -1.26 -5.12 115.64 108.84 1fbx s THR 87 Ca 0.18 -0.45 0.11 0.00 -1.18 0.00 0.00 61.69 60.35 1fbx s THR 87 Cb -0.14 -1.09 -0.04 0.00 1.34 0.00 0.00 72.50 72.57 1fbx s THR 87 CO 0.06 0.37 -0.20 -0.76 -0.54 0.00 0.00 174.62 173.55 1fbx s LEU 88 N 1.04 2.57 0.29 4.79 1.43 -1.26 -2.57 118.68 124.97 1fbx s LEU 88 Ca -0.07 -0.81 0.05 0.00 -1.03 0.00 0.00 54.13 52.27 1fbx s LEU 88 Cb -0.15 -1.28 -0.06 0.00 0.03 0.00 0.00 46.19 44.73 1fbx s LEU 88 CO -0.01 0.11 0.01 0.27 0.23 0.00 0.00 176.35 176.96 1fbx s ILE 89 N -1.72 1.33 0.26 -0.59 -4.36 -0.50 -4.94 121.20 110.69 1fbx s ILE 89 Ca 0.22 -2.05 -0.30 0.00 -0.26 0.00 0.00 60.65 58.27 1fbx s ILE 89 Cb -0.08 -2.60 -0.09 0.00 1.25 0.00 0.00 42.46 40.94 1fbx s ILE 89 CO 0.11 -0.17 1.11 -0.70 0.24 0.00 0.00 174.94 175.54 1fbx s GLU 90 N -3.83 4.62 -1.49 0.37 2.12 -1.26 -1.32 118.70 117.91 1fbx s GLU 90 Ca 0.32 1.80 -0.11 0.00 0.36 0.00 0.00 54.97 57.35 1fbx s GLU 90 Cb 0.07 -3.20 0.01 0.00 0.26 0.00 0.00 34.13 31.27 1fbx s GLU 90 CO 0.13 0.17 2.51 -1.71 -0.54 0.00 0.00 175.26 175.82 1fbx n ASN 91 N 1.45 6.61 0.23 -1.70 5.15 0.13 -4.48 115.26 122.67 1fbx n ASN 91 Ca -0.00 -2.81 0.13 0.00 -0.60 0.00 0.00 54.58 51.30 1fbx n ASN 91 Cb 0.45 -1.55 0.34 0.00 -0.53 0.00 0.00 39.78 38.48 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 5.36 0.00 0.00 1.20 1.57 -1.91 -2.83 116.57 119.96 1fbx h LYS 92 Ca 0.69 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.47 1fbx h LYS 92 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1fbx h LYS 92 CO 1.76 0.05 0.00 -1.33 -0.57 0.00 0.00 179.45 179.36 1fbx n MET 93 N -3.12 0.05 -3.71 3.15 2.81 -1.26 -4.89 117.12 110.14 1fbx n MET 93 Ca 0.03 0.19 -0.24 0.00 -1.81 0.00 0.00 57.70 55.87 1fbx n MET 93 Cb 0.47 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.52 1fbx n MET 93 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1fbx n LYS 94 N -1.46 -5.78 -2.38 0.03 5.02 -1.07 -4.92 118.16 107.60 1fbx n LYS 94 Ca 0.05 0.68 -0.42 0.00 -2.02 0.00 0.00 58.31 56.59 1fbx n LYS 94 Cb 0.19 -5.47 -0.03 0.00 -0.02 0.00 0.00 35.03 29.70 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 -3.47 4.11 -0.02 -0.18 1.01 -1.26 -4.90 120.40 115.68 1fbx s VAL 95 Ca 0.28 1.43 0.03 0.00 0.00 0.00 0.00 61.98 63.72 1fbx s VAL 95 Cb -0.13 -3.92 0.04 0.00 0.00 0.00 0.00 36.38 32.36 1fbx s VAL 95 CO 0.79 -0.02 0.84 -0.90 0.00 0.00 0.00 175.10 175.81 1fbx n ASP 96 N 5.50 0.59 -4.78 3.32 5.75 -1.26 -4.53 116.55 121.14 1fbx n ASP 96 Ca 0.12 -1.79 -0.24 0.00 -0.01 0.00 0.00 54.79 52.87 1fbx n ASP 96 Cb 0.45 -0.13 -0.06 0.00 -1.03 0.00 0.00 41.12 40.35 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 -0.53 2.31 0.55 0.11 0.41 -1.26 -4.94 118.70 115.34 1fbx s GLU 97 Ca 0.04 -1.77 -0.17 0.00 -0.41 0.00 0.00 54.97 52.66 1fbx s GLU 97 Cb 0.04 -2.08 -0.06 0.00 -1.78 0.00 0.00 34.13 30.25 1fbx s GLU 97 CO 0.00 -0.14 1.04 0.00 -0.49 0.00 0.00 175.26 175.67 1fbx s MET 98 N -3.97 3.58 -0.17 1.61 0.23 -1.26 -4.44 119.30 114.88 1fbx s MET 98 Ca 0.43 1.20 -0.02 0.00 -1.03 0.00 0.00 55.69 56.27 1fbx s MET 98 Cb 0.02 -2.07 -0.01 0.00 -1.53 0.00 0.00 34.83 31.24 1fbx s MET 98 CO 0.24 -0.59 -0.09 0.08 -2.03 0.00 0.00 175.02 172.62 1fbx s VAL 99 N -2.36 3.20 -0.08 5.16 1.01 -0.54 -4.96 120.40 121.82 1fbx s VAL 99 Ca 0.64 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 62.06 1fbx s VAL 99 Cb -0.15 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1fbx s VAL 99 CO 0.31 0.48 -0.18 -0.89 0.00 0.00 0.00 175.10 174.82 1fbx s THR 100 N 0.84 2.66 -0.23 3.92 2.01 -1.26 -2.46 115.64 121.13 1fbx s THR 100 Ca -0.03 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.14 1fbx s THR 100 Cb -0.15 -2.05 0.03 0.00 0.01 0.00 0.00 72.50 70.35 1fbx s THR 100 CO 0.01 0.56 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.69 1fbx s VAL 101 N -0.12 2.39 0.24 3.82 1.01 0.12 -4.99 120.40 122.88 1fbx s VAL 101 Ca -0.03 -1.17 0.08 0.00 0.00 0.00 0.00 61.98 60.86 1fbx s VAL 101 Cb -0.14 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 34.00 1fbx s VAL 101 CO 0.04 0.25 0.08 0.00 0.00 0.00 0.00 175.10 175.47 1fbx s ARG 102 N 1.25 2.58 -1.45 2.72 1.70 -1.26 -0.58 118.95 123.91 1fbx s ARG 102 Ca -0.01 -1.20 -0.07 0.00 -0.47 0.00 0.00 55.73 53.98 1fbx s ARG 102 Cb -0.16 -2.37 0.05 0.00 -0.57 0.00 0.00 34.95 31.89 1fbx s ARG 102 CO -0.08 0.40 0.74 -0.25 -1.08 0.00 0.00 175.30 175.03 1fbx n ASP 103 N -0.85 -2.40 -4.72 -2.89 8.00 -1.02 -4.93 116.55 107.75 1fbx n ASP 103 Ca -0.08 -0.87 -0.42 0.00 0.71 0.00 0.00 54.79 54.14 1fbx n ASP 103 Cb 0.58 -3.63 -0.03 0.00 -0.02 0.00 0.00 41.12 38.01 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 -3.57 3.73 0.07 0.53 1.01 0.76 -4.77 121.20 118.96 1fbx s ILE 104 Ca 0.30 1.26 -0.31 0.00 0.00 0.00 0.00 60.65 61.91 1fbx s ILE 104 Cb -0.15 -3.81 -0.07 0.00 0.01 0.00 0.00 42.46 38.43 1fbx s ILE 104 CO 0.85 0.11 1.45 -0.89 0.00 0.00 0.00 174.94 176.46 1fbx s THR 105 N 0.96 3.37 -0.20 2.92 2.01 -1.26 -0.21 115.64 123.23 1fbx s THR 105 Ca 0.60 0.88 -0.02 0.00 0.31 0.00 0.00 61.69 63.46 1fbx s THR 105 Cb -0.32 -3.57 0.06 0.00 0.01 0.00 0.00 72.50 68.68 1fbx s THR 105 CO 0.30 0.03 0.01 -0.22 -0.69 0.00 0.00 174.62 174.05 1fbx s LEU 106 N 1.88 1.53 -0.26 4.42 0.20 -0.70 -4.81 118.68 120.94 1fbx s LEU 106 Ca 0.66 -0.90 0.01 0.00 0.69 0.00 0.00 54.13 54.59 1fbx s LEU 106 Cb -0.36 -0.75 0.05 0.00 -0.43 0.00 0.00 46.19 44.71 1fbx s LEU 106 CO 0.29 -0.29 -0.08 0.42 -0.29 0.00 0.00 176.35 176.41 1fbx s THR 107 N 1.74 2.53 0.00 3.68 -4.23 -1.26 -1.12 115.64 116.97 1fbx s THR 107 Ca -0.02 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1fbx s THR 107 Cb -0.17 -2.41 0.00 0.00 1.34 0.00 0.00 72.50 71.25 1fbx s THR 107 CO -0.07 0.02 0.00 -0.24 -0.54 0.00 0.00 174.62 173.79 1fbx n SER 108 N 4.54 1.15 -3.73 3.99 2.88 -0.62 -4.60 113.62 117.23 1fbx n SER 108 Ca -0.15 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.27 1fbx n SER 108 Cb 0.44 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.79 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 1.48 -0.01 0.31 2.46 2.01 -1.26 -2.16 115.64 118.47 1fbx s THR 109 Ca 0.00 0.04 -0.28 0.00 0.31 0.00 0.00 61.69 61.76 1fbx s THR 109 Cb 0.00 -0.53 -0.09 0.00 0.01 0.00 0.00 72.50 71.88 1fbx s THR 109 CO 0.00 0.02 1.04 0.00 -0.69 0.00 0.00 174.62 174.99 1fbx h GLU 111 N 3.47 0.00 0.00 0.00 4.11 -1.04 0.31 114.58 121.44 1fbx h GLU 111 Ca -0.47 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.95 1fbx h GLU 111 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 1fbx h GLU 111 CO 0.66 0.00 -0.07 0.45 0.07 0.00 0.00 179.01 180.12 1fbx h HIS 112 N 0.00 0.00 0.00 2.06 3.86 -1.91 -3.38 115.15 115.77 1fbx h HIS 112 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1fbx h HIS 112 Cb 0.73 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.20 1fbx h HIS 112 CO 0.00 0.07 0.00 0.72 0.86 0.00 0.00 177.93 179.58 1fbx n HIS 113 N -3.13 0.00 -3.62 2.45 8.25 -1.22 -5.01 115.22 112.94 1fbx n HIS 113 Ca 0.03 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.25 1fbx n HIS 113 Cb 0.48 0.04 0.07 0.00 1.12 0.00 0.00 29.99 31.71 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 -2.62 -4.16 4.41 3.01 0.11 -4.98 117.46 113.23 1fbx n PHE 114 Ca 0.00 0.98 -0.30 0.00 1.01 0.00 0.00 57.45 59.14 1fbx n PHE 114 Cb 0.34 -4.87 -0.08 0.00 -0.01 0.00 0.00 39.48 34.86 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 -3.34 3.85 0.21 -4.37 1.01 -1.21 -4.81 120.40 111.73 1fbx s VAL 115 Ca 0.45 -1.11 -0.32 0.00 0.00 0.00 0.00 61.98 61.01 1fbx s VAL 115 Cb -0.21 -2.85 -0.15 0.00 0.00 0.00 0.00 36.38 33.18 1fbx s VAL 115 CO 0.75 0.08 1.23 0.41 0.00 0.00 0.00 175.10 177.57 1fbx n THR 116 N 0.49 1.02 -5.14 3.92 -1.04 -1.26 0.17 114.28 112.43 1fbx n THR 116 Ca -0.11 -0.25 -0.31 0.00 -2.04 0.00 0.00 64.05 61.33 1fbx n THR 116 Cb 0.52 -1.06 -0.17 0.00 -1.82 0.00 0.00 70.33 67.80 1fbx n THR 116 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1fbx s ILE 117 N -0.23 1.95 -0.19 12.58 1.01 -0.92 -1.63 121.20 133.77 1fbx s ILE 117 Ca 0.70 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 60.38 1fbx s ILE 117 Cb -0.77 -1.69 0.06 0.00 0.01 0.00 0.00 42.46 40.07 1fbx s ILE 117 CO 0.52 0.54 0.00 -0.62 0.00 0.00 0.00 174.94 175.38 1fbx s ASP 118 N 0.36 3.05 0.00 3.58 2.15 -0.06 -1.59 116.67 124.17 1fbx s ASP 118 Ca -0.18 -0.85 0.00 0.00 0.43 0.00 0.00 52.55 51.95 1fbx s ASP 118 Cb -0.18 -0.77 0.00 0.00 -0.30 0.00 0.00 42.92 41.68 1fbx s ASP 118 CO 0.08 -0.27 0.00 0.61 -0.17 0.00 0.00 175.17 175.42 1fbx n GLY 119 N 4.94 4.41 2.86 2.66 0.00 -0.28 -0.68 105.19 119.10 1fbx n GLY 119 Ca -0.10 -1.49 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.58 0.04 0.12 1.61 3.01 -0.15 -1.72 119.74 122.07 1fbx s LYS 120 Ca 0.00 0.02 0.09 0.00 -1.01 0.00 0.00 55.97 55.07 1fbx s LYS 120 Cb 0.00 -0.09 -0.04 0.00 -1.01 0.00 0.00 37.83 36.69 1fbx s LYS 120 CO 0.00 -0.02 -0.18 0.00 0.51 0.00 0.00 175.35 175.66 1fbx s ALA 121 N 0.20 2.69 -0.15 5.17 0.00 0.71 -2.07 121.76 128.30 1fbx s ALA 121 Ca -0.02 -1.35 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1fbx s ALA 121 Cb -0.03 -0.65 0.03 0.00 0.00 0.00 0.00 23.12 22.47 1fbx s ALA 121 CO -0.01 0.59 -0.11 0.99 0.00 0.00 0.00 175.76 177.23 1fbx s THR 122 N -1.15 1.42 -0.02 0.00 2.01 -0.29 -0.17 115.64 117.44 1fbx s THR 122 Ca 0.18 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 61.62 1fbx s THR 122 Cb -0.11 -1.41 -0.02 0.00 0.01 0.00 0.00 72.50 70.98 1fbx s THR 122 CO 0.10 0.35 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.47 1fbx s VAL 123 N 1.53 1.75 0.03 3.82 1.01 0.25 -1.16 120.40 127.64 1fbx s VAL 123 Ca 0.03 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.01 1fbx s VAL 123 Cb -0.14 -1.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 1fbx s VAL 123 CO -0.09 0.49 0.07 0.00 0.00 0.00 0.00 175.10 175.56 1fbx s ALA 124 N -0.53 -0.01 0.03 5.51 0.00 -0.70 0.11 121.76 126.17 1fbx s ALA 124 Ca 0.09 -0.57 -0.26 0.00 0.00 0.00 0.00 51.96 51.22 1fbx s ALA 124 Cb -0.09 0.22 0.06 0.00 0.00 0.00 0.00 23.12 23.31 1fbx s ALA 124 CO -0.01 -0.28 0.59 1.52 0.00 0.00 0.00 175.76 177.58 1fbx s TYR 125 N -2.38 -0.53 -0.38 0.00 1.13 -1.03 -0.04 117.35 114.12 1fbx s TYR 125 Ca -0.07 0.71 -0.12 0.00 -1.41 0.00 0.00 57.07 56.18 1fbx s TYR 125 Cb -0.03 0.40 0.03 0.00 -1.10 0.00 0.00 41.96 41.26 1fbx s TYR 125 CO -0.04 -0.66 0.22 0.42 -2.51 0.00 0.00 175.55 172.99 1fbx s ILE 126 N -2.13 4.67 0.36 -3.49 1.01 -0.59 -1.47 121.20 119.55 1fbx s ILE 126 Ca -0.07 -0.86 -0.26 0.00 0.00 0.00 0.00 60.65 59.46 1fbx s ILE 126 Cb -0.01 -3.62 -0.13 0.00 0.01 0.00 0.00 42.46 38.72 1fbx s ILE 126 CO 0.01 -0.27 0.90 -2.65 0.00 0.00 0.00 174.94 172.94 1fbx n PRO 127 N 5.02 1.15 0.00 2.79 -0.02 -1.26 -4.85 135.00 137.83 1fbx n PRO 127 Ca -0.12 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1fbx n PRO 127 Cb 0.46 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 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 0.50 0.00 -0.08 -0.52 4.81 -1.26 -4.75 118.16 116.87 1fbx n LYS 128 Ca 0.10 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.43 1fbx n LYS 128 Cb 0.36 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.26 1fbx n LYS 128 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1fbx n ASP 129 N 0.00 0.64 -4.58 3.14 8.00 -1.26 -4.80 116.55 117.69 1fbx n ASP 129 Ca 0.00 0.10 -0.26 0.00 0.71 0.00 0.00 54.79 55.34 1fbx n ASP 129 Cb 0.00 0.41 -0.09 0.00 -0.02 0.00 0.00 41.12 41.42 1fbx n ASP 129 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1fbx s SER 130 N -5.89 4.25 -0.17 -2.24 1.04 -1.26 -0.69 113.70 108.74 1fbx s SER 130 Ca -0.13 -0.63 0.01 0.00 0.48 0.00 0.00 55.95 55.67 1fbx s SER 130 Cb 0.07 -0.71 0.03 0.00 0.10 0.00 0.00 66.02 65.51 1fbx s SER 130 CO 0.79 0.08 -0.13 -0.69 0.98 0.00 0.00 173.24 174.26 1fbx s VAL 131 N -1.90 1.67 0.44 5.02 1.01 -0.44 -4.80 120.40 121.41 1fbx s VAL 131 Ca 0.27 -0.82 -0.22 0.00 0.00 0.00 0.00 61.98 61.21 1fbx s VAL 131 Cb -0.08 -1.62 -0.09 0.00 0.00 0.00 0.00 36.38 34.59 1fbx s VAL 131 CO 0.16 0.36 1.02 -0.51 0.00 0.00 0.00 175.10 176.13 1fbx s ILE 132 N 1.42 3.89 0.20 2.22 2.07 -1.26 -1.40 121.20 128.33 1fbx s ILE 132 Ca 0.03 1.27 -0.30 0.00 -1.41 0.00 0.00 60.65 60.23 1fbx s ILE 132 Cb -0.14 -3.57 -0.09 0.00 0.13 0.00 0.00 42.46 38.79 1fbx s ILE 132 CO -0.10 -0.16 1.40 -0.83 -1.91 0.00 0.00 174.94 173.33 1fbx s GLY 133 N -1.87 2.22 0.15 1.50 0.00 -1.06 -4.93 107.32 103.33 1fbx s GLY 133 Ca 0.63 1.21 -0.27 0.00 0.00 0.00 0.00 44.72 46.28 1fbx s GLY 133 CO 0.21 2.25 1.58 1.41 0.00 0.00 0.00 173.10 178.55 1fbx h LEU 134 N 5.69 -1.38 -1.92 0.66 3.38 -1.94 -1.25 115.31 118.55 1fbx h LEU 134 Ca -0.44 0.21 0.21 0.00 0.09 0.00 0.00 57.88 57.95 1fbx h LEU 134 Cb 1.21 0.60 -0.03 0.00 0.09 0.00 0.00 40.66 42.53 1fbx h LEU 134 CO 0.81 -0.38 0.63 0.77 0.09 0.00 0.00 178.44 180.36 1fbx h SER 135 N -0.36 0.00 0.07 -0.43 4.64 -2.01 -1.61 113.55 113.85 1fbx h SER 135 Ca 0.12 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.45 1fbx h SER 135 Cb 0.59 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 1fbx h SER 135 CO -0.53 0.00 -0.08 0.11 -0.87 0.00 0.00 176.83 175.45 1fbx h LYS 136 N 0.00 -0.17 -0.58 4.77 1.79 -1.60 -2.06 116.57 118.71 1fbx h LYS 136 Ca 0.35 0.01 0.12 0.00 -2.18 0.00 0.00 60.65 58.95 1fbx h LYS 136 Cb 1.60 0.04 -0.10 0.00 -1.58 0.00 0.00 32.23 32.19 1fbx h LYS 136 CO -0.00 -0.12 -0.05 0.82 -1.08 0.00 0.00 179.45 179.02 1fbx h ILE 137 N -0.18 0.48 -0.30 1.86 2.04 -1.38 0.51 117.51 120.53 1fbx h ILE 137 Ca 0.01 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.91 1fbx h ILE 137 Cb 0.18 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 1fbx h ILE 137 CO -0.04 0.01 -0.12 0.78 0.00 0.00 0.00 178.15 178.78 1fbx h ASN 138 N 0.07 -0.42 -0.84 1.72 2.35 -1.54 -1.70 115.58 115.22 1fbx h ASN 138 Ca 0.29 0.11 0.04 0.00 -0.55 0.00 0.00 56.30 56.19 1fbx h ASN 138 Cb 0.47 0.24 -0.05 0.00 0.05 0.00 0.00 38.32 39.03 1fbx h ASN 138 CO -0.54 -0.15 0.53 0.03 -1.65 0.00 0.00 177.43 175.65 1fbx h ARG 139 N -0.07 0.99 0.06 0.81 3.08 0.51 -1.70 114.38 118.06 1fbx h ARG 139 Ca 0.15 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 1fbx h ARG 139 Cb 0.30 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1fbx h ARG 139 CO -0.35 0.66 -0.04 0.82 -1.07 0.00 0.00 179.97 179.99 1fbx h ILE 140 N 1.02 0.92 -0.38 2.04 2.04 0.08 -2.16 117.51 121.07 1fbx h ILE 140 Ca 0.34 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.28 1fbx h ILE 140 Cb 0.05 0.92 -0.07 0.00 -0.74 0.00 0.00 36.82 36.98 1fbx h ILE 140 CO -0.13 0.00 -0.04 0.58 0.00 0.00 0.00 178.15 178.56 1fbx h VAL 141 N -0.10 0.68 0.00 1.67 2.07 -0.73 -0.78 116.25 119.07 1fbx h VAL 141 Ca -0.00 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 1fbx h VAL 141 Cb 0.08 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1fbx h VAL 141 CO 0.00 0.01 -0.16 1.56 0.02 0.00 0.00 177.57 179.01 1fbx h GLN 142 N 0.06 0.00 0.51 1.57 1.08 -1.21 -1.86 115.11 115.26 1fbx h GLN 142 Ca 0.19 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1fbx h GLN 142 Cb 0.27 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.70 1fbx h GLN 142 CO -0.34 0.16 -0.29 0.35 -0.95 0.00 0.00 178.83 177.75 1fbx h PHE 143 N 0.00 -0.77 0.00 2.96 3.57 -0.46 -0.14 116.94 122.10 1fbx h PHE 143 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.49 1fbx h PHE 143 Cb 0.29 0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 1fbx h PHE 143 CO 0.00 -0.45 -0.01 0.74 -2.23 0.00 0.00 178.31 176.35 1fbx h PHE 144 N -0.75 0.00 0.00 0.41 0.04 -1.42 -1.92 116.94 113.30 1fbx h PHE 144 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1fbx h PHE 144 Cb 0.61 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.76 1fbx h PHE 144 CO -0.08 0.01 0.00 0.00 -0.60 0.00 0.00 178.31 177.64 1fbx h ALA 145 N 1.99 1.00 -0.28 2.45 0.00 -0.78 -3.28 119.26 120.35 1fbx h ALA 145 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 1fbx h ALA 145 Cb 0.53 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 1fbx h ALA 145 CO 0.00 0.00 0.07 1.04 0.00 0.00 0.00 179.25 180.36 1fbx n GLN 146 N -3.04 2.05 -3.85 0.00 1.13 -0.11 -4.17 117.38 109.38 1fbx n GLN 146 Ca 0.03 -1.54 -0.11 0.00 -1.94 0.00 0.00 57.00 53.45 1fbx n GLN 146 Cb 0.48 -1.92 -0.09 0.00 0.11 0.00 0.00 30.24 28.82 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 -0.58 0.61 0.10 -1.09 0.52 -1.21 -1.40 118.95 115.89 1fbx s ARG 147 Ca 0.53 -0.50 -0.31 0.00 -0.52 0.00 0.00 55.73 54.93 1fbx s ARG 147 Cb 0.31 0.25 -0.09 0.00 0.52 0.00 0.00 34.95 35.94 1fbx s ARG 147 CO -0.09 -0.16 1.71 -2.14 0.02 0.00 0.00 175.30 174.64 1fbx s PRO 148 N -1.99 4.17 0.35 3.54 0.02 -1.26 -4.32 135.00 135.52 1fbx s PRO 148 Ca -0.10 2.43 0.04 0.00 0.02 0.00 0.00 61.00 63.40 1fbx s PRO 148 Cb -0.04 -3.56 -0.06 0.00 0.02 0.00 0.00 34.50 30.85 1fbx s PRO 148 CO -0.01 -0.77 0.05 -0.65 -0.33 0.00 0.00 177.00 175.29 1fbx s GLN 149 N 2.57 1.75 -0.09 5.54 -1.52 -0.37 -4.71 119.66 122.81 1fbx s GLN 149 Ca 0.76 -1.98 -0.00 0.00 -1.95 0.00 0.00 55.36 52.19 1fbx s GLN 149 Cb -0.42 -1.04 0.02 0.00 -0.22 0.00 0.00 33.01 31.35 1fbx s GLN 149 CO 0.34 -0.18 -0.06 0.08 -0.25 0.00 0.00 175.29 175.22 1fbx s VAL 150 N -3.16 0.83 0.22 1.09 1.01 -1.26 -0.44 120.40 118.69 1fbx s VAL 150 Ca 0.35 -0.20 -0.15 0.00 0.00 0.00 0.00 61.98 61.98 1fbx s VAL 150 Cb 0.09 -0.87 0.25 0.00 0.00 0.00 0.00 36.38 35.84 1fbx s VAL 150 CO 0.16 0.33 1.59 -0.61 0.00 0.00 0.00 175.10 176.56 1fbx h GLN 151 N 7.97 -0.06 -0.65 2.72 4.15 -2.00 -0.07 115.11 127.18 1fbx h GLN 151 Ca -0.28 0.00 0.19 0.00 0.77 0.00 0.00 58.65 59.33 1fbx h GLN 151 Cb 1.14 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.81 1fbx h GLN 151 CO 0.39 -0.04 0.54 0.93 -1.93 0.00 0.00 178.83 178.72 1fbx h GLU 152 N -0.06 0.00 0.06 1.69 3.07 -1.99 -2.29 114.58 115.05 1fbx h GLU 152 Ca 0.32 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.98 1fbx h GLU 152 Cb 0.57 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 1fbx h GLU 152 CO -0.79 0.00 -1.08 -0.09 -1.40 0.00 0.00 179.01 175.65 1fbx h ARG 153 N 0.00 0.12 -0.81 2.33 2.43 -1.46 -3.29 114.38 113.71 1fbx h ARG 153 Ca 0.31 -0.20 0.18 0.00 -0.81 0.00 0.00 59.98 59.46 1fbx h ARG 153 Cb 1.39 0.08 -0.11 0.00 -0.42 0.00 0.00 29.97 30.90 1fbx h ARG 153 CO -0.00 1.10 0.28 1.25 -1.51 0.00 0.00 179.97 181.08 1fbx h LEU 154 N -0.66 0.17 -0.26 3.80 5.85 -0.90 0.32 115.31 123.63 1fbx h LEU 154 Ca -0.26 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1fbx h LEU 154 Cb 1.47 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.64 1fbx h LEU 154 CO -0.04 -0.00 0.16 0.74 -0.34 0.00 0.00 178.44 178.96 1fbx h THR 155 N 0.35 1.08 -0.70 1.05 2.02 -1.62 -1.98 112.91 113.10 1fbx h THR 155 Ca 0.47 -0.16 -0.05 0.00 0.77 0.00 0.00 66.41 67.45 1fbx h THR 155 Cb 0.84 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.94 1fbx h THR 155 CO -0.51 0.07 0.26 1.56 0.37 0.00 0.00 175.52 177.28 1fbx h GLN 156 N 0.34 1.06 0.28 6.66 1.08 -1.09 -2.66 115.11 120.79 1fbx h GLN 156 Ca 0.09 -0.21 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 1fbx h GLN 156 Cb -0.02 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.25 1fbx h GLN 156 CO -0.02 0.89 -0.14 1.96 -0.95 0.00 0.00 178.83 180.58 1fbx h GLN 157 N 1.01 -0.37 -0.85 1.46 4.20 -0.21 -2.54 115.11 117.81 1fbx h GLN 157 Ca 0.23 0.02 0.17 0.00 0.06 0.00 0.00 58.65 59.14 1fbx h GLN 157 Cb 0.24 0.08 -0.06 0.00 0.30 0.00 0.00 27.48 28.04 1fbx h GLN 157 CO -0.02 -0.14 0.56 0.82 -0.67 0.00 0.00 178.83 179.39 1fbx h ILE 158 N -0.53 0.75 0.46 2.54 2.04 -1.34 -0.44 117.51 120.99 1fbx h ILE 158 Ca -0.04 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 1fbx h ILE 158 Cb 0.39 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1fbx h ILE 158 CO 0.06 0.09 -0.22 0.25 0.00 0.00 0.00 178.15 178.33 1fbx h LEU 159 N 0.47 -0.52 -0.14 1.44 5.85 -1.19 -2.44 115.31 118.78 1fbx h LEU 159 Ca 0.44 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.07 1fbx h LEU 159 Cb 0.98 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 1fbx h LEU 159 CO -0.17 -0.15 0.09 0.40 -0.34 0.00 0.00 178.44 178.28 1fbx h ILE 160 N -0.97 1.03 -0.99 4.05 1.08 -1.05 0.38 117.51 121.05 1fbx h ILE 160 Ca -0.06 -0.06 0.18 0.00 -0.39 0.00 0.00 64.86 64.52 1fbx h ILE 160 Cb 0.58 0.83 -0.10 0.00 -3.07 0.00 0.00 36.82 35.07 1fbx h ILE 160 CO 0.10 0.03 0.61 0.00 -0.69 0.00 0.00 178.15 178.21 1fbx h ALA 161 N 1.05 1.74 0.00 1.87 0.00 -1.17 -0.48 119.26 122.27 1fbx h ALA 161 Ca 0.05 0.06 -0.23 0.00 0.00 0.00 0.00 54.91 54.79 1fbx h ALA 161 Cb -0.02 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.69 1fbx h ALA 161 CO -0.02 -0.08 -0.91 -0.07 0.00 0.00 0.00 179.25 178.18 1fbx h LEU 162 N 0.74 0.80 -2.28 0.00 3.38 -0.81 -2.81 115.31 114.33 1fbx h LEU 162 Ca 0.55 -0.75 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1fbx h LEU 162 Cb 0.87 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1fbx h LEU 162 CO -0.32 1.44 -0.03 1.56 0.09 0.00 0.00 178.44 181.17 1fbx h GLN 163 N 0.24 0.00 0.15 1.13 4.20 -0.19 -1.13 115.11 119.50 1fbx h GLN 163 Ca -0.11 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.38 1fbx h GLN 163 Cb 1.58 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.38 1fbx h GLN 163 CO 0.18 0.03 -0.93 1.15 -0.67 0.00 0.00 178.83 178.60 1fbx h THR 164 N 0.00 1.46 0.00 -0.54 2.02 -1.07 -2.35 112.91 112.43 1fbx h THR 164 Ca -0.00 -2.54 0.00 0.00 0.77 0.00 0.00 66.41 64.64 1fbx h THR 164 Cb 0.09 3.13 0.00 0.00 -1.74 0.00 0.00 68.15 69.62 1fbx h THR 164 CO 0.00 0.73 0.00 -0.07 0.37 0.00 0.00 175.52 176.55 1fbx h LEU 165 N -0.25 0.00 0.00 2.58 3.38 -1.20 -3.29 115.31 116.53 1fbx h LEU 165 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1fbx h LEU 165 Cb 1.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.47 1fbx h LEU 165 CO 0.17 0.00 -1.59 0.18 0.09 0.00 0.00 178.44 177.30 1fbx n LEU 166 N -2.90 0.22 -1.63 1.67 4.77 -0.46 -5.01 117.00 113.66 1fbx n LEU 166 Ca 0.04 -0.13 -0.10 0.00 -0.03 0.00 0.00 56.01 55.79 1fbx n LEU 166 Cb 0.47 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.59 1fbx n LEU 166 CO 0.32 0.05 0.06 0.61 -1.33 0.00 0.00 177.39 177.10 1fbx n GLY 167 N 1.44 0.27 3.27 -0.72 0.00 -0.89 -4.67 105.19 103.89 1fbx n GLY 167 Ca -0.02 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.53 1fbx n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fbx s THR 168 N -2.99 0.05 -0.69 2.61 2.01 -1.17 -4.94 115.64 110.52 1fbx s THR 168 Ca 0.20 -0.45 0.24 0.00 0.31 0.00 0.00 61.69 61.99 1fbx s THR 168 Cb -0.09 -0.70 0.06 0.00 0.01 0.00 0.00 72.50 71.78 1fbx s THR 168 CO 0.24 -0.25 1.37 0.59 -0.69 0.00 0.00 174.62 175.88 1fbx n ASN 169 N 1.12 0.67 -3.56 3.53 4.13 -1.26 -4.39 115.26 115.50 1fbx n ASN 169 Ca -0.21 0.11 -0.39 0.00 1.68 0.00 0.00 54.58 55.77 1fbx n ASN 169 Cb 0.57 0.11 -0.04 0.00 -1.54 0.00 0.00 39.78 38.88 1fbx n ASN 169 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1fbx n ASN 170 N -2.04 3.54 -4.13 6.41 3.02 -1.26 -1.27 115.26 119.52 1fbx n ASN 170 Ca 0.04 -2.65 -0.16 0.00 -0.03 0.00 0.00 54.58 51.77 1fbx n ASN 170 Cb 0.43 -1.26 -0.12 0.00 -0.61 0.00 0.00 39.78 38.22 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 4.18 0.89 0.00 2.41 1.01 -1.26 -1.54 120.40 126.09 1fbx s VAL 171 Ca 0.53 -1.26 -0.02 0.00 0.00 0.00 0.00 61.98 61.23 1fbx s VAL 171 Cb 0.14 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 1fbx s VAL 171 CO 0.04 -0.31 0.03 0.00 0.00 0.00 0.00 175.10 174.86 1fbx s ALA 172 N -1.42 -0.06 -0.04 5.51 0.00 0.94 -0.75 121.76 125.94 1fbx s ALA 172 Ca -0.04 -0.26 -0.03 0.00 0.00 0.00 0.00 51.96 51.63 1fbx s ALA 172 Cb -0.09 0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.12 1fbx s ALA 172 CO 0.01 -0.13 0.10 0.08 0.00 0.00 0.00 175.76 175.83 1fbx s VAL 173 N -0.99 -0.02 -0.01 0.00 1.01 -0.30 -1.71 120.40 118.38 1fbx s VAL 173 Ca -0.11 0.09 0.02 0.00 0.00 0.00 0.00 61.98 61.98 1fbx s VAL 173 Cb -0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 36.38 36.15 1fbx s VAL 173 CO -0.00 0.04 -0.06 -0.55 0.00 0.00 0.00 175.10 174.53 1fbx s SER 174 N 0.57 0.75 -0.04 3.32 0.15 -0.31 -1.13 113.70 117.00 1fbx s SER 174 Ca -0.04 -0.11 0.02 0.00 0.70 0.00 0.00 55.95 56.51 1fbx s SER 174 Cb -0.06 -0.11 0.01 0.00 -1.71 0.00 0.00 66.02 64.15 1fbx s SER 174 CO -0.02 0.06 -0.09 -0.63 1.20 0.00 0.00 173.24 173.76 1fbx s ILE 175 N -0.04 0.82 -0.19 6.45 1.01 -0.38 -1.14 121.20 127.73 1fbx s ILE 175 Ca 0.01 -0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.31 1fbx s ILE 175 Cb -0.04 -0.76 0.05 0.00 0.01 0.00 0.00 42.46 41.73 1fbx s ILE 175 CO -0.00 0.27 -0.02 -0.62 0.00 0.00 0.00 174.94 174.57 1fbx s ASP 176 N 0.47 3.14 0.20 3.58 2.15 -0.88 -1.32 116.67 124.01 1fbx s ASP 176 Ca -0.08 -0.87 -0.02 0.00 0.43 0.00 0.00 52.55 52.01 1fbx s ASP 176 Cb -0.12 -0.87 -0.04 0.00 -0.30 0.00 0.00 42.92 41.60 1fbx s ASP 176 CO 0.01 -0.25 0.17 0.00 -0.17 0.00 0.00 175.17 174.93 1fbx s ALA 177 N 1.65 0.97 -0.14 3.66 0.00 -0.32 -0.97 121.76 126.61 1fbx s ALA 177 Ca -0.02 -1.58 0.01 0.00 0.00 0.00 0.00 51.96 50.37 1fbx s ALA 177 Cb -0.17 1.31 -0.01 0.00 0.00 0.00 0.00 23.12 24.25 1fbx s ALA 177 CO -0.07 -0.61 -0.16 0.08 0.00 0.00 0.00 175.76 175.00 1fbx s VAL 178 N -4.13 2.73 -0.36 0.00 1.01 0.14 -0.36 120.40 119.43 1fbx s VAL 178 Ca 0.36 -0.76 -0.14 0.00 0.00 0.00 0.00 61.98 61.43 1fbx s VAL 178 Cb 0.06 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1fbx s VAL 178 CO 0.11 0.52 0.30 -1.00 0.00 0.00 0.00 175.10 175.03 1fbx s HIS 179 N 0.58 3.22 -1.44 5.22 3.76 -1.26 -0.88 115.29 124.49 1fbx s HIS 179 Ca -0.09 -0.26 0.10 0.00 -0.15 0.00 0.00 55.06 54.66 1fbx s HIS 179 Cb -0.16 -2.58 0.50 0.00 1.11 0.00 0.00 32.58 31.44 1fbx s HIS 179 CO 0.03 -0.45 1.19 0.66 -0.85 0.00 0.00 174.74 175.32 1fbx n TYR 180 N 5.22 0.00 1.22 1.40 4.02 -0.64 -0.52 117.16 127.86 1fbx n TYR 180 Ca -0.11 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.91 1fbx n TYR 180 Cb 0.49 -0.28 0.49 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 -1.10 0.54 -0.08 0.00 0.31 0.32 -4.39 118.33 113.94 1fbx n VAL 182 Ca 0.11 -0.45 -0.23 0.00 -0.01 0.00 0.00 64.34 63.76 1fbx n VAL 182 Cb 0.31 -0.35 -0.12 0.00 -0.91 0.00 0.00 33.84 32.77 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 -2.28 0.63 -0.15 5.55 4.81 -0.81 -0.73 118.16 125.18 1fbx n LYS 183 Ca -0.14 0.40 0.11 0.00 -0.87 0.00 0.00 58.31 57.81 1fbx n LYS 183 Cb 0.70 -1.67 0.28 0.00 0.02 0.00 0.00 35.03 34.36 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 -3.42 2.46 -3.67 3.14 0.00 -0.30 -3.92 120.51 114.80 1fbx n ALA 184 Ca -0.37 -0.77 -0.06 0.00 0.00 0.00 0.00 53.44 52.24 1fbx n ALA 184 Cb 0.85 -0.98 -0.02 0.00 0.00 0.00 0.00 19.45 19.30 1fbx n ALA 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1fbx s ARG 185 N -1.62 1.22 7.37 0.00 3.00 -1.25 -4.98 118.95 122.69 1fbx s ARG 185 Ca 0.35 -0.61 0.00 0.00 -1.00 0.00 0.00 55.73 54.47 1fbx s ARG 185 Cb 0.20 0.46 0.00 0.00 0.00 0.00 0.00 34.95 35.60 1fbx s ARG 185 CO 0.28 -0.55 0.00 0.41 0.00 0.00 0.00 175.30 175.44 1fbx n GLY 186 N -0.40 2.32 0.25 8.12 0.00 -1.26 -2.52 105.19 111.69 1fbx n GLY 186 Ca -0.08 -0.35 0.17 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 -6.39 -0.61 6.09 -1.86 -3.47 117.51 111.28 1fbx h ILE 187 Ca 0.00 -0.22 -0.47 0.00 -1.37 0.00 0.00 64.86 62.80 1fbx h ILE 187 Cb 0.00 1.08 -0.00 0.00 0.47 0.00 0.00 36.82 38.37 1fbx h ILE 187 CO 0.00 0.00 -0.90 0.54 -3.07 0.00 0.00 178.15 174.72 1fbx n ARG 188 N -2.78 -2.79 -3.02 2.19 1.74 -1.05 -4.94 116.66 106.02 1fbx n ARG 188 Ca -0.01 0.43 -0.43 0.00 -0.77 0.00 0.00 57.85 57.08 1fbx n ARG 188 Cb 0.17 -4.43 -0.06 0.00 -1.02 0.00 0.00 32.46 27.13 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 -4.10 6.30 0.00 0.55 -1.08 0.09 -4.90 116.67 113.53 1fbx s ASP 189 Ca 0.15 -0.53 0.22 0.00 -0.52 0.00 0.00 52.55 51.88 1fbx s ASP 189 Cb -0.06 -2.36 0.95 0.00 -1.46 0.00 0.00 42.92 40.00 1fbx s ASP 189 CO 0.87 -0.99 1.71 0.00 0.52 0.00 0.00 175.17 177.29 1fbx n ALA 190 N 6.69 2.02 -0.01 3.66 0.00 -1.26 -4.08 120.51 127.53 1fbx n ALA 190 Ca -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.36 1fbx n ALA 190 Cb 0.47 -1.36 -0.05 0.00 0.00 0.00 0.00 19.45 18.51 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 -1.52 0.14 -1.61 0.00 -2.24 -1.26 -5.05 114.28 102.74 1fbx n THR 191 Ca 0.05 -0.18 -0.32 0.00 -2.27 0.00 0.00 64.05 61.33 1fbx n THR 191 Cb 0.26 -0.04 0.06 0.00 -2.10 0.00 0.00 70.33 68.51 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 -3.08 5.09 0.05 3.42 1.04 -1.26 -5.07 113.70 113.90 1fbx s SER 192 Ca -0.03 1.83 -0.11 0.00 0.48 0.00 0.00 55.95 58.13 1fbx s SER 192 Cb 0.03 -2.53 0.01 0.00 0.10 0.00 0.00 66.02 63.64 1fbx s SER 192 CO 0.26 -1.64 0.25 0.00 0.98 0.00 0.00 173.24 173.09 1fbx s ALA 193 N -2.68 -0.49 0.10 5.32 0.00 -1.26 -4.79 121.76 117.96 1fbx s ALA 193 Ca 0.63 -0.22 0.08 0.00 0.00 0.00 0.00 51.96 52.45 1fbx s ALA 193 Cb -0.17 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.26 1fbx s ALA 193 CO 0.48 -0.42 -0.17 0.99 0.00 0.00 0.00 175.76 176.64 1fbx s THR 194 N -2.85 2.90 -0.06 0.00 2.01 0.52 -4.93 115.64 113.22 1fbx s THR 194 Ca -0.03 -1.41 0.02 0.00 0.31 0.00 0.00 61.69 60.58 1fbx s THR 194 Cb 0.00 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.22 1fbx s THR 194 CO -0.05 0.15 -0.09 -0.89 -0.69 0.00 0.00 174.62 173.04 1fbx s THR 195 N -1.11 0.91 0.08 -0.82 2.01 -1.26 -1.18 115.64 114.27 1fbx s THR 195 Ca 0.18 -0.34 0.06 0.00 0.31 0.00 0.00 61.69 61.90 1fbx s THR 195 Cb -0.11 -0.86 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 1fbx s THR 195 CO 0.10 0.31 -0.17 0.42 -0.69 0.00 0.00 174.62 174.58 1fbx s THR 196 N 0.77 1.36 -0.11 -0.82 -4.23 -0.43 -4.98 115.64 107.19 1fbx s THR 196 Ca -0.13 -1.40 -0.12 0.00 -1.18 0.00 0.00 61.69 58.86 1fbx s THR 196 Cb -0.15 -1.27 0.03 0.00 1.34 0.00 0.00 72.50 72.45 1fbx s THR 196 CO 0.02 -0.15 0.33 0.42 -0.54 0.00 0.00 174.62 174.70 1fbx s THR 197 N -1.22 0.01 -0.07 3.99 -4.23 -1.26 -1.25 115.64 111.61 1fbx s THR 197 Ca 0.01 -0.09 0.04 0.00 -1.18 0.00 0.00 61.69 60.48 1fbx s THR 197 Cb -0.10 -0.50 -0.00 0.00 1.34 0.00 0.00 72.50 73.24 1fbx s THR 197 CO 0.03 -0.05 -0.21 -0.44 -0.54 0.00 0.00 174.62 173.42 1fbx s SER 198 N -0.09 2.63 -0.09 3.99 0.01 -0.29 -4.99 113.70 114.87 1fbx s SER 198 Ca -0.02 -0.45 0.04 0.00 1.31 0.00 0.00 55.95 56.82 1fbx s SER 198 Cb -0.03 -0.94 0.00 0.00 0.21 0.00 0.00 66.02 65.26 1fbx s SER 198 CO 0.01 0.16 -0.21 -0.76 0.41 0.00 0.00 173.24 172.85 1fbx s LEU 199 N 0.17 1.98 0.40 2.44 1.43 -1.26 -1.15 118.68 122.69 1fbx s LEU 199 Ca -0.10 -0.50 0.08 0.00 -1.03 0.00 0.00 54.13 52.58 1fbx s LEU 199 Cb -0.15 -1.27 -0.04 0.00 0.03 0.00 0.00 46.19 44.76 1fbx s LEU 199 CO 0.05 0.13 0.20 -0.83 0.23 0.00 0.00 176.35 176.13 1fbx s GLY 200 N 0.41 2.22 0.00 -3.19 0.00 0.07 -4.58 107.32 102.24 1fbx s GLY 200 Ca -0.18 -2.01 0.00 0.00 0.00 0.00 0.00 44.72 42.53 1fbx s GLY 200 CO 0.08 -1.84 0.00 0.61 0.00 0.00 0.00 173.10 171.94 1fbx n GLY 201 N -1.26 2.56 0.25 0.20 0.00 -0.40 -0.97 105.19 105.57 1fbx n GLY 201 Ca -0.01 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 -1.47 0.99 3.38 -1.95 -1.40 115.31 114.86 1fbx h LEU 202 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1fbx h LEU 202 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1fbx h LEU 202 CO 0.00 0.14 0.00 -0.26 0.09 0.00 0.00 178.44 178.41 1fbx h PHE 203 N 0.00 0.00 0.00 1.13 0.04 -1.34 0.11 116.94 116.87 1fbx h PHE 203 Ca -0.00 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.50 1fbx h PHE 203 Cb 0.38 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.48 1fbx h PHE 203 CO 0.00 0.00 -1.99 1.17 -0.60 0.00 0.00 178.31 176.89 1fbx n LYS 204 N -2.49 0.42 0.02 1.51 4.81 -0.58 -4.14 118.16 117.71 1fbx n LYS 204 Ca -0.00 0.12 -0.04 0.00 -0.87 0.00 0.00 58.31 57.51 1fbx n LYS 204 Cb 0.13 -1.30 -0.10 0.00 0.02 0.00 0.00 35.03 33.78 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 -0.16 0.00 -3.58 3.14 4.64 -1.35 -3.44 113.55 112.80 1fbx h SER 205 Ca -0.40 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.28 1fbx h SER 205 Cb 1.55 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.51 1fbx h SER 205 CO -0.11 0.79 0.25 -0.55 -0.87 0.00 0.00 176.83 176.34 1fbx s SER 206 N -6.06 6.42 0.13 4.97 0.15 0.02 -4.93 113.70 114.40 1fbx s SER 206 Ca -0.03 0.00 -0.21 0.00 0.70 0.00 0.00 55.95 56.41 1fbx s SER 206 Cb 0.08 -2.36 -0.03 0.00 -1.71 0.00 0.00 66.02 62.01 1fbx s SER 206 CO 0.81 -0.76 1.69 -0.61 1.20 0.00 0.00 173.24 175.57 1fbx h GLN 207 N 8.71 -0.11 0.28 5.44 5.75 -1.86 0.26 115.11 133.59 1fbx h GLN 207 Ca -0.25 0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.26 1fbx h GLN 207 Cb 1.10 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 29.64 1fbx h GLN 207 CO 0.90 -0.07 -0.37 -0.97 -2.65 0.00 0.00 178.83 175.67 1fbx h ASN 208 N -0.11 -1.03 -0.54 -0.69 -1.24 -1.93 -0.84 115.58 109.20 1fbx h ASN 208 Ca 0.09 0.10 0.01 0.00 0.71 0.00 0.00 56.30 57.21 1fbx h ASN 208 Cb 0.24 0.36 -0.03 0.00 0.73 0.00 0.00 38.32 39.62 1fbx h ASN 208 CO -0.21 -0.49 0.35 0.74 -1.29 0.00 0.00 177.43 176.54 1fbx h THR 209 N -0.70 1.12 -0.48 -3.57 2.02 -1.79 -1.19 112.91 108.33 1fbx h THR 209 Ca -0.01 -0.25 0.09 0.00 0.77 0.00 0.00 66.41 67.02 1fbx h THR 209 Cb 0.66 0.34 -0.08 0.00 -1.74 0.00 0.00 68.15 67.33 1fbx h THR 209 CO -0.12 0.13 -0.01 -0.09 0.37 0.00 0.00 175.52 175.80 1fbx h ARG 210 N 0.72 0.10 0.00 6.66 2.43 -0.15 -2.14 114.38 122.00 1fbx h ARG 210 Ca 0.20 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.26 1fbx h ARG 210 Cb -0.06 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1fbx h ARG 210 CO -0.05 0.07 -0.51 0.45 -1.51 0.00 0.00 179.97 178.42 1fbx h HIS 211 N 0.11 0.00 -0.56 2.20 3.86 -0.77 -2.46 115.15 117.52 1fbx h HIS 211 Ca 0.24 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.44 1fbx h HIS 211 Cb 0.36 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.80 1fbx h HIS 211 CO -0.31 0.51 0.30 0.93 0.86 0.00 0.00 177.93 180.22 1fbx h GLU 212 N 0.00 0.78 -0.09 2.45 5.08 -0.57 -0.32 114.58 121.91 1fbx h GLU 212 Ca -0.01 -0.09 -0.21 0.00 -1.00 0.00 0.00 59.36 58.06 1fbx h GLU 212 Cb 1.08 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1fbx h GLU 212 CO 0.07 0.60 -0.79 0.35 -1.00 0.00 0.00 179.01 178.24 1fbx h PHE 213 N 0.75 0.74 0.00 4.33 3.57 -1.47 -2.87 116.94 121.99 1fbx h PHE 213 Ca 0.20 -0.34 -0.10 0.00 3.53 0.00 0.00 57.97 61.25 1fbx h PHE 213 Cb 0.05 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 1fbx h PHE 213 CO -0.01 1.13 -0.50 -0.07 -2.23 0.00 0.00 178.31 176.63 1fbx h LEU 214 N 0.36 0.00 -0.93 0.59 3.38 -1.33 -2.21 115.31 115.17 1fbx h LEU 214 Ca -0.05 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.84 1fbx h LEU 214 Cb 1.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.13 1fbx h LEU 214 CO 0.14 0.50 -0.40 -0.09 0.09 0.00 0.00 178.44 178.69 1fbx h ARG 215 N 0.00 0.00 0.15 1.13 2.43 -1.01 -3.06 114.38 114.02 1fbx h ARG 215 Ca -0.00 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 58.88 1fbx h ARG 215 Cb 0.94 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.50 1fbx h ARG 215 CO 0.06 0.40 -1.33 0.00 -1.51 0.00 0.00 179.97 177.59 1fbx h ALA 216 N 1.60 0.07 -2.80 2.80 0.00 -1.24 -3.47 119.26 116.24 1fbx h ALA 216 Ca -0.00 -0.91 -0.56 0.00 0.00 0.00 0.00 54.91 53.43 1fbx h ALA 216 Cb 0.91 0.08 0.17 0.00 0.00 0.00 0.00 17.79 18.95 1fbx h ALA 216 CO 0.05 0.95 0.18 0.28 0.00 0.00 0.00 179.25 180.71 1fbx n VAL 217 N -3.55 3.40 -1.29 0.00 0.31 -0.86 -4.42 118.33 111.91 1fbx n VAL 217 Ca -0.11 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 1fbx n VAL 217 Cb 1.04 -1.18 0.00 0.00 -0.91 0.00 0.00 33.84 32.79 1fbx n VAL 217 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1fbx n ARG 218 N -1.72 0.00 -3.37 5.55 3.00 -1.26 -5.02 116.66 113.84 1fbx n ARG 218 Ca 0.14 0.27 -0.40 0.00 -0.00 0.00 0.00 57.85 57.85 1fbx n ARG 218 Cb 0.49 -1.29 -0.02 0.00 0.00 0.00 0.00 32.46 31.64 1fbx n ARG 218 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1fbx n HIS 219 N -1.02 4.12 -1.55 -0.14 8.25 -1.26 -5.00 115.22 118.62 1fbx n HIS 219 Ca 0.00 -3.70 -0.24 0.00 -0.26 0.00 0.00 57.72 53.52 1fbx n HIS 219 Cb 0.43 -1.33 -0.08 0.00 1.12 0.00 0.00 29.99 30.13 1fbx n HIS 219 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1fbx n HIS 220 N 2.09 1.08 -0.45 4.41 -0.00 -1.26 -4.83 115.22 116.26 1fbx n HIS 220 Ca 0.24 0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.48 1fbx n HIS 220 Cb 0.37 -2.38 0.00 0.00 -0.12 0.00 0.00 29.99 27.86 1fbx n HIS 220 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89