#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 -4.59 3.54 2.88 -1.26 -5.16 113.62 109.03 1fbx n SER 2 Ca 0.00 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.26 1fbx n SER 2 Cb 0.00 0.11 -0.09 0.00 -0.75 0.00 0.00 64.21 63.47 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 -2.64 2.47 0.20 2.46 1.43 -1.26 -4.74 118.68 116.61 1fbx s LEU 3 Ca 0.00 -1.50 0.10 0.00 -1.03 0.00 0.00 54.13 51.69 1fbx s LEU 3 Cb 0.00 -0.67 -0.04 0.00 0.03 0.00 0.00 46.19 45.50 1fbx s LEU 3 CO 0.00 -0.67 -0.11 -0.94 0.23 0.00 0.00 176.35 174.86 1fbx s SER 4 N -3.72 4.10 0.13 2.29 1.04 -1.26 -4.99 113.70 111.29 1fbx s SER 4 Ca 0.24 -0.68 -0.26 0.00 0.48 0.00 0.00 55.95 55.73 1fbx s SER 4 Cb 0.06 -0.62 -0.06 0.00 0.10 0.00 0.00 66.02 65.50 1fbx s SER 4 CO 0.12 0.08 1.45 0.29 0.98 0.00 0.00 173.24 176.17 1fbx n LYS 5 N -0.13 -0.37 -0.09 4.02 5.02 -1.26 -0.56 118.16 124.79 1fbx n LYS 5 Ca -0.10 1.43 -0.10 0.00 -2.02 0.00 0.00 58.31 57.52 1fbx n LYS 5 Cb 0.56 -2.10 -0.02 0.00 -0.02 0.00 0.00 35.03 33.45 1fbx n LYS 5 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1fbx h GLU 6 N 0.00 0.44 -0.55 1.97 3.07 -1.98 -0.97 114.58 116.57 1fbx h GLU 6 Ca 0.13 -0.07 0.10 0.00 -0.50 0.00 0.00 59.36 59.02 1fbx h GLU 6 Cb 0.34 -0.08 -0.08 0.00 -0.84 0.00 0.00 28.75 28.10 1fbx h GLU 6 CO -0.79 0.43 0.12 0.00 -1.40 0.00 0.00 179.01 177.38 1fbx h ALA 7 N 0.98 0.64 -0.26 3.43 0.00 -1.56 -0.68 119.26 121.81 1fbx h ALA 7 Ca 0.10 0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 1fbx h ALA 7 Cb 0.15 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1fbx h ALA 7 CO -0.01 -0.29 -0.41 0.00 0.00 0.00 0.00 179.25 178.53 1fbx h ALA 8 N 1.43 0.79 0.30 0.00 0.00 -0.55 -1.83 119.26 119.40 1fbx h ALA 8 Ca 0.28 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 1fbx h ALA 8 Cb 0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1fbx h ALA 8 CO -0.36 0.65 -0.24 -0.07 0.00 0.00 0.00 179.25 179.24 1fbx h LEU 9 N 0.51 -0.63 -0.30 0.00 3.38 -0.44 -0.98 115.31 116.86 1fbx h LEU 9 Ca 0.04 0.05 0.05 0.00 0.09 0.00 0.00 57.88 58.11 1fbx h LEU 9 Cb 0.93 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 1fbx h LEU 9 CO 0.08 -0.36 0.03 0.58 0.09 0.00 0.00 178.44 178.86 1fbx h VAL 10 N -0.55 0.82 -0.36 1.22 2.07 -1.04 -1.45 116.25 116.97 1fbx h VAL 10 Ca -0.02 -0.04 0.04 0.00 0.82 0.00 0.00 66.70 67.50 1fbx h VAL 10 Cb 0.48 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1fbx h VAL 10 CO -0.02 0.02 0.12 -0.74 0.02 0.00 0.00 177.57 176.98 1fbx h HIS 11 N 0.13 0.22 0.55 1.57 -0.00 -1.17 -1.54 115.15 114.92 1fbx h HIS 11 Ca 0.14 0.02 -0.02 0.00 -0.00 0.00 0.00 60.37 60.51 1fbx h HIS 11 Cb 0.17 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.41 27.53 1fbx h HIS 11 CO -0.19 0.09 -0.34 0.93 -0.00 0.00 0.00 177.93 178.41 1fbx h GLU 12 N 0.27 -0.82 -1.20 5.26 5.08 -0.84 -1.78 114.58 120.56 1fbx h GLU 12 Ca 0.16 0.06 0.34 0.00 -1.00 0.00 0.00 59.36 58.92 1fbx h GLU 12 Cb 0.14 0.19 -0.08 0.00 0.50 0.00 0.00 28.75 29.50 1fbx h GLU 12 CO -0.17 -0.55 0.82 0.00 -1.00 0.00 0.00 179.01 178.12 1fbx h ALA 13 N -0.47 2.80 -0.00 3.43 0.00 -0.83 0.58 119.26 124.77 1fbx h ALA 13 Ca -0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1fbx h ALA 13 Cb 0.69 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1fbx h ALA 13 CO 0.07 -1.22 -0.02 -0.07 0.00 0.00 0.00 179.25 178.01 1fbx h LEU 14 N 0.15 0.02 -0.72 0.00 3.38 -0.89 -2.66 115.31 114.59 1fbx h LEU 14 Ca 0.63 -0.78 0.02 0.00 0.09 0.00 0.00 57.88 57.84 1fbx h LEU 14 Cb 2.13 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 42.83 1fbx h LEU 14 CO -0.16 0.80 0.46 0.58 0.09 0.00 0.00 178.44 180.21 1fbx h VAL 15 N -0.76 1.13 -0.62 1.22 2.07 0.21 -0.00 116.25 119.50 1fbx h VAL 15 Ca -0.00 -0.32 0.09 0.00 0.82 0.00 0.00 66.70 67.30 1fbx h VAL 15 Cb 0.80 0.13 -0.07 0.00 -1.52 0.00 0.00 31.29 30.63 1fbx h VAL 15 CO 0.00 0.17 0.23 0.00 0.02 0.00 0.00 177.57 178.00 1fbx h ALA 16 N 1.29 0.80 -0.05 1.67 0.00 -0.08 -0.99 119.26 121.90 1fbx h ALA 16 Ca 0.28 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1fbx h ALA 16 Cb -0.03 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1fbx h ALA 16 CO -0.09 -0.18 0.00 0.54 0.00 0.00 0.00 179.25 179.52 1fbx n ARG 17 N -4.99 1.33 -1.76 0.00 3.00 -0.59 -4.90 116.66 108.75 1fbx n ARG 17 Ca 0.09 -0.49 -0.11 0.00 -0.01 0.00 0.00 57.85 57.33 1fbx n ARG 17 Cb 0.28 -1.41 -0.03 0.00 0.00 0.00 0.00 32.46 31.30 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 1.01 0.56 0.65 -0.13 0.00 -0.18 -4.91 105.19 102.20 1fbx n GLY 18 Ca 0.18 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.39 2.54 -4.61 0.99 4.77 -0.23 -5.00 117.00 114.07 1fbx n LEU 19 Ca -0.12 -1.38 -0.29 0.00 -0.03 0.00 0.00 56.01 54.20 1fbx n LEU 19 Cb 0.48 -0.11 0.20 0.00 -2.33 0.00 0.00 43.42 41.66 1fbx n LEU 19 CO 0.16 0.54 0.60 -1.61 -1.33 0.00 0.00 177.39 175.75 1fbx s GLU 20 N -1.10 -0.04 0.34 3.23 0.41 -1.23 -4.88 118.70 115.43 1fbx s GLU 20 Ca 0.21 0.65 -0.26 0.00 -0.41 0.00 0.00 54.97 55.15 1fbx s GLU 20 Cb 0.13 -1.67 -0.09 0.00 -1.78 0.00 0.00 34.13 30.72 1fbx s GLU 20 CO 0.18 -3.08 1.05 0.99 -0.49 0.00 0.00 175.26 173.91 1fbx s THR 21 N -2.78 3.71 -0.75 3.63 2.01 -1.26 -4.89 115.64 115.32 1fbx s THR 21 Ca 0.66 1.48 -0.24 0.00 0.31 0.00 0.00 61.69 63.90 1fbx s THR 21 Cb -0.21 -3.85 -0.15 0.00 0.01 0.00 0.00 72.50 68.30 1fbx s THR 21 CO 0.60 0.17 2.40 -2.65 -0.69 0.00 0.00 174.62 174.46 1fbx n PRO 22 N 0.52 0.60 -4.37 4.92 -0.02 -1.26 -4.90 135.00 130.49 1fbx n PRO 22 Ca 0.02 -0.51 -0.24 0.00 -2.02 0.00 0.00 63.50 60.75 1fbx n PRO 22 Cb 0.48 -3.26 -0.08 0.00 -0.02 0.00 0.00 33.50 30.62 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 12.40 2.94 0.21 2.45 1.02 -1.26 -5.15 118.68 131.29 1fbx s LEU 23 Ca 1.00 -0.83 0.11 0.00 0.02 0.00 0.00 54.13 54.43 1fbx s LEU 23 Cb -0.27 -1.44 -0.05 0.00 0.02 0.00 0.00 46.19 44.46 1fbx s LEU 23 CO 0.20 -0.01 -0.22 -0.13 0.02 0.00 0.00 176.35 176.20 1fbx s ARG 24 N -3.62 1.52 0.08 1.70 0.52 -1.26 -5.10 118.95 112.80 1fbx s ARG 24 Ca 0.31 -1.56 -0.31 0.00 -0.52 0.00 0.00 55.73 53.65 1fbx s ARG 24 Cb -0.05 -1.76 -0.08 0.00 0.52 0.00 0.00 34.95 33.58 1fbx s ARG 24 CO 0.18 0.37 1.56 -2.14 0.02 0.00 0.00 175.30 175.29 1fbx s PRO 25 N -2.87 4.23 0.00 3.54 0.02 -1.26 -4.82 135.00 133.84 1fbx s PRO 25 Ca 0.22 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.49 1fbx s PRO 25 Cb -0.07 -3.46 0.00 0.00 0.02 0.00 0.00 34.50 30.99 1fbx s PRO 25 CO 0.10 -0.65 0.00 -2.30 -0.33 0.00 0.00 177.00 173.83 1fbx n PRO 26 N 5.01 0.00 0.00 5.54 -0.02 -1.26 -4.80 135.00 139.48 1fbx n PRO 26 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1fbx n PRO 26 Cb 0.41 -0.86 0.00 0.00 -0.02 0.00 0.00 33.50 33.03 1fbx n PRO 26 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1fbx n VAL 27 N 0.06 0.00 -4.14 -1.45 0.31 -1.26 -4.29 118.33 107.55 1fbx n VAL 27 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 1fbx n VAL 27 Cb 0.00 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.86 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 3.21 -0.73 3.52 -3.43 -1.26 -5.02 115.29 111.58 1fbx s HIS 28 Ca 0.00 0.15 -0.27 0.00 -0.80 0.00 0.00 55.06 54.14 1fbx s HIS 28 Cb 0.00 -1.70 -0.14 0.00 -1.43 0.00 0.00 32.58 29.31 1fbx s HIS 28 CO 0.00 0.52 2.51 0.39 -2.00 0.00 0.00 174.74 176.16 1fbx n GLU 29 N 1.13 0.57 -3.72 -0.38 1.02 -1.26 -4.92 120.64 113.08 1fbx n GLU 29 Ca -0.13 -0.07 -0.37 0.00 -0.02 0.00 0.00 57.16 56.57 1fbx n GLU 29 Cb 0.53 -2.64 -0.12 0.00 -0.02 0.00 0.00 31.44 29.19 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 8.53 3.61 0.27 3.49 1.75 -1.26 -5.08 119.30 130.61 1fbx s MET 30 Ca 1.13 -0.51 -0.29 0.00 -1.25 0.00 0.00 55.69 54.76 1fbx s MET 30 Cb -0.60 -3.39 -0.10 0.00 2.84 0.00 0.00 34.83 33.58 1fbx s MET 30 CO 0.35 -0.23 1.30 0.34 -0.65 0.00 0.00 175.02 176.12 1fbx s ASP 31 N 1.62 6.86 0.57 1.11 2.15 -1.26 -4.88 116.67 122.85 1fbx s ASP 31 Ca 0.06 2.53 0.28 0.00 0.43 0.00 0.00 52.55 55.86 1fbx s ASP 31 Cb -0.16 -2.63 1.72 0.00 -0.30 0.00 0.00 42.92 41.55 1fbx s ASP 31 CO 0.05 -0.51 2.21 0.78 -0.17 0.00 0.00 175.17 177.53 1fbx h ASN 32 N 4.35 0.00 0.56 -0.34 2.35 -1.99 -0.44 115.58 120.06 1fbx h ASN 32 Ca -0.47 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.19 1fbx h ASN 32 Cb 1.22 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.58 1fbx h ASN 32 CO 0.71 0.03 -0.43 -0.33 -1.65 0.00 0.00 177.43 175.76 1fbx h GLU 33 N 0.00 0.00 0.05 0.81 5.08 -1.99 -1.44 114.58 117.09 1fbx h GLU 33 Ca -0.00 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.12 1fbx h GLU 33 Cb 0.07 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.34 1fbx h GLU 33 CO 0.00 0.43 -0.98 1.15 -1.00 0.00 0.00 179.01 178.61 1fbx h THR 34 N 0.00 1.34 -0.77 1.13 2.02 -1.49 -2.47 112.91 112.67 1fbx h THR 34 Ca -0.00 -2.30 -0.04 0.00 0.77 0.00 0.00 66.41 64.83 1fbx h THR 34 Cb 0.82 2.62 -0.03 0.00 -1.74 0.00 0.00 68.15 69.82 1fbx h THR 34 CO 0.06 0.69 0.31 0.03 0.37 0.00 0.00 175.52 176.98 1fbx h ARG 35 N 0.15 1.14 -0.50 6.66 3.08 -1.23 -2.11 114.38 121.57 1fbx h ARG 35 Ca -0.14 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 59.66 1fbx h ARG 35 Cb 1.67 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.51 1fbx h ARG 35 CO 0.19 0.92 0.12 0.87 -1.07 0.00 0.00 179.97 181.00 1fbx h LYS 36 N 1.11 0.79 -0.22 0.04 1.57 -1.28 -0.88 116.57 117.70 1fbx h LYS 36 Ca 0.26 -0.19 -0.16 0.00 -1.87 0.00 0.00 60.65 58.68 1fbx h LYS 36 Cb 0.21 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1fbx h LYS 36 CO -0.02 0.77 -0.50 0.66 -0.57 0.00 0.00 179.45 179.78 1fbx h SER 37 N 0.68 0.83 -0.22 0.86 4.64 -1.35 -0.12 113.55 118.86 1fbx h SER 37 Ca 0.16 -0.56 0.04 0.00 -0.47 0.00 0.00 61.79 60.96 1fbx h SER 37 Cb 0.33 -0.24 -0.04 0.00 -0.31 0.00 0.00 62.40 62.14 1fbx h SER 37 CO 0.00 1.23 -0.01 -0.07 -0.87 0.00 0.00 176.83 177.11 1fbx h LEU 38 N 0.45 -0.11 -0.44 5.97 3.38 -1.34 0.82 115.31 124.04 1fbx h LEU 38 Ca -0.00 0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1fbx h LEU 38 Cb 1.12 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 1fbx h LEU 38 CO 0.11 -0.03 0.23 0.40 0.09 0.00 0.00 178.44 179.24 1fbx h ILE 39 N 0.05 0.99 -0.88 1.22 2.04 -1.11 -1.79 117.51 118.03 1fbx h ILE 39 Ca 0.11 -0.16 0.11 0.00 1.00 0.00 0.00 64.86 65.91 1fbx h ILE 39 Cb 0.14 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 36.63 1fbx h ILE 39 CO -0.19 0.08 0.51 0.00 0.00 0.00 0.00 178.15 178.56 1fbx h ALA 40 N 1.23 1.28 -0.69 1.87 0.00 -0.39 -1.38 119.26 121.18 1fbx h ALA 40 Ca 0.19 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 1fbx h ALA 40 Cb 0.08 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1fbx h ALA 40 CO -0.12 0.12 0.23 0.78 0.00 0.00 0.00 179.25 180.26 1fbx h GLY 41 N 0.83 1.12 1.24 0.00 0.00 0.01 -0.79 103.07 105.48 1fbx h GLY 41 Ca 0.43 -0.63 -0.12 0.00 0.00 0.00 0.00 47.33 47.01 1fbx h GLY 41 CO -0.26 0.59 -0.20 0.45 0.00 0.00 0.00 176.54 177.12 1fbx h HIS 42 N 1.01 0.99 -0.22 5.60 -0.00 -0.87 -2.33 115.15 119.34 1fbx h HIS 42 Ca 0.23 -0.22 -0.07 0.00 -0.00 0.00 0.00 60.37 60.30 1fbx h HIS 42 Cb 0.26 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.42 1fbx h HIS 42 CO 0.02 0.99 -0.18 0.52 -0.00 0.00 0.00 177.93 179.28 1fbx h MET 43 N 0.76 0.38 -0.41 2.45 2.86 -1.08 -0.75 114.93 119.15 1fbx h MET 43 Ca 0.11 -0.12 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1fbx h MET 43 Cb 0.74 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 1fbx h MET 43 CO 0.06 0.56 0.26 1.15 1.06 0.00 0.00 176.91 180.00 1fbx h THR 44 N 0.35 1.12 -0.38 2.22 2.02 -0.67 -0.95 112.91 116.62 1fbx h THR 44 Ca 0.06 -0.26 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1fbx h THR 44 Cb 0.53 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1fbx h THR 44 CO 0.03 0.12 0.18 -0.33 0.37 0.00 0.00 175.52 175.89 1fbx h GLU 45 N 0.55 0.56 -1.00 6.66 4.39 -0.91 -1.52 114.58 123.31 1fbx h GLU 45 Ca 0.15 -0.09 0.01 0.00 0.34 0.00 0.00 59.36 59.78 1fbx h GLU 45 Cb -0.03 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 28.48 1fbx h GLU 45 CO -0.03 0.50 0.66 0.82 -1.16 0.00 0.00 179.01 179.80 1fbx h ILE 46 N 0.48 1.24 -0.14 3.13 2.04 -0.94 0.38 117.51 123.71 1fbx h ILE 46 Ca 0.13 -0.46 -0.15 0.00 1.00 0.00 0.00 64.86 65.39 1fbx h ILE 46 Cb 0.14 -0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 35.99 1fbx h ILE 46 CO -0.02 0.24 -0.54 0.24 0.00 0.00 0.00 178.15 178.08 1fbx h MET 47 N 1.34 0.39 -0.46 2.37 2.86 -1.00 -2.25 114.93 118.18 1fbx h MET 47 Ca 0.37 -0.24 -0.12 0.00 -2.06 0.00 0.00 59.70 57.65 1fbx h MET 47 Cb -0.14 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1fbx h MET 47 CO -0.09 0.83 -0.16 1.96 1.06 0.00 0.00 176.91 180.51 1fbx h GLN 48 N 0.30 0.93 0.00 1.72 4.20 -0.20 -1.41 115.11 120.65 1fbx h GLN 48 Ca 0.01 -0.38 0.00 0.00 0.06 0.00 0.00 58.65 58.34 1fbx h GLN 48 Cb 1.04 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.78 1fbx h GLN 48 CO 0.09 1.04 0.00 1.28 -0.67 0.00 0.00 178.83 180.57 1fbx n LEU 49 N -4.19 0.39 -0.98 1.46 4.77 0.12 -0.62 117.00 117.96 1fbx n LEU 49 Ca -0.00 0.66 0.12 0.00 -0.03 0.00 0.00 56.01 56.76 1fbx n LEU 49 Cb 0.42 -0.69 0.14 0.00 -2.33 0.00 0.00 43.42 40.96 1fbx n LEU 49 CO 0.45 -0.74 0.65 0.18 -1.33 0.00 0.00 177.39 176.61 1fbx n LEU 50 N -2.01 3.03 -0.57 2.23 4.77 -0.58 -4.96 117.00 118.92 1fbx n LEU 50 Ca -0.00 -1.07 -0.07 0.00 -0.03 0.00 0.00 56.01 54.84 1fbx n LEU 50 Cb 0.06 -0.05 -0.02 0.00 -2.33 0.00 0.00 43.42 41.08 1fbx n LEU 50 CO 0.09 0.54 -0.07 0.59 -1.33 0.00 0.00 177.39 177.21 1fbx n ASN 51 N 1.33 -3.44 -4.84 -1.43 3.02 0.21 -5.02 115.26 105.10 1fbx n ASN 51 Ca 0.15 0.11 -0.33 0.00 -0.03 0.00 0.00 54.58 54.49 1fbx n ASN 51 Cb 0.59 -1.87 -0.06 0.00 -0.61 0.00 0.00 39.78 37.83 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 -1.59 3.99 -0.86 3.41 1.43 -0.92 -5.00 118.68 119.13 1fbx s LEU 52 Ca 0.00 1.46 -0.15 0.00 -1.03 0.00 0.00 54.13 54.40 1fbx s LEU 52 Cb 0.00 -4.29 0.19 0.00 0.03 0.00 0.00 46.19 42.12 1fbx s LEU 52 CO 0.00 -0.29 0.89 -0.62 0.23 0.00 0.00 176.35 176.55 1fbx s ASP 53 N -2.29 6.73 0.00 2.29 2.15 -1.26 -4.61 116.67 119.67 1fbx s ASP 53 Ca 0.58 -2.50 0.01 0.00 0.43 0.00 0.00 52.55 51.07 1fbx s ASP 53 Cb -0.10 -2.27 0.06 0.00 -0.30 0.00 0.00 42.92 40.31 1fbx s ASP 53 CO 0.16 -0.72 0.77 0.18 -0.17 0.00 0.00 175.17 175.39 1fbx n LEU 54 N 4.77 0.00 0.07 -1.34 4.77 -1.26 -0.67 117.00 123.34 1fbx n LEU 54 Ca 0.17 0.21 0.13 0.00 -0.03 0.00 0.00 56.01 56.50 1fbx n LEU 54 Cb 0.48 -0.21 0.48 0.00 -2.33 0.00 0.00 43.42 41.83 1fbx n LEU 54 CO 0.39 -0.21 0.91 0.00 -1.33 0.00 0.00 177.39 177.15 1fbx n ALA 55 N -1.21 2.29 -1.77 -1.18 0.00 -1.26 -3.84 120.51 113.53 1fbx n ALA 55 Ca 0.01 -0.05 -0.40 0.00 0.00 0.00 0.00 53.44 53.00 1fbx n ALA 55 Cb 0.01 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 17.97 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 -4.00 6.74 0.01 0.00 2.15 0.15 -4.90 116.67 116.82 1fbx s ASP 56 Ca 0.12 2.48 0.13 0.00 0.43 0.00 0.00 52.55 55.70 1fbx s ASP 56 Cb 0.15 -2.63 0.54 0.00 -0.30 0.00 0.00 42.92 40.67 1fbx s ASP 56 CO 0.57 -0.54 1.40 -0.90 -0.17 0.00 0.00 175.17 175.54 1fbx n ASP 57 N 0.55 0.03 -0.11 -0.34 5.75 -1.26 -0.75 116.55 120.41 1fbx n ASP 57 Ca 0.02 0.51 -0.16 0.00 -0.01 0.00 0.00 54.79 55.15 1fbx n ASP 57 Cb 0.44 -0.51 -0.13 0.00 -1.03 0.00 0.00 41.12 39.89 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 -1.53 1.38 0.10 -1.12 2.88 -1.26 -4.46 113.62 109.62 1fbx n SER 58 Ca 0.03 -0.07 0.04 0.00 -1.33 0.00 0.00 58.87 57.54 1fbx n SER 58 Cb 0.14 -0.01 -0.01 0.00 -0.75 0.00 0.00 64.21 63.58 1fbx n SER 58 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1fbx h LEU 59 N 0.00 0.00 -0.73 2.46 3.38 -1.84 -3.39 115.31 115.19 1fbx h LEU 59 Ca -0.56 0.00 0.16 0.00 0.09 0.00 0.00 57.88 57.58 1fbx h LEU 59 Cb 2.01 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.64 1fbx h LEU 59 CO -0.04 0.39 0.10 -0.03 0.09 0.00 0.00 178.44 178.95 1fbx h MET 60 N 0.00 0.18 -0.05 1.13 4.05 -1.05 -0.94 114.93 118.26 1fbx h MET 60 Ca -0.07 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.34 1fbx h MET 60 Cb 1.36 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 32.12 1fbx h MET 60 CO 0.04 0.12 0.00 0.39 0.23 0.00 0.00 176.91 177.69 1fbx n GLU 61 N -5.24 1.34 -0.07 0.39 -0.58 -1.26 -4.42 120.64 110.80 1fbx n GLU 61 Ca 0.14 -0.50 -0.06 0.00 -0.42 0.00 0.00 57.16 56.31 1fbx n GLU 61 Cb 0.47 -1.41 0.12 0.00 -0.57 0.00 0.00 31.44 30.05 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 1.10 1.27 -0.71 2.62 2.02 -1.39 -2.17 112.91 115.64 1fbx h THR 62 Ca 0.00 -1.29 -0.05 0.00 0.77 0.00 0.00 66.41 65.83 1fbx h THR 62 Cb 0.24 1.21 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 1fbx h THR 62 CO 0.00 0.43 0.23 -0.65 0.37 0.00 0.00 175.52 175.90 1fbx h PRO 63 N 0.63 1.09 -0.04 6.66 0.11 -1.78 0.18 132.00 138.85 1fbx h PRO 63 Ca 0.09 -0.22 -0.14 0.00 0.11 0.00 0.00 66.00 65.84 1fbx h PRO 63 Cb 0.69 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1fbx h PRO 63 CO 0.05 0.92 -0.60 1.25 -0.21 0.00 0.00 178.00 179.41 1fbx h HIS 64 N 1.05 0.19 -0.16 0.65 -0.00 -1.83 -2.49 115.15 112.56 1fbx h HIS 64 Ca 0.23 -0.07 -0.02 0.00 -0.00 0.00 0.00 60.37 60.51 1fbx h HIS 64 Cb 0.28 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.65 1fbx h HIS 64 CO 0.02 0.71 0.01 0.00 -0.00 0.00 0.00 177.93 178.67 1fbx h ARG 65 N 0.11 0.28 -0.47 5.26 3.08 -0.85 -2.28 114.38 119.51 1fbx h ARG 65 Ca -0.01 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 59.96 1fbx h ARG 65 Cb 1.09 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 1fbx h ARG 65 CO 0.09 0.49 0.31 0.82 -1.07 0.00 0.00 179.97 180.60 1fbx h ILE 66 N 0.04 1.12 -0.78 2.04 2.04 -0.96 -0.26 117.51 120.75 1fbx h ILE 66 Ca 0.05 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1fbx h ILE 66 Cb 0.35 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.84 1fbx h ILE 66 CO 0.01 0.12 0.49 0.00 0.00 0.00 0.00 178.15 178.77 1fbx h ALA 67 N 1.17 0.99 -0.25 1.87 0.00 -1.45 -0.05 119.26 121.54 1fbx h ALA 67 Ca 0.17 -0.07 -0.14 0.00 0.00 0.00 0.00 54.91 54.87 1fbx h ALA 67 Cb -0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1fbx h ALA 67 CO -0.04 0.43 -0.42 -0.22 0.00 0.00 0.00 179.25 179.01 1fbx h LYS 68 N 1.06 0.59 -0.50 0.00 3.64 -1.14 -1.59 116.57 118.64 1fbx h LYS 68 Ca 0.28 -0.31 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1fbx h LYS 68 Cb -0.08 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1fbx h LYS 68 CO -0.06 0.90 0.27 1.98 -2.27 0.00 0.00 179.45 180.28 1fbx h MET 69 N 0.48 0.70 0.08 1.90 4.05 -0.30 -0.21 114.93 121.63 1fbx h MET 69 Ca 0.04 -0.09 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1fbx h MET 69 Cb 0.93 -0.14 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 1fbx h MET 69 CO 0.08 0.56 -0.04 1.88 0.23 0.00 0.00 176.91 179.62 1fbx h TYR 70 N 0.67 -0.10 0.08 1.39 -1.99 -0.82 -0.38 116.97 115.83 1fbx h TYR 70 Ca 0.18 -0.00 -0.21 0.00 2.00 0.00 0.00 58.73 60.69 1fbx h TYR 70 Cb 0.06 0.03 0.02 0.00 2.00 0.00 0.00 36.73 38.84 1fbx h TYR 70 CO -0.02 0.06 -0.88 0.28 -0.00 0.00 0.00 178.16 177.61 1fbx h VAL 71 N -0.24 1.40 0.00 -2.88 2.07 -1.19 -2.35 116.25 113.06 1fbx h VAL 71 Ca -0.01 -2.33 -0.26 0.00 0.82 0.00 0.00 66.70 64.91 1fbx h VAL 71 Cb 0.20 2.80 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 1fbx h VAL 71 CO 0.02 0.68 -1.74 0.47 0.02 0.00 0.00 177.57 177.02 1fbx n ASP 72 N -4.05 0.71 0.00 0.57 8.00 -0.10 -3.95 116.55 117.73 1fbx n ASP 72 Ca -0.12 0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1fbx n ASP 72 Cb 0.82 0.22 0.00 0.00 -0.02 0.00 0.00 41.12 42.14 1fbx n ASP 72 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1fbx n GLU 73 N -2.93 0.00 0.26 -1.24 1.02 -0.50 -4.51 120.64 112.74 1fbx n GLU 73 Ca -0.17 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.13 1fbx n GLU 73 Cb 1.00 0.00 0.73 0.00 -0.02 0.00 0.00 31.44 33.15 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 0.09 -0.05 -3.67 3.07 -1.32 -1.00 117.51 114.63 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 0.60 0.00 0.00 -0.27 0.00 0.00 36.82 37.15 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 -3.08 0.06 0.00 0.16 3.72 -0.88 -3.06 117.46 114.39 1fbx n PHE 75 Ca 0.01 -0.42 0.00 0.00 -0.05 0.00 0.00 57.45 56.99 1fbx n PHE 75 Cb 0.51 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 1fbx n PHE 75 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1fbx n SER 76 N -0.26 0.00 0.06 4.37 3.41 -0.38 -1.28 113.62 119.54 1fbx n SER 76 Ca 0.02 0.38 0.12 0.00 -0.26 0.00 0.00 58.87 59.13 1fbx n SER 76 Cb 0.24 -0.38 0.48 0.00 -0.26 0.00 0.00 64.21 64.29 1fbx n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fbx n GLY 77 N -1.37 -1.49 0.06 5.00 0.00 0.84 -3.03 105.19 105.19 1fbx n GLY 77 Ca 0.00 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1fbx n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fbx n LEU 78 N -1.92 0.43 -4.18 0.99 4.77 -0.40 -4.59 117.00 112.10 1fbx n LEU 78 Ca 0.05 0.55 -0.36 0.00 -0.03 0.00 0.00 56.01 56.22 1fbx n LEU 78 Cb 0.34 -0.43 -0.12 0.00 -2.33 0.00 0.00 43.42 40.87 1fbx n LEU 78 CO 0.26 -0.18 -0.25 -0.62 -1.33 0.00 0.00 177.39 175.27 1fbx s ASP 79 N -3.81 5.16 0.00 -1.43 -1.08 -1.17 -4.97 116.67 109.37 1fbx s ASP 79 Ca 0.11 -1.55 0.00 0.00 -0.52 0.00 0.00 52.55 50.58 1fbx s ASP 79 Cb 0.14 -1.81 0.00 0.00 -1.46 0.00 0.00 42.92 39.79 1fbx s ASP 79 CO 0.51 -0.40 0.83 -1.22 0.52 0.00 0.00 175.17 175.41 1fbx n TYR 80 N 4.67 0.00 0.39 -5.34 4.02 -1.26 -0.60 117.16 119.03 1fbx n TYR 80 Ca -0.09 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 57.89 1fbx n TYR 80 Cb 0.43 -0.34 0.37 0.00 -0.02 0.00 0.00 39.34 39.78 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 -1.33 1.55 0.89 -0.72 0.00 -1.26 -1.76 120.51 117.88 1fbx n ALA 81 Ca 0.00 0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.59 1fbx n ALA 81 Cb 0.07 -1.28 0.19 0.00 0.00 0.00 0.00 19.45 18.43 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 -1.85 2.90 -4.64 0.00 3.02 0.23 -4.97 115.26 109.95 1fbx n ASN 82 Ca 0.02 -1.93 -0.38 0.00 -0.03 0.00 0.00 54.58 52.26 1fbx n ASN 82 Cb 0.17 -0.07 0.05 0.00 -0.61 0.00 0.00 39.78 39.32 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 1.21 1.08 -2.83 3.10 7.35 -0.72 -4.93 117.46 121.72 1fbx n PHE 83 Ca 0.16 0.44 -0.34 0.00 -0.76 0.00 0.00 57.45 56.95 1fbx n PHE 83 Cb 0.56 -2.18 -0.07 0.00 0.35 0.00 0.00 39.48 38.15 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 -2.78 4.34 0.05 -7.13 0.04 -1.26 -5.01 135.00 123.26 1fbx s PRO 84 Ca 0.75 1.16 -0.31 0.00 0.04 0.00 0.00 61.00 62.65 1fbx s PRO 84 Cb -0.42 -2.43 -0.07 0.00 0.04 0.00 0.00 34.50 31.61 1fbx s PRO 84 CO 0.47 0.10 1.45 0.15 0.04 0.00 0.00 177.00 179.21 1fbx s LYS 85 N -2.73 4.28 0.00 4.56 1.02 -1.26 -4.95 119.74 120.66 1fbx s LYS 85 Ca 0.57 2.08 -0.03 0.00 0.02 0.00 0.00 55.97 58.60 1fbx s LYS 85 Cb -0.13 -3.46 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 1fbx s LYS 85 CO 0.17 -0.56 0.21 0.42 -0.92 0.00 0.00 175.35 174.67 1fbx s ILE 86 N 1.99 5.40 -0.06 2.17 -1.09 -1.26 -4.98 121.20 123.37 1fbx s ILE 86 Ca 0.66 -0.11 -0.01 0.00 -2.23 0.00 0.00 60.65 58.96 1fbx s ILE 86 Cb -0.35 -3.55 0.03 0.00 -1.58 0.00 0.00 42.46 37.00 1fbx s ILE 86 CO 0.29 0.31 0.01 0.42 -1.23 0.00 0.00 174.94 174.73 1fbx s THR 87 N -1.35 0.26 -0.06 2.92 -4.23 -1.26 -5.11 115.64 106.81 1fbx s THR 87 Ca 0.28 0.16 0.06 0.00 -1.18 0.00 0.00 61.69 61.01 1fbx s THR 87 Cb -0.13 -0.41 -0.01 0.00 1.34 0.00 0.00 72.50 73.29 1fbx s THR 87 CO 0.19 0.22 -0.25 -0.76 -0.54 0.00 0.00 174.62 173.49 1fbx s LEU 88 N 1.76 2.06 0.23 4.79 1.43 -1.26 -2.21 118.68 125.48 1fbx s LEU 88 Ca 0.01 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 52.68 1fbx s LEU 88 Cb -0.13 -1.36 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 1fbx s LEU 88 CO -0.04 0.23 0.10 0.27 0.23 0.00 0.00 176.35 177.14 1fbx s ILE 89 N -0.11 4.07 0.14 -0.59 -4.36 -0.83 -4.97 121.20 114.55 1fbx s ILE 89 Ca -0.05 -1.48 -0.31 0.00 -0.26 0.00 0.00 60.65 58.55 1fbx s ILE 89 Cb -0.14 -3.15 -0.08 0.00 1.25 0.00 0.00 42.46 40.34 1fbx s ILE 89 CO 0.04 -0.27 1.36 -0.70 0.24 0.00 0.00 174.94 175.61 1fbx s GLU 90 N -3.50 4.34 -0.92 0.37 2.12 -1.26 -2.01 118.70 117.84 1fbx s GLU 90 Ca 0.31 2.06 -0.06 0.00 0.36 0.00 0.00 54.97 57.64 1fbx s GLU 90 Cb -0.08 -3.23 -0.06 0.00 0.26 0.00 0.00 34.13 31.01 1fbx s GLU 90 CO 0.22 -0.38 2.23 -1.71 -0.54 0.00 0.00 175.26 175.08 1fbx n ASN 91 N 3.58 5.21 0.26 -1.70 5.15 0.12 -4.49 115.26 123.39 1fbx n ASN 91 Ca 0.10 -2.33 0.15 0.00 -0.60 0.00 0.00 54.58 51.90 1fbx n ASN 91 Cb 0.43 -1.13 0.60 0.00 -0.53 0.00 0.00 39.78 39.14 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 5.99 0.00 0.00 1.20 1.57 -1.90 -1.78 116.57 121.65 1fbx h LYS 92 Ca 0.50 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.28 1fbx h LYS 92 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1fbx h LYS 92 CO 1.39 0.08 0.00 -1.33 -0.57 0.00 0.00 179.45 179.02 1fbx n MET 93 N -3.21 0.14 -3.58 3.15 2.81 -1.26 -4.91 117.12 110.26 1fbx n MET 93 Ca 0.00 0.30 -0.20 0.00 -1.81 0.00 0.00 57.70 56.00 1fbx n MET 93 Cb 0.35 -1.73 0.06 0.00 -0.71 0.00 0.00 33.22 31.18 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 -1.99 -5.35 -2.42 0.03 5.02 -0.67 -4.93 118.16 107.85 1fbx n LYS 94 Ca 0.04 0.71 -0.41 0.00 -2.02 0.00 0.00 58.31 56.63 1fbx n LYS 94 Cb 0.27 -5.44 -0.04 0.00 -0.02 0.00 0.00 35.03 29.80 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 -3.54 3.58 -0.01 -0.18 1.01 -1.26 -4.91 120.40 115.10 1fbx s VAL 95 Ca 0.03 1.40 0.06 0.00 0.00 0.00 0.00 61.98 63.48 1fbx s VAL 95 Cb -0.01 -3.90 0.11 0.00 0.00 0.00 0.00 36.38 32.59 1fbx s VAL 95 CO 0.78 0.26 1.05 -0.90 0.00 0.00 0.00 175.10 176.28 1fbx n ASP 96 N 2.09 0.33 -4.49 3.32 5.75 -1.26 -4.59 116.55 117.71 1fbx n ASP 96 Ca 0.02 -2.07 -0.24 0.00 -0.01 0.00 0.00 54.79 52.49 1fbx n ASP 96 Cb 0.45 -0.24 -0.10 0.00 -1.03 0.00 0.00 41.12 40.20 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 -0.16 1.70 0.41 0.11 0.41 -1.26 -5.01 118.70 114.90 1fbx s GLU 97 Ca 0.09 -1.83 -0.23 0.00 -0.41 0.00 0.00 54.97 52.59 1fbx s GLU 97 Cb 0.10 -1.63 -0.09 0.00 -1.78 0.00 0.00 34.13 30.72 1fbx s GLU 97 CO -0.04 0.21 1.01 0.00 -0.49 0.00 0.00 175.26 175.95 1fbx s MET 98 N -3.59 4.17 -0.19 1.61 0.23 -1.26 -4.51 119.30 115.76 1fbx s MET 98 Ca 0.30 1.38 -0.06 0.00 -1.03 0.00 0.00 55.69 56.29 1fbx s MET 98 Cb -0.01 -2.42 -0.03 0.00 -1.53 0.00 0.00 34.83 30.84 1fbx s MET 98 CO 0.15 -0.11 0.02 0.08 -2.03 0.00 0.00 175.02 173.12 1fbx s VAL 99 N -1.81 4.19 -0.12 5.16 1.01 -0.26 -4.97 120.40 123.59 1fbx s VAL 99 Ca 0.59 -0.24 0.02 0.00 0.00 0.00 0.00 61.98 62.36 1fbx s VAL 99 Cb -0.18 -2.89 -0.00 0.00 0.00 0.00 0.00 36.38 33.31 1fbx s VAL 99 CO 0.23 0.44 -0.19 -0.89 0.00 0.00 0.00 175.10 174.69 1fbx s THR 100 N 0.77 2.47 -0.27 3.92 2.01 -1.26 -2.45 115.64 120.82 1fbx s THR 100 Ca 0.01 -0.86 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 1fbx s THR 100 Cb -0.14 -2.00 0.00 0.00 0.01 0.00 0.00 72.50 70.37 1fbx s THR 100 CO 0.02 0.54 0.06 -0.69 -0.69 0.00 0.00 174.62 173.86 1fbx s VAL 101 N 0.49 3.89 0.17 3.82 1.01 0.14 -5.00 120.40 124.92 1fbx s VAL 101 Ca -0.13 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.35 1fbx s VAL 101 Cb -0.17 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1fbx s VAL 101 CO 0.05 0.17 -0.11 0.00 0.00 0.00 0.00 175.10 175.21 1fbx s ARG 102 N 1.51 2.00 -1.25 2.72 1.70 -1.26 -0.70 118.95 123.67 1fbx s ARG 102 Ca 0.04 -1.27 -0.07 0.00 -0.47 0.00 0.00 55.73 53.96 1fbx s ARG 102 Cb -0.16 -2.14 0.01 0.00 -0.57 0.00 0.00 34.95 32.08 1fbx s ARG 102 CO 0.02 0.44 1.09 -0.25 -1.08 0.00 0.00 175.30 175.51 1fbx n ASP 103 N 0.14 -5.34 -4.72 -2.89 8.00 -1.06 -4.97 116.55 105.71 1fbx n ASP 103 Ca -0.11 -0.52 -0.42 0.00 0.71 0.00 0.00 54.79 54.45 1fbx n ASP 103 Cb 0.55 -4.80 -0.03 0.00 -0.02 0.00 0.00 41.12 36.82 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 -3.31 3.49 0.31 0.53 1.01 -0.22 -4.81 121.20 118.20 1fbx s ILE 104 Ca 0.45 1.13 -0.29 0.00 0.00 0.00 0.00 60.65 61.94 1fbx s ILE 104 Cb -0.20 -3.72 -0.10 0.00 0.01 0.00 0.00 42.46 38.45 1fbx s ILE 104 CO 0.69 0.12 1.39 -0.89 0.00 0.00 0.00 174.94 176.25 1fbx s THR 105 N 0.68 2.56 -0.16 2.92 2.01 -1.26 -1.45 115.64 120.95 1fbx s THR 105 Ca 0.60 0.53 -0.04 0.00 0.31 0.00 0.00 61.69 63.08 1fbx s THR 105 Cb -0.34 -3.34 0.06 0.00 0.01 0.00 0.00 72.50 68.89 1fbx s THR 105 CO 0.33 0.11 0.12 -0.22 -0.69 0.00 0.00 174.62 174.27 1fbx s LEU 106 N -1.32 0.18 -0.10 4.42 0.20 -0.81 -4.83 118.68 116.43 1fbx s LEU 106 Ca 0.54 -0.38 0.02 0.00 0.69 0.00 0.00 54.13 54.99 1fbx s LEU 106 Cb -0.42 -0.05 -0.02 0.00 -0.43 0.00 0.00 46.19 45.28 1fbx s LEU 106 CO 0.51 -0.33 -0.14 0.42 -0.29 0.00 0.00 176.35 176.52 1fbx s THR 107 N 2.20 2.99 0.18 3.68 -4.23 -1.26 -0.49 115.64 118.70 1fbx s THR 107 Ca 0.04 -0.71 -0.02 0.00 -1.18 0.00 0.00 61.69 59.82 1fbx s THR 107 Cb -0.15 -2.21 0.01 0.00 1.34 0.00 0.00 72.50 71.48 1fbx s THR 107 CO -0.09 0.55 0.26 -0.24 -0.54 0.00 0.00 174.62 174.56 1fbx n SER 108 N 3.06 -0.73 -4.16 3.99 2.88 0.73 -4.58 113.62 114.80 1fbx n SER 108 Ca -0.18 -1.91 -0.28 0.00 -1.33 0.00 0.00 58.87 55.17 1fbx n SER 108 Cb 0.52 1.33 -0.16 0.00 -0.75 0.00 0.00 64.21 65.15 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 -2.61 1.60 0.01 2.46 2.01 -1.26 0.12 115.64 117.96 1fbx s THR 109 Ca 0.13 -0.80 -0.30 0.00 0.31 0.00 0.00 61.69 61.03 1fbx s THR 109 Cb -0.01 -1.38 -0.05 0.00 0.01 0.00 0.00 72.50 71.08 1fbx s THR 109 CO 0.10 0.46 1.19 0.00 -0.69 0.00 0.00 174.62 175.67 1fbx n GLU 111 N 4.46 0.04 0.12 0.00 0.28 0.45 0.17 120.64 126.15 1fbx n GLU 111 Ca 0.10 0.20 0.03 0.00 -0.16 0.00 0.00 57.16 57.32 1fbx n GLU 111 Cb 0.46 -1.56 0.01 0.00 1.43 0.00 0.00 31.44 31.78 1fbx n GLU 111 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1fbx h HIS 112 N 0.00 0.00 0.00 -1.84 3.86 -1.91 -3.40 115.15 111.86 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 0.36 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.83 1fbx h HIS 112 CO 0.00 0.46 0.00 0.72 0.86 0.00 0.00 177.93 179.97 1fbx n HIS 113 N -3.11 0.00 -3.37 2.45 8.25 -1.18 -5.04 115.22 113.22 1fbx n HIS 113 Ca -0.01 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.27 1fbx n HIS 113 Cb 0.74 0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.91 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 -2.35 -4.14 4.41 3.01 0.13 -5.01 117.46 113.50 1fbx n PHE 114 Ca 0.00 0.77 -0.16 0.00 1.01 0.00 0.00 57.45 59.07 1fbx n PHE 114 Cb 0.30 -3.89 -0.12 0.00 -0.01 0.00 0.00 39.48 35.77 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 -3.35 0.85 0.30 -4.37 1.01 -1.24 -4.90 120.40 108.70 1fbx s VAL 115 Ca 0.40 -1.15 -0.29 0.00 0.00 0.00 0.00 61.98 60.94 1fbx s VAL 115 Cb -0.08 -0.85 -0.13 0.00 0.00 0.00 0.00 36.38 35.32 1fbx s VAL 115 CO 0.78 -0.26 1.21 0.41 0.00 0.00 0.00 175.10 177.24 1fbx n THR 116 N 1.47 1.80 -5.15 3.92 -1.04 -1.26 -0.53 114.28 113.48 1fbx n THR 116 Ca -0.21 -0.45 -0.31 0.00 -2.04 0.00 0.00 64.05 61.04 1fbx n THR 116 Cb 0.54 -1.34 -0.17 0.00 -1.82 0.00 0.00 70.33 67.54 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 -0.89 1.95 -0.12 12.58 1.01 0.31 -1.72 121.20 134.32 1fbx s ILE 117 Ca 0.59 -0.96 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 1fbx s ILE 117 Cb -0.63 -1.68 0.02 0.00 0.01 0.00 0.00 42.46 40.18 1fbx s ILE 117 CO 0.59 0.54 -0.09 -0.62 0.00 0.00 0.00 174.94 175.36 1fbx s ASP 118 N 0.31 2.24 0.00 3.58 2.15 -0.11 -0.19 116.67 124.65 1fbx s ASP 118 Ca -0.16 -0.33 0.00 0.00 0.43 0.00 0.00 52.55 52.49 1fbx s ASP 118 Cb -0.17 -0.89 0.00 0.00 -0.30 0.00 0.00 42.92 41.56 1fbx s ASP 118 CO 0.08 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.58 1fbx n GLY 119 N 4.88 3.09 3.00 2.66 0.00 0.36 -0.23 105.19 118.95 1fbx n GLY 119 Ca -0.13 -0.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.84 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 0.26 0.16 0.08 1.61 1.02 0.51 -1.92 119.74 121.46 1fbx s LYS 120 Ca 0.00 0.12 0.06 0.00 0.02 0.00 0.00 55.97 56.17 1fbx s LYS 120 Cb 0.00 0.08 -0.04 0.00 -0.52 0.00 0.00 37.83 37.35 1fbx s LYS 120 CO 0.00 -0.02 -0.10 0.00 -0.92 0.00 0.00 175.35 174.31 1fbx s ALA 121 N -0.05 2.95 -0.12 5.17 0.00 -0.53 -1.75 121.76 127.43 1fbx s ALA 121 Ca -0.01 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 50.77 1fbx s ALA 121 Cb -0.01 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.18 1fbx s ALA 121 CO 0.00 0.63 -0.16 0.99 0.00 0.00 0.00 175.76 177.22 1fbx s THR 122 N -1.15 1.62 -0.01 0.00 2.01 0.66 -1.06 115.64 117.71 1fbx s THR 122 Ca 0.20 -0.70 0.07 0.00 0.31 0.00 0.00 61.69 61.57 1fbx s THR 122 Cb -0.11 -1.47 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 1fbx s THR 122 CO 0.12 0.46 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.61 1fbx s VAL 123 N 1.07 1.67 -0.00 3.82 1.01 0.13 -0.71 120.40 127.39 1fbx s VAL 123 Ca -0.04 -0.95 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 1fbx s VAL 123 Cb -0.15 -1.40 -0.00 0.00 0.00 0.00 0.00 36.38 34.83 1fbx s VAL 123 CO -0.04 0.43 0.08 0.00 0.00 0.00 0.00 175.10 175.57 1fbx s ALA 124 N -0.55 -0.19 0.16 5.51 0.00 0.66 -0.68 121.76 126.68 1fbx s ALA 124 Ca 0.08 -0.17 -0.11 0.00 0.00 0.00 0.00 51.96 51.76 1fbx s ALA 124 Cb -0.08 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1fbx s ALA 124 CO -0.00 -0.16 0.33 1.52 0.00 0.00 0.00 175.76 177.44 1fbx s TYR 125 N -1.11 0.25 -0.26 0.00 1.13 -1.03 0.34 117.35 116.68 1fbx s TYR 125 Ca -0.12 -0.62 0.00 0.00 -1.41 0.00 0.00 57.07 54.92 1fbx s TYR 125 Cb -0.07 0.05 0.04 0.00 -1.10 0.00 0.00 41.96 40.88 1fbx s TYR 125 CO 0.01 -0.75 -0.07 0.42 -2.51 0.00 0.00 175.55 172.65 1fbx s ILE 126 N -3.94 2.60 0.32 -3.49 1.01 -0.47 -1.11 121.20 116.13 1fbx s ILE 126 Ca 0.14 -1.34 -0.29 0.00 0.00 0.00 0.00 60.65 59.16 1fbx s ILE 126 Cb 0.02 -2.43 -0.13 0.00 0.01 0.00 0.00 42.46 39.94 1fbx s ILE 126 CO -0.02 0.05 1.32 -2.65 0.00 0.00 0.00 174.94 173.65 1fbx n PRO 127 N 4.57 2.12 0.00 2.79 -0.02 -1.26 -4.84 135.00 138.35 1fbx n PRO 127 Ca -0.15 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1fbx n PRO 127 Cb 0.44 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 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 0.94 0.00 0.08 -0.52 4.81 -1.26 -4.74 118.16 117.47 1fbx n LYS 128 Ca 0.06 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.40 1fbx n LYS 128 Cb 0.35 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.35 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 0.30 -4.34 3.14 3.32 -1.92 -3.44 116.42 113.48 1fbx h ASP 129 Ca 0.00 -0.26 -0.42 0.00 0.02 0.00 0.00 57.03 56.37 1fbx h ASP 129 Cb 0.00 -0.09 -0.20 0.00 0.22 0.00 0.00 39.33 39.25 1fbx h ASP 129 CO 0.00 1.10 -0.77 -0.94 -1.72 0.00 0.00 179.24 176.91 1fbx s SER 130 N -6.97 1.79 -0.14 6.45 1.04 -1.26 -0.70 113.70 113.91 1fbx s SER 130 Ca -0.03 -0.68 -0.04 0.00 0.48 0.00 0.00 55.95 55.68 1fbx s SER 130 Cb 0.09 -0.06 -0.03 0.00 0.10 0.00 0.00 66.02 66.13 1fbx s SER 130 CO 0.84 -0.10 -0.01 -0.69 0.98 0.00 0.00 173.24 174.26 1fbx s VAL 131 N -1.57 4.12 0.30 5.02 1.01 -0.85 -4.74 120.40 123.69 1fbx s VAL 131 Ca 0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 1fbx s VAL 131 Cb -0.08 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1fbx s VAL 131 CO 0.02 0.51 0.52 -0.51 0.00 0.00 0.00 175.10 175.65 1fbx s ILE 132 N 0.09 5.09 0.16 2.22 2.07 -1.26 -1.96 121.20 127.62 1fbx s ILE 132 Ca 0.01 -0.24 -0.31 0.00 -1.41 0.00 0.00 60.65 58.70 1fbx s ILE 132 Cb -0.13 -3.79 -0.09 0.00 0.13 0.00 0.00 42.46 38.58 1fbx s ILE 132 CO 0.02 -0.40 1.49 -0.83 -1.91 0.00 0.00 174.94 173.32 1fbx s GLY 133 N -3.53 1.81 0.15 1.50 0.00 -0.94 -4.91 107.32 101.40 1fbx s GLY 133 Ca 0.41 1.29 -0.22 0.00 0.00 0.00 0.00 44.72 46.20 1fbx s GLY 133 CO 0.32 2.49 1.64 1.41 0.00 0.00 0.00 173.10 178.96 1fbx h LEU 134 N 6.50 -0.66 -1.77 0.66 3.38 -1.96 -1.07 115.31 120.39 1fbx h LEU 134 Ca -0.43 0.13 0.20 0.00 0.09 0.00 0.00 57.88 57.87 1fbx h LEU 134 Cb 1.21 0.32 -0.05 0.00 0.09 0.00 0.00 40.66 42.23 1fbx h LEU 134 CO 0.88 -0.24 0.55 0.77 0.09 0.00 0.00 178.44 180.48 1fbx h SER 135 N -0.20 0.20 -0.31 -0.43 4.64 -2.01 -0.40 113.55 115.04 1fbx h SER 135 Ca 0.14 0.02 0.07 0.00 -0.47 0.00 0.00 61.79 61.54 1fbx h SER 135 Cb 0.41 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 1fbx h SER 135 CO -0.36 0.09 0.21 0.11 -0.87 0.00 0.00 176.83 176.01 1fbx h LYS 136 N 0.20 0.10 0.61 4.77 1.79 -1.56 -1.11 116.57 121.37 1fbx h LYS 136 Ca 0.39 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.83 1fbx h LYS 136 Cb 1.24 -0.02 0.01 0.00 -1.58 0.00 0.00 32.23 31.87 1fbx h LYS 136 CO -0.08 0.07 -0.29 0.82 -1.08 0.00 0.00 179.45 178.88 1fbx h ILE 137 N 0.10 0.14 -0.68 1.86 2.04 -1.13 -0.39 117.51 119.46 1fbx h ILE 137 Ca 0.14 -0.37 0.11 0.00 1.00 0.00 0.00 64.86 65.74 1fbx h ILE 137 Cb 0.43 0.20 -0.12 0.00 -0.74 0.00 0.00 36.82 36.59 1fbx h ILE 137 CO -0.01 0.02 -0.38 0.78 0.00 0.00 0.00 178.15 178.56 1fbx h ASN 138 N -1.14 -1.32 -0.60 1.72 2.35 -1.49 0.56 115.58 115.65 1fbx h ASN 138 Ca -0.08 0.25 0.10 0.00 -0.55 0.00 0.00 56.30 56.02 1fbx h ASN 138 Cb 0.67 0.65 -0.08 0.00 0.05 0.00 0.00 38.32 39.61 1fbx h ASN 138 CO 0.14 -0.31 0.19 0.03 -1.65 0.00 0.00 177.43 175.83 1fbx h ARG 139 N -0.14 0.34 -0.86 0.81 3.08 -1.12 -0.30 114.38 116.20 1fbx h ARG 139 Ca 0.24 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 1fbx h ARG 139 Cb 0.56 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.49 1fbx h ARG 139 CO -0.75 0.23 0.50 0.82 -1.07 0.00 0.00 179.97 179.70 1fbx h ILE 140 N 0.36 1.24 -0.02 2.04 2.04 0.84 -1.07 117.51 122.93 1fbx h ILE 140 Ca 0.31 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1fbx h ILE 140 Cb 0.41 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1fbx h ILE 140 CO -0.34 0.26 0.01 0.58 0.00 0.00 0.00 178.15 178.66 1fbx h VAL 141 N 1.18 1.12 -0.69 1.67 2.07 0.10 -2.78 116.25 118.92 1fbx h VAL 141 Ca 0.31 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1fbx h VAL 141 Cb -0.03 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.03 1fbx h VAL 141 CO -0.06 0.10 0.40 1.56 0.02 0.00 0.00 177.57 179.59 1fbx h GLN 142 N -0.11 0.95 0.09 1.57 1.08 -0.66 -1.71 115.11 116.32 1fbx h GLN 142 Ca 0.01 -0.09 0.02 0.00 -1.45 0.00 0.00 58.65 57.14 1fbx h GLN 142 Cb 0.15 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.35 1fbx h GLN 142 CO -0.00 0.68 -0.21 0.35 -0.95 0.00 0.00 178.83 178.70 1fbx h PHE 143 N 0.96 -0.56 0.00 2.96 3.57 -1.02 0.13 116.94 122.98 1fbx h PHE 143 Ca 0.25 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.76 1fbx h PHE 143 Cb -0.01 0.24 0.00 0.00 2.79 0.00 0.00 35.95 38.97 1fbx h PHE 143 CO 0.00 -0.31 0.00 1.19 -2.23 0.00 0.00 178.31 176.97 1fbx n PHE 144 N -5.34 0.75 0.11 0.41 3.72 -1.07 -2.39 117.46 113.66 1fbx n PHE 144 Ca -0.06 0.28 0.04 0.00 -0.05 0.00 0.00 57.45 57.65 1fbx n PHE 144 Cb 0.25 -0.95 0.00 0.00 -0.94 0.00 0.00 39.48 37.84 1fbx n PHE 144 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1fbx h ALA 145 N 2.34 0.68 -0.28 4.37 0.00 -0.30 -3.35 119.26 122.72 1fbx h ALA 145 Ca 0.00 -0.48 -0.62 0.00 0.00 0.00 0.00 54.91 53.80 1fbx h ALA 145 Cb 0.42 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1fbx h ALA 145 CO 0.00 0.59 2.51 1.04 0.00 0.00 0.00 179.25 183.39 1fbx n GLN 146 N -3.05 3.70 -3.65 0.00 1.13 -0.08 -4.22 117.38 111.22 1fbx n GLN 146 Ca -0.02 -2.53 -0.15 0.00 -1.94 0.00 0.00 57.00 52.36 1fbx n GLN 146 Cb 0.73 -2.58 -0.07 0.00 0.11 0.00 0.00 30.24 28.42 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 0.46 0.84 0.17 -1.09 0.52 -1.17 -0.11 118.95 118.56 1fbx s ARG 147 Ca 0.63 0.04 -0.32 0.00 -0.52 0.00 0.00 55.73 55.56 1fbx s ARG 147 Cb 0.22 0.39 -0.10 0.00 0.52 0.00 0.00 34.95 35.97 1fbx s ARG 147 CO -0.08 -0.25 1.57 -2.14 0.02 0.00 0.00 175.30 174.42 1fbx s PRO 148 N -1.22 4.21 0.34 3.54 0.02 -1.26 -4.20 135.00 136.44 1fbx s PRO 148 Ca -0.12 2.36 0.03 0.00 0.02 0.00 0.00 61.00 63.30 1fbx s PRO 148 Cb -0.03 -3.15 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 1fbx s PRO 148 CO 0.07 -0.61 0.12 -0.65 -0.33 0.00 0.00 177.00 175.60 1fbx s GLN 149 N 1.13 1.70 -0.07 5.54 -1.52 0.07 -4.75 119.66 121.77 1fbx s GLN 149 Ca 0.70 -1.98 0.00 0.00 -1.95 0.00 0.00 55.36 52.13 1fbx s GLN 149 Cb -0.44 -0.46 0.02 0.00 -0.22 0.00 0.00 33.01 31.92 1fbx s GLN 149 CO 0.31 -0.38 -0.06 0.08 -0.25 0.00 0.00 175.29 174.99 1fbx s VAL 150 N -3.42 0.76 0.30 1.09 1.01 -1.26 -0.42 120.40 118.46 1fbx s VAL 150 Ca 0.32 -0.20 0.05 0.00 0.00 0.00 0.00 61.98 62.16 1fbx s VAL 150 Cb 0.05 -0.78 0.29 0.00 0.00 0.00 0.00 36.38 35.94 1fbx s VAL 150 CO 0.16 0.30 1.73 -0.61 0.00 0.00 0.00 175.10 176.67 1fbx h GLN 151 N 7.60 0.53 -0.31 2.72 4.15 -1.99 -0.78 115.11 127.02 1fbx h GLN 151 Ca -0.31 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.07 1fbx h GLN 151 Cb 1.15 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.70 1fbx h GLN 151 CO 0.42 0.35 0.17 0.93 -1.93 0.00 0.00 178.83 178.77 1fbx h GLU 152 N 0.55 0.42 0.01 1.69 3.07 -2.00 -1.55 114.58 116.77 1fbx h GLU 152 Ca 0.58 -0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 59.39 1fbx h GLU 152 Cb 1.03 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1fbx h GLU 152 CO -0.46 0.31 -0.07 -0.09 -1.40 0.00 0.00 179.01 177.30 1fbx h ARG 153 N 0.43 0.03 -0.82 2.33 2.43 -1.60 -3.29 114.38 113.90 1fbx h ARG 153 Ca 0.11 -0.04 0.18 0.00 -0.81 0.00 0.00 59.98 59.42 1fbx h ARG 153 Cb 0.01 0.02 -0.11 0.00 -0.42 0.00 0.00 29.97 29.46 1fbx h ARG 153 CO -0.02 1.00 0.30 1.25 -1.51 0.00 0.00 179.97 180.99 1fbx h LEU 154 N -0.92 0.21 -0.35 3.80 5.85 -1.25 -1.36 115.31 121.30 1fbx h LEU 154 Ca -0.01 0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1fbx h LEU 154 Cb 1.03 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 1fbx h LEU 154 CO 0.01 0.01 0.15 0.74 -0.34 0.00 0.00 178.44 179.02 1fbx h THR 155 N 0.37 0.95 -0.54 1.05 2.02 -1.38 -2.71 112.91 112.67 1fbx h THR 155 Ca 0.48 -0.11 -0.08 0.00 0.77 0.00 0.00 66.41 67.47 1fbx h THR 155 Cb 0.84 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1fbx h THR 155 CO -0.50 0.06 0.01 1.56 0.37 0.00 0.00 175.52 177.02 1fbx h GLN 156 N 0.32 0.91 -0.18 6.66 1.08 -1.40 -2.88 115.11 119.63 1fbx h GLN 156 Ca 0.15 -0.26 -0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1fbx h GLN 156 Cb 0.09 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.41 1fbx h GLN 156 CO -0.13 0.90 0.11 1.96 -0.95 0.00 0.00 178.83 180.72 1fbx h GLN 157 N 0.85 0.25 -0.67 1.46 4.20 -1.02 -0.07 115.11 120.10 1fbx h GLN 157 Ca 0.16 -0.03 0.09 0.00 0.06 0.00 0.00 58.65 58.94 1fbx h GLN 157 Cb 0.49 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.14 1fbx h GLN 157 CO 0.02 0.23 0.30 0.82 -0.67 0.00 0.00 178.83 179.53 1fbx h ILE 158 N 0.21 0.82 0.28 2.54 2.04 -1.45 0.13 117.51 122.08 1fbx h ILE 158 Ca 0.07 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1fbx h ILE 158 Cb 0.05 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.37 1fbx h ILE 158 CO -0.01 0.10 -0.17 0.25 0.00 0.00 0.00 178.15 178.32 1fbx h LEU 159 N 0.52 -0.42 -0.81 1.44 5.85 -1.14 -1.54 115.31 119.22 1fbx h LEU 159 Ca 0.33 0.02 0.18 0.00 0.84 0.00 0.00 57.88 59.26 1fbx h LEU 159 Cb 0.37 0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.41 1fbx h LEU 159 CO -0.28 -0.26 0.27 0.40 -0.34 0.00 0.00 178.44 178.22 1fbx h ILE 160 N -0.42 0.50 -0.12 4.05 1.08 -0.87 0.14 117.51 121.87 1fbx h ILE 160 Ca -0.04 -0.11 -0.00 0.00 -0.39 0.00 0.00 64.86 64.32 1fbx h ILE 160 Cb 0.33 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 34.22 1fbx h ILE 160 CO 0.04 0.06 0.07 0.00 -0.69 0.00 0.00 178.15 177.63 1fbx h ALA 161 N 1.65 0.16 -0.33 1.87 0.00 -0.92 -1.42 119.26 120.27 1fbx h ALA 161 Ca 0.47 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.35 1fbx h ALA 161 Cb 0.84 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1fbx h ALA 161 CO -0.52 -0.30 0.17 -0.07 0.00 0.00 0.00 179.25 178.54 1fbx h LEU 162 N 0.10 0.27 0.07 0.00 3.38 0.07 0.15 115.31 119.34 1fbx h LEU 162 Ca 0.04 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1fbx h LEU 162 Cb 0.08 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1fbx h LEU 162 CO -0.01 0.20 -0.36 1.56 0.09 0.00 0.00 178.44 179.92 1fbx h GLN 163 N 0.36 -0.54 -0.26 1.13 4.20 -0.64 0.17 115.11 119.53 1fbx h GLN 163 Ca 0.13 0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.94 1fbx h GLN 163 Cb 0.03 0.12 -0.08 0.00 0.30 0.00 0.00 27.48 27.85 1fbx h GLN 163 CO -0.08 -0.36 -0.37 1.15 -0.67 0.00 0.00 178.83 178.50 1fbx h THR 164 N -0.56 0.19 -0.39 -0.54 2.02 -0.86 -0.43 112.91 112.35 1fbx h THR 164 Ca 0.04 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.17 1fbx h THR 164 Cb 0.61 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1fbx h THR 164 CO -0.25 0.00 0.01 -0.07 0.37 0.00 0.00 175.52 175.58 1fbx h LEU 165 N -0.37 0.57 -0.92 2.58 3.38 -0.54 -3.10 115.31 116.91 1fbx h LEU 165 Ca 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1fbx h LEU 165 Cb 0.58 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1fbx h LEU 165 CO -0.46 0.64 -0.06 0.18 0.09 0.00 0.00 178.44 178.82 1fbx n LEU 166 N -4.26 1.48 -2.02 1.67 4.77 0.54 -4.95 117.00 114.23 1fbx n LEU 166 Ca 0.02 -0.48 -0.19 0.00 -0.03 0.00 0.00 56.01 55.33 1fbx n LEU 166 Cb 0.25 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.30 1fbx n LEU 166 CO 0.40 0.25 -0.23 0.61 -1.33 0.00 0.00 177.39 177.09 1fbx n GLY 167 N 1.22 -0.06 3.14 -0.72 0.00 -0.23 -4.73 105.19 103.81 1fbx n GLY 167 Ca 0.17 -0.10 -0.12 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.90 0.08 -1.56 2.61 2.01 -1.16 -4.93 115.64 109.80 1fbx s THR 168 Ca 0.00 -0.67 0.25 0.00 0.31 0.00 0.00 61.69 61.58 1fbx s THR 168 Cb 0.00 -0.52 0.12 0.00 0.01 0.00 0.00 72.50 72.12 1fbx s THR 168 CO 0.00 -0.37 1.40 0.59 -0.69 0.00 0.00 174.62 175.55 1fbx n ASN 169 N 1.34 1.06 -4.22 3.53 3.02 -1.26 -4.30 115.26 114.42 1fbx n ASN 169 Ca -0.22 -0.85 -0.43 0.00 -0.03 0.00 0.00 54.58 53.05 1fbx n ASN 169 Cb 0.56 0.29 0.00 0.00 -0.61 0.00 0.00 39.78 40.02 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 -0.82 4.74 -4.01 6.41 3.02 -1.26 -0.06 115.26 123.27 1fbx n ASN 170 Ca 0.09 -2.94 -0.09 0.00 -0.03 0.00 0.00 54.58 51.62 1fbx n ASN 170 Cb 0.36 -1.65 -0.11 0.00 -0.61 0.00 0.00 39.78 37.78 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 2.81 0.14 -0.10 2.41 1.01 -1.26 -1.37 120.40 124.06 1fbx s VAL 171 Ca 0.48 -1.15 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1fbx s VAL 171 Cb 0.06 -0.60 0.03 0.00 0.00 0.00 0.00 36.38 35.87 1fbx s VAL 171 CO 0.01 -0.63 0.31 0.00 0.00 0.00 0.00 175.10 174.78 1fbx s ALA 172 N -2.12 -0.77 -0.01 5.51 0.00 0.15 -0.43 121.76 124.11 1fbx s ALA 172 Ca -0.10 0.76 0.02 0.00 0.00 0.00 0.00 51.96 52.64 1fbx s ALA 172 Cb -0.05 -0.39 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 1fbx s ALA 172 CO -0.03 -0.17 -0.06 0.08 0.00 0.00 0.00 175.76 175.57 1fbx s VAL 173 N -0.14 0.52 -0.02 0.00 1.01 -0.60 -0.24 120.40 120.92 1fbx s VAL 173 Ca -0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 61.98 61.68 1fbx s VAL 173 Cb -0.03 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 35.93 1fbx s VAL 173 CO 0.01 0.15 0.03 -0.55 0.00 0.00 0.00 175.10 174.74 1fbx s SER 174 N -0.08 0.04 -0.07 3.32 0.15 0.11 -1.09 113.70 116.08 1fbx s SER 174 Ca 0.02 0.05 0.02 0.00 0.70 0.00 0.00 55.95 56.74 1fbx s SER 174 Cb -0.03 -0.03 0.01 0.00 -1.71 0.00 0.00 66.02 64.26 1fbx s SER 174 CO -0.00 -0.10 -0.12 -0.63 1.20 0.00 0.00 173.24 173.59 1fbx s ILE 175 N 0.78 1.12 -0.20 6.45 1.01 0.34 -0.25 121.20 130.46 1fbx s ILE 175 Ca -0.06 -0.47 0.01 0.00 0.00 0.00 0.00 60.65 60.13 1fbx s ILE 175 Cb -0.09 -1.03 0.03 0.00 0.01 0.00 0.00 42.46 41.37 1fbx s ILE 175 CO -0.02 0.35 -0.18 -0.62 0.00 0.00 0.00 174.94 174.47 1fbx s ASP 176 N 0.69 3.43 0.12 3.58 2.15 -0.72 -0.74 116.67 125.19 1fbx s ASP 176 Ca -0.14 -0.80 -0.05 0.00 0.43 0.00 0.00 52.55 51.99 1fbx s ASP 176 Cb -0.16 -1.50 -0.02 0.00 -0.30 0.00 0.00 42.92 40.94 1fbx s ASP 176 CO 0.03 -0.04 0.13 0.00 -0.17 0.00 0.00 175.17 175.13 1fbx s ALA 177 N 1.25 0.37 -0.11 3.66 0.00 -0.44 -0.37 121.76 126.13 1fbx s ALA 177 Ca 0.02 -1.12 -0.00 0.00 0.00 0.00 0.00 51.96 50.86 1fbx s ALA 177 Cb -0.14 0.71 -0.02 0.00 0.00 0.00 0.00 23.12 23.67 1fbx s ALA 177 CO -0.11 -0.52 -0.09 0.08 0.00 0.00 0.00 175.76 175.12 1fbx s VAL 178 N -3.97 3.48 -0.27 0.00 1.01 0.68 -1.16 120.40 120.16 1fbx s VAL 178 Ca 0.16 -0.53 -0.08 0.00 0.00 0.00 0.00 61.98 61.53 1fbx s VAL 178 Cb 0.06 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1fbx s VAL 178 CO -0.03 0.54 0.09 -1.00 0.00 0.00 0.00 175.10 174.71 1fbx s HIS 179 N -0.09 3.12 -0.58 5.22 3.76 -1.26 -0.93 115.29 124.52 1fbx s HIS 179 Ca -0.00 -0.47 0.23 0.00 -0.15 0.00 0.00 55.06 54.66 1fbx s HIS 179 Cb -0.13 -2.27 0.93 0.00 1.11 0.00 0.00 32.58 32.21 1fbx s HIS 179 CO 0.03 -0.39 1.70 0.66 -0.85 0.00 0.00 174.74 175.89 1fbx n TYR 180 N 4.94 0.72 1.77 1.40 4.02 -0.70 -1.28 117.16 128.03 1fbx n TYR 180 Ca -0.15 0.27 0.12 0.00 -0.01 0.00 0.00 57.90 58.13 1fbx n TYR 180 Cb 0.51 -0.94 0.64 0.00 -0.02 0.00 0.00 39.34 39.53 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 -0.49 0.91 0.10 0.00 0.31 -0.40 -4.52 118.33 114.24 1fbx n VAL 182 Ca 0.18 -0.37 -0.23 0.00 -0.01 0.00 0.00 64.34 63.91 1fbx n VAL 182 Cb 0.18 -1.02 -0.15 0.00 -0.91 0.00 0.00 33.84 31.94 1fbx n VAL 182 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1fbx h LYS 183 N 0.00 0.44 -0.01 5.55 3.64 -1.16 -0.48 116.57 124.55 1fbx h LYS 183 Ca -0.35 -0.74 0.00 0.00 -1.27 0.00 0.00 60.65 58.28 1fbx h LYS 183 Cb 1.58 0.28 0.00 0.00 -0.41 0.00 0.00 32.23 33.68 1fbx h LYS 183 CO -0.05 1.35 -0.26 0.00 -2.27 0.00 0.00 179.45 178.22 1fbx n ALA 184 N -2.78 3.07 -3.92 5.00 0.00 0.30 -4.15 120.51 118.03 1fbx n ALA 184 Ca -0.20 -0.36 -0.02 0.00 0.00 0.00 0.00 53.44 52.86 1fbx n ALA 184 Cb 1.08 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 19.37 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 -2.59 1.14 7.28 0.00 3.03 -1.25 -4.98 118.95 121.58 1fbx s ARG 185 Ca 0.23 -0.74 0.00 0.00 2.03 0.00 0.00 55.73 57.25 1fbx s ARG 185 Cb 0.19 0.31 0.00 0.00 -1.03 0.00 0.00 34.95 34.42 1fbx s ARG 185 CO 0.54 -0.53 0.00 0.41 -1.13 0.00 0.00 175.30 174.59 1fbx n GLY 186 N -0.77 2.48 0.29 3.88 0.00 -1.26 -1.78 105.19 108.04 1fbx n GLY 186 Ca -0.01 -0.31 0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 0.45 -5.58 -0.61 6.09 -1.87 -3.47 117.51 112.53 1fbx h ILE 187 Ca 0.00 -0.18 -0.30 0.00 -1.37 0.00 0.00 64.86 63.01 1fbx h ILE 187 Cb 0.00 1.12 0.18 0.00 0.47 0.00 0.00 36.82 38.59 1fbx h ILE 187 CO 0.00 0.04 -0.81 0.54 -3.07 0.00 0.00 178.15 174.85 1fbx n ARG 188 N -3.66 -4.88 -3.09 2.19 1.74 -0.73 -4.98 116.66 103.26 1fbx n ARG 188 Ca -0.03 0.85 -0.43 0.00 -0.77 0.00 0.00 57.85 57.48 1fbx n ARG 188 Cb 0.13 -5.84 -0.06 0.00 -1.02 0.00 0.00 32.46 25.67 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 -3.98 6.32 0.00 0.55 -1.08 -0.26 -4.89 116.67 113.33 1fbx s ASP 189 Ca 0.18 -0.37 0.21 0.00 -0.52 0.00 0.00 52.55 52.05 1fbx s ASP 189 Cb -0.02 -2.33 0.98 0.00 -1.46 0.00 0.00 42.92 40.09 1fbx s ASP 189 CO 0.74 -0.83 1.68 0.00 0.52 0.00 0.00 175.17 177.28 1fbx n ALA 190 N 6.36 2.03 0.00 3.66 0.00 -1.26 -4.01 120.51 127.28 1fbx n ALA 190 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1fbx n ALA 190 Cb 0.48 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.41 0.00 -1.36 0.00 -2.24 -1.26 -5.07 114.28 102.94 1fbx n THR 191 Ca 0.07 -0.09 -0.31 0.00 -2.27 0.00 0.00 64.05 61.46 1fbx n THR 191 Cb 0.21 0.57 0.08 0.00 -2.10 0.00 0.00 70.33 69.10 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 -1.69 4.66 0.02 3.42 1.04 -1.26 -5.06 113.70 114.83 1fbx s SER 192 Ca 0.00 1.70 -0.18 0.00 0.48 0.00 0.00 55.95 57.95 1fbx s SER 192 Cb 0.00 -2.45 0.03 0.00 0.10 0.00 0.00 66.02 63.71 1fbx s SER 192 CO 0.00 -1.92 0.41 0.00 0.98 0.00 0.00 173.24 172.71 1fbx s ALA 193 N -2.96 -1.00 -0.11 5.32 0.00 -1.26 -4.80 121.76 116.94 1fbx s ALA 193 Ca 0.60 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.94 1fbx s ALA 193 Cb -0.16 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.20 1fbx s ALA 193 CO 0.56 -0.40 -0.11 0.99 0.00 0.00 0.00 175.76 176.80 1fbx s THR 194 N -2.13 3.31 -0.09 0.00 2.01 -0.31 -4.94 115.64 113.48 1fbx s THR 194 Ca -0.07 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.36 1fbx s THR 194 Cb -0.02 -2.38 -0.01 0.00 0.01 0.00 0.00 72.50 70.10 1fbx s THR 194 CO 0.00 0.54 -0.17 -0.89 -0.69 0.00 0.00 174.62 173.41 1fbx s THR 195 N -0.06 2.70 0.04 -0.82 2.01 -1.26 -1.33 115.64 116.92 1fbx s THR 195 Ca -0.01 -0.81 0.03 0.00 0.31 0.00 0.00 61.69 61.20 1fbx s THR 195 Cb -0.14 -2.08 -0.02 0.00 0.01 0.00 0.00 72.50 70.28 1fbx s THR 195 CO 0.03 0.55 -0.09 0.42 -0.69 0.00 0.00 174.62 174.85 1fbx s THR 196 N 0.01 0.69 0.03 -0.82 -4.23 0.08 -4.99 115.64 106.42 1fbx s THR 196 Ca -0.06 -0.92 -0.06 0.00 -1.18 0.00 0.00 61.69 59.48 1fbx s THR 196 Cb -0.15 -0.69 -0.01 0.00 1.34 0.00 0.00 72.50 73.00 1fbx s THR 196 CO 0.05 -0.19 0.10 0.42 -0.54 0.00 0.00 174.62 174.46 1fbx s THR 197 N -1.01 0.12 -0.03 3.99 -4.23 -1.26 -0.50 115.64 112.72 1fbx s THR 197 Ca -0.04 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.47 1fbx s THR 197 Cb -0.08 -0.78 0.03 0.00 1.34 0.00 0.00 72.50 73.01 1fbx s THR 197 CO 0.01 -0.55 0.01 -0.44 -0.54 0.00 0.00 174.62 173.11 1fbx s SER 198 N -1.95 0.56 0.00 3.99 0.01 -0.25 -5.00 113.70 111.06 1fbx s SER 198 Ca -0.07 -0.02 0.08 0.00 1.31 0.00 0.00 55.95 57.25 1fbx s SER 198 Cb -0.03 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.96 1fbx s SER 198 CO -0.03 -0.12 -0.25 -0.76 0.41 0.00 0.00 173.24 172.49 1fbx s LEU 199 N 1.21 2.09 0.48 2.44 1.43 -1.26 -1.56 118.68 123.51 1fbx s LEU 199 Ca -0.07 -0.49 0.04 0.00 -1.03 0.00 0.00 54.13 52.58 1fbx s LEU 199 Cb -0.13 -1.25 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 1fbx s LEU 199 CO -0.02 0.28 0.13 -0.83 0.23 0.00 0.00 176.35 176.14 1fbx s GLY 200 N -0.82 2.66 0.00 -3.19 0.00 0.43 -4.63 107.32 101.77 1fbx s GLY 200 Ca 0.10 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.58 1fbx s GLY 200 CO 0.00 -2.07 0.00 0.61 0.00 0.00 0.00 173.10 171.65 1fbx n GLY 201 N -1.32 1.31 0.37 0.20 0.00 0.92 -0.82 105.19 105.84 1fbx n GLY 201 Ca -0.09 -0.01 0.19 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.53 0.99 3.38 -1.95 -0.18 115.31 117.01 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 0.00 0.00 0.49 0.09 0.00 0.00 178.44 179.02 1fbx n PHE 203 N -3.95 0.54 -0.06 1.13 3.72 -0.00 -0.86 117.46 117.98 1fbx n PHE 203 Ca 0.06 0.22 -0.06 0.00 -0.05 0.00 0.00 57.45 57.62 1fbx n PHE 203 Cb 0.53 -0.86 -0.02 0.00 -0.94 0.00 0.00 39.48 38.19 1fbx n PHE 203 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1fbx n LYS 204 N -2.00 0.38 0.05 -1.08 4.81 -0.13 -4.10 118.16 116.10 1fbx n LYS 204 Ca 0.02 0.15 -0.13 0.00 -0.87 0.00 0.00 58.31 57.48 1fbx n LYS 204 Cb 0.19 -1.16 -0.08 0.00 0.02 0.00 0.00 35.03 34.00 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 -0.72 -0.07 -3.56 3.14 4.64 -1.44 -3.41 113.55 112.12 1fbx h SER 205 Ca 0.00 -0.14 -0.56 0.00 -0.47 0.00 0.00 61.79 60.61 1fbx h SER 205 Cb 0.72 0.02 -0.07 0.00 -0.31 0.00 0.00 62.40 62.76 1fbx h SER 205 CO 0.00 0.10 0.93 -0.55 -0.87 0.00 0.00 176.83 176.44 1fbx s SER 206 N -5.27 6.67 0.37 4.97 0.15 -0.04 -4.86 113.70 115.69 1fbx s SER 206 Ca -0.14 0.66 0.06 0.00 0.70 0.00 0.00 55.95 57.23 1fbx s SER 206 Cb 0.04 -2.55 0.76 0.00 -1.71 0.00 0.00 66.02 62.56 1fbx s SER 206 CO 0.65 -1.18 1.97 -0.61 1.20 0.00 0.00 173.24 175.26 1fbx h GLN 207 N 9.13 0.71 0.58 5.44 5.75 -1.83 0.76 115.11 135.65 1fbx h GLN 207 Ca -0.23 -0.04 -0.02 0.00 -0.15 0.00 0.00 58.65 58.20 1fbx h GLN 207 Cb 1.07 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 29.45 1fbx h GLN 207 CO 1.10 0.47 -0.41 -0.97 -2.65 0.00 0.00 178.83 176.37 1fbx h ASN 208 N 0.73 -1.07 0.22 -0.69 -1.24 -1.92 -1.44 115.58 110.18 1fbx h ASN 208 Ca 0.30 0.07 0.00 0.00 0.71 0.00 0.00 56.30 57.38 1fbx h ASN 208 Cb 0.25 0.32 -0.02 0.00 0.73 0.00 0.00 38.32 39.60 1fbx h ASN 208 CO -0.10 -0.60 -0.21 0.74 -1.29 0.00 0.00 177.43 175.98 1fbx h THR 209 N -0.95 0.56 -0.65 -3.57 2.02 -1.68 -2.61 112.91 106.03 1fbx h THR 209 Ca -0.08 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.24 1fbx h THR 209 Cb 0.78 0.56 -0.12 0.00 -1.74 0.00 0.00 68.15 67.62 1fbx h THR 209 CO 0.04 0.00 -0.11 -0.09 0.37 0.00 0.00 175.52 175.74 1fbx h ARG 210 N -0.45 0.03 0.00 6.66 2.43 -0.86 -1.08 114.38 121.10 1fbx h ARG 210 Ca -0.01 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.09 1fbx h ARG 210 Cb 0.42 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1fbx h ARG 210 CO -0.04 0.02 -0.34 0.45 -1.51 0.00 0.00 179.97 178.56 1fbx h HIS 211 N 0.03 0.00 -0.46 2.20 3.86 -1.11 -1.71 115.15 117.97 1fbx h HIS 211 Ca 0.32 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.45 1fbx h HIS 211 Cb 0.51 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 1fbx h HIS 211 CO -0.48 0.34 -0.04 0.93 0.86 0.00 0.00 177.93 179.54 1fbx h GLU 212 N 0.00 0.77 0.03 2.45 5.08 -0.83 0.18 114.58 122.26 1fbx h GLU 212 Ca -0.00 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.13 1fbx h GLU 212 Cb 0.93 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1fbx h GLU 212 CO 0.04 0.81 -0.02 0.35 -1.00 0.00 0.00 179.01 179.19 1fbx h PHE 213 N 0.71 -0.04 -0.92 4.33 3.57 -1.17 -2.81 116.94 120.61 1fbx h PHE 213 Ca 0.13 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.66 1fbx h PHE 213 Cb 0.49 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.19 1fbx h PHE 213 CO 0.03 0.61 0.60 -0.07 -2.23 0.00 0.00 178.31 177.24 1fbx h LEU 214 N -0.76 1.00 -0.88 0.59 3.38 -1.28 -1.37 115.31 115.99 1fbx h LEU 214 Ca -0.00 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.02 1fbx h LEU 214 Cb 0.67 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.12 1fbx h LEU 214 CO 0.01 0.69 0.54 -0.09 0.09 0.00 0.00 178.44 179.69 1fbx h ARG 215 N 1.17 0.95 0.00 1.13 2.43 -0.67 -1.66 114.38 117.73 1fbx h ARG 215 Ca 0.36 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.47 1fbx h ARG 215 Cb -0.02 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 1fbx h ARG 215 CO -0.11 0.63 0.00 0.00 -1.51 0.00 0.00 179.97 178.98 1fbx h ALA 216 N 1.42 1.00 -2.40 2.80 0.00 -1.00 -3.46 119.26 117.62 1fbx h ALA 216 Ca 0.39 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.80 1fbx h ALA 216 Cb 0.19 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.06 1fbx h ALA 216 CO -0.18 0.00 0.38 0.08 0.00 0.00 0.00 179.25 179.53 1fbx s VAL 217 N -3.31 3.57 0.00 0.00 1.01 -0.63 -4.55 120.40 116.50 1fbx s VAL 217 Ca 0.06 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.80 1fbx s VAL 217 Cb 0.09 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1fbx s VAL 217 CO 0.57 -0.43 0.00 -1.14 0.00 0.00 0.00 175.10 174.11 1fbx n ARG 218 N -2.09 0.00 -3.40 2.72 3.00 -1.26 -5.03 116.66 110.59 1fbx n ARG 218 Ca 0.09 0.39 -0.37 0.00 -0.00 0.00 0.00 57.85 57.97 1fbx n ARG 218 Cb 0.52 -1.18 -0.04 0.00 0.00 0.00 0.00 32.46 31.76 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 -0.77 3.67 -1.55 -0.14 8.25 -1.26 -5.01 115.22 118.40 1fbx n HIS 219 Ca 0.00 -3.71 -0.20 0.00 -0.26 0.00 0.00 57.72 53.55 1fbx n HIS 219 Cb 0.38 -1.09 -0.08 0.00 1.12 0.00 0.00 29.99 30.33 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 1.75 1.11 -0.45 4.41 -0.00 -1.26 -4.88 115.22 115.90 1fbx n HIS 220 Ca 0.25 0.03 0.00 0.00 0.46 0.00 0.00 57.72 58.45 1fbx n HIS 220 Cb 0.37 -2.44 0.00 0.00 -0.12 0.00 0.00 29.99 27.80 1fbx n HIS 220 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89