#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 -4.40 3.54 2.88 -1.26 -5.16 113.62 109.21 1fbx n SER 2 Ca 0.00 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 1fbx n SER 2 Cb 0.00 0.30 -0.10 0.00 -0.75 0.00 0.00 64.21 63.66 1fbx n SER 2 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1fbx s LEU 3 N -3.81 2.39 0.27 2.46 1.43 -1.26 -4.73 118.68 115.42 1fbx s LEU 3 Ca 0.00 -1.22 0.07 0.00 -1.03 0.00 0.00 54.13 51.96 1fbx s LEU 3 Cb 0.00 -0.52 -0.04 0.00 0.03 0.00 0.00 46.19 45.67 1fbx s LEU 3 CO 0.00 -0.41 0.19 -0.94 0.23 0.00 0.00 176.35 175.41 1fbx s SER 4 N -3.41 5.34 0.09 2.29 1.04 -1.26 -4.96 113.70 112.82 1fbx s SER 4 Ca 0.30 -0.36 -0.26 0.00 0.48 0.00 0.00 55.95 56.11 1fbx s SER 4 Cb 0.05 -1.24 -0.10 0.00 0.10 0.00 0.00 66.02 64.82 1fbx s SER 4 CO 0.11 -0.10 1.43 0.11 0.98 0.00 0.00 173.24 175.77 1fbx h LYS 5 N 1.50 -0.48 0.15 4.02 1.57 -2.02 0.37 116.57 121.67 1fbx h LYS 5 Ca -0.47 0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.35 1fbx h LYS 5 Cb 1.24 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 33.62 1fbx h LYS 5 CO 0.60 -0.32 -0.49 0.93 -0.57 0.00 0.00 179.45 179.60 1fbx h GLU 6 N -0.50 -0.71 -0.87 3.15 3.07 -1.97 0.95 114.58 117.71 1fbx h GLU 6 Ca 0.01 0.05 0.23 0.00 -0.50 0.00 0.00 59.36 59.15 1fbx h GLU 6 Cb 0.55 0.16 -0.14 0.00 -0.84 0.00 0.00 28.75 28.48 1fbx h GLU 6 CO -0.30 -0.48 0.22 0.00 -1.40 0.00 0.00 179.01 177.05 1fbx h ALA 7 N -0.43 1.23 0.20 3.43 0.00 -1.83 -0.10 119.26 121.77 1fbx h ALA 7 Ca 0.00 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1fbx h ALA 7 Cb 0.75 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1fbx h ALA 7 CO -0.26 -0.46 -0.10 0.00 0.00 0.00 0.00 179.25 178.44 1fbx h ALA 8 N 1.77 -0.27 -0.11 0.00 0.00 0.12 -1.19 119.26 119.58 1fbx h ALA 8 Ca 0.54 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.36 1fbx h ALA 8 Cb 1.07 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1fbx h ALA 8 CO -0.65 -0.62 0.06 -0.07 0.00 0.00 0.00 179.25 177.97 1fbx h LEU 9 N -0.33 0.13 -0.35 0.00 3.38 0.39 -1.30 115.31 117.22 1fbx h LEU 9 Ca -0.03 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.96 1fbx h LEU 9 Cb 0.26 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1fbx h LEU 9 CO 0.04 0.13 0.06 0.58 0.09 0.00 0.00 178.44 179.35 1fbx h VAL 10 N 0.11 0.81 -0.57 1.22 2.07 -1.04 0.39 116.25 119.25 1fbx h VAL 10 Ca 0.04 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1fbx h VAL 10 Cb 0.03 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1fbx h VAL 10 CO -0.01 0.03 0.36 -0.74 0.02 0.00 0.00 177.57 177.24 1fbx h HIS 11 N 0.18 0.73 0.55 1.57 -0.00 -1.05 -1.55 115.15 115.57 1fbx h HIS 11 Ca 0.17 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.53 1fbx h HIS 11 Cb 0.20 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.35 1fbx h HIS 11 CO -0.19 0.47 -0.37 0.93 -0.00 0.00 0.00 177.93 178.78 1fbx h GLU 12 N 0.77 -0.85 -0.82 5.26 5.08 -0.48 -2.06 114.58 121.48 1fbx h GLU 12 Ca 0.21 0.06 0.20 0.00 -1.00 0.00 0.00 59.36 58.82 1fbx h GLU 12 Cb -0.06 0.19 -0.14 0.00 0.50 0.00 0.00 28.75 29.25 1fbx h GLU 12 CO -0.04 -0.56 0.12 0.00 -1.00 0.00 0.00 179.01 177.52 1fbx h ALA 13 N -0.53 1.03 -0.46 3.43 0.00 -0.05 0.25 119.26 122.92 1fbx h ALA 13 Ca -0.06 0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 1fbx h ALA 13 Cb 0.73 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1fbx h ALA 13 CO 0.05 -0.44 -0.08 -0.07 0.00 0.00 0.00 179.25 178.71 1fbx h LEU 14 N 0.16 0.79 -0.55 0.00 3.38 -1.02 -2.58 115.31 115.50 1fbx h LEU 14 Ca 0.48 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 58.08 1fbx h LEU 14 Cb 0.91 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1fbx h LEU 14 CO -0.66 0.91 -0.35 0.58 0.09 0.00 0.00 178.44 179.01 1fbx h VAL 15 N 0.74 1.28 0.20 1.22 2.07 -0.29 0.20 116.25 121.67 1fbx h VAL 15 Ca 0.13 -1.52 0.01 0.00 0.82 0.00 0.00 66.70 66.14 1fbx h VAL 15 Cb 0.57 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1fbx h VAL 15 CO 0.03 0.50 -0.29 0.00 0.02 0.00 0.00 177.57 177.83 1fbx h ALA 16 N 0.95 -0.54 0.00 1.67 0.00 -1.06 -1.83 119.26 118.44 1fbx h ALA 16 Ca 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fbx h ALA 16 Cb 0.90 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1fbx h ALA 16 CO 0.08 -0.85 0.00 0.54 0.00 0.00 0.00 179.25 179.02 1fbx n ARG 17 N -5.40 0.17 -3.03 0.00 3.00 -0.99 -4.90 116.66 105.51 1fbx n ARG 17 Ca -0.08 0.13 -0.12 0.00 -0.01 0.00 0.00 57.85 57.77 1fbx n ARG 17 Cb 0.31 -1.50 0.04 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 0.41 0.16 0.15 -0.13 0.00 -0.67 -4.94 105.19 100.16 1fbx n GLY 18 Ca 0.07 -0.19 0.01 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.83 1.93 -4.76 0.99 4.77 0.63 -5.02 117.00 112.72 1fbx n LEU 19 Ca -0.01 -1.69 -0.35 0.00 -0.03 0.00 0.00 56.01 53.92 1fbx n LEU 19 Cb 0.54 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.62 1fbx n LEU 19 CO 0.34 0.47 0.81 -1.61 -1.33 0.00 0.00 177.39 176.07 1fbx s GLU 20 N -0.77 2.93 0.29 3.23 0.41 -1.16 -4.86 118.70 118.77 1fbx s GLU 20 Ca 0.05 1.71 -0.30 0.00 -0.41 0.00 0.00 54.97 56.02 1fbx s GLU 20 Cb 0.03 -1.94 -0.10 0.00 -1.78 0.00 0.00 34.13 30.34 1fbx s GLU 20 CO 0.04 -1.21 1.45 0.99 -0.49 0.00 0.00 175.26 176.04 1fbx s THR 21 N -1.79 2.49 -0.60 3.63 2.01 -1.26 -4.83 115.64 115.29 1fbx s THR 21 Ca 0.74 0.43 -0.27 0.00 0.31 0.00 0.00 61.69 62.90 1fbx s THR 21 Cb -0.27 -3.27 -0.10 0.00 0.01 0.00 0.00 72.50 68.86 1fbx s THR 21 CO 0.34 0.08 2.48 -2.65 -0.69 0.00 0.00 174.62 174.18 1fbx n PRO 22 N 1.81 0.82 -4.99 4.92 -0.02 -1.26 -4.93 135.00 131.34 1fbx n PRO 22 Ca 0.05 -0.01 -0.28 0.00 -2.02 0.00 0.00 63.50 61.25 1fbx n PRO 22 Cb 0.40 -3.04 -0.15 0.00 -0.02 0.00 0.00 33.50 30.69 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 11.57 2.08 -0.14 2.45 1.02 -1.26 -5.14 118.68 129.26 1fbx s LEU 23 Ca 1.06 -0.44 -0.08 0.00 0.02 0.00 0.00 54.13 54.69 1fbx s LEU 23 Cb -0.41 -1.13 -0.04 0.00 0.02 0.00 0.00 46.19 44.63 1fbx s LEU 23 CO 0.31 0.25 0.15 -0.13 0.02 0.00 0.00 176.35 176.95 1fbx s ARG 24 N -0.72 3.65 0.25 1.70 0.52 -1.26 -5.04 118.95 118.05 1fbx s ARG 24 Ca 0.09 -0.13 -0.31 0.00 -0.52 0.00 0.00 55.73 54.86 1fbx s ARG 24 Cb -0.09 -3.25 -0.14 0.00 0.52 0.00 0.00 34.95 32.00 1fbx s ARG 24 CO -0.00 0.65 1.32 -2.30 0.02 0.00 0.00 175.30 174.99 1fbx n PRO 25 N 2.38 1.87 -0.36 3.54 -0.02 -1.26 -4.80 135.00 136.34 1fbx n PRO 25 Ca -0.19 0.66 -0.00 0.00 -2.02 0.00 0.00 63.50 61.95 1fbx n PRO 25 Cb 0.54 -2.26 0.05 0.00 -0.02 0.00 0.00 33.50 31.81 1fbx n PRO 25 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1fbx n PRO 26 N 1.66 -0.21 0.00 0.52 -0.02 -1.26 -4.87 135.00 130.82 1fbx n PRO 26 Ca 0.11 1.47 0.00 0.00 -2.02 0.00 0.00 63.50 63.06 1fbx n PRO 26 Cb 0.31 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 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 -5.41 0.00 -4.71 -1.45 0.31 -1.26 -4.98 118.33 100.82 1fbx n VAL 27 Ca 0.10 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.13 1fbx n VAL 27 Cb 0.39 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 33.18 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 2.37 -0.94 3.52 -3.43 -1.26 -5.03 115.29 110.52 1fbx s HIS 28 Ca 0.00 -0.37 -0.27 0.00 -0.80 0.00 0.00 55.06 53.62 1fbx s HIS 28 Cb 0.00 -1.37 -0.25 0.00 -1.43 0.00 0.00 32.58 29.53 1fbx s HIS 28 CO 0.00 0.21 2.03 0.39 -2.00 0.00 0.00 174.74 175.37 1fbx n GLU 29 N 1.48 0.17 -2.95 -0.38 1.02 -1.26 -4.90 120.64 113.83 1fbx n GLU 29 Ca -0.17 -1.65 -0.41 0.00 -0.02 0.00 0.00 57.16 54.90 1fbx n GLU 29 Cb 0.52 -3.73 -0.05 0.00 -0.02 0.00 0.00 31.44 28.16 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 8.21 4.15 0.75 3.49 -2.45 -1.26 -5.02 119.30 127.17 1fbx s MET 30 Ca 0.79 0.81 -0.16 0.00 -1.25 0.00 0.00 55.69 55.88 1fbx s MET 30 Cb -0.02 -3.65 -0.14 0.00 1.25 0.00 0.00 34.83 32.27 1fbx s MET 30 CO 0.21 -0.50 -0.50 -3.47 1.05 0.00 0.00 175.02 171.80 1fbx n ASP 31 N 5.95 -4.74 0.05 1.11 2.03 -1.26 -4.82 116.55 114.87 1fbx n ASP 31 Ca 0.04 0.33 -0.03 0.00 0.52 0.00 0.00 54.79 55.65 1fbx n ASP 31 Cb 0.48 -0.73 -0.08 0.00 -0.72 0.00 0.00 41.12 40.07 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 -0.57 0.00 1.80 1.67 4.21 -1.99 -3.07 115.58 117.63 1fbx h ASN 32 Ca -0.40 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.10 1fbx h ASN 32 Cb 1.25 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.45 1fbx h ASN 32 CO 0.28 0.76 -0.08 -0.33 -1.29 0.00 0.00 177.43 176.77 1fbx h GLU 33 N 0.00 0.00 0.00 0.81 5.08 -1.99 -0.76 114.58 117.73 1fbx h GLU 33 Ca -0.12 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.02 1fbx h GLU 33 Cb 1.68 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.95 1fbx h GLU 33 CO 0.08 0.08 -0.87 1.15 -1.00 0.00 0.00 179.01 178.45 1fbx h THR 34 N 0.00 1.34 -0.66 1.13 2.02 -1.91 -2.18 112.91 112.65 1fbx h THR 34 Ca -0.00 -2.18 -0.07 0.00 0.77 0.00 0.00 66.41 64.93 1fbx h THR 34 Cb 1.00 2.48 -0.03 0.00 -1.74 0.00 0.00 68.15 69.86 1fbx h THR 34 CO 0.01 0.66 0.15 0.03 0.37 0.00 0.00 175.52 176.74 1fbx h ARG 35 N 0.19 1.07 -0.71 6.66 3.08 -1.43 0.14 114.38 123.39 1fbx h ARG 35 Ca -0.11 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 59.60 1fbx h ARG 35 Cb 1.55 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 31.43 1fbx h ARG 35 CO 0.17 0.97 0.16 0.87 -1.07 0.00 0.00 179.97 181.07 1fbx h LYS 36 N 1.00 1.14 -0.00 0.04 1.57 -1.13 -0.21 116.57 118.98 1fbx h LYS 36 Ca 0.21 -0.28 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 1fbx h LYS 36 Cb 0.39 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1fbx h LYS 36 CO 0.01 1.01 -0.77 0.66 -0.57 0.00 0.00 179.45 179.79 1fbx h SER 37 N 1.07 0.05 -0.48 0.86 4.64 -1.10 0.14 113.55 118.74 1fbx h SER 37 Ca 0.22 -0.04 -0.11 0.00 -0.47 0.00 0.00 61.79 61.39 1fbx h SER 37 Cb 0.39 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1fbx h SER 37 CO 0.00 0.80 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.55 1fbx h LEU 38 N 0.03 0.95 -0.21 5.97 3.38 -0.44 0.10 115.31 125.09 1fbx h LEU 38 Ca -0.01 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.56 1fbx h LEU 38 Cb 1.35 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1fbx h LEU 38 CO 0.10 1.11 0.02 0.40 0.09 0.00 0.00 178.44 180.16 1fbx h ILE 39 N 0.79 1.23 -0.30 1.22 2.04 -0.89 0.19 117.51 121.79 1fbx h ILE 39 Ca 0.12 -0.78 0.09 0.00 1.00 0.00 0.00 64.86 65.28 1fbx h ILE 39 Cb 0.70 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 1fbx h ILE 39 CO 0.05 0.24 0.22 0.00 0.00 0.00 0.00 178.15 178.67 1fbx h ALA 40 N 0.82 2.24 0.35 1.87 0.00 -0.57 -0.52 119.26 123.45 1fbx h ALA 40 Ca 0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1fbx h ALA 40 Cb 0.34 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1fbx h ALA 40 CO 0.01 -0.38 -0.17 0.78 0.00 0.00 0.00 179.25 179.49 1fbx h GLY 41 N 0.00 -0.50 1.58 0.00 0.00 0.12 -1.56 103.07 102.71 1fbx h GLY 41 Ca 0.14 0.18 0.05 0.00 0.00 0.00 0.00 47.33 47.70 1fbx h GLY 41 CO -0.00 -0.18 0.16 0.45 0.00 0.00 0.00 176.54 176.97 1fbx h HIS 42 N -0.48 0.00 -0.30 5.60 3.86 -0.68 -1.38 115.15 121.76 1fbx h HIS 42 Ca -0.05 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 58.99 1fbx h HIS 42 Cb 0.36 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.83 1fbx h HIS 42 CO 0.15 0.00 -0.48 0.52 0.86 0.00 0.00 177.93 178.98 1fbx h MET 43 N 0.00 0.85 -0.75 2.45 2.86 -0.91 -2.04 114.93 117.38 1fbx h MET 43 Ca 0.07 -0.52 0.04 0.00 -2.06 0.00 0.00 59.70 57.23 1fbx h MET 43 Cb 0.40 0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.07 1fbx h MET 43 CO -0.00 1.15 0.47 1.15 1.06 0.00 0.00 176.91 180.74 1fbx h THR 44 N 0.63 1.09 0.24 2.22 2.02 -0.22 -0.51 112.91 118.38 1fbx h THR 44 Ca 0.02 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.88 1fbx h THR 44 Cb 1.08 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 1fbx h THR 44 CO 0.11 0.17 -0.11 -0.33 0.37 0.00 0.00 175.52 175.72 1fbx h GLU 45 N 0.91 -0.30 -0.50 6.66 5.08 -1.39 -1.89 114.58 123.14 1fbx h GLU 45 Ca 0.31 0.02 0.10 0.00 -1.00 0.00 0.00 59.36 58.79 1fbx h GLU 45 Cb 0.05 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.27 1fbx h GLU 45 CO -0.12 -0.04 -0.12 0.82 -1.00 0.00 0.00 179.01 178.55 1fbx h ILE 46 N -0.56 0.50 -0.24 3.13 2.04 -1.06 0.71 117.51 122.04 1fbx h ILE 46 Ca -0.03 -0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.87 1fbx h ILE 46 Cb 0.41 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 1fbx h ILE 46 CO 0.05 0.00 0.17 0.24 0.00 0.00 0.00 178.15 178.61 1fbx h MET 47 N 0.00 0.12 -0.04 2.37 2.86 -1.00 0.72 114.93 119.96 1fbx h MET 47 Ca 0.24 -0.01 -0.17 0.00 -2.06 0.00 0.00 59.70 57.70 1fbx h MET 47 Cb 0.37 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 1fbx h MET 47 CO -0.51 0.08 -0.74 1.96 1.06 0.00 0.00 176.91 178.76 1fbx h GLN 48 N 0.12 0.22 0.00 1.72 4.20 0.11 -2.23 115.11 119.26 1fbx h GLN 48 Ca 0.11 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 1fbx h GLN 48 Cb 0.28 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1fbx h GLN 48 CO -0.01 0.86 -0.21 -0.07 -0.67 0.00 0.00 178.83 178.73 1fbx h LEU 49 N 0.15 0.00 -1.87 1.46 3.38 0.16 -1.29 115.31 117.31 1fbx h LEU 49 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1fbx h LEU 49 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1fbx h LEU 49 CO 0.11 0.21 0.00 0.18 0.09 0.00 0.00 178.44 179.03 1fbx n LEU 50 N -3.68 2.74 -2.42 1.67 4.77 -0.57 -4.91 117.00 114.62 1fbx n LEU 50 Ca -0.01 -1.38 -0.16 0.00 -0.03 0.00 0.00 56.01 54.42 1fbx n LEU 50 Cb 0.33 -0.44 -0.01 0.00 -2.33 0.00 0.00 43.42 40.97 1fbx n LEU 50 CO 0.33 0.46 -0.21 0.59 -1.33 0.00 0.00 177.39 177.23 1fbx n ASN 51 N 0.43 -4.83 -4.76 -1.43 3.02 -0.49 -4.97 115.26 102.23 1fbx n ASN 51 Ca 0.13 0.10 -0.39 0.00 -0.03 0.00 0.00 54.58 54.39 1fbx n ASN 51 Cb 0.54 -4.06 -0.06 0.00 -0.61 0.00 0.00 39.78 35.60 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 -5.80 4.48 -1.01 3.41 1.43 -0.86 -4.99 118.68 115.34 1fbx s LEU 52 Ca 0.00 1.37 -0.23 0.00 -1.03 0.00 0.00 54.13 54.24 1fbx s LEU 52 Cb 0.00 -3.10 0.02 0.00 0.03 0.00 0.00 46.19 43.13 1fbx s LEU 52 CO 0.00 0.11 1.64 -0.62 0.23 0.00 0.00 176.35 177.71 1fbx s ASP 53 N -0.43 6.04 0.00 2.29 -1.08 -1.26 -4.65 116.67 117.58 1fbx s ASP 53 Ca 0.34 -1.29 0.02 0.00 -0.52 0.00 0.00 52.55 51.11 1fbx s ASP 53 Cb -0.20 -2.57 0.14 0.00 -1.46 0.00 0.00 42.92 38.83 1fbx s ASP 53 CO 0.21 -1.93 0.46 0.18 0.52 0.00 0.00 175.17 174.61 1fbx n LEU 54 N 10.66 0.00 -0.54 -1.34 4.77 -1.26 -2.16 117.00 127.12 1fbx n LEU 54 Ca 0.37 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.48 1fbx n LEU 54 Cb 0.49 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.04 1fbx n LEU 54 CO 0.65 0.00 0.83 0.00 -1.33 0.00 0.00 177.39 177.54 1fbx n ALA 55 N -0.77 2.55 -1.88 -1.18 0.00 -1.26 -4.17 120.51 113.80 1fbx n ALA 55 Ca 0.02 -0.49 -0.34 0.00 0.00 0.00 0.00 53.44 52.63 1fbx n ALA 55 Cb 0.01 -1.12 -0.07 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.92 7.03 0.64 0.00 2.15 -0.92 -4.96 116.67 118.69 1fbx s ASP 56 Ca 0.36 1.65 0.42 0.00 0.43 0.00 0.00 52.55 55.40 1fbx s ASP 56 Cb 0.20 -2.52 2.26 0.00 -0.30 0.00 0.00 42.92 42.57 1fbx s ASP 56 CO 0.32 -0.23 2.27 -2.24 -0.17 0.00 0.00 175.17 175.13 1fbx h ASP 57 N 2.41 0.00 0.00 -0.34 2.03 -1.92 -2.72 116.42 115.88 1fbx h ASP 57 Ca -0.48 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.82 1fbx h ASP 57 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 1fbx h ASP 57 CO 0.63 0.00 -0.68 -0.24 -1.03 0.00 0.00 179.24 177.92 1fbx n SER 58 N -3.00 1.78 0.19 4.15 2.88 -1.26 -4.50 113.62 113.87 1fbx n SER 58 Ca -0.03 0.50 0.13 0.00 -1.33 0.00 0.00 58.87 58.15 1fbx n SER 58 Cb 0.10 -0.81 0.70 0.00 -0.75 0.00 0.00 64.21 63.46 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 -0.96 0.00 -0.28 2.46 3.38 -1.89 -3.27 115.31 114.76 1fbx h LEU 59 Ca 0.00 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1fbx h LEU 59 Cb 0.68 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 1fbx h LEU 59 CO 0.00 0.00 0.11 -0.03 0.09 0.00 0.00 178.44 178.61 1fbx h MET 60 N 0.00 0.23 0.00 1.13 4.05 -1.64 -2.86 114.93 115.84 1fbx h MET 60 Ca 0.00 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1fbx h MET 60 Cb 0.03 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 30.78 1fbx h MET 60 CO 0.00 0.15 -0.15 0.39 0.23 0.00 0.00 176.91 177.53 1fbx n GLU 61 N -5.02 0.21 -0.26 0.39 -0.58 -1.23 -4.31 120.64 109.84 1fbx n GLU 61 Ca -0.01 0.14 0.04 0.00 -0.42 0.00 0.00 57.16 56.92 1fbx n GLU 61 Cb 0.09 -1.72 0.18 0.00 -0.57 0.00 0.00 31.44 29.42 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 0.72 0.00 2.62 2.02 -1.67 0.15 112.91 116.75 1fbx h THR 62 Ca 0.00 -0.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 1fbx h THR 62 Cb 0.69 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1fbx h THR 62 CO 0.00 0.09 -0.15 -0.65 0.37 0.00 0.00 175.52 175.18 1fbx h PRO 63 N 0.51 0.00 0.08 6.66 0.11 -1.75 0.11 132.00 137.71 1fbx h PRO 63 Ca 0.40 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 66.25 1fbx h PRO 63 Cb 0.56 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.67 1fbx h PRO 63 CO -0.36 0.15 -1.13 1.25 -0.21 0.00 0.00 178.00 177.71 1fbx h HIS 64 N 0.00 0.61 -0.11 0.65 2.76 -1.37 -2.26 115.15 115.44 1fbx h HIS 64 Ca -0.00 -0.39 -0.02 0.00 -2.20 0.00 0.00 60.37 57.76 1fbx h HIS 64 Cb 0.28 -0.05 -0.00 0.00 1.55 0.00 0.00 27.41 29.19 1fbx h HIS 64 CO 0.00 1.26 -0.00 0.00 -1.30 0.00 0.00 177.93 177.88 1fbx h ARG 65 N 0.16 0.20 -0.43 5.26 3.08 -0.13 -1.70 114.38 120.82 1fbx h ARG 65 Ca -0.12 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.86 1fbx h ARG 65 Cb 1.81 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.82 1fbx h ARG 65 CO 0.19 0.46 0.27 0.82 -1.07 0.00 0.00 179.97 180.64 1fbx h ILE 66 N -0.08 1.12 -0.23 2.04 2.04 -0.86 -0.90 117.51 120.63 1fbx h ILE 66 Ca 0.03 -0.25 -0.10 0.00 1.00 0.00 0.00 64.86 65.54 1fbx h ILE 66 Cb 0.37 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 1fbx h ILE 66 CO 0.01 0.12 -0.26 0.00 0.00 0.00 0.00 178.15 178.02 1fbx h ALA 67 N 1.71 0.34 -0.54 1.87 0.00 -1.12 -1.85 119.26 119.67 1fbx h ALA 67 Ca 0.16 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 1fbx h ALA 67 Cb -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1fbx h ALA 67 CO -0.03 0.32 -0.08 -0.22 0.00 0.00 0.00 179.25 179.25 1fbx h LYS 68 N 0.28 1.00 -0.40 0.00 3.64 -1.04 -2.49 116.57 117.55 1fbx h LYS 68 Ca 0.03 -0.36 -0.01 0.00 -1.27 0.00 0.00 60.65 59.05 1fbx h LYS 68 Cb 0.82 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 1fbx h LYS 68 CO 0.06 1.04 0.23 1.98 -2.27 0.00 0.00 179.45 180.49 1fbx h MET 69 N 0.88 0.56 -0.70 1.90 4.05 -1.12 0.22 114.93 120.71 1fbx h MET 69 Ca 0.14 -0.06 -0.07 0.00 -0.28 0.00 0.00 59.70 59.43 1fbx h MET 69 Cb 0.64 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.30 1fbx h MET 69 CO 0.04 0.44 0.17 1.88 0.23 0.00 0.00 176.91 179.67 1fbx h TYR 70 N 0.53 1.18 0.10 1.39 -1.99 -1.26 -1.32 116.97 115.61 1fbx h TYR 70 Ca 0.14 -0.14 -0.33 0.00 2.00 0.00 0.00 58.73 60.40 1fbx h TYR 70 Cb 0.04 -0.33 -0.02 0.00 2.00 0.00 0.00 36.73 38.42 1fbx h TYR 70 CO -0.03 0.96 -1.75 0.28 -0.00 0.00 0.00 178.16 177.63 1fbx h VAL 71 N 1.06 0.89 0.00 -2.88 2.07 -1.29 -3.03 116.25 113.07 1fbx h VAL 71 Ca 0.22 -2.59 0.00 0.00 0.82 0.00 0.00 66.70 65.15 1fbx h VAL 71 Cb 0.38 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 1fbx h VAL 71 CO 0.00 0.79 -1.12 0.47 0.02 0.00 0.00 177.57 177.73 1fbx n ASP 72 N -3.40 0.82 0.00 0.57 8.00 0.75 -4.15 116.55 119.15 1fbx n ASP 72 Ca -0.23 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.48 1fbx n ASP 72 Cb 1.05 1.17 0.00 0.00 -0.02 0.00 0.00 41.12 43.32 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 -1.61 0.00 -0.13 -1.24 1.02 -0.57 -4.70 120.64 113.41 1fbx n GLU 73 Ca 0.02 0.00 0.28 0.00 -0.02 0.00 0.00 57.16 57.44 1fbx n GLU 73 Cb 0.35 0.00 0.68 0.00 -0.02 0.00 0.00 31.44 32.45 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 0.28 -0.22 -3.67 3.07 -1.60 -0.26 117.51 115.11 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 0.40 0.00 0.00 -0.27 0.00 0.00 36.82 36.95 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 -3.74 0.31 0.33 0.16 3.72 -1.14 -2.61 117.46 114.48 1fbx n PHE 75 Ca 0.18 -0.51 0.21 0.00 -0.05 0.00 0.00 57.45 57.28 1fbx n PHE 75 Cb 1.07 -0.04 1.15 0.00 -0.94 0.00 0.00 39.48 40.72 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 1.28 0.00 0.00 4.37 4.64 -1.09 -1.42 113.55 121.34 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 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1fbx h SER 76 CO 0.01 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1fbx n GLY 77 N -1.12 -0.64 0.00 -0.77 0.00 -0.41 -2.20 105.19 100.04 1fbx n GLY 77 Ca -0.03 -0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.90 0.24 -4.11 0.99 4.77 -0.54 -4.64 117.00 112.82 1fbx n LEU 78 Ca 0.12 0.26 -0.33 0.00 -0.03 0.00 0.00 56.01 56.03 1fbx n LEU 78 Cb 0.06 -0.38 -0.14 0.00 -2.33 0.00 0.00 43.42 40.62 1fbx n LEU 78 CO 0.09 0.06 -0.38 -0.62 -1.33 0.00 0.00 177.39 175.21 1fbx s ASP 79 N -3.01 4.72 0.00 -1.43 2.15 -0.93 -4.96 116.67 113.20 1fbx s ASP 79 Ca 0.13 -1.49 0.00 0.00 0.43 0.00 0.00 52.55 51.61 1fbx s ASP 79 Cb 0.18 -1.64 0.00 0.00 -0.30 0.00 0.00 42.92 41.16 1fbx s ASP 79 CO 0.61 -0.27 0.85 -1.22 -0.17 0.00 0.00 175.17 174.98 1fbx n TYR 80 N 4.50 0.00 0.35 -5.34 4.02 -1.26 0.01 117.16 119.43 1fbx n TYR 80 Ca -0.10 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.86 1fbx n TYR 80 Cb 0.42 -0.36 0.32 0.00 -0.02 0.00 0.00 39.34 39.70 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 -1.35 1.48 -0.41 -0.72 0.00 -1.26 -1.81 120.51 116.44 1fbx n ALA 81 Ca 0.00 0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.53 1fbx n ALA 81 Cb 0.06 -1.24 0.23 0.00 0.00 0.00 0.00 19.45 18.50 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 -1.76 3.53 -4.71 0.00 3.02 0.10 -5.01 115.26 110.44 1fbx n ASN 82 Ca 0.02 -2.23 -0.38 0.00 -0.03 0.00 0.00 54.58 51.96 1fbx n ASN 82 Cb 0.14 -0.38 0.05 0.00 -0.61 0.00 0.00 39.78 38.99 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 0.62 1.87 -1.60 3.10 7.35 -0.75 -4.95 117.46 123.10 1fbx n PHE 83 Ca 0.17 0.43 -0.30 0.00 -0.76 0.00 0.00 57.45 57.00 1fbx n PHE 83 Cb 0.60 -2.29 0.09 0.00 0.35 0.00 0.00 39.48 38.24 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 -2.96 2.07 -0.18 -7.13 0.04 -1.26 -5.00 135.00 120.58 1fbx s PRO 84 Ca 0.75 0.57 -0.24 0.00 0.04 0.00 0.00 61.00 62.12 1fbx s PRO 84 Cb -0.41 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.19 1fbx s PRO 84 CO 0.46 -1.61 0.79 0.15 0.04 0.00 0.00 177.00 176.83 1fbx s LYS 85 N -5.20 4.27 -0.11 4.56 1.02 -1.26 -4.91 119.74 118.11 1fbx s LYS 85 Ca 0.61 0.92 -0.16 0.00 0.02 0.00 0.00 55.97 57.36 1fbx s LYS 85 Cb -0.14 -3.58 -0.05 0.00 -0.52 0.00 0.00 37.83 33.55 1fbx s LYS 85 CO 0.54 -0.32 0.42 0.42 -0.92 0.00 0.00 175.35 175.49 1fbx s ILE 86 N 2.13 5.19 -0.07 2.17 -1.09 -1.26 -4.99 121.20 123.28 1fbx s ILE 86 Ca 0.36 0.83 0.04 0.00 -2.23 0.00 0.00 60.65 59.65 1fbx s ILE 86 Cb -0.16 -3.75 0.00 0.00 -1.58 0.00 0.00 42.46 36.97 1fbx s ILE 86 CO 0.12 0.39 -0.19 0.42 -1.23 0.00 0.00 174.94 174.44 1fbx s THR 87 N 0.28 1.62 -0.06 2.92 -4.23 -1.26 -5.11 115.64 109.79 1fbx s THR 87 Ca 0.23 -0.79 0.00 0.00 -1.18 0.00 0.00 61.69 59.96 1fbx s THR 87 Cb -0.15 -1.40 0.02 0.00 1.34 0.00 0.00 72.50 72.31 1fbx s THR 87 CO 0.09 0.46 -0.05 -0.76 -0.54 0.00 0.00 174.62 173.82 1fbx s LEU 88 N 0.27 1.19 0.36 4.79 1.43 -1.26 -2.31 118.68 123.15 1fbx s LEU 88 Ca -0.11 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1fbx s LEU 88 Cb -0.15 -0.55 -0.02 0.00 0.03 0.00 0.00 46.19 45.50 1fbx s LEU 88 CO 0.05 -0.08 0.55 0.27 0.23 0.00 0.00 176.35 177.36 1fbx s ILE 89 N 1.21 4.60 0.33 -0.59 -4.36 0.58 -4.85 121.20 118.13 1fbx s ILE 89 Ca -0.06 -0.65 -0.26 0.00 -0.26 0.00 0.00 60.65 59.42 1fbx s ILE 89 Cb -0.14 -3.66 -0.10 0.00 1.25 0.00 0.00 42.46 39.81 1fbx s ILE 89 CO -0.02 -0.38 0.98 -0.70 0.24 0.00 0.00 174.94 175.06 1fbx s GLU 90 N -4.32 4.51 0.00 0.37 2.12 -1.26 -0.06 118.70 120.06 1fbx s GLU 90 Ca 0.43 1.40 -0.02 0.00 0.36 0.00 0.00 54.97 57.13 1fbx s GLU 90 Cb -0.10 -2.78 -0.10 0.00 0.26 0.00 0.00 34.13 31.41 1fbx s GLU 90 CO 0.35 0.20 1.91 -1.71 -0.54 0.00 0.00 175.26 175.46 1fbx n ASN 91 N 0.49 3.04 -0.04 -1.70 2.85 0.35 -4.53 115.26 115.73 1fbx n ASN 91 Ca 0.02 -1.98 0.13 0.00 -0.11 0.00 0.00 54.58 52.64 1fbx n ASN 91 Cb 0.50 -0.76 0.54 0.00 1.24 0.00 0.00 39.78 41.29 1fbx n ASN 91 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1fbx h LYS 92 N 3.59 0.31 0.00 1.20 1.57 -1.92 0.22 116.57 121.53 1fbx h LYS 92 Ca 0.07 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1fbx h LYS 92 Cb 0.77 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1fbx h LYS 92 CO 0.23 0.20 0.00 -1.33 -0.57 0.00 0.00 179.45 177.98 1fbx n MET 93 N -4.46 0.60 -4.03 3.15 2.81 -1.26 -4.88 117.12 109.05 1fbx n MET 93 Ca 0.09 0.00 -0.27 0.00 -1.81 0.00 0.00 57.70 55.71 1fbx n MET 93 Cb 0.38 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.38 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 -0.98 -2.98 -2.34 0.03 5.02 0.76 -4.88 118.16 112.79 1fbx n LYS 94 Ca 0.14 0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 56.37 1fbx n LYS 94 Cb 0.06 -4.47 -0.03 0.00 -0.02 0.00 0.00 35.03 30.57 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 -3.94 4.00 -0.07 -0.18 1.01 -1.26 -4.90 120.40 115.05 1fbx s VAL 95 Ca 0.09 1.34 0.11 0.00 0.00 0.00 0.00 61.98 63.51 1fbx s VAL 95 Cb -0.05 -3.86 0.17 0.00 0.00 0.00 0.00 36.38 32.64 1fbx s VAL 95 CO 0.91 -0.02 1.06 -0.90 0.00 0.00 0.00 175.10 176.15 1fbx n ASP 96 N 5.49 1.75 -4.38 3.32 5.75 -1.26 -4.43 116.55 122.79 1fbx n ASP 96 Ca 0.12 -2.57 -0.28 0.00 -0.01 0.00 0.00 54.79 52.06 1fbx n ASP 96 Cb 0.45 -0.28 -0.13 0.00 -1.03 0.00 0.00 41.12 40.13 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 -1.85 1.39 0.34 0.11 0.41 -1.26 -4.98 118.70 112.86 1fbx s GLU 97 Ca 0.18 -1.38 -0.29 0.00 -0.41 0.00 0.00 54.97 53.08 1fbx s GLU 97 Cb 0.16 -1.80 -0.12 0.00 -1.78 0.00 0.00 34.13 30.59 1fbx s GLU 97 CO 0.02 0.42 1.44 0.00 -0.49 0.00 0.00 175.26 176.65 1fbx n MET 98 N 0.74 2.45 -3.93 1.61 0.00 -1.26 -4.57 117.12 112.16 1fbx n MET 98 Ca -0.17 0.86 -0.35 0.00 0.00 0.00 0.00 57.70 58.05 1fbx n MET 98 Cb 0.54 -2.55 -0.10 0.00 0.00 0.00 0.00 33.22 31.10 1fbx n MET 98 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1fbx s VAL 99 N -0.77 4.73 -0.11 3.17 1.01 -0.07 -4.93 120.40 123.43 1fbx s VAL 99 Ca 0.58 -0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.53 1fbx s VAL 99 Cb -0.52 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 1fbx s VAL 99 CO 0.59 0.42 -0.18 -0.89 0.00 0.00 0.00 175.10 175.04 1fbx s THR 100 N 0.71 2.64 -0.27 3.92 2.01 -1.26 -1.86 115.64 121.53 1fbx s THR 100 Ca 0.04 -0.82 -0.01 0.00 0.31 0.00 0.00 61.69 61.21 1fbx s THR 100 Cb -0.13 -2.06 0.04 0.00 0.01 0.00 0.00 72.50 70.35 1fbx s THR 100 CO 0.02 0.54 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.76 1fbx s VAL 101 N 0.25 2.86 0.13 3.82 1.01 0.13 -5.01 120.40 123.60 1fbx s VAL 101 Ca -0.12 -1.22 0.06 0.00 0.00 0.00 0.00 61.98 60.71 1fbx s VAL 101 Cb -0.16 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 1fbx s VAL 101 CO 0.06 0.06 -0.01 0.00 0.00 0.00 0.00 175.10 175.22 1fbx s ARG 102 N 1.28 2.44 -1.27 2.72 1.70 -1.26 -0.98 118.95 123.57 1fbx s ARG 102 Ca -0.03 -0.98 -0.05 0.00 -0.47 0.00 0.00 55.73 54.20 1fbx s ARG 102 Cb -0.18 -2.43 0.01 0.00 -0.57 0.00 0.00 34.95 31.77 1fbx s ARG 102 CO -0.03 0.50 1.09 -0.25 -1.08 0.00 0.00 175.30 175.52 1fbx n ASP 103 N 0.25 -4.36 -4.70 -2.89 8.00 -0.91 -4.94 116.55 107.00 1fbx n ASP 103 Ca -0.11 -0.57 -0.42 0.00 0.71 0.00 0.00 54.79 54.40 1fbx n ASP 103 Cb 0.53 -5.02 -0.03 0.00 -0.02 0.00 0.00 41.12 36.59 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 -3.33 4.11 0.20 0.53 1.01 0.82 -4.78 121.20 119.76 1fbx s ILE 104 Ca 0.31 1.49 -0.31 0.00 0.00 0.00 0.00 60.65 62.14 1fbx s ILE 104 Cb -0.14 -3.96 -0.11 0.00 0.01 0.00 0.00 42.46 38.27 1fbx s ILE 104 CO 0.72 0.07 1.59 -0.89 0.00 0.00 0.00 174.94 176.44 1fbx s THR 105 N 1.48 2.41 -0.03 2.92 2.01 -1.26 -0.36 115.64 122.81 1fbx s THR 105 Ca 0.58 0.31 -0.01 0.00 0.31 0.00 0.00 61.69 62.88 1fbx s THR 105 Cb -0.28 -3.20 0.03 0.00 0.01 0.00 0.00 72.50 69.06 1fbx s THR 105 CO 0.27 0.03 0.04 -0.22 -0.69 0.00 0.00 174.62 174.05 1fbx s LEU 106 N 0.77 0.59 -0.07 4.42 0.20 -0.79 -4.82 118.68 118.99 1fbx s LEU 106 Ca 0.69 0.06 0.00 0.00 0.69 0.00 0.00 54.13 55.57 1fbx s LEU 106 Cb -0.45 -0.11 0.02 0.00 -0.43 0.00 0.00 46.19 45.22 1fbx s LEU 106 CO 0.35 -0.19 -0.04 0.42 -0.29 0.00 0.00 176.35 176.60 1fbx s THR 107 N 1.64 0.61 0.00 3.68 -4.23 -1.26 -0.19 115.64 115.90 1fbx s THR 107 Ca -0.02 -0.10 0.00 0.00 -1.18 0.00 0.00 61.69 60.39 1fbx s THR 107 Cb -0.12 -0.67 0.00 0.00 1.34 0.00 0.00 72.50 73.04 1fbx s THR 107 CO -0.03 0.27 0.00 -0.24 -0.54 0.00 0.00 174.62 174.08 1fbx n SER 108 N 4.54 0.53 -3.74 3.99 2.88 0.75 -4.56 113.62 118.01 1fbx n SER 108 Ca -0.17 -0.11 -0.13 0.00 -1.33 0.00 0.00 58.87 57.13 1fbx n SER 108 Cb 0.50 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.83 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 -0.61 -0.04 0.01 2.46 2.01 -1.26 -1.16 115.64 117.05 1fbx s THR 109 Ca 0.00 0.13 -0.30 0.00 0.31 0.00 0.00 61.69 61.83 1fbx s THR 109 Cb 0.00 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 72.10 1fbx s THR 109 CO 0.00 0.05 1.29 0.00 -0.69 0.00 0.00 174.62 175.27 1fbx n GLU 111 N 4.83 0.11 0.08 0.00 0.28 -0.02 0.74 120.64 126.67 1fbx n GLU 111 Ca 0.11 0.56 -0.11 0.00 -0.16 0.00 0.00 57.16 57.57 1fbx n GLU 111 Cb 0.45 -1.83 -0.13 0.00 1.43 0.00 0.00 31.44 31.36 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 0.22 0.00 -1.84 3.86 -1.88 -3.39 115.15 112.11 1fbx h HIS 112 Ca 0.00 -0.16 0.00 0.00 -1.16 0.00 0.00 60.37 59.05 1fbx h HIS 112 Cb 0.06 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.52 1fbx h HIS 112 CO 0.00 1.13 0.00 0.72 0.86 0.00 0.00 177.93 180.64 1fbx n HIS 113 N -3.42 0.00 -3.12 2.45 8.25 -1.06 -5.01 115.22 113.31 1fbx n HIS 113 Ca -0.04 -0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.21 1fbx n HIS 113 Cb 0.98 -0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.13 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 -2.06 -4.15 4.41 3.01 0.23 -4.98 117.46 113.91 1fbx n PHE 114 Ca 0.00 0.62 -0.27 0.00 1.01 0.00 0.00 57.45 58.81 1fbx n PHE 114 Cb 0.28 -4.36 -0.07 0.00 -0.01 0.00 0.00 39.48 35.32 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 -3.18 4.00 0.24 -4.37 1.01 -1.24 -4.82 120.40 112.04 1fbx s VAL 115 Ca 0.36 -1.23 -0.31 0.00 0.00 0.00 0.00 61.98 60.80 1fbx s VAL 115 Cb -0.16 -3.00 -0.13 0.00 0.00 0.00 0.00 36.38 33.10 1fbx s VAL 115 CO 0.44 -0.06 1.46 0.41 0.00 0.00 0.00 175.10 177.35 1fbx n THR 116 N -0.02 0.86 -4.08 3.92 -1.04 -1.26 -0.52 114.28 112.13 1fbx n THR 116 Ca -0.10 -0.21 -0.32 0.00 -2.04 0.00 0.00 64.05 61.38 1fbx n THR 116 Cb 0.54 -1.56 -0.15 0.00 -1.82 0.00 0.00 70.33 67.34 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 0.06 2.16 -0.24 12.58 1.01 -0.31 -2.30 121.20 134.16 1fbx s ILE 117 Ca 0.69 -1.38 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 1fbx s ILE 117 Cb -0.63 -2.15 0.01 0.00 0.01 0.00 0.00 42.46 39.71 1fbx s ILE 117 CO 0.48 0.17 -0.04 -0.62 0.00 0.00 0.00 174.94 174.93 1fbx s ASP 118 N 1.17 4.34 0.02 3.58 2.15 -0.53 -0.18 116.67 127.23 1fbx s ASP 118 Ca -0.04 -0.67 -0.00 0.00 0.43 0.00 0.00 52.55 52.27 1fbx s ASP 118 Cb -0.17 -1.71 0.00 0.00 -0.30 0.00 0.00 42.92 40.74 1fbx s ASP 118 CO -0.08 -0.09 0.03 0.61 -0.17 0.00 0.00 175.17 175.48 1fbx n GLY 119 N 4.74 3.11 3.06 2.66 0.00 0.73 -0.41 105.19 119.07 1fbx n GLY 119 Ca -0.17 -1.41 -0.19 0.00 0.00 0.00 0.00 46.02 44.25 1fbx n GLY 119 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fbx s LYS 120 N -2.06 0.82 0.08 1.61 2.47 0.43 -1.88 119.74 121.21 1fbx s LYS 120 Ca 0.02 -0.44 0.10 0.00 -1.56 0.00 0.00 55.97 54.09 1fbx s LYS 120 Cb -0.00 -0.78 -0.03 0.00 -1.46 0.00 0.00 37.83 35.55 1fbx s LYS 120 CO 0.01 0.21 -0.26 0.00 0.16 0.00 0.00 175.35 175.48 1fbx s ALA 121 N -0.38 2.23 -0.11 3.13 0.00 0.51 -0.11 121.76 127.04 1fbx s ALA 121 Ca 0.03 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 50.67 1fbx s ALA 121 Cb -0.05 -0.42 0.02 0.00 0.00 0.00 0.00 23.12 22.67 1fbx s ALA 121 CO -0.00 0.52 -0.10 0.99 0.00 0.00 0.00 175.76 177.17 1fbx s THR 122 N -0.91 1.14 -0.03 0.00 2.01 0.25 -0.12 115.64 117.99 1fbx s THR 122 Ca 0.12 -0.39 0.06 0.00 0.31 0.00 0.00 61.69 61.78 1fbx s THR 122 Cb -0.10 -1.12 -0.01 0.00 0.01 0.00 0.00 72.50 71.28 1fbx s THR 122 CO 0.03 0.38 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.46 1fbx s VAL 123 N 1.42 1.58 0.01 3.82 1.01 -0.15 0.87 120.40 128.96 1fbx s VAL 123 Ca 0.00 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 1fbx s VAL 123 Cb -0.13 -1.33 0.00 0.00 0.00 0.00 0.00 36.38 34.92 1fbx s VAL 123 CO -0.06 0.45 0.15 0.00 0.00 0.00 0.00 175.10 175.65 1fbx s ALA 124 N -0.30 -0.35 0.01 5.51 0.00 -0.29 0.18 121.76 126.52 1fbx s ALA 124 Ca 0.03 -0.14 -0.23 0.00 0.00 0.00 0.00 51.96 51.63 1fbx s ALA 124 Cb -0.09 0.14 0.05 0.00 0.00 0.00 0.00 23.12 23.21 1fbx s ALA 124 CO 0.00 -0.24 0.51 1.52 0.00 0.00 0.00 175.76 177.56 1fbx s TYR 125 N -1.59 -0.42 -0.40 0.00 1.13 -0.78 -0.85 117.35 114.45 1fbx s TYR 125 Ca -0.13 0.57 -0.14 0.00 -1.41 0.00 0.00 57.07 55.96 1fbx s TYR 125 Cb -0.06 0.30 0.02 0.00 -1.10 0.00 0.00 41.96 41.12 1fbx s TYR 125 CO 0.01 -0.58 0.27 0.42 -2.51 0.00 0.00 175.55 173.16 1fbx s ILE 126 N -1.95 5.06 0.36 -3.49 1.01 -0.92 -0.89 121.20 120.38 1fbx s ILE 126 Ca -0.08 -0.72 -0.26 0.00 0.00 0.00 0.00 60.65 59.58 1fbx s ILE 126 Cb -0.01 -3.82 -0.12 0.00 0.01 0.00 0.00 42.46 38.51 1fbx s ILE 126 CO 0.02 -0.29 1.02 -2.65 0.00 0.00 0.00 174.94 173.04 1fbx n PRO 127 N 5.11 1.42 0.00 2.79 -0.02 -1.26 -4.86 135.00 138.18 1fbx n PRO 127 Ca -0.11 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1fbx n PRO 127 Cb 0.47 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 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 0.43 0.00 -0.06 -0.52 4.81 -1.26 -4.78 118.16 116.77 1fbx n LYS 128 Ca 0.09 0.00 -0.16 0.00 -0.87 0.00 0.00 58.31 57.37 1fbx n LYS 128 Cb 0.36 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 35.27 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 -0.01 1.53 -4.70 3.14 8.00 -1.26 -4.83 116.55 118.43 1fbx n ASP 129 Ca 0.00 0.09 -0.27 0.00 0.71 0.00 0.00 54.79 55.32 1fbx n ASP 129 Cb 0.00 -0.28 -0.07 0.00 -0.02 0.00 0.00 41.12 40.75 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 -6.46 4.97 -0.25 -2.24 1.04 -1.26 0.13 113.70 109.62 1fbx s SER 130 Ca -0.22 -0.31 0.02 0.00 0.48 0.00 0.00 55.95 55.92 1fbx s SER 130 Cb 0.08 -1.13 0.06 0.00 0.10 0.00 0.00 66.02 65.13 1fbx s SER 130 CO 0.73 0.09 -0.07 -0.69 0.98 0.00 0.00 173.24 174.29 1fbx s VAL 131 N -1.69 1.80 0.51 5.02 1.01 0.91 -4.75 120.40 123.21 1fbx s VAL 131 Ca 0.28 -1.44 -0.20 0.00 0.00 0.00 0.00 61.98 60.62 1fbx s VAL 131 Cb -0.10 -2.02 -0.07 0.00 0.00 0.00 0.00 36.38 34.19 1fbx s VAL 131 CO 0.20 -0.11 1.08 -0.51 0.00 0.00 0.00 175.10 175.76 1fbx s ILE 132 N 1.26 3.49 0.45 2.22 2.07 -1.26 -0.31 121.20 129.11 1fbx s ILE 132 Ca -0.06 0.93 -0.25 0.00 -1.41 0.00 0.00 60.65 59.86 1fbx s ILE 132 Cb -0.19 -3.38 -0.08 0.00 0.13 0.00 0.00 42.46 38.94 1fbx s ILE 132 CO -0.06 -0.20 1.31 -0.83 -1.91 0.00 0.00 174.94 173.26 1fbx s GLY 133 N -1.87 2.90 0.08 1.50 0.00 -0.98 -4.89 107.32 104.06 1fbx s GLY 133 Ca 0.70 1.25 -0.33 0.00 0.00 0.00 0.00 44.72 46.34 1fbx s GLY 133 CO 0.23 1.81 1.60 1.41 0.00 0.00 0.00 173.10 178.15 1fbx h LEU 134 N 2.31 -1.00 -1.86 0.66 3.38 -1.94 -2.93 115.31 113.94 1fbx h LEU 134 Ca -0.50 0.07 0.33 0.00 0.09 0.00 0.00 57.88 57.87 1fbx h LEU 134 Cb 1.26 0.31 -0.06 0.00 0.09 0.00 0.00 40.66 42.26 1fbx h LEU 134 CO 0.61 -0.57 0.81 0.77 0.09 0.00 0.00 178.44 180.15 1fbx h SER 135 N -0.88 0.10 -0.83 -0.43 4.64 -2.01 0.36 113.55 114.49 1fbx h SER 135 Ca -0.06 0.02 0.08 0.00 -0.47 0.00 0.00 61.79 61.37 1fbx h SER 135 Cb 0.74 0.01 -0.07 0.00 -0.31 0.00 0.00 62.40 62.77 1fbx h SER 135 CO 0.02 0.01 0.49 0.11 -0.87 0.00 0.00 176.83 176.59 1fbx h LYS 136 N 0.08 0.82 -0.12 4.77 1.79 -1.90 0.18 116.57 122.19 1fbx h LYS 136 Ca 0.57 -0.05 0.03 0.00 -2.18 0.00 0.00 60.65 59.02 1fbx h LYS 136 Cb 2.11 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 32.54 1fbx h LYS 136 CO -0.08 0.54 -0.05 0.82 -1.08 0.00 0.00 179.45 179.61 1fbx h ILE 137 N 0.85 0.83 -0.44 1.86 2.04 -1.05 0.68 117.51 122.28 1fbx h ILE 137 Ca 0.39 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.34 1fbx h ILE 137 Cb 0.30 0.83 -0.08 0.00 -0.74 0.00 0.00 36.82 37.14 1fbx h ILE 137 CO -0.22 0.00 -0.10 0.78 0.00 0.00 0.00 178.15 178.60 1fbx h ASN 138 N -0.03 -0.39 0.26 1.72 2.35 -1.37 -0.95 115.58 117.16 1fbx h ASN 138 Ca 0.06 0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.93 1fbx h ASN 138 Cb 0.13 0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1fbx h ASN 138 CO -0.14 -0.14 -0.14 0.03 -1.65 0.00 0.00 177.43 175.39 1fbx h ARG 139 N 0.01 -0.35 -0.86 0.81 3.08 0.35 0.10 114.38 117.52 1fbx h ARG 139 Ca 0.21 0.02 0.14 0.00 0.07 0.00 0.00 59.98 60.43 1fbx h ARG 139 Cb 0.32 0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.38 1fbx h ARG 139 CO -0.44 -0.23 0.56 0.82 -1.07 0.00 0.00 179.97 179.60 1fbx h ILE 140 N -0.36 0.83 -0.24 2.04 2.04 0.67 -0.45 117.51 122.03 1fbx h ILE 140 Ca -0.03 -0.22 -0.17 0.00 1.00 0.00 0.00 64.86 65.45 1fbx h ILE 140 Cb 0.29 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1fbx h ILE 140 CO 0.05 0.12 -0.52 0.58 0.00 0.00 0.00 178.15 178.38 1fbx h VAL 141 N 0.63 1.30 0.00 1.67 2.07 -0.58 -2.90 116.25 118.45 1fbx h VAL 141 Ca 0.43 -1.73 -0.07 0.00 0.82 0.00 0.00 66.70 66.15 1fbx h VAL 141 Cb 0.73 1.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.15 1fbx h VAL 141 CO -0.18 0.55 -0.31 1.56 0.02 0.00 0.00 177.57 179.20 1fbx h GLN 142 N 0.54 0.00 0.70 1.57 1.08 0.49 -2.69 115.11 116.80 1fbx h GLN 142 Ca 0.02 0.00 -0.03 0.00 -1.45 0.00 0.00 58.65 57.18 1fbx h GLN 142 Cb 1.08 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.52 1fbx h GLN 142 CO 0.11 0.31 -0.34 0.35 -0.95 0.00 0.00 178.83 178.31 1fbx h PHE 143 N 0.00 -0.87 0.00 2.96 3.57 -0.96 -2.27 116.94 119.37 1fbx h PHE 143 Ca -0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1fbx h PHE 143 Cb 0.83 0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.86 1fbx h PHE 143 CO 0.00 -0.53 0.00 1.19 -2.23 0.00 0.00 178.31 176.74 1fbx n PHE 144 N -5.41 0.00 0.03 0.41 3.72 -1.12 -2.06 117.46 113.04 1fbx n PHE 144 Ca -0.12 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.18 1fbx n PHE 144 Cb 0.38 -0.47 -0.13 0.00 -0.94 0.00 0.00 39.48 38.31 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 2.37 0.50 0.00 4.37 0.00 -1.28 -3.38 119.26 121.83 1fbx h ALA 145 Ca 0.00 -1.17 -0.67 0.00 0.00 0.00 0.00 54.91 53.06 1fbx h ALA 145 Cb 0.16 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1fbx h ALA 145 CO 0.00 1.36 3.43 1.04 0.00 0.00 0.00 179.25 185.08 1fbx n GLN 146 N -3.26 3.17 -3.51 0.00 1.13 -0.87 -4.27 117.38 109.77 1fbx n GLN 146 Ca -0.10 -2.33 -0.13 0.00 -1.94 0.00 0.00 57.00 52.50 1fbx n GLN 146 Cb 1.01 -3.00 -0.04 0.00 0.11 0.00 0.00 30.24 28.31 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 2.79 0.94 -0.21 -1.09 0.52 -1.07 -1.29 118.95 119.54 1fbx s ARG 147 Ca 0.58 -0.01 -0.28 0.00 -0.52 0.00 0.00 55.73 55.49 1fbx s ARG 147 Cb 0.16 0.44 -0.04 0.00 0.52 0.00 0.00 34.95 36.02 1fbx s ARG 147 CO -0.06 -0.34 2.02 -2.14 0.02 0.00 0.00 175.30 174.79 1fbx s PRO 148 N -2.03 3.39 0.37 3.54 0.02 -1.26 -4.13 135.00 134.90 1fbx s PRO 148 Ca -0.03 1.93 0.08 0.00 0.02 0.00 0.00 61.00 63.00 1fbx s PRO 148 Cb -0.00 -4.27 -0.06 0.00 0.02 0.00 0.00 34.50 30.19 1fbx s PRO 148 CO -0.00 -1.80 0.06 -0.65 -0.33 0.00 0.00 177.00 174.28 1fbx s GLN 149 N 5.74 2.11 -0.09 5.54 -1.52 0.22 -4.60 119.66 127.06 1fbx s GLN 149 Ca 0.91 -1.80 0.01 0.00 -1.95 0.00 0.00 55.36 52.52 1fbx s GLN 149 Cb -0.31 -1.92 0.02 0.00 -0.22 0.00 0.00 33.01 30.58 1fbx s GLN 149 CO 0.35 0.05 -0.08 0.54 -0.25 0.00 0.00 175.29 175.90 1fbx s VAL 150 N -2.56 0.97 0.28 1.09 0.11 -1.26 -0.84 120.40 118.19 1fbx s VAL 150 Ca 0.36 -0.31 0.01 0.00 -2.93 0.00 0.00 61.98 59.12 1fbx s VAL 150 Cb 0.02 -0.96 0.27 0.00 -1.53 0.00 0.00 36.38 34.18 1fbx s VAL 150 CO 0.20 0.34 1.71 -0.61 -3.33 0.00 0.00 175.10 173.41 1fbx h GLN 151 N 7.68 0.42 -1.01 1.54 4.15 -1.99 0.04 115.11 125.94 1fbx h GLN 151 Ca -0.30 -0.03 0.13 0.00 0.77 0.00 0.00 58.65 59.22 1fbx h GLN 151 Cb 1.15 -0.10 -0.09 0.00 0.21 0.00 0.00 27.48 28.66 1fbx h GLN 151 CO 0.43 0.28 0.63 0.93 -1.93 0.00 0.00 178.83 179.17 1fbx h GLU 152 N 0.44 0.94 0.16 1.69 3.07 -2.00 -2.26 114.58 116.62 1fbx h GLU 152 Ca 0.51 -0.06 -0.23 0.00 -0.50 0.00 0.00 59.36 59.08 1fbx h GLU 152 Cb 0.90 -0.21 0.03 0.00 -0.84 0.00 0.00 28.75 28.63 1fbx h GLU 152 CO -0.48 0.62 -1.01 -0.09 -1.40 0.00 0.00 179.01 176.65 1fbx h ARG 153 N 0.97 0.41 -1.00 2.33 2.43 -1.47 -3.23 114.38 114.82 1fbx h ARG 153 Ca 0.51 -0.65 0.20 0.00 -0.81 0.00 0.00 59.98 59.23 1fbx h ARG 153 Cb 0.54 0.23 -0.11 0.00 -0.42 0.00 0.00 29.97 30.22 1fbx h ARG 153 CO -0.28 1.30 0.61 1.25 -1.51 0.00 0.00 179.97 181.34 1fbx h LEU 154 N -0.15 0.74 0.10 3.80 5.85 -0.88 -1.52 115.31 123.26 1fbx h LEU 154 Ca -0.17 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1fbx h LEU 154 Cb 1.77 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.77 1fbx h LEU 154 CO 0.19 0.25 -0.05 0.74 -0.34 0.00 0.00 178.44 179.23 1fbx h THR 155 N 0.71 1.05 -0.93 1.05 2.02 -1.50 -2.64 112.91 112.68 1fbx h THR 155 Ca 0.58 -0.62 0.07 0.00 0.77 0.00 0.00 66.41 67.22 1fbx h THR 155 Cb 0.97 1.45 -0.06 0.00 -1.74 0.00 0.00 68.15 68.76 1fbx h THR 155 CO -0.37 0.15 0.60 1.56 0.37 0.00 0.00 175.52 177.83 1fbx h GLN 156 N -0.43 0.99 0.23 6.66 1.08 -1.36 -2.34 115.11 119.95 1fbx h GLN 156 Ca -0.01 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.11 1fbx h GLN 156 Cb 0.35 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1fbx h GLN 156 CO 0.02 0.66 -0.11 1.96 -0.95 0.00 0.00 178.83 180.41 1fbx h GLN 157 N 1.02 -0.30 -0.91 1.46 4.20 -1.25 -2.05 115.11 117.29 1fbx h GLN 157 Ca 0.41 0.02 0.20 0.00 0.06 0.00 0.00 58.65 59.34 1fbx h GLN 157 Cb 0.25 0.07 -0.11 0.00 0.30 0.00 0.00 27.48 27.99 1fbx h GLN 157 CO -0.16 -0.02 0.46 0.82 -0.67 0.00 0.00 178.83 179.25 1fbx h ILE 158 N -0.57 0.58 0.01 2.54 2.04 -1.25 0.25 117.51 121.11 1fbx h ILE 158 Ca -0.03 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1fbx h ILE 158 Cb 0.42 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1fbx h ILE 158 CO 0.05 0.10 -0.01 0.25 0.00 0.00 0.00 178.15 178.54 1fbx h LEU 159 N 0.53 -0.02 -0.66 1.44 5.85 -1.11 -0.92 115.31 120.41 1fbx h LEU 159 Ca 0.55 0.00 0.13 0.00 0.84 0.00 0.00 57.88 59.40 1fbx h LEU 159 Cb 0.96 0.01 -0.13 0.00 0.37 0.00 0.00 40.66 41.87 1fbx h LEU 159 CO -0.46 -0.01 -0.24 0.40 -0.34 0.00 0.00 178.44 177.79 1fbx h ILE 160 N -0.02 0.24 -0.84 4.05 1.08 -0.93 0.27 117.51 121.37 1fbx h ILE 160 Ca -0.00 0.00 0.19 0.00 -0.39 0.00 0.00 64.86 64.66 1fbx h ILE 160 Cb 0.02 0.24 -0.12 0.00 -3.07 0.00 0.00 36.82 33.89 1fbx h ILE 160 CO -0.00 0.00 0.32 0.00 -0.69 0.00 0.00 178.15 177.78 1fbx h ALA 161 N 1.42 1.25 0.06 1.87 0.00 -0.40 0.74 119.26 124.20 1fbx h ALA 161 Ca 0.30 0.16 -0.25 0.00 0.00 0.00 0.00 54.91 55.12 1fbx h ALA 161 Cb 0.53 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1fbx h ALA 161 CO -0.71 -0.31 -1.08 -0.07 0.00 0.00 0.00 179.25 177.08 1fbx h LEU 162 N 0.38 0.47 0.00 0.00 3.38 0.84 -2.76 115.31 117.63 1fbx h LEU 162 Ca 0.50 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 1fbx h LEU 162 Cb 0.90 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1fbx h LEU 162 CO -0.51 1.27 -0.00 1.56 0.09 0.00 0.00 178.44 180.86 1fbx h GLN 163 N 0.15 -0.01 -0.42 1.13 4.20 0.52 -2.40 115.11 118.28 1fbx h GLN 163 Ca -0.10 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.66 1fbx h GLN 163 Cb 1.76 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 29.49 1fbx h GLN 163 CO 0.18 0.19 0.16 1.15 -0.67 0.00 0.00 178.83 179.84 1fbx h THR 164 N -0.20 0.88 0.00 -0.54 2.02 -0.99 -1.14 112.91 112.95 1fbx h THR 164 Ca -0.00 -0.11 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 1fbx h THR 164 Cb 0.20 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1fbx h THR 164 CO 0.00 0.06 -0.23 -0.07 0.37 0.00 0.00 175.52 175.65 1fbx h LEU 165 N 0.33 0.00 -0.09 2.58 3.38 -1.45 -3.26 115.31 116.80 1fbx h LEU 165 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1fbx h LEU 165 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1fbx h LEU 165 CO -0.19 0.23 -0.83 0.18 0.09 0.00 0.00 178.44 177.92 1fbx n LEU 166 N -3.37 0.97 -2.65 1.67 4.77 -0.91 -5.00 117.00 112.47 1fbx n LEU 166 Ca 0.00 -0.52 -0.15 0.00 -0.03 0.00 0.00 56.01 55.31 1fbx n LEU 166 Cb 0.44 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.59 1fbx n LEU 166 CO 0.33 0.23 0.14 0.61 -1.33 0.00 0.00 177.39 177.38 1fbx n GLY 167 N 1.42 -0.09 3.45 -0.72 0.00 -0.45 -4.69 105.19 104.12 1fbx n GLY 167 Ca 0.04 -0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.23 0.01 -2.34 2.61 2.01 -1.15 -4.91 115.64 108.65 1fbx s THR 168 Ca 0.29 -0.11 0.26 0.00 0.31 0.00 0.00 61.69 62.44 1fbx s THR 168 Cb -0.13 -0.87 0.33 0.00 0.01 0.00 0.00 72.50 71.84 1fbx s THR 168 CO 0.50 -0.06 1.52 0.59 -0.69 0.00 0.00 174.62 176.48 1fbx n ASN 169 N 1.47 1.74 -3.89 3.53 3.02 -1.26 -4.39 115.26 115.49 1fbx n ASN 169 Ca -0.18 -1.44 -0.42 0.00 -0.03 0.00 0.00 54.58 52.51 1fbx n ASN 169 Cb 0.56 0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.84 1fbx n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1fbx n ASN 170 N 0.16 4.55 -4.16 6.41 3.02 -1.26 -0.47 115.26 123.51 1fbx n ASN 170 Ca 0.15 -2.97 -0.19 0.00 -0.03 0.00 0.00 54.58 51.54 1fbx n ASN 170 Cb 0.42 -1.58 -0.12 0.00 -0.61 0.00 0.00 39.78 37.88 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 1.93 1.10 -0.03 2.41 1.01 -1.25 -2.16 120.40 123.41 1fbx s VAL 171 Ca 0.44 -1.22 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 1fbx s VAL 171 Cb 0.10 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.44 1fbx s VAL 171 CO -0.03 -0.17 0.11 0.00 0.00 0.00 0.00 175.10 175.01 1fbx s ALA 172 N -1.16 -0.26 -0.02 5.51 0.00 -0.03 -0.73 121.76 125.07 1fbx s ALA 172 Ca -0.01 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1fbx s ALA 172 Cb -0.09 -0.09 0.02 0.00 0.00 0.00 0.00 23.12 22.96 1fbx s ALA 172 CO 0.02 -0.10 0.02 0.08 0.00 0.00 0.00 175.76 175.78 1fbx s VAL 173 N -0.43 -0.01 -0.03 0.00 1.01 -0.81 -1.14 120.40 118.98 1fbx s VAL 173 Ca -0.05 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.11 1fbx s VAL 173 Cb -0.03 -0.09 0.01 0.00 0.00 0.00 0.00 36.38 36.26 1fbx s VAL 173 CO 0.00 0.08 -0.09 -0.55 0.00 0.00 0.00 175.10 174.54 1fbx s SER 174 N 0.85 1.27 -0.05 3.32 0.15 0.25 -1.10 113.70 118.39 1fbx s SER 174 Ca -0.07 -0.20 0.04 0.00 0.70 0.00 0.00 55.95 56.42 1fbx s SER 174 Cb -0.10 -0.39 -0.00 0.00 -1.71 0.00 0.00 66.02 63.81 1fbx s SER 174 CO -0.02 0.05 -0.18 -0.63 1.20 0.00 0.00 173.24 173.66 1fbx s ILE 175 N 0.30 1.53 -0.11 6.45 1.01 -0.58 0.87 121.20 130.67 1fbx s ILE 175 Ca -0.05 -0.77 0.02 0.00 0.00 0.00 0.00 60.65 59.85 1fbx s ILE 175 Cb -0.10 -1.31 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1fbx s ILE 175 CO 0.01 0.44 -0.15 -0.62 0.00 0.00 0.00 174.94 174.61 1fbx s ASP 176 N 0.03 2.48 0.18 3.58 2.15 0.84 -1.46 116.67 124.47 1fbx s ASP 176 Ca -0.04 -0.44 -0.20 0.00 0.43 0.00 0.00 52.55 52.29 1fbx s ASP 176 Cb -0.12 -1.11 0.05 0.00 -0.30 0.00 0.00 42.92 41.44 1fbx s ASP 176 CO 0.03 0.01 0.56 0.00 -0.17 0.00 0.00 175.17 175.60 1fbx s ALA 177 N 1.02 -1.29 -0.11 3.66 0.00 -0.75 0.16 121.76 124.46 1fbx s ALA 177 Ca -0.06 0.14 -0.03 0.00 0.00 0.00 0.00 51.96 52.02 1fbx s ALA 177 Cb -0.15 0.84 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 1fbx s ALA 177 CO -0.02 -0.79 -0.02 0.08 0.00 0.00 0.00 175.76 175.01 1fbx s VAL 178 N -3.81 4.13 -0.38 0.00 1.01 0.45 -1.39 120.40 120.43 1fbx s VAL 178 Ca 0.04 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.65 1fbx s VAL 178 Cb -0.01 -2.77 0.06 0.00 0.00 0.00 0.00 36.38 33.66 1fbx s VAL 178 CO -0.08 0.56 0.18 -1.00 0.00 0.00 0.00 175.10 174.75 1fbx s HIS 179 N -0.36 3.30 -0.78 5.22 3.76 -1.26 -1.46 115.29 123.71 1fbx s HIS 179 Ca 0.07 -1.45 0.12 0.00 -0.15 0.00 0.00 55.06 53.65 1fbx s HIS 179 Cb -0.12 -2.59 0.56 0.00 1.11 0.00 0.00 32.58 31.54 1fbx s HIS 179 CO 0.02 -0.77 1.38 0.66 -0.85 0.00 0.00 174.74 175.18 1fbx n TYR 180 N 4.86 0.26 0.92 1.40 4.02 -0.97 -0.32 117.16 127.32 1fbx n TYR 180 Ca -0.11 0.12 0.02 0.00 -0.01 0.00 0.00 57.90 57.92 1fbx n TYR 180 Cb 0.44 -0.69 0.09 0.00 -0.02 0.00 0.00 39.34 39.16 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 0.09 0.00 -0.03 0.00 0.31 0.57 -4.69 118.33 114.58 1fbx n VAL 182 Ca 0.06 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1fbx n VAL 182 Cb 0.34 -0.42 -0.00 0.00 -0.91 0.00 0.00 33.84 32.85 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 -0.02 0.00 5.55 3.64 -1.12 -0.19 116.57 124.42 1fbx h LYS 183 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1fbx h LYS 183 Cb 0.58 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1fbx h LYS 183 CO 0.00 -0.02 0.00 0.00 -2.27 0.00 0.00 179.45 177.16 1fbx n ALA 184 N -2.65 1.92 -3.57 5.00 0.00 0.13 -4.01 120.51 117.34 1fbx n ALA 184 Ca -0.00 -0.08 -0.07 0.00 0.00 0.00 0.00 53.44 53.29 1fbx n ALA 184 Cb 0.01 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 18.16 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 -2.63 0.94 7.69 0.00 3.00 -1.19 -4.97 118.95 121.79 1fbx s ARG 185 Ca 0.15 -0.41 0.00 0.00 -1.00 0.00 0.00 55.73 54.48 1fbx s ARG 185 Cb 0.12 0.39 0.00 0.00 0.00 0.00 0.00 34.95 35.46 1fbx s ARG 185 CO 0.27 -0.42 0.00 0.41 0.00 0.00 0.00 175.30 175.56 1fbx n GLY 186 N -0.31 2.38 0.29 8.12 0.00 -1.26 -3.03 105.19 111.38 1fbx n GLY 186 Ca -0.08 -0.36 0.18 0.00 0.00 0.00 0.00 46.02 45.76 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 0.10 -6.24 -0.61 6.09 -1.89 -3.47 117.51 111.49 1fbx h ILE 187 Ca 0.00 -0.41 -0.44 0.00 -1.37 0.00 0.00 64.86 62.64 1fbx h ILE 187 Cb 0.00 1.36 0.05 0.00 0.47 0.00 0.00 36.82 38.70 1fbx h ILE 187 CO 0.00 0.03 -0.90 0.54 -3.07 0.00 0.00 178.15 174.74 1fbx n ARG 188 N -3.17 -2.48 -2.96 2.19 1.74 -0.88 -4.93 116.66 106.16 1fbx n ARG 188 Ca -0.01 0.49 -0.43 0.00 -0.77 0.00 0.00 57.85 57.13 1fbx n ARG 188 Cb 0.24 -4.49 -0.05 0.00 -1.02 0.00 0.00 32.46 27.14 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 -3.87 6.48 0.00 0.55 -1.08 -0.13 -4.91 116.67 113.71 1fbx s ASP 189 Ca 0.26 0.12 0.29 0.00 -0.52 0.00 0.00 52.55 52.70 1fbx s ASP 189 Cb -0.09 -2.39 1.72 0.00 -1.46 0.00 0.00 42.92 40.70 1fbx s ASP 189 CO 0.85 -0.83 2.08 0.00 0.52 0.00 0.00 175.17 177.79 1fbx n ALA 190 N 6.59 2.57 0.00 3.66 0.00 -1.26 -3.94 120.51 128.13 1fbx n ALA 190 Ca 0.03 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1fbx n ALA 190 Cb 0.48 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 -1.03 0.00 -2.80 0.00 -2.24 -1.26 -5.09 114.28 101.87 1fbx n THR 191 Ca 0.21 -0.10 -0.37 0.00 -2.27 0.00 0.00 64.05 61.52 1fbx n THR 191 Cb 0.11 0.70 -0.06 0.00 -2.10 0.00 0.00 70.33 68.98 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 -0.40 7.35 0.20 3.42 1.04 -1.26 -5.07 113.70 118.97 1fbx s SER 192 Ca 0.00 1.82 0.07 0.00 0.48 0.00 0.00 55.95 58.32 1fbx s SER 192 Cb 0.00 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.50 1fbx s SER 192 CO 0.00 -0.04 -0.12 0.00 0.98 0.00 0.00 173.24 174.06 1fbx s ALA 193 N -1.57 1.88 -0.06 5.32 0.00 -1.26 -4.78 121.76 121.28 1fbx s ALA 193 Ca 0.49 -1.64 0.05 0.00 0.00 0.00 0.00 51.96 50.86 1fbx s ALA 193 Cb -0.19 -0.00 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 1fbx s ALA 193 CO 0.24 -0.00 -0.22 0.99 0.00 0.00 0.00 175.76 176.77 1fbx s THR 194 N -3.09 2.36 -0.10 0.00 2.01 -0.48 -4.96 115.64 111.38 1fbx s THR 194 Ca 0.22 -0.96 0.04 0.00 0.31 0.00 0.00 61.69 61.30 1fbx s THR 194 Cb 0.01 -1.89 0.00 0.00 0.01 0.00 0.00 72.50 70.63 1fbx s THR 194 CO 0.06 0.57 -0.23 -0.89 -0.69 0.00 0.00 174.62 173.43 1fbx s THR 195 N -0.20 1.98 0.08 -0.82 2.01 -1.26 -1.80 115.64 115.63 1fbx s THR 195 Ca -0.02 -0.97 0.07 0.00 0.31 0.00 0.00 61.69 61.08 1fbx s THR 195 Cb -0.13 -1.72 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 1fbx s THR 195 CO 0.03 0.54 -0.19 0.42 -0.69 0.00 0.00 174.62 174.73 1fbx s THR 196 N 0.37 1.56 -0.03 -0.82 -4.23 -0.54 -5.00 115.64 106.95 1fbx s THR 196 Ca -0.19 -1.40 -0.03 0.00 -1.18 0.00 0.00 61.69 58.90 1fbx s THR 196 Cb -0.18 -1.42 0.01 0.00 1.34 0.00 0.00 72.50 72.25 1fbx s THR 196 CO 0.09 -0.03 0.09 0.42 -0.54 0.00 0.00 174.62 174.64 1fbx s THR 197 N -1.08 0.01 -0.13 3.99 -4.23 -1.26 -1.52 115.64 111.41 1fbx s THR 197 Ca 0.05 -0.09 0.02 0.00 -1.18 0.00 0.00 61.69 60.49 1fbx s THR 197 Cb -0.10 -0.16 0.01 0.00 1.34 0.00 0.00 72.50 73.60 1fbx s THR 197 CO 0.03 -0.05 -0.19 -0.44 -0.54 0.00 0.00 174.62 173.43 1fbx s SER 198 N -0.12 2.87 -0.21 3.99 0.01 -0.26 -5.01 113.70 114.97 1fbx s SER 198 Ca -0.02 -0.54 -0.04 0.00 1.31 0.00 0.00 55.95 56.66 1fbx s SER 198 Cb -0.02 -1.32 -0.01 0.00 0.21 0.00 0.00 66.02 64.89 1fbx s SER 198 CO 0.00 0.04 -0.05 -0.76 0.41 0.00 0.00 173.24 172.89 1fbx s LEU 199 N 0.95 2.90 0.10 2.44 1.43 -1.26 -1.93 118.68 123.30 1fbx s LEU 199 Ca -0.05 -0.38 0.05 0.00 -1.03 0.00 0.00 54.13 52.72 1fbx s LEU 199 Cb -0.15 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1fbx s LEU 199 CO -0.03 -0.01 -0.02 -0.83 0.23 0.00 0.00 176.35 175.69 1fbx s GLY 200 N 1.39 1.89 0.00 -3.19 0.00 0.09 -4.48 107.32 103.02 1fbx s GLY 200 Ca 0.05 -1.15 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1fbx s GLY 200 CO -0.03 -1.13 0.00 0.61 0.00 0.00 0.00 173.10 172.55 1fbx n GLY 201 N 0.58 2.95 0.37 0.20 0.00 0.38 -1.21 105.19 108.46 1fbx n GLY 201 Ca -0.11 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.10 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 0.66 -0.56 0.99 3.38 -1.94 0.61 115.31 118.45 1fbx h LEU 202 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1fbx h LEU 202 Cb 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1fbx h LEU 202 CO 0.00 0.31 0.00 0.49 0.09 0.00 0.00 178.44 179.33 1fbx n PHE 203 N -4.59 0.34 -0.02 1.13 3.72 -0.35 -0.47 117.46 117.22 1fbx n PHE 203 Ca 0.19 0.16 -0.02 0.00 -0.05 0.00 0.00 57.45 57.74 1fbx n PHE 203 Cb 0.51 -0.76 -0.05 0.00 -0.94 0.00 0.00 39.48 38.23 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 -1.84 2.36 -0.11 -1.08 4.81 0.15 -4.27 118.16 118.18 1fbx n LYS 204 Ca 0.00 -0.02 -0.19 0.00 -0.87 0.00 0.00 58.31 57.24 1fbx n LYS 204 Cb 0.06 -1.16 -0.12 0.00 0.02 0.00 0.00 35.03 33.84 1fbx n LYS 204 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1fbx n SER 205 N -2.11 2.00 -4.53 3.14 3.41 -0.87 -4.84 113.62 109.82 1fbx n SER 205 Ca -0.08 -0.07 -0.42 0.00 -0.26 0.00 0.00 58.87 58.04 1fbx n SER 205 Cb 0.57 -0.49 -0.03 0.00 -0.26 0.00 0.00 64.21 64.00 1fbx n SER 205 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1fbx s SER 206 N -6.63 6.26 0.46 4.04 0.15 0.38 -4.87 113.70 113.50 1fbx s SER 206 Ca -0.33 -0.87 0.32 0.00 0.70 0.00 0.00 55.95 55.77 1fbx s SER 206 Cb 0.09 -2.52 1.44 0.00 -1.71 0.00 0.00 66.02 63.31 1fbx s SER 206 CO 0.63 -1.64 1.65 -0.61 1.20 0.00 0.00 173.24 174.46 1fbx h GLN 207 N 9.82 0.10 0.18 5.44 5.75 -1.88 0.25 115.11 134.76 1fbx h GLN 207 Ca -0.15 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.33 1fbx h GLN 207 Cb 1.04 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.57 1fbx h GLN 207 CO 1.28 0.07 -0.09 -0.97 -2.65 0.00 0.00 178.83 176.47 1fbx h ASN 208 N 0.10 -0.21 -0.52 -0.69 -1.24 -1.92 -3.02 115.58 108.09 1fbx h ASN 208 Ca 0.79 -0.33 -0.00 0.00 0.71 0.00 0.00 56.30 57.47 1fbx h ASN 208 Cb 2.58 0.05 -0.03 0.00 0.73 0.00 0.00 38.32 41.66 1fbx h ASN 208 CO -0.31 0.30 0.32 0.74 -1.29 0.00 0.00 177.43 177.19 1fbx h THR 209 N -0.81 1.15 -0.77 -3.57 2.02 -1.32 -2.42 112.91 107.19 1fbx h THR 209 Ca -0.02 -0.32 0.17 0.00 0.77 0.00 0.00 66.41 67.01 1fbx h THR 209 Cb 0.52 0.43 -0.11 0.00 -1.74 0.00 0.00 68.15 67.25 1fbx h THR 209 CO 0.04 0.15 0.23 -0.09 0.37 0.00 0.00 175.52 176.22 1fbx h ARG 210 N 0.70 0.30 0.04 6.66 2.43 -0.68 -2.34 114.38 121.49 1fbx h ARG 210 Ca 0.19 -0.02 -0.23 0.00 -0.81 0.00 0.00 59.98 59.11 1fbx h ARG 210 Cb -0.03 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 1fbx h ARG 210 CO -0.04 0.20 -1.10 0.45 -1.51 0.00 0.00 179.97 177.98 1fbx h HIS 211 N 0.31 0.14 -0.76 2.20 3.86 -1.34 -2.34 115.15 117.21 1fbx h HIS 211 Ca 0.45 -0.10 0.07 0.00 -1.16 0.00 0.00 60.37 59.63 1fbx h HIS 211 Cb 0.77 -0.01 -0.06 0.00 1.06 0.00 0.00 27.41 29.18 1fbx h HIS 211 CO -0.23 1.08 0.44 0.93 0.86 0.00 0.00 177.93 181.01 1fbx h GLU 212 N 0.02 0.77 0.77 2.45 5.08 -1.02 -1.14 114.58 121.50 1fbx h GLU 212 Ca -0.06 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 1fbx h GLU 212 Cb 1.84 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 30.92 1fbx h GLU 212 CO 0.15 0.51 -0.37 0.35 -1.00 0.00 0.00 179.01 178.65 1fbx h PHE 213 N 0.80 -0.95 -0.04 4.33 3.57 -1.39 -2.34 116.94 120.91 1fbx h PHE 213 Ca 0.35 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.84 1fbx h PHE 213 Cb 0.23 0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.28 1fbx h PHE 213 CO -0.06 -0.58 0.07 -0.07 -2.23 0.00 0.00 178.31 175.44 1fbx h LEU 214 N -1.23 0.00 -0.10 0.59 3.38 -1.38 0.51 115.31 117.09 1fbx h LEU 214 Ca -0.11 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.64 1fbx h LEU 214 Cb 0.80 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.54 1fbx h LEU 214 CO 0.17 0.00 -1.01 -0.09 0.09 0.00 0.00 178.44 177.60 1fbx h ARG 215 N 0.00 0.18 0.00 1.13 2.43 -1.14 -3.16 114.38 113.82 1fbx h ARG 215 Ca 0.02 -0.24 -0.02 0.00 -0.81 0.00 0.00 59.98 58.92 1fbx h ARG 215 Cb 0.15 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1fbx h ARG 215 CO -0.00 1.04 -0.10 0.00 -1.51 0.00 0.00 179.97 179.41 1fbx h ALA 216 N 0.86 0.98 -2.34 2.80 0.00 -0.34 -3.46 119.26 117.76 1fbx h ALA 216 Ca -0.06 -0.09 -0.50 0.00 0.00 0.00 0.00 54.91 54.26 1fbx h ALA 216 Cb 1.70 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 19.55 1fbx h ALA 216 CO 0.15 0.12 0.37 0.08 0.00 0.00 0.00 179.25 179.98 1fbx s VAL 217 N -3.50 3.91 -0.11 0.00 1.01 -0.91 -4.58 120.40 116.22 1fbx s VAL 217 Ca 0.03 0.77 -0.00 0.00 0.00 0.00 0.00 61.98 62.77 1fbx s VAL 217 Cb 0.08 -3.39 -0.00 0.00 0.00 0.00 0.00 36.38 33.07 1fbx s VAL 217 CO 0.61 -0.67 0.10 -1.14 0.00 0.00 0.00 175.10 174.01 1fbx n ARG 218 N -2.55 -0.22 -3.36 2.72 3.00 -1.26 -5.02 116.66 109.97 1fbx n ARG 218 Ca 0.08 0.41 -0.41 0.00 -0.00 0.00 0.00 57.85 57.93 1fbx n ARG 218 Cb 0.53 -2.06 -0.02 0.00 0.00 0.00 0.00 32.46 30.91 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 -1.37 4.29 -1.55 -0.14 8.25 -1.26 -4.99 115.22 118.45 1fbx n HIS 219 Ca -0.00 -3.72 -0.16 0.00 -0.26 0.00 0.00 57.72 53.57 1fbx n HIS 219 Cb 0.51 -1.39 -0.08 0.00 1.12 0.00 0.00 29.99 30.14 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 2.19 1.10 -0.52 4.41 -0.00 -1.26 -4.85 115.22 116.29 1fbx n HIS 220 Ca 0.24 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.42 1fbx n HIS 220 Cb 0.37 -2.46 0.00 0.00 -0.12 0.00 0.00 29.99 27.79 1fbx n HIS 220 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89