#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 -4.35 3.54 2.88 -1.26 -5.16 113.62 109.27 1fbx n SER 2 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 1fbx n SER 2 Cb 0.00 0.21 -0.11 0.00 -0.75 0.00 0.00 64.21 63.56 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 -3.28 2.50 0.68 2.46 1.43 -1.26 -4.77 118.68 116.44 1fbx s LEU 3 Ca 0.00 -0.95 -0.03 0.00 -1.03 0.00 0.00 54.13 52.13 1fbx s LEU 3 Cb 0.00 -0.80 0.08 0.00 0.03 0.00 0.00 46.19 45.51 1fbx s LEU 3 CO 0.00 -0.08 0.95 -0.94 0.23 0.00 0.00 176.35 176.51 1fbx s SER 4 N -3.03 4.69 0.01 2.29 1.04 -1.26 -4.95 113.70 112.50 1fbx s SER 4 Ca 0.20 0.02 -0.10 0.00 0.48 0.00 0.00 55.95 56.55 1fbx s SER 4 Cb -0.04 -0.61 -0.06 0.00 0.10 0.00 0.00 66.02 65.41 1fbx s SER 4 CO 0.08 -1.62 1.08 0.11 0.98 0.00 0.00 173.24 173.86 1fbx h LYS 5 N -0.43 -0.36 -0.69 4.02 1.57 -2.01 -2.53 116.57 116.14 1fbx h LYS 5 Ca -0.41 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 58.50 1fbx h LYS 5 Cb 1.29 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.64 1fbx h LYS 5 CO 0.49 -0.24 0.46 0.93 -0.57 0.00 0.00 179.45 180.52 1fbx h GLU 6 N -0.40 0.50 0.38 3.15 3.07 -1.97 -1.52 114.58 117.81 1fbx h GLU 6 Ca -0.04 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.36 58.77 1fbx h GLU 6 Cb 0.29 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.09 1fbx h GLU 6 CO 0.06 0.33 -0.18 0.00 -1.40 0.00 0.00 179.01 177.82 1fbx h ALA 7 N 1.66 -0.51 -0.34 3.43 0.00 -1.91 -1.69 119.26 119.89 1fbx h ALA 7 Ca 0.32 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1fbx h ALA 7 Cb 0.56 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1fbx h ALA 7 CO -0.11 -0.79 0.00 0.00 0.00 0.00 0.00 179.25 178.36 1fbx h ALA 8 N 0.11 1.38 0.92 0.00 0.00 -0.96 -1.20 119.26 119.50 1fbx h ALA 8 Ca -0.05 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 1fbx h ALA 8 Cb 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1fbx h ALA 8 CO 0.09 0.43 -0.49 -0.07 0.00 0.00 0.00 179.25 179.21 1fbx h LEU 9 N 0.50 -1.21 -0.09 0.00 3.38 -1.05 -2.20 115.31 114.65 1fbx h LEU 9 Ca 0.11 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.17 1fbx h LEU 9 Cb 0.32 0.33 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 1fbx h LEU 9 CO 0.01 -0.80 -0.34 0.58 0.09 0.00 0.00 178.44 177.98 1fbx h VAL 10 N -1.30 0.26 -0.95 1.22 2.07 -1.07 -0.42 116.25 116.07 1fbx h VAL 10 Ca -0.13 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.57 1fbx h VAL 10 Cb 1.02 0.26 -0.10 0.00 -1.52 0.00 0.00 31.29 30.95 1fbx h VAL 10 CO 0.17 0.00 0.54 -0.74 0.02 0.00 0.00 177.57 177.56 1fbx h HIS 11 N -0.44 0.94 -0.15 1.57 -0.00 -1.22 0.48 115.15 116.34 1fbx h HIS 11 Ca 0.08 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.44 1fbx h HIS 11 Cb 0.57 -0.28 -0.00 0.00 -0.00 0.00 0.00 27.41 27.70 1fbx h HIS 11 CO -0.40 0.20 -0.10 0.93 -0.00 0.00 0.00 177.93 178.57 1fbx h GLU 12 N 0.70 0.32 -0.85 5.26 5.08 -0.82 -1.24 114.58 123.04 1fbx h GLU 12 Ca 0.54 -0.15 0.19 0.00 -1.00 0.00 0.00 59.36 58.93 1fbx h GLU 12 Cb 0.82 -0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.96 1fbx h GLU 12 CO -0.38 0.67 0.36 0.00 -1.00 0.00 0.00 179.01 178.65 1fbx h ALA 13 N 0.65 1.29 0.20 3.43 0.00 0.61 0.54 119.26 125.97 1fbx h ALA 13 Ca 0.03 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 1fbx h ALA 13 Cb 0.59 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1fbx h ALA 13 CO 0.03 -0.28 -0.10 -0.07 0.00 0.00 0.00 179.25 178.83 1fbx h LEU 14 N 0.43 -0.23 -1.00 0.00 3.38 -0.82 -2.58 115.31 114.49 1fbx h LEU 14 Ca 0.50 -0.26 0.12 0.00 0.09 0.00 0.00 57.88 58.34 1fbx h LEU 14 Cb 0.88 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.60 1fbx h LEU 14 CO -0.48 0.16 0.63 0.58 0.09 0.00 0.00 178.44 179.42 1fbx h VAL 15 N -0.66 0.92 -0.12 1.22 2.07 -0.11 0.10 116.25 119.67 1fbx h VAL 15 Ca -0.03 -0.34 0.04 0.00 0.82 0.00 0.00 66.70 67.19 1fbx h VAL 15 Cb 0.47 -0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.04 1fbx h VAL 15 CO 0.05 0.18 -0.12 0.00 0.02 0.00 0.00 177.57 177.70 1fbx h ALA 16 N 1.54 -0.03 0.00 1.67 0.00 0.09 -1.82 119.26 120.70 1fbx h ALA 16 Ca 0.50 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1fbx h ALA 16 Cb 0.49 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1fbx h ALA 16 CO -0.27 -0.57 0.00 0.54 0.00 0.00 0.00 179.25 178.95 1fbx n ARG 17 N -5.26 0.22 -2.22 0.00 3.00 -0.55 -4.89 116.66 106.96 1fbx n ARG 17 Ca -0.03 0.05 -0.05 0.00 -0.01 0.00 0.00 57.85 57.81 1fbx n ARG 17 Cb 0.18 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.14 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 1.00 0.25 0.08 -0.13 0.00 -0.10 -4.95 105.19 101.33 1fbx n GLY 18 Ca 0.10 -0.64 0.06 0.00 0.00 0.00 0.00 46.02 45.55 1fbx n GLY 18 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fbx n LEU 19 N -0.88 0.84 -4.37 0.99 4.77 -0.47 -5.01 117.00 112.87 1fbx n LEU 19 Ca -0.05 -0.57 -0.30 0.00 -0.03 0.00 0.00 56.01 55.07 1fbx n LEU 19 Cb 0.54 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 41.86 1fbx n LEU 19 CO 0.08 0.19 0.04 -0.62 -1.33 0.00 0.00 177.39 175.75 1fbx n GLU 20 N -1.03 -2.25 -2.88 3.23 -0.58 -1.24 -4.85 120.64 111.05 1fbx n GLU 20 Ca 0.03 -0.63 -0.37 0.00 -0.42 0.00 0.00 57.16 55.77 1fbx n GLU 20 Cb 0.23 -1.95 -0.06 0.00 -0.57 0.00 0.00 31.44 29.08 1fbx n GLU 20 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1fbx s THR 21 N -2.32 4.31 -0.78 2.62 2.01 -1.26 -4.93 115.64 115.30 1fbx s THR 21 Ca 0.63 1.68 -0.25 0.00 0.31 0.00 0.00 61.69 64.06 1fbx s THR 21 Cb -0.20 -3.99 -0.14 0.00 0.01 0.00 0.00 72.50 68.18 1fbx s THR 21 CO 0.66 0.19 2.41 -2.65 -0.69 0.00 0.00 174.62 174.54 1fbx n PRO 22 N 0.68 0.57 -4.34 4.92 -0.02 -1.26 -4.94 135.00 130.61 1fbx n PRO 22 Ca 0.00 -0.74 -0.29 0.00 -2.02 0.00 0.00 63.50 60.45 1fbx n PRO 22 Cb 0.50 -3.55 -0.12 0.00 -0.02 0.00 0.00 33.50 30.32 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 13.96 2.58 -0.10 2.45 1.02 -1.26 -5.13 118.68 132.20 1fbx s LEU 23 Ca 0.96 -0.62 -0.01 0.00 0.02 0.00 0.00 54.13 54.48 1fbx s LEU 23 Cb -0.17 -1.44 -0.03 0.00 0.02 0.00 0.00 46.19 44.56 1fbx s LEU 23 CO 0.12 0.18 -0.05 -0.13 0.02 0.00 0.00 176.35 176.49 1fbx s ARG 24 N -2.10 3.08 0.06 1.70 0.52 -1.26 -5.07 118.95 115.88 1fbx s ARG 24 Ca 0.17 -0.52 -0.35 0.00 -0.52 0.00 0.00 55.73 54.51 1fbx s ARG 24 Cb -0.10 -2.72 -0.14 0.00 0.52 0.00 0.00 34.95 32.50 1fbx s ARG 24 CO 0.09 0.54 1.60 -2.30 0.02 0.00 0.00 175.30 175.25 1fbx n PRO 25 N 2.61 1.87 -0.54 3.54 -0.02 -1.26 -4.77 135.00 136.44 1fbx n PRO 25 Ca -0.18 0.68 0.44 0.00 -2.02 0.00 0.00 63.50 62.42 1fbx n PRO 25 Cb 0.53 -2.43 0.71 0.00 -0.02 0.00 0.00 33.50 32.29 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 4.06 -0.02 0.00 0.52 -0.02 -1.26 -4.78 135.00 133.50 1fbx n PRO 26 Ca 0.19 1.18 0.00 0.00 -2.02 0.00 0.00 63.50 62.86 1fbx n PRO 26 Cb 0.26 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 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 -4.44 0.00 -4.74 -1.45 0.31 -1.26 -4.85 118.33 101.90 1fbx n VAL 27 Ca 0.41 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.44 1fbx n VAL 27 Cb 1.69 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 34.49 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 2.48 -0.84 3.52 -3.43 -1.26 -5.04 115.29 110.72 1fbx s HIS 28 Ca 0.00 -0.31 -0.24 0.00 -0.80 0.00 0.00 55.06 53.71 1fbx s HIS 28 Cb 0.00 -1.44 -0.17 0.00 -1.43 0.00 0.00 32.58 29.54 1fbx s HIS 28 CO 0.00 0.21 2.32 0.39 -2.00 0.00 0.00 174.74 175.66 1fbx n GLU 29 N 1.63 0.42 -3.66 -0.38 1.02 -1.26 -4.91 120.64 113.50 1fbx n GLU 29 Ca -0.16 -0.88 -0.36 0.00 -0.02 0.00 0.00 57.16 55.73 1fbx n GLU 29 Cb 0.52 -3.42 -0.09 0.00 -0.02 0.00 0.00 31.44 28.44 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 8.61 4.13 0.50 3.49 1.75 -1.26 -5.08 119.30 131.44 1fbx s MET 30 Ca 0.93 -0.20 -0.22 0.00 -1.25 0.00 0.00 55.69 54.95 1fbx s MET 30 Cb -0.19 -3.50 -0.06 0.00 2.84 0.00 0.00 34.83 33.92 1fbx s MET 30 CO 0.14 0.14 1.25 0.34 -0.65 0.00 0.00 175.02 176.24 1fbx s ASP 31 N 0.81 5.76 0.06 1.11 2.15 -1.26 -4.89 116.67 120.41 1fbx s ASP 31 Ca 0.09 2.51 -0.20 0.00 0.43 0.00 0.00 52.55 55.37 1fbx s ASP 31 Cb -0.13 -2.62 -0.12 0.00 -0.30 0.00 0.00 42.92 39.76 1fbx s ASP 31 CO 0.03 -1.21 1.46 0.78 -0.17 0.00 0.00 175.17 176.05 1fbx h ASN 32 N 1.77 0.32 -1.04 -0.34 4.21 -1.98 -0.70 115.58 117.81 1fbx h ASN 32 Ca -0.50 -0.35 0.27 0.00 1.21 0.00 0.00 56.30 56.93 1fbx h ASN 32 Cb 1.27 -0.09 -0.09 0.00 -1.12 0.00 0.00 38.32 38.30 1fbx h ASN 32 CO 0.59 0.59 0.68 -0.33 -1.29 0.00 0.00 177.43 177.67 1fbx h GLU 33 N 0.04 0.33 0.31 0.81 5.08 -1.99 0.14 114.58 119.30 1fbx h GLU 33 Ca 0.04 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1fbx h GLU 33 Cb 0.45 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1fbx h GLU 33 CO 0.01 0.22 -0.15 1.15 -1.00 0.00 0.00 179.01 179.25 1fbx h THR 34 N 0.34 0.23 -0.92 1.13 2.02 -1.85 -2.25 112.91 111.62 1fbx h THR 34 Ca 0.58 -0.78 0.23 0.00 0.77 0.00 0.00 66.41 67.21 1fbx h THR 34 Cb 1.57 0.38 -0.13 0.00 -1.74 0.00 0.00 68.15 68.24 1fbx h THR 34 CO -0.26 0.06 0.44 0.03 0.37 0.00 0.00 175.52 176.17 1fbx h ARG 35 N -1.06 0.43 0.90 6.66 3.08 -0.22 0.58 114.38 124.75 1fbx h ARG 35 Ca -0.04 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 1fbx h ARG 35 Cb 0.41 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.38 1fbx h ARG 35 CO 0.07 0.28 -0.43 0.87 -1.07 0.00 0.00 179.97 179.69 1fbx h LYS 36 N 0.44 -1.17 -0.79 0.04 1.57 -0.82 0.27 116.57 116.11 1fbx h LYS 36 Ca 0.58 0.08 0.18 0.00 -1.87 0.00 0.00 60.65 59.62 1fbx h LYS 36 Cb 1.12 0.27 -0.05 0.00 0.08 0.00 0.00 32.23 33.64 1fbx h LYS 36 CO -0.52 -0.78 0.54 0.66 -0.57 0.00 0.00 179.45 178.78 1fbx h SER 37 N -1.23 0.29 0.46 0.86 4.64 -0.29 0.37 113.55 118.65 1fbx h SER 37 Ca -0.12 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.20 1fbx h SER 37 Cb 0.93 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1fbx h SER 37 CO 0.20 0.14 -0.22 -0.07 -0.87 0.00 0.00 176.83 176.01 1fbx h LEU 38 N 0.30 -0.52 -1.60 5.97 3.38 0.71 -1.82 115.31 121.74 1fbx h LEU 38 Ca 0.39 -0.08 0.15 0.00 0.09 0.00 0.00 57.88 58.43 1fbx h LEU 38 Cb 1.08 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.92 1fbx h LEU 38 CO -0.11 -0.12 0.50 0.40 0.09 0.00 0.00 178.44 179.20 1fbx h ILE 39 N -1.03 0.79 -0.45 1.22 2.04 0.48 0.20 117.51 120.76 1fbx h ILE 39 Ca -0.06 -0.14 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1fbx h ILE 39 Cb 0.57 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1fbx h ILE 39 CO 0.10 0.07 0.13 0.00 0.00 0.00 0.00 178.15 178.46 1fbx h ALA 40 N 1.65 0.59 0.07 1.87 0.00 -0.24 -1.78 119.26 121.41 1fbx h ALA 40 Ca 0.37 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1fbx h ALA 40 Cb 0.86 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1fbx h ALA 40 CO -0.11 0.25 -0.09 0.78 0.00 0.00 0.00 179.25 180.07 1fbx h GLY 41 N 0.59 -0.16 1.26 0.00 0.00 0.26 -1.53 103.07 103.48 1fbx h GLY 41 Ca 0.14 0.10 0.09 0.00 0.00 0.00 0.00 47.33 47.66 1fbx h GLY 41 CO -0.00 -0.10 0.29 0.45 0.00 0.00 0.00 176.54 177.18 1fbx h HIS 42 N -0.19 0.00 0.18 5.60 -0.00 -1.13 -0.91 115.15 118.70 1fbx h HIS 42 Ca 0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 60.37 60.10 1fbx h HIS 42 Cb 0.20 0.00 0.03 0.00 -0.00 0.00 0.00 27.41 27.64 1fbx h HIS 42 CO -0.12 0.00 -1.21 0.52 -0.00 0.00 0.00 177.93 177.12 1fbx h MET 43 N 0.00 0.49 -0.81 2.45 2.86 -0.66 -2.87 114.93 116.39 1fbx h MET 43 Ca 0.14 -0.78 0.10 0.00 -2.06 0.00 0.00 59.70 57.11 1fbx h MET 43 Cb 0.72 0.28 -0.08 0.00 0.06 0.00 0.00 31.60 32.58 1fbx h MET 43 CO -0.00 1.36 0.45 1.15 1.06 0.00 0.00 176.91 180.93 1fbx h THR 44 N 0.02 0.87 -0.80 2.22 2.02 -0.22 0.21 112.91 117.22 1fbx h THR 44 Ca -0.20 -0.25 -0.02 0.00 0.77 0.00 0.00 66.41 66.70 1fbx h THR 44 Cb 1.93 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 1fbx h THR 44 CO 0.23 0.14 0.42 -0.33 0.37 0.00 0.00 175.52 176.34 1fbx h GLU 45 N 0.74 1.14 -0.30 6.66 4.39 -1.32 -2.57 114.58 123.31 1fbx h GLU 45 Ca 0.40 -0.15 -0.13 0.00 0.34 0.00 0.00 59.36 59.83 1fbx h GLU 45 Cb 0.41 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1fbx h GLU 45 CO -0.27 0.85 -0.31 0.82 -1.16 0.00 0.00 179.01 178.94 1fbx h ILE 46 N 1.12 1.30 0.00 3.13 2.04 -0.77 -2.05 117.51 122.28 1fbx h ILE 46 Ca 0.28 -1.48 -0.03 0.00 1.00 0.00 0.00 64.86 64.63 1fbx h ILE 46 Cb 0.06 1.56 -0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1fbx h ILE 46 CO -0.04 0.48 -0.13 0.24 0.00 0.00 0.00 178.15 178.70 1fbx h MET 47 N 0.50 0.00 0.05 2.37 2.86 -0.61 -1.30 114.93 118.80 1fbx h MET 47 Ca 0.05 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.44 1fbx h MET 47 Cb 0.89 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 1fbx h MET 47 CO 0.08 0.13 -1.22 1.96 1.06 0.00 0.00 176.91 178.92 1fbx h GLN 48 N 0.00 0.10 0.00 1.72 4.20 -1.29 -1.09 115.11 118.76 1fbx h GLN 48 Ca -0.00 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.53 1fbx h GLN 48 Cb 0.36 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1fbx h GLN 48 CO 0.02 1.01 0.00 1.28 -0.67 0.00 0.00 178.83 180.47 1fbx n LEU 49 N -3.37 0.49 -1.08 1.46 4.77 -0.58 -1.51 117.00 117.17 1fbx n LEU 49 Ca -0.06 0.62 0.10 0.00 -0.03 0.00 0.00 56.01 56.63 1fbx n LEU 49 Cb 0.99 -0.54 0.25 0.00 -2.33 0.00 0.00 43.42 41.79 1fbx n LEU 49 CO 0.49 -0.45 0.71 0.18 -1.33 0.00 0.00 177.39 176.99 1fbx n LEU 50 N -2.03 3.53 -1.42 2.23 4.77 -0.66 -4.97 117.00 118.45 1fbx n LEU 50 Ca 0.03 -1.93 -0.14 0.00 -0.03 0.00 0.00 56.01 53.94 1fbx n LEU 50 Cb 0.22 -0.37 -0.02 0.00 -2.33 0.00 0.00 43.42 40.92 1fbx n LEU 50 CO 0.19 0.87 -0.16 0.59 -1.33 0.00 0.00 177.39 177.54 1fbx n ASN 51 N 1.24 -4.41 -4.71 -1.43 3.02 -0.57 -4.98 115.26 103.43 1fbx n ASN 51 Ca 0.19 0.10 -0.39 0.00 -0.03 0.00 0.00 54.58 54.46 1fbx n ASN 51 Cb 0.55 -3.44 -0.06 0.00 -0.61 0.00 0.00 39.78 36.23 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 -3.74 4.26 -1.01 3.41 1.43 -0.42 -4.98 118.68 117.63 1fbx s LEU 52 Ca 0.00 0.88 -0.23 0.00 -1.03 0.00 0.00 54.13 53.74 1fbx s LEU 52 Cb 0.00 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.42 1fbx s LEU 52 CO 0.00 -0.07 1.76 -0.62 0.23 0.00 0.00 176.35 177.65 1fbx s ASP 53 N 0.78 5.73 0.00 2.29 2.15 -1.26 -4.59 116.67 121.77 1fbx s ASP 53 Ca 0.28 -1.20 0.01 0.00 0.43 0.00 0.00 52.55 52.07 1fbx s ASP 53 Cb -0.16 -2.57 0.05 0.00 -0.30 0.00 0.00 42.92 39.94 1fbx s ASP 53 CO 0.12 -2.24 0.74 0.18 -0.17 0.00 0.00 175.17 173.81 1fbx n LEU 54 N 11.84 0.00 0.03 -1.34 4.77 -1.26 -1.21 117.00 129.83 1fbx n LEU 54 Ca 0.39 0.20 0.12 0.00 -0.03 0.00 0.00 56.01 56.69 1fbx n LEU 54 Cb 0.48 -0.20 0.49 0.00 -2.33 0.00 0.00 43.42 41.86 1fbx n LEU 54 CO 0.64 -0.20 0.88 0.00 -1.33 0.00 0.00 177.39 177.38 1fbx n ALA 55 N -1.20 2.08 -1.79 -1.18 0.00 -1.26 -3.88 120.51 113.28 1fbx n ALA 55 Ca 0.00 -0.05 -0.41 0.00 0.00 0.00 0.00 53.44 52.98 1fbx n ALA 55 Cb 0.01 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.04 1fbx n ALA 55 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1fbx s ASP 56 N -3.41 6.63 0.36 0.00 2.15 -0.35 -4.89 116.67 117.17 1fbx s ASP 56 Ca 0.11 2.79 0.25 0.00 0.43 0.00 0.00 52.55 56.13 1fbx s ASP 56 Cb 0.14 -2.65 1.29 0.00 -0.30 0.00 0.00 42.92 41.40 1fbx s ASP 56 CO 0.46 -0.65 1.77 -2.24 -0.17 0.00 0.00 175.17 174.33 1fbx h ASP 57 N 3.51 0.00 0.00 -0.34 2.03 -1.91 -0.37 116.42 119.34 1fbx h ASP 57 Ca -0.49 0.00 -0.37 0.00 -0.73 0.00 0.00 57.03 55.44 1fbx h ASP 57 Cb 1.23 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.66 1fbx h ASP 57 CO 0.67 0.00 -2.41 -0.24 -1.03 0.00 0.00 179.24 176.23 1fbx n SER 58 N -2.38 2.07 0.04 4.15 2.88 -1.26 -4.45 113.62 114.66 1fbx n SER 58 Ca -0.01 -0.13 0.13 0.00 -1.33 0.00 0.00 58.87 57.53 1fbx n SER 58 Cb 0.09 -0.39 0.42 0.00 -0.75 0.00 0.00 64.21 63.58 1fbx n SER 58 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1fbx n LEU 59 N -3.22 0.43 -0.17 2.46 4.77 -1.13 -4.21 117.00 115.94 1fbx n LEU 59 Ca -0.44 0.39 -0.02 0.00 -0.03 0.00 0.00 56.01 55.90 1fbx n LEU 59 Cb 0.97 -0.35 0.05 0.00 -2.33 0.00 0.00 43.42 41.75 1fbx n LEU 59 CO 0.25 -0.04 0.78 -0.03 -1.33 0.00 0.00 177.39 177.03 1fbx h MET 60 N 0.00 0.03 0.00 3.23 4.05 -1.18 -2.76 114.93 118.31 1fbx h MET 60 Ca 0.00 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1fbx h MET 60 Cb 0.60 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 1fbx h MET 60 CO 0.00 0.02 -0.40 0.93 0.23 0.00 0.00 176.91 177.69 1fbx h GLU 61 N 0.03 0.00 -0.88 0.39 4.39 -1.86 -3.40 114.58 113.25 1fbx h GLU 61 Ca 0.25 0.00 0.23 0.00 0.34 0.00 0.00 59.36 60.19 1fbx h GLU 61 Cb 0.39 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.89 1fbx h GLU 61 CO -0.51 0.00 0.11 1.15 -1.16 0.00 0.00 179.01 178.60 1fbx h THR 62 N 0.00 0.21 -0.43 1.13 2.02 -1.70 0.19 112.91 114.34 1fbx h THR 62 Ca 0.00 -0.04 0.04 0.00 0.77 0.00 0.00 66.41 67.18 1fbx h THR 62 Cb 0.79 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1fbx h THR 62 CO 0.00 0.02 0.29 -0.65 0.37 0.00 0.00 175.52 175.54 1fbx h PRO 63 N 0.11 0.41 0.00 6.66 0.11 -1.78 -1.42 132.00 136.10 1fbx h PRO 63 Ca 0.53 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.54 1fbx h PRO 63 Cb 1.07 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.09 1fbx h PRO 63 CO -0.75 0.27 -0.30 1.25 -0.21 0.00 0.00 178.00 178.26 1fbx h HIS 64 N 0.43 0.29 -0.77 0.65 2.76 -0.95 -2.94 115.15 114.61 1fbx h HIS 64 Ca 0.18 -0.16 0.08 0.00 -2.20 0.00 0.00 60.37 58.26 1fbx h HIS 64 Cb 0.17 -0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.05 1fbx h HIS 64 CO -0.00 0.98 0.51 0.00 -1.30 0.00 0.00 177.93 178.11 1fbx h ARG 65 N -0.47 0.75 0.15 5.26 3.08 -1.21 0.22 114.38 122.17 1fbx h ARG 65 Ca -0.04 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1fbx h ARG 65 Cb 1.06 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.94 1fbx h ARG 65 CO 0.06 0.50 -0.07 0.82 -1.07 0.00 0.00 179.97 180.20 1fbx h ILE 66 N 0.77 0.97 -0.90 2.04 2.04 -1.32 -0.07 117.51 121.04 1fbx h ILE 66 Ca 0.34 -0.53 0.01 0.00 1.00 0.00 0.00 64.86 65.68 1fbx h ILE 66 Cb 0.33 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 1fbx h ILE 66 CO -0.12 0.13 0.60 0.00 0.00 0.00 0.00 178.15 178.75 1fbx h ALA 67 N 0.34 1.37 -0.46 1.87 0.00 -1.17 0.85 119.26 122.06 1fbx h ALA 67 Ca -0.02 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1fbx h ALA 67 Cb 0.36 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1fbx h ALA 67 CO 0.03 0.58 -0.14 -0.22 0.00 0.00 0.00 179.25 179.51 1fbx h LYS 68 N 1.21 0.85 -0.40 0.00 3.64 -0.50 -2.35 116.57 119.03 1fbx h LYS 68 Ca 0.33 -0.31 -0.14 0.00 -1.27 0.00 0.00 60.65 59.27 1fbx h LYS 68 Cb -0.13 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1fbx h LYS 68 CO -0.08 0.94 -0.29 1.98 -2.27 0.00 0.00 179.45 179.73 1fbx h MET 69 N 0.76 0.90 -0.60 1.90 4.05 -0.11 -0.28 114.93 121.55 1fbx h MET 69 Ca 0.12 -0.43 -0.06 0.00 -0.28 0.00 0.00 59.70 59.05 1fbx h MET 69 Cb 0.65 -0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.42 1fbx h MET 69 CO 0.05 1.08 0.14 1.88 0.23 0.00 0.00 176.91 180.29 1fbx h TYR 70 N 0.71 1.01 0.12 1.39 -1.99 -0.74 -0.50 116.97 116.98 1fbx h TYR 70 Ca 0.08 -0.12 -0.30 0.00 2.00 0.00 0.00 58.73 60.38 1fbx h TYR 70 Cb 0.87 -0.28 -0.01 0.00 2.00 0.00 0.00 36.73 39.31 1fbx h TYR 70 CO 0.06 0.86 -1.58 0.28 -0.00 0.00 0.00 178.16 177.79 1fbx h VAL 71 N 0.87 0.92 0.00 -2.88 2.07 -1.42 -2.91 116.25 112.91 1fbx h VAL 71 Ca 0.19 -2.39 -0.04 0.00 0.82 0.00 0.00 66.70 65.28 1fbx h VAL 71 Cb 0.36 2.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.77 1fbx h VAL 71 CO 0.00 0.74 -1.37 0.47 0.02 0.00 0.00 177.57 177.44 1fbx n ASP 72 N -3.82 0.61 0.00 0.57 8.00 -0.12 -4.12 116.55 117.67 1fbx n ASP 72 Ca -0.27 0.24 0.00 0.00 0.71 0.00 0.00 54.79 55.47 1fbx n ASP 72 Cb 0.94 0.82 0.00 0.00 -0.02 0.00 0.00 41.12 42.86 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 -2.61 0.00 0.12 -1.24 1.02 -0.63 -4.61 120.64 112.69 1fbx n GLU 73 Ca -0.04 0.00 0.20 0.00 -0.02 0.00 0.00 57.16 57.30 1fbx n GLU 73 Cb 0.62 0.00 0.74 0.00 -0.02 0.00 0.00 31.44 32.78 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 0.30 -0.21 -3.67 3.07 -1.37 -1.52 117.51 114.11 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 0.62 0.00 0.00 -0.27 0.00 0.00 36.82 37.17 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 -3.57 0.41 0.27 0.16 3.72 -1.10 -3.45 117.46 113.90 1fbx n PHE 75 Ca 0.06 -0.63 0.18 0.00 -0.05 0.00 0.00 57.45 57.02 1fbx n PHE 75 Cb 0.62 -0.10 0.93 0.00 -0.94 0.00 0.00 39.48 39.98 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 1.31 0.00 0.34 4.37 4.64 -1.26 -1.30 113.55 121.64 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 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1fbx h SER 76 CO 0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1fbx n GLY 77 N -1.29 -0.82 0.00 -0.77 0.00 -0.55 -2.30 105.19 99.45 1fbx n GLY 77 Ca -0.01 -0.04 0.14 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 -1.45 0.00 -3.90 0.99 4.77 -0.49 -4.53 117.00 112.39 1fbx n LEU 78 Ca 0.03 0.25 -0.30 0.00 -0.03 0.00 0.00 56.01 55.96 1fbx n LEU 78 Cb 0.12 -0.25 -0.15 0.00 -2.33 0.00 0.00 43.42 40.80 1fbx n LEU 78 CO 0.10 -0.02 -0.38 -0.62 -1.33 0.00 0.00 177.39 175.14 1fbx s ASP 79 N -2.51 4.05 0.00 -1.43 2.15 -0.97 -5.00 116.67 112.96 1fbx s ASP 79 Ca 0.28 -1.47 0.00 0.00 0.43 0.00 0.00 52.55 51.79 1fbx s ASP 79 Cb 0.19 -1.18 0.03 0.00 -0.30 0.00 0.00 42.92 41.66 1fbx s ASP 79 CO 0.41 -0.31 0.28 -1.22 -0.17 0.00 0.00 175.17 174.16 1fbx n TYR 80 N 4.64 0.00 0.90 -5.34 4.02 -1.26 -1.35 117.16 118.77 1fbx n TYR 80 Ca -0.06 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.96 1fbx n TYR 80 Cb 0.43 0.00 0.57 0.00 -0.02 0.00 0.00 39.34 40.32 1fbx n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fbx n ALA 81 N -0.74 2.28 0.60 -0.72 0.00 -1.26 -2.85 120.51 117.81 1fbx n ALA 81 Ca 0.00 -0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.45 1fbx n ALA 81 Cb 0.00 -1.46 0.09 0.00 0.00 0.00 0.00 19.45 18.08 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 -1.64 2.50 -4.74 0.00 3.02 -0.46 -5.00 115.26 108.94 1fbx n ASN 82 Ca 0.07 -1.73 -0.42 0.00 -0.03 0.00 0.00 54.58 52.47 1fbx n ASN 82 Cb 0.34 -0.04 -0.00 0.00 -0.61 0.00 0.00 39.78 39.47 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 0.95 2.71 -1.88 3.10 7.35 -1.13 -4.93 117.46 123.63 1fbx n PHE 83 Ca 0.11 0.49 -0.35 0.00 -0.76 0.00 0.00 57.45 56.94 1fbx n PHE 83 Cb 0.43 -2.49 0.04 0.00 0.35 0.00 0.00 39.48 37.82 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 -2.01 2.83 -0.26 -7.13 0.04 -1.26 -4.96 135.00 122.25 1fbx s PRO 84 Ca 0.54 1.65 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 1fbx s PRO 84 Cb -0.51 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.10 1fbx s PRO 84 CO 0.63 -1.27 1.23 0.15 0.04 0.00 0.00 177.00 177.78 1fbx s LYS 85 N -3.65 4.06 0.08 4.56 1.02 -1.26 -4.94 119.74 119.60 1fbx s LYS 85 Ca 0.73 1.34 -0.23 0.00 0.02 0.00 0.00 55.97 57.84 1fbx s LYS 85 Cb -0.26 -3.80 -0.06 0.00 -0.52 0.00 0.00 37.83 33.18 1fbx s LYS 85 CO 0.37 -0.93 0.68 0.42 -0.92 0.00 0.00 175.35 174.97 1fbx s ILE 86 N 3.92 4.67 0.02 2.17 -1.09 -1.26 -5.01 121.20 124.61 1fbx s ILE 86 Ca 0.53 1.47 0.06 0.00 -2.23 0.00 0.00 60.65 60.47 1fbx s ILE 86 Cb -0.17 -4.03 -0.02 0.00 -1.58 0.00 0.00 42.46 36.66 1fbx s ILE 86 CO 0.18 0.47 -0.17 0.42 -1.23 0.00 0.00 174.94 174.61 1fbx s THR 87 N -0.65 1.33 0.04 2.92 -4.23 -1.26 -5.11 115.64 108.68 1fbx s THR 87 Ca 0.34 -0.94 0.02 0.00 -1.18 0.00 0.00 61.69 59.93 1fbx s THR 87 Cb -0.20 -1.16 -0.02 0.00 1.34 0.00 0.00 72.50 72.46 1fbx s THR 87 CO 0.22 0.20 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.66 1fbx s LEU 88 N -0.86 2.23 -0.02 4.79 1.43 -1.26 -3.25 118.68 121.74 1fbx s LEU 88 Ca 0.05 -0.51 0.06 0.00 -1.03 0.00 0.00 54.13 52.70 1fbx s LEU 88 Cb -0.07 -0.18 -0.01 0.00 0.03 0.00 0.00 46.19 45.95 1fbx s LEU 88 CO 0.01 -0.17 -0.19 0.27 0.23 0.00 0.00 176.35 176.50 1fbx s ILE 89 N -1.25 1.48 0.40 -0.59 -4.36 -0.70 -4.98 121.20 111.20 1fbx s ILE 89 Ca -0.09 -0.79 -0.26 0.00 -0.26 0.00 0.00 60.65 59.25 1fbx s ILE 89 Cb -0.09 -1.23 -0.10 0.00 1.25 0.00 0.00 42.46 42.28 1fbx s ILE 89 CO 0.00 0.42 1.23 1.21 0.24 0.00 0.00 174.94 178.05 1fbx n GLU 90 N 2.67 1.88 -1.07 0.37 2.13 -1.26 -1.16 120.64 124.19 1fbx n GLU 90 Ca -0.15 0.67 -0.24 0.00 0.66 0.00 0.00 57.16 58.10 1fbx n GLU 90 Cb 0.53 -2.31 -0.09 0.00 0.27 0.00 0.00 31.44 29.84 1fbx n GLU 90 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1fbx n ASN 91 N 0.38 6.50 0.01 4.31 2.85 0.35 -4.60 115.26 125.06 1fbx n ASN 91 Ca 0.07 -2.47 -0.03 0.00 -0.11 0.00 0.00 54.58 52.04 1fbx n ASN 91 Cb 0.39 -1.40 0.22 0.00 1.24 0.00 0.00 39.78 40.22 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 4.21 0.51 0.00 1.20 1.57 -1.88 -2.40 116.57 119.78 1fbx h LYS 92 Ca 0.49 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1fbx h LYS 92 Cb 0.84 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.11 1fbx h LYS 92 CO 0.99 0.67 0.03 0.52 -0.57 0.00 0.00 179.45 181.09 1fbx h MET 93 N 0.46 0.00 -4.69 3.15 2.86 -2.00 -3.46 114.93 111.24 1fbx h MET 93 Ca 0.08 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1fbx h MET 93 Cb 0.59 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.27 1fbx h MET 93 CO 0.04 0.00 -0.11 1.63 1.06 0.00 0.00 176.91 179.53 1fbx n LYS 94 N -2.91 -1.06 -3.47 1.72 5.02 -0.90 -5.01 118.16 111.55 1fbx n LYS 94 Ca -0.03 1.10 -0.40 0.00 -2.02 0.00 0.00 58.31 56.96 1fbx n LYS 94 Cb 0.09 -4.54 -0.10 0.00 -0.02 0.00 0.00 35.03 30.46 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 -3.05 5.23 -0.03 -0.18 1.01 -1.26 -4.91 120.40 117.21 1fbx s VAL 95 Ca 0.06 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.00 1fbx s VAL 95 Cb -0.01 -3.76 0.06 0.00 0.00 0.00 0.00 36.38 32.67 1fbx s VAL 95 CO 0.53 -0.04 1.02 -0.90 0.00 0.00 0.00 175.10 175.71 1fbx n ASP 96 N 5.24 2.04 -5.00 3.32 5.75 -1.26 -4.26 116.55 122.37 1fbx n ASP 96 Ca -0.11 -2.22 -0.19 0.00 -0.01 0.00 0.00 54.79 52.26 1fbx n ASP 96 Cb 0.50 -0.09 0.03 0.00 -1.03 0.00 0.00 41.12 40.52 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 -1.39 2.50 -0.04 0.11 0.41 -1.26 -4.95 118.70 114.08 1fbx s GLU 97 Ca 0.07 -1.53 -0.12 0.00 -0.41 0.00 0.00 54.97 52.97 1fbx s GLU 97 Cb 0.06 -2.60 -0.05 0.00 -1.78 0.00 0.00 34.13 29.76 1fbx s GLU 97 CO 0.01 -0.57 0.32 0.00 -0.49 0.00 0.00 175.26 174.53 1fbx s MET 98 N -4.47 3.78 -0.16 1.61 0.23 -1.26 -4.27 119.30 114.76 1fbx s MET 98 Ca 0.55 0.24 -0.13 0.00 -1.03 0.00 0.00 55.69 55.32 1fbx s MET 98 Cb -0.07 -3.22 -0.05 0.00 -1.53 0.00 0.00 34.83 29.97 1fbx s MET 98 CO 0.34 0.71 0.26 0.08 -2.03 0.00 0.00 175.02 174.38 1fbx s VAL 99 N -1.02 5.32 -0.12 5.16 1.01 0.11 -4.91 120.40 125.95 1fbx s VAL 99 Ca 0.21 0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.70 1fbx s VAL 99 Cb -0.15 -3.60 0.01 0.00 0.00 0.00 0.00 36.38 32.64 1fbx s VAL 99 CO 0.10 0.42 -0.21 -0.89 0.00 0.00 0.00 175.10 174.53 1fbx s THR 100 N 0.26 1.91 -0.35 3.92 2.01 -1.26 -1.41 115.64 120.72 1fbx s THR 100 Ca 0.15 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.21 1fbx s THR 100 Cb -0.13 -1.69 0.06 0.00 0.01 0.00 0.00 72.50 70.76 1fbx s THR 100 CO 0.03 0.52 0.11 -0.69 -0.69 0.00 0.00 174.62 173.91 1fbx s VAL 101 N 0.73 3.43 0.23 3.82 1.01 -0.33 -5.02 120.40 124.27 1fbx s VAL 101 Ca -0.10 -1.48 0.07 0.00 0.00 0.00 0.00 61.98 60.47 1fbx s VAL 101 Cb -0.16 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 33.11 1fbx s VAL 101 CO 0.01 -0.31 0.17 0.00 0.00 0.00 0.00 175.10 174.96 1fbx s ARG 102 N 1.29 2.88 -1.58 2.72 1.70 -1.26 -1.82 118.95 122.88 1fbx s ARG 102 Ca 0.00 -1.02 -0.04 0.00 -0.47 0.00 0.00 55.73 54.21 1fbx s ARG 102 Cb -0.21 -2.56 0.00 0.00 -0.57 0.00 0.00 34.95 31.61 1fbx s ARG 102 CO -0.00 0.42 0.48 -0.25 -1.08 0.00 0.00 175.30 174.87 1fbx n ASP 103 N -0.90 -6.02 -4.69 -2.89 8.00 -0.99 -4.92 116.55 104.13 1fbx n ASP 103 Ca -0.08 -0.23 -0.42 0.00 0.71 0.00 0.00 54.79 54.77 1fbx n ASP 103 Cb 0.57 -4.88 -0.03 0.00 -0.02 0.00 0.00 41.12 36.76 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 -3.14 2.81 0.34 0.53 1.01 0.64 -4.73 121.20 118.64 1fbx s ILE 104 Ca 0.24 0.33 -0.29 0.00 0.00 0.00 0.00 60.65 60.93 1fbx s ILE 104 Cb -0.10 -3.21 -0.11 0.00 0.01 0.00 0.00 42.46 39.05 1fbx s ILE 104 CO 0.29 0.00 1.47 -0.89 0.00 0.00 0.00 174.94 175.82 1fbx s THR 105 N 2.49 2.25 -0.12 2.92 2.01 -1.26 -0.52 115.64 123.41 1fbx s THR 105 Ca 0.76 0.24 -0.05 0.00 0.31 0.00 0.00 61.69 62.95 1fbx s THR 105 Cb -0.42 -3.15 0.06 0.00 0.01 0.00 0.00 72.50 68.99 1fbx s THR 105 CO 0.33 0.05 0.26 -0.22 -0.69 0.00 0.00 174.62 174.35 1fbx s LEU 106 N -1.50 -0.03 0.00 4.42 0.20 -0.89 -4.82 118.68 116.06 1fbx s LEU 106 Ca 0.55 0.57 0.06 0.00 0.69 0.00 0.00 54.13 56.00 1fbx s LEU 106 Cb -0.45 0.71 -0.02 0.00 -0.43 0.00 0.00 46.19 46.01 1fbx s LEU 106 CO 0.56 -0.21 -0.18 0.42 -0.29 0.00 0.00 176.35 176.64 1fbx s THR 107 N 1.98 1.43 0.00 3.68 -4.23 -1.26 0.08 115.64 117.32 1fbx s THR 107 Ca -0.03 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 59.61 1fbx s THR 107 Cb -0.11 -1.21 0.00 0.00 1.34 0.00 0.00 72.50 72.52 1fbx s THR 107 CO -0.09 0.32 0.00 -0.24 -0.54 0.00 0.00 174.62 174.07 1fbx n SER 108 N 2.40 0.00 -3.82 3.99 2.88 0.21 -4.63 113.62 114.66 1fbx n SER 108 Ca -0.16 -0.19 -0.12 0.00 -1.33 0.00 0.00 58.87 57.07 1fbx n SER 108 Cb 0.54 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.87 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 -2.43 0.00 0.30 2.46 2.01 -1.26 -0.51 115.64 116.21 1fbx s THR 109 Ca 0.00 -0.01 -0.28 0.00 0.31 0.00 0.00 61.69 61.71 1fbx s THR 109 Cb 0.00 -0.23 -0.09 0.00 0.01 0.00 0.00 72.50 72.18 1fbx s THR 109 CO 0.00 -0.01 0.98 0.00 -0.69 0.00 0.00 174.62 174.91 1fbx n GLU 111 N 0.91 0.22 -0.12 0.00 0.28 0.55 -0.66 120.64 121.82 1fbx n GLU 111 Ca 0.00 0.16 -0.12 0.00 -0.16 0.00 0.00 57.16 57.04 1fbx n GLU 111 Cb 0.48 -1.73 -0.03 0.00 1.43 0.00 0.00 31.44 31.59 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 0.89 0.00 -1.84 3.86 -1.92 -3.38 115.15 112.76 1fbx h HIS 112 Ca 0.00 -0.23 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 1fbx h HIS 112 Cb 0.70 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.97 1fbx h HIS 112 CO 0.00 0.98 -0.31 0.72 0.86 0.00 0.00 177.93 180.17 1fbx n HIS 113 N -4.27 0.00 -3.61 2.45 8.25 -1.25 -5.04 115.22 111.75 1fbx n HIS 113 Ca -0.02 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.23 1fbx n HIS 113 Cb 0.43 -0.02 0.05 0.00 1.12 0.00 0.00 29.99 31.56 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 -2.00 -4.43 4.41 3.01 0.16 -4.98 117.46 113.63 1fbx n PHE 114 Ca 0.00 0.85 -0.26 0.00 1.01 0.00 0.00 57.45 59.05 1fbx n PHE 114 Cb 0.63 -4.51 -0.11 0.00 -0.01 0.00 0.00 39.48 35.47 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 -3.58 2.33 0.18 -4.37 1.01 -1.23 -4.83 120.40 109.92 1fbx s VAL 115 Ca 0.04 -2.11 -0.33 0.00 0.00 0.00 0.00 61.98 59.58 1fbx s VAL 115 Cb -0.01 -2.14 -0.15 0.00 0.00 0.00 0.00 36.38 34.08 1fbx s VAL 115 CO 0.79 -0.20 1.36 0.41 0.00 0.00 0.00 175.10 177.47 1fbx n THR 116 N 0.07 0.59 -4.09 3.92 -1.04 -1.26 -0.73 114.28 111.74 1fbx n THR 116 Ca -0.11 -0.15 -0.33 0.00 -2.04 0.00 0.00 64.05 61.42 1fbx n THR 116 Cb 0.57 -1.21 -0.16 0.00 -1.82 0.00 0.00 70.33 67.72 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 0.19 2.19 -0.20 12.58 1.01 0.33 -1.39 121.20 135.91 1fbx s ILE 117 Ca 0.74 -1.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.31 1fbx s ILE 117 Cb -0.76 -2.01 0.01 0.00 0.01 0.00 0.00 42.46 39.71 1fbx s ILE 117 CO 0.47 0.40 -0.13 -0.62 0.00 0.00 0.00 174.94 175.06 1fbx s ASP 118 N 1.26 3.68 0.00 3.58 2.15 -0.85 0.67 116.67 127.17 1fbx s ASP 118 Ca 0.02 -0.56 0.00 0.00 0.43 0.00 0.00 52.55 52.44 1fbx s ASP 118 Cb -0.15 -1.60 0.00 0.00 -0.30 0.00 0.00 42.92 40.88 1fbx s ASP 118 CO -0.10 -0.02 0.00 0.61 -0.17 0.00 0.00 175.17 175.49 1fbx n GLY 119 N 4.70 4.24 2.80 2.66 0.00 0.11 -1.86 105.19 117.83 1fbx n GLY 119 Ca -0.20 -1.26 -0.15 0.00 0.00 0.00 0.00 46.02 44.42 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 0.36 0.01 0.06 1.61 3.01 0.09 -2.09 119.74 122.78 1fbx s LYS 120 Ca 0.00 0.14 0.05 0.00 -1.01 0.00 0.00 55.97 55.15 1fbx s LYS 120 Cb 0.00 -0.23 -0.04 0.00 -1.01 0.00 0.00 37.83 36.55 1fbx s LYS 120 CO 0.00 -0.13 -0.04 0.00 0.51 0.00 0.00 175.35 175.69 1fbx s ALA 121 N 0.86 3.15 -0.11 5.17 0.00 0.32 -1.20 121.76 129.96 1fbx s ALA 121 Ca -0.07 -1.11 -0.00 0.00 0.00 0.00 0.00 51.96 50.78 1fbx s ALA 121 Cb -0.11 -1.13 0.02 0.00 0.00 0.00 0.00 23.12 21.91 1fbx s ALA 121 CO -0.02 0.66 -0.08 0.99 0.00 0.00 0.00 175.76 177.31 1fbx s THR 122 N -1.19 1.01 0.10 0.00 2.01 0.92 -0.26 115.64 118.23 1fbx s THR 122 Ca 0.22 -0.30 0.09 0.00 0.31 0.00 0.00 61.69 62.02 1fbx s THR 122 Cb -0.11 -1.02 -0.03 0.00 0.01 0.00 0.00 72.50 71.34 1fbx s THR 122 CO 0.14 0.36 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.51 1fbx s VAL 123 N 1.58 1.94 0.05 3.82 1.01 -0.75 -0.27 120.40 127.78 1fbx s VAL 123 Ca 0.02 -1.55 -0.10 0.00 0.00 0.00 0.00 61.98 60.35 1fbx s VAL 123 Cb -0.13 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.54 1fbx s VAL 123 CO -0.07 0.08 0.22 0.00 0.00 0.00 0.00 175.10 175.33 1fbx s ALA 124 N -1.03 -0.40 0.23 5.51 0.00 -0.05 -1.18 121.76 124.84 1fbx s ALA 124 Ca 0.10 -0.29 -0.21 0.00 0.00 0.00 0.00 51.96 51.56 1fbx s ALA 124 Cb -0.10 0.33 0.04 0.00 0.00 0.00 0.00 23.12 23.39 1fbx s ALA 124 CO 0.04 -0.40 0.66 1.52 0.00 0.00 0.00 175.76 177.58 1fbx s TYR 125 N -2.82 -0.27 -0.25 0.00 1.13 -0.50 -0.57 117.35 114.06 1fbx s TYR 125 Ca -0.03 -0.10 -0.00 0.00 -1.41 0.00 0.00 57.07 55.53 1fbx s TYR 125 Cb 0.00 0.62 0.04 0.00 -1.10 0.00 0.00 41.96 41.52 1fbx s TYR 125 CO -0.05 -1.09 -0.08 0.42 -2.51 0.00 0.00 175.55 172.24 1fbx s ILE 126 N -3.87 2.59 0.21 -3.49 1.01 -0.96 0.06 121.20 116.76 1fbx s ILE 126 Ca 0.08 -1.26 -0.32 0.00 0.00 0.00 0.00 60.65 59.15 1fbx s ILE 126 Cb -0.04 -2.38 -0.13 0.00 0.01 0.00 0.00 42.46 39.92 1fbx s ILE 126 CO 0.00 0.12 1.56 -2.65 0.00 0.00 0.00 174.94 173.96 1fbx n PRO 127 N 4.59 2.31 0.00 2.79 -0.02 -1.26 -4.87 135.00 138.54 1fbx n PRO 127 Ca -0.16 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1fbx n PRO 127 Cb 0.45 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.35 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 2.91 0.00 -0.06 -0.52 4.81 -1.26 -4.65 118.16 119.38 1fbx n LYS 128 Ca 0.14 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.48 1fbx n LYS 128 Cb 0.32 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.22 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 -0.05 0.61 -4.29 3.14 8.00 -1.26 -4.81 116.55 117.90 1fbx n ASP 129 Ca 0.00 0.20 -0.29 0.00 0.71 0.00 0.00 54.79 55.42 1fbx n ASP 129 Cb 0.00 0.33 -0.15 0.00 -0.02 0.00 0.00 41.12 41.28 1fbx n ASP 129 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1fbx s SER 130 N -5.90 2.81 -0.33 -2.24 1.04 -1.26 -0.50 113.70 107.32 1fbx s SER 130 Ca -0.09 -0.50 -0.08 0.00 0.48 0.00 0.00 55.95 55.76 1fbx s SER 130 Cb 0.07 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.94 1fbx s SER 130 CO 0.81 0.25 0.13 -0.69 0.98 0.00 0.00 173.24 174.72 1fbx s VAL 131 N -0.69 4.15 0.51 5.02 1.01 -0.31 -4.75 120.40 125.35 1fbx s VAL 131 Ca 0.09 -0.82 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 1fbx s VAL 131 Cb -0.09 -3.24 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 1fbx s VAL 131 CO 0.01 -0.07 0.99 -0.51 0.00 0.00 0.00 175.10 175.52 1fbx s ILE 132 N 1.50 4.40 -0.11 2.22 2.07 -1.26 -1.73 121.20 128.29 1fbx s ILE 132 Ca 0.02 1.20 -0.29 0.00 -1.41 0.00 0.00 60.65 60.16 1fbx s ILE 132 Cb -0.18 -3.65 -0.04 0.00 0.13 0.00 0.00 42.46 38.72 1fbx s ILE 132 CO 0.04 -0.60 1.51 -0.83 -1.91 0.00 0.00 174.94 173.14 1fbx s GLY 133 N -2.89 1.54 0.13 1.50 0.00 -1.20 -4.91 107.32 101.49 1fbx s GLY 133 Ca 0.60 0.70 -0.20 0.00 0.00 0.00 0.00 44.72 45.83 1fbx s GLY 133 CO 0.29 2.84 1.12 1.04 0.00 0.00 0.00 173.10 178.39 1fbx n LEU 134 N 7.10 -0.69 0.22 0.66 4.77 -1.26 0.87 117.00 128.67 1fbx n LEU 134 Ca 0.16 1.28 0.17 0.00 -0.03 0.00 0.00 56.01 57.60 1fbx n LEU 134 Cb 0.44 -0.20 0.76 0.00 -2.33 0.00 0.00 43.42 42.09 1fbx n LEU 134 CO 0.60 -1.07 1.15 0.77 -1.33 0.00 0.00 177.39 177.51 1fbx h SER 135 N 0.00 0.00 -0.44 -1.43 4.64 -2.01 0.56 113.55 114.87 1fbx h SER 135 Ca 0.15 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.38 1fbx h SER 135 Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 1fbx h SER 135 CO -0.69 0.00 -0.04 0.11 -0.87 0.00 0.00 176.83 175.34 1fbx h LYS 136 N 0.00 0.87 0.22 4.77 1.79 0.11 -0.34 116.57 123.99 1fbx h LYS 136 Ca 0.09 -0.26 0.01 0.00 -2.18 0.00 0.00 60.65 58.31 1fbx h LYS 136 Cb 0.91 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 31.45 1fbx h LYS 136 CO -0.00 0.89 -0.28 0.82 -1.08 0.00 0.00 179.45 179.80 1fbx h ILE 137 N 0.80 0.40 -0.31 1.86 2.04 -0.96 0.14 117.51 121.48 1fbx h ILE 137 Ca 0.14 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.07 1fbx h ILE 137 Cb 0.53 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 36.96 1fbx h ILE 137 CO 0.03 0.00 -0.08 0.78 0.00 0.00 0.00 178.15 178.87 1fbx h ASN 138 N -0.55 -0.31 -0.97 1.72 2.35 -1.56 -1.81 115.58 114.45 1fbx h ASN 138 Ca 0.00 0.10 0.07 0.00 -0.55 0.00 0.00 56.30 55.92 1fbx h ASN 138 Cb 0.53 0.20 -0.07 0.00 0.05 0.00 0.00 38.32 39.04 1fbx h ASN 138 CO -0.10 -0.11 0.62 0.03 -1.65 0.00 0.00 177.43 176.22 1fbx h ARG 139 N -0.01 1.07 -0.37 0.81 3.08 -0.59 -1.38 114.38 117.00 1fbx h ARG 139 Ca 0.15 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 1fbx h ARG 139 Cb 0.24 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1fbx h ARG 139 CO -0.33 0.71 0.02 0.82 -1.07 0.00 0.00 179.97 180.12 1fbx h ILE 140 N 1.10 1.25 0.11 2.04 2.04 -0.20 -1.94 117.51 121.92 1fbx h ILE 140 Ca 0.43 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1fbx h ILE 140 Cb 0.21 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1fbx h ILE 140 CO -0.19 0.32 -0.11 0.58 0.00 0.00 0.00 178.15 178.75 1fbx h VAL 141 N 0.46 0.75 -0.06 1.67 2.07 -0.79 -2.10 116.25 118.25 1fbx h VAL 141 Ca 0.11 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.64 1fbx h VAL 141 Cb 0.43 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1fbx h VAL 141 CO 0.02 0.00 0.05 1.56 0.02 0.00 0.00 177.57 179.21 1fbx h GLN 142 N -0.24 0.00 -0.03 1.57 1.08 -1.17 -0.26 115.11 116.06 1fbx h GLN 142 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1fbx h GLN 142 Cb 0.23 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.66 1fbx h GLN 142 CO -0.03 0.00 0.00 0.35 -0.95 0.00 0.00 178.83 178.20 1fbx h PHE 143 N 0.00 0.05 0.00 2.96 3.57 -0.67 -1.49 116.94 121.36 1fbx h PHE 143 Ca 0.03 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 1fbx h PHE 143 Cb 0.13 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 1fbx h PHE 143 CO 0.00 0.31 -0.16 0.74 -2.23 0.00 0.00 178.31 176.97 1fbx h PHE 144 N -0.23 0.00 -0.00 0.41 0.04 -1.07 -2.89 116.94 113.20 1fbx h PHE 144 Ca 0.01 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.67 1fbx h PHE 144 Cb 0.29 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.43 1fbx h PHE 144 CO 0.02 0.16 -0.53 0.00 -0.60 0.00 0.00 178.31 177.37 1fbx h ALA 145 N 1.84 1.12 0.00 2.45 0.00 -0.91 -3.27 119.26 120.49 1fbx h ALA 145 Ca -0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1fbx h ALA 145 Cb 0.93 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1fbx h ALA 145 CO 0.02 0.66 -0.09 1.04 0.00 0.00 0.00 179.25 180.88 1fbx n GLN 146 N -3.91 1.14 -3.95 0.00 1.13 -0.57 -4.32 117.38 106.90 1fbx n GLN 146 Ca -0.01 -0.29 -0.09 0.00 -1.94 0.00 0.00 57.00 54.67 1fbx n GLN 146 Cb 0.54 -1.37 -0.09 0.00 0.11 0.00 0.00 30.24 29.43 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 0.65 0.67 -0.20 -1.09 0.52 -1.22 -1.48 118.95 116.79 1fbx s ARG 147 Ca 0.19 -0.93 -0.29 0.00 -0.52 0.00 0.00 55.73 54.19 1fbx s ARG 147 Cb 0.09 0.26 -0.04 0.00 0.52 0.00 0.00 34.95 35.78 1fbx s ARG 147 CO 0.00 -0.17 1.74 -2.14 0.02 0.00 0.00 175.30 174.75 1fbx s PRO 148 N -3.29 3.73 0.10 3.54 0.02 -1.26 -4.25 135.00 133.58 1fbx s PRO 148 Ca 0.01 1.81 0.01 0.00 0.02 0.00 0.00 61.00 62.85 1fbx s PRO 148 Cb 0.03 -4.10 0.01 0.00 0.02 0.00 0.00 34.50 30.45 1fbx s PRO 148 CO -0.08 -1.39 0.07 1.04 -0.33 0.00 0.00 177.00 176.31 1fbx n GLN 149 N 7.83 1.38 -3.30 5.54 1.13 0.72 -4.63 117.38 126.05 1fbx n GLN 149 Ca 0.21 -0.63 -0.04 0.00 -1.94 0.00 0.00 57.00 54.60 1fbx n GLN 149 Cb 0.45 0.08 -0.05 0.00 0.11 0.00 0.00 30.24 30.82 1fbx n GLN 149 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1fbx s VAL 150 N -0.55 -0.77 0.32 5.09 1.01 -1.26 -0.33 120.40 123.91 1fbx s VAL 150 Ca 0.05 -0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.10 1fbx s VAL 150 Cb -0.00 -0.88 0.36 0.00 0.00 0.00 0.00 36.38 35.86 1fbx s VAL 150 CO 0.03 -0.06 1.47 1.67 0.00 0.00 0.00 175.10 178.21 1fbx n GLN 151 N 5.39 -0.07 -0.09 2.72 7.27 -1.26 -0.24 117.38 131.11 1fbx n GLN 151 Ca -0.03 1.35 0.01 0.00 0.07 0.00 0.00 57.00 58.40 1fbx n GLN 151 Cb 0.50 -2.27 0.30 0.00 2.41 0.00 0.00 30.24 31.18 1fbx n GLN 151 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1fbx h GLU 152 N 0.00 0.73 -0.00 3.69 3.07 -1.99 -2.67 114.58 117.41 1fbx h GLU 152 Ca 0.67 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.36 59.44 1fbx h GLU 152 Cb 1.61 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 29.37 1fbx h GLU 152 CO -0.81 0.56 -0.06 -0.09 -1.40 0.00 0.00 179.01 177.21 1fbx h ARG 153 N 0.74 0.05 -0.80 2.33 2.43 -1.04 -3.30 114.38 114.79 1fbx h ARG 153 Ca 0.19 -0.05 0.17 0.00 -0.81 0.00 0.00 59.98 59.48 1fbx h ARG 153 Cb 0.06 0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 29.47 1fbx h ARG 153 CO -0.03 0.79 -0.12 1.25 -1.51 0.00 0.00 179.97 180.35 1fbx h LEU 154 N -0.68 -0.60 -0.36 3.80 5.85 -1.32 -0.87 115.31 121.14 1fbx h LEU 154 Ca -0.01 0.23 0.05 0.00 0.84 0.00 0.00 57.88 59.00 1fbx h LEU 154 Cb 0.80 0.45 -0.05 0.00 0.37 0.00 0.00 40.66 42.23 1fbx h LEU 154 CO 0.01 -0.25 0.06 0.74 -0.34 0.00 0.00 178.44 178.67 1fbx h THR 155 N 0.03 0.81 0.88 1.05 2.02 -1.58 -1.73 112.91 114.39 1fbx h THR 155 Ca 0.41 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.48 1fbx h THR 155 Cb 0.68 0.61 0.01 0.00 -1.74 0.00 0.00 68.15 67.71 1fbx h THR 155 CO -0.78 0.03 -0.42 1.56 0.37 0.00 0.00 175.52 176.28 1fbx h GLN 156 N 0.18 -1.14 -0.87 6.66 1.08 -1.28 -0.27 115.11 119.47 1fbx h GLN 156 Ca 0.17 0.08 0.14 0.00 -1.45 0.00 0.00 58.65 57.59 1fbx h GLN 156 Cb 0.20 0.26 -0.15 0.00 -0.05 0.00 0.00 27.48 27.74 1fbx h GLN 156 CO -0.23 -0.76 -0.37 1.96 -0.95 0.00 0.00 178.83 178.48 1fbx h GLN 157 N -1.19 -0.05 -0.82 1.46 4.20 -1.08 0.80 115.11 118.42 1fbx h GLN 157 Ca -0.12 0.00 0.05 0.00 0.06 0.00 0.00 58.65 58.64 1fbx h GLN 157 Cb 0.91 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.64 1fbx h GLN 157 CO 0.20 -0.03 0.51 0.82 -0.67 0.00 0.00 178.83 179.66 1fbx h ILE 158 N -0.05 1.06 -0.22 2.54 2.04 -1.17 0.34 117.51 122.05 1fbx h ILE 158 Ca 0.31 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1fbx h ILE 158 Cb 0.58 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 1fbx h ILE 158 CO -0.89 0.17 0.10 0.25 0.00 0.00 0.00 178.15 177.79 1fbx h LEU 159 N 0.96 0.30 0.32 1.44 5.85 0.23 -2.15 115.31 122.25 1fbx h LEU 159 Ca 0.35 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 1fbx h LEU 159 Cb 0.12 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1fbx h LEU 159 CO -0.15 0.35 -0.15 0.40 -0.34 0.00 0.00 178.44 178.55 1fbx h ILE 160 N 0.23 0.70 -0.49 4.05 1.08 -0.10 -0.30 117.51 122.67 1fbx h ILE 160 Ca 0.08 -0.48 0.06 0.00 -0.39 0.00 0.00 64.86 64.13 1fbx h ILE 160 Cb 0.14 0.95 -0.09 0.00 -3.07 0.00 0.00 36.82 34.74 1fbx h ILE 160 CO -0.01 0.09 -0.51 0.00 -0.69 0.00 0.00 178.15 177.04 1fbx h ALA 161 N -0.12 -0.60 -0.10 1.87 0.00 -0.97 0.35 119.26 119.68 1fbx h ALA 161 Ca -0.04 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1fbx h ALA 161 Cb 0.48 1.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.30 1fbx h ALA 161 CO 0.07 -0.96 -0.11 -0.07 0.00 0.00 0.00 179.25 178.17 1fbx h LEU 162 N -0.32 -0.35 -0.55 0.00 3.38 -1.37 -1.44 115.31 114.65 1fbx h LEU 162 Ca 0.12 0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.27 1fbx h LEU 162 Cb 0.58 0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.40 1fbx h LEU 162 CO -0.64 -0.15 -0.05 1.56 0.09 0.00 0.00 178.44 179.25 1fbx h GLN 163 N -0.14 0.07 0.05 1.13 4.20 0.16 0.17 115.11 120.75 1fbx h GLN 163 Ca 0.08 -0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1fbx h GLN 163 Cb 0.26 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1fbx h GLN 163 CO -0.19 0.05 -0.05 1.15 -0.67 0.00 0.00 178.83 179.12 1fbx h THR 164 N 0.07 0.00 -0.53 -0.54 2.02 0.14 -1.53 112.91 112.54 1fbx h THR 164 Ca 0.28 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.56 1fbx h THR 164 Cb 0.44 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.74 1fbx h THR 164 CO -0.50 0.00 -0.24 -0.07 0.37 0.00 0.00 175.52 175.07 1fbx h LEU 165 N -0.09 -0.85 0.00 2.58 3.38 -0.94 -0.70 115.31 118.69 1fbx h LEU 165 Ca -0.01 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1fbx h LEU 165 Cb 0.08 0.46 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1fbx h LEU 165 CO -0.01 -0.26 0.00 0.18 0.09 0.00 0.00 178.44 178.44 1fbx n LEU 166 N -5.42 0.00 -3.53 1.67 4.77 0.58 -4.91 117.00 110.16 1fbx n LEU 166 Ca 0.04 0.47 -0.19 0.00 -0.03 0.00 0.00 56.01 56.31 1fbx n LEU 166 Cb 0.33 -0.47 0.07 0.00 -2.33 0.00 0.00 43.42 41.02 1fbx n LEU 166 CO 0.05 -0.21 0.04 0.61 -1.33 0.00 0.00 177.39 176.56 1fbx n GLY 167 N 0.17 -0.34 3.44 -0.72 0.00 -0.27 -4.73 105.19 102.73 1fbx n GLY 167 Ca 0.04 0.12 -0.11 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.48 0.00 -0.16 2.61 2.01 -1.04 -4.88 115.64 110.71 1fbx s THR 168 Ca 0.01 -0.01 0.20 0.00 0.31 0.00 0.00 61.69 62.20 1fbx s THR 168 Cb -0.00 -1.01 -0.29 0.00 0.01 0.00 0.00 72.50 71.21 1fbx s THR 168 CO 0.76 0.00 0.49 0.59 -0.69 0.00 0.00 174.62 175.78 1fbx n ASN 169 N -0.35 0.54 -4.52 3.53 3.02 -1.26 -4.44 115.26 111.77 1fbx n ASN 169 Ca -0.15 -0.15 -0.33 0.00 -0.03 0.00 0.00 54.58 53.91 1fbx n ASN 169 Cb 0.64 1.77 -0.04 0.00 -0.61 0.00 0.00 39.78 41.54 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 -2.07 3.62 -3.87 6.41 3.02 -1.26 -2.42 115.26 118.68 1fbx n ASN 170 Ca -0.02 -2.77 -0.12 0.00 -0.03 0.00 0.00 54.58 51.64 1fbx n ASN 170 Cb 0.48 -1.72 -0.13 0.00 -0.61 0.00 0.00 39.78 37.80 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 8.65 0.01 -0.03 2.41 1.01 -1.25 -2.27 120.40 128.93 1fbx s VAL 171 Ca 0.63 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.58 1fbx s VAL 171 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 36.38 36.33 1fbx s VAL 171 CO 0.12 -0.03 -0.12 0.00 0.00 0.00 0.00 175.10 175.06 1fbx s ALA 172 N -0.08 1.10 -0.05 5.51 0.00 0.26 -2.60 121.76 125.91 1fbx s ALA 172 Ca -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.51 1fbx s ALA 172 Cb -0.01 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.73 1fbx s ALA 172 CO 0.00 0.19 -0.11 0.08 0.00 0.00 0.00 175.76 175.92 1fbx s VAL 173 N 0.15 0.97 -0.05 0.00 1.01 -0.85 -0.87 120.40 120.76 1fbx s VAL 173 Ca -0.04 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 1fbx s VAL 173 Cb -0.10 -0.88 0.03 0.00 0.00 0.00 0.00 36.38 35.43 1fbx s VAL 173 CO 0.01 0.31 0.01 -0.55 0.00 0.00 0.00 175.10 174.88 1fbx s SER 174 N 0.48 1.00 -0.03 3.32 0.15 0.63 -0.54 113.70 118.70 1fbx s SER 174 Ca -0.09 -0.02 0.06 0.00 0.70 0.00 0.00 55.95 56.59 1fbx s SER 174 Cb -0.13 -0.28 -0.02 0.00 -1.71 0.00 0.00 66.02 63.88 1fbx s SER 174 CO 0.02 -0.16 -0.20 -0.63 1.20 0.00 0.00 173.24 173.47 1fbx s ILE 175 N 1.60 2.60 -0.11 6.45 1.01 -0.55 -0.05 121.20 132.15 1fbx s ILE 175 Ca -0.01 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.73 1fbx s ILE 175 Cb -0.13 -1.97 0.02 0.00 0.01 0.00 0.00 42.46 40.39 1fbx s ILE 175 CO -0.03 0.58 -0.11 -0.62 0.00 0.00 0.00 174.94 174.76 1fbx s ASP 176 N -0.69 2.21 0.24 3.58 3.68 -0.34 -1.82 116.67 123.51 1fbx s ASP 176 Ca 0.11 -0.35 -0.11 0.00 2.13 0.00 0.00 52.55 54.33 1fbx s ASP 176 Cb -0.10 -0.93 -0.01 0.00 -1.45 0.00 0.00 42.92 40.42 1fbx s ASP 176 CO -0.00 -0.05 0.41 0.00 0.13 0.00 0.00 175.17 175.66 1fbx s ALA 177 N 1.32 0.03 0.01 3.66 0.00 -0.46 -0.74 121.76 125.58 1fbx s ALA 177 Ca -0.01 -1.03 0.08 0.00 0.00 0.00 0.00 51.96 50.99 1fbx s ALA 177 Cb -0.14 1.13 -0.03 0.00 0.00 0.00 0.00 23.12 24.08 1fbx s ALA 177 CO -0.05 -0.80 -0.23 0.08 0.00 0.00 0.00 175.76 174.77 1fbx s VAL 178 N -4.04 2.41 -0.25 0.00 1.01 -0.78 -1.11 120.40 117.64 1fbx s VAL 178 Ca 0.25 -1.17 -0.03 0.00 0.00 0.00 0.00 61.98 61.03 1fbx s VAL 178 Cb 0.01 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.46 1fbx s VAL 178 CO 0.09 0.45 -0.03 -1.00 0.00 0.00 0.00 175.10 174.61 1fbx s HIS 179 N -0.77 3.03 -1.51 5.22 3.76 -1.26 -2.01 115.29 121.75 1fbx s HIS 179 Ca 0.12 -1.20 0.19 0.00 -0.15 0.00 0.00 55.06 54.02 1fbx s HIS 179 Cb -0.10 -2.11 0.98 0.00 1.11 0.00 0.00 32.58 32.46 1fbx s HIS 179 CO 0.02 -0.63 1.58 0.66 -0.85 0.00 0.00 174.74 175.52 1fbx n TYR 180 N 4.76 0.00 1.07 1.40 4.02 -0.49 -0.16 117.16 127.76 1fbx n TYR 180 Ca -0.17 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.85 1fbx n TYR 180 Cb 0.49 -0.24 0.48 0.00 -0.02 0.00 0.00 39.34 40.04 1fbx n TYR 180 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fbx n VAL 182 N -1.41 1.11 -0.10 0.00 0.31 0.77 -4.49 118.33 114.53 1fbx n VAL 182 Ca 0.08 -0.57 -0.23 0.00 -0.01 0.00 0.00 64.34 63.61 1fbx n VAL 182 Cb 0.33 -0.85 -0.12 0.00 -0.91 0.00 0.00 33.84 32.29 1fbx n VAL 182 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1fbx n LYS 183 N -2.79 0.59 0.09 5.55 4.81 -0.38 -1.76 118.16 124.26 1fbx n LYS 183 Ca -0.30 0.52 0.11 0.00 -0.87 0.00 0.00 58.31 57.76 1fbx n LYS 183 Cb 0.95 -1.72 0.44 0.00 0.02 0.00 0.00 35.03 34.73 1fbx n LYS 183 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fbx n ALA 184 N -3.47 1.70 -3.00 3.14 0.00 0.48 -4.42 120.51 114.94 1fbx n ALA 184 Ca -0.35 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1fbx n ALA 184 Cb 0.74 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1fbx n ALA 184 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1fbx n ARG 185 N -2.03 0.00 0.00 0.00 0.00 -1.25 -4.97 116.66 108.41 1fbx n ARG 185 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 1fbx n ARG 185 Cb 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.68 1fbx n ARG 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1fbx n GLY 186 N 0.00 3.17 0.01 2.89 0.00 -1.26 -1.37 105.19 108.63 1fbx n GLY 186 Ca 0.00 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 45.97 1fbx n GLY 186 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1fbx n ILE 187 N 0.00 0.37 -3.91 -0.61 3.06 -1.26 -4.94 119.36 112.07 1fbx n ILE 187 Ca 0.00 0.06 -0.26 0.00 -2.50 0.00 0.00 62.75 60.05 1fbx n ILE 187 Cb 0.00 -0.68 -0.00 0.00 0.54 0.00 0.00 39.64 39.50 1fbx n ILE 187 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1fbx n ARG 188 N -1.59 -3.88 -2.65 9.51 1.74 -0.47 -4.92 116.66 114.39 1fbx n ARG 188 Ca 0.06 0.47 -0.42 0.00 -0.77 0.00 0.00 57.85 57.19 1fbx n ARG 188 Cb 0.29 -4.82 -0.03 0.00 -1.02 0.00 0.00 32.46 26.88 1fbx n ARG 188 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1fbx s ASP 189 N -4.19 7.33 -0.13 0.55 -1.08 -0.72 -4.89 116.67 113.53 1fbx s ASP 189 Ca 0.12 1.76 0.15 0.00 -0.52 0.00 0.00 52.55 54.06 1fbx s ASP 189 Cb -0.06 -2.58 0.55 0.00 -1.46 0.00 0.00 42.92 39.37 1fbx s ASP 189 CO 0.87 -0.27 1.46 0.00 0.52 0.00 0.00 175.17 177.75 1fbx n ALA 190 N 3.70 2.93 0.00 3.66 0.00 -1.26 -3.91 120.51 125.63 1fbx n ALA 190 Ca 0.06 -1.87 0.00 0.00 0.00 0.00 0.00 53.44 51.63 1fbx n ALA 190 Cb 0.50 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.19 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 0.16 0.00 -2.37 0.00 -2.24 -1.26 -5.11 114.28 103.46 1fbx n THR 191 Ca 0.21 -0.06 -0.33 0.00 -2.27 0.00 0.00 64.05 61.60 1fbx n THR 191 Cb 0.82 0.90 -0.03 0.00 -2.10 0.00 0.00 70.33 69.93 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 -0.15 6.36 -0.03 3.42 1.04 -1.26 -5.08 113.70 118.00 1fbx s SER 192 Ca 0.00 1.72 -0.12 0.00 0.48 0.00 0.00 55.95 58.04 1fbx s SER 192 Cb 0.00 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.61 1fbx s SER 192 CO 0.00 -0.77 0.25 0.00 0.98 0.00 0.00 173.24 173.70 1fbx s ALA 193 N -2.40 -0.63 -0.03 5.32 0.00 -1.26 -4.75 121.76 118.00 1fbx s ALA 193 Ca 0.62 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.88 1fbx s ALA 193 Cb -0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1fbx s ALA 193 CO 0.29 -0.22 -0.03 0.99 0.00 0.00 0.00 175.76 176.79 1fbx s THR 194 N -1.04 3.97 -0.06 0.00 2.01 -0.27 -4.94 115.64 115.32 1fbx s THR 194 Ca -0.11 -0.55 0.04 0.00 0.31 0.00 0.00 61.69 61.38 1fbx s THR 194 Cb -0.05 -2.71 -0.00 0.00 0.01 0.00 0.00 72.50 69.74 1fbx s THR 194 CO 0.03 0.47 -0.19 -0.89 -0.69 0.00 0.00 174.62 173.34 1fbx s THR 195 N -0.97 1.65 0.01 -0.82 2.01 -1.26 -1.35 115.64 114.90 1fbx s THR 195 Ca 0.16 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 61.37 1fbx s THR 195 Cb -0.11 -1.42 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 1fbx s THR 195 CO 0.06 0.47 -0.07 0.42 -0.69 0.00 0.00 174.62 174.81 1fbx s THR 196 N 0.16 0.56 0.00 -0.82 -4.23 -0.76 -5.02 115.64 105.53 1fbx s THR 196 Ca -0.09 -0.58 -0.01 0.00 -1.18 0.00 0.00 61.69 59.84 1fbx s THR 196 Cb -0.14 -0.53 -0.01 0.00 1.34 0.00 0.00 72.50 73.17 1fbx s THR 196 CO 0.04 -0.03 0.01 0.42 -0.54 0.00 0.00 174.62 174.51 1fbx s THR 197 N -0.58 0.04 -0.23 3.99 -4.23 -1.26 -1.49 115.64 111.88 1fbx s THR 197 Ca -0.01 -0.33 0.01 0.00 -1.18 0.00 0.00 61.69 60.18 1fbx s THR 197 Cb -0.05 -0.12 0.05 0.00 1.34 0.00 0.00 72.50 73.72 1fbx s THR 197 CO 0.00 -0.18 -0.09 -0.44 -0.54 0.00 0.00 174.62 173.37 1fbx s SER 198 N -0.54 3.82 -0.03 3.99 0.01 0.29 -5.01 113.70 116.23 1fbx s SER 198 Ca -0.06 -1.11 -0.02 0.00 1.31 0.00 0.00 55.95 56.07 1fbx s SER 198 Cb -0.04 -1.31 -0.04 0.00 0.21 0.00 0.00 66.02 64.85 1fbx s SER 198 CO -0.00 -0.18 0.09 -0.76 0.41 0.00 0.00 173.24 172.80 1fbx s LEU 199 N 1.31 4.00 0.05 2.44 1.43 -1.26 -2.01 118.68 124.64 1fbx s LEU 199 Ca -0.05 0.23 -0.00 0.00 -1.03 0.00 0.00 54.13 53.28 1fbx s LEU 199 Cb -0.18 -2.23 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 1fbx s LEU 199 CO -0.07 0.31 -0.04 -0.83 0.23 0.00 0.00 176.35 175.95 1fbx s GLY 200 N -1.54 0.44 0.00 -3.19 0.00 -1.07 -4.64 107.32 97.33 1fbx s GLY 200 Ca 0.21 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1fbx s GLY 200 CO 0.11 -1.13 0.00 0.61 0.00 0.00 0.00 173.10 172.70 1fbx n GLY 201 N 0.57 0.88 0.46 0.20 0.00 -1.02 -1.69 105.19 104.59 1fbx n GLY 201 Ca -0.17 -0.69 0.39 0.00 0.00 0.00 0.00 46.02 45.55 1fbx n GLY 201 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fbx n LEU 202 N 0.00 0.20 0.19 0.99 4.77 -1.26 0.20 117.00 122.08 1fbx n LEU 202 Ca 0.00 1.32 0.15 0.00 -0.03 0.00 0.00 56.01 57.45 1fbx n LEU 202 Cb 0.00 -0.65 0.75 0.00 -2.33 0.00 0.00 43.42 41.19 1fbx n LEU 202 CO 0.00 -1.43 1.13 -0.26 -1.33 0.00 0.00 177.39 175.50 1fbx h PHE 203 N 0.00 0.00 0.01 -1.77 0.04 -1.61 -0.07 116.94 113.54 1fbx h PHE 203 Ca 0.85 0.00 -0.38 0.00 2.80 0.00 0.00 57.97 61.24 1fbx h PHE 203 Cb 2.74 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 40.84 1fbx h PHE 203 CO -0.01 0.00 -2.13 1.17 -0.60 0.00 0.00 178.31 176.75 1fbx n LYS 204 N -4.16 0.61 0.01 1.51 4.81 0.54 -4.09 118.16 117.39 1fbx n LYS 204 Ca 0.02 0.33 -0.05 0.00 -0.87 0.00 0.00 58.31 57.73 1fbx n LYS 204 Cb 0.29 -1.59 -0.04 0.00 0.02 0.00 0.00 35.03 33.71 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 -0.70 -0.12 -2.63 3.14 4.64 -1.21 -3.45 113.55 113.23 1fbx h SER 205 Ca -0.56 -0.20 -0.54 0.00 -0.47 0.00 0.00 61.79 60.02 1fbx h SER 205 Cb 1.63 0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.75 1fbx h SER 205 CO -0.25 0.45 1.07 -0.55 -0.87 0.00 0.00 176.83 176.68 1fbx s SER 206 N -5.52 6.66 0.22 4.97 0.15 -0.06 -4.89 113.70 115.23 1fbx s SER 206 Ca -0.06 2.29 -0.03 0.00 0.70 0.00 0.00 55.95 58.85 1fbx s SER 206 Cb -0.00 -2.54 0.21 0.00 -1.71 0.00 0.00 66.02 61.98 1fbx s SER 206 CO 0.22 -0.91 1.62 -0.61 1.20 0.00 0.00 173.24 174.76 1fbx h GLN 207 N 9.30 0.68 0.31 5.44 5.75 -1.87 0.06 115.11 134.78 1fbx h GLN 207 Ca -0.40 -0.30 -0.02 0.00 -0.15 0.00 0.00 58.65 57.78 1fbx h GLN 207 Cb 1.18 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.72 1fbx h GLN 207 CO 0.95 0.89 -0.15 -0.97 -2.65 0.00 0.00 178.83 176.90 1fbx h ASN 208 N 0.58 -0.36 -0.39 -0.69 -1.24 -1.93 -1.58 115.58 109.98 1fbx h ASN 208 Ca 0.07 -0.07 -0.03 0.00 0.71 0.00 0.00 56.30 56.98 1fbx h ASN 208 Cb 0.80 0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.92 1fbx h ASN 208 CO 0.07 -0.15 0.13 0.74 -1.29 0.00 0.00 177.43 176.93 1fbx h THR 209 N -0.55 1.21 -0.72 -3.57 2.02 -1.83 -2.01 112.91 107.45 1fbx h THR 209 Ca -0.04 -0.67 0.09 0.00 0.77 0.00 0.00 66.41 66.56 1fbx h THR 209 Cb 0.41 0.92 -0.07 0.00 -1.74 0.00 0.00 68.15 67.66 1fbx h THR 209 CO 0.07 0.24 0.36 -0.09 0.37 0.00 0.00 175.52 176.47 1fbx h ARG 210 N 0.48 0.60 0.00 6.66 2.43 -0.95 -1.47 114.38 122.12 1fbx h ARG 210 Ca 0.13 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1fbx h ARG 210 Cb 0.23 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1fbx h ARG 210 CO -0.01 0.40 0.00 0.45 -1.51 0.00 0.00 179.97 179.30 1fbx h HIS 211 N 0.62 0.00 -0.03 2.20 3.86 -1.07 -1.90 115.15 118.82 1fbx h HIS 211 Ca 0.35 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.30 1fbx h HIS 211 Cb 0.36 0.00 0.02 0.00 1.06 0.00 0.00 27.41 28.85 1fbx h HIS 211 CO -0.10 0.00 -0.99 0.93 0.86 0.00 0.00 177.93 178.63 1fbx h GLU 212 N 0.00 0.73 0.52 2.45 5.08 -0.54 -0.79 114.58 122.03 1fbx h GLU 212 Ca 0.00 -0.74 -0.03 0.00 -1.00 0.00 0.00 59.36 57.60 1fbx h GLU 212 Cb 0.72 0.20 0.01 0.00 0.50 0.00 0.00 28.75 30.18 1fbx h GLU 212 CO 0.00 1.32 -0.25 0.35 -1.00 0.00 0.00 179.01 179.43 1fbx h PHE 213 N 0.43 -0.65 -1.00 4.33 3.57 -1.34 -2.96 116.94 119.33 1fbx h PHE 213 Ca -0.11 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.57 1fbx h PHE 213 Cb 1.63 0.21 -0.10 0.00 2.79 0.00 0.00 35.95 40.48 1fbx h PHE 213 CO 0.10 -0.36 0.61 -0.07 -2.23 0.00 0.00 178.31 176.36 1fbx h LEU 214 N -1.14 0.72 -1.30 0.59 3.38 -1.44 0.23 115.31 116.35 1fbx h LEU 214 Ca -0.07 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1fbx h LEU 214 Cb 0.58 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1fbx h LEU 214 CO 0.12 0.24 0.19 -0.09 0.09 0.00 0.00 178.44 178.99 1fbx h ARG 215 N 0.69 0.67 0.00 1.13 2.43 -1.14 -2.71 114.38 115.45 1fbx h ARG 215 Ca 0.58 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.66 1fbx h ARG 215 Cb 1.00 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 1fbx h ARG 215 CO -0.37 0.55 -0.39 0.00 -1.51 0.00 0.00 179.97 178.25 1fbx n ALA 216 N -2.46 3.04 -1.42 2.80 0.00 -0.01 -4.92 120.51 117.53 1fbx n ALA 216 Ca 0.04 -0.25 -0.32 0.00 0.00 0.00 0.00 53.44 52.91 1fbx n ALA 216 Cb 0.15 -1.23 0.06 0.00 0.00 0.00 0.00 19.45 18.43 1fbx n ALA 216 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1fbx s VAL 217 N -3.05 3.46 -0.15 0.00 1.01 -0.75 -4.57 120.40 116.34 1fbx s VAL 217 Ca 0.10 0.55 -0.02 0.00 0.00 0.00 0.00 61.98 62.62 1fbx s VAL 217 Cb 0.16 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.45 1fbx s VAL 217 CO 0.66 -0.54 0.17 -1.14 0.00 0.00 0.00 175.10 174.25 1fbx n ARG 218 N -2.98 -0.45 -3.53 2.72 3.00 -1.26 -5.02 116.66 109.15 1fbx n ARG 218 Ca 0.09 0.82 -0.35 0.00 -0.00 0.00 0.00 57.85 58.41 1fbx n ARG 218 Cb 0.53 -2.57 -0.06 0.00 0.00 0.00 0.00 32.46 30.35 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 -0.88 3.84 -1.55 -0.14 8.25 -1.26 -5.02 115.22 118.46 1fbx n HIS 219 Ca 0.01 -3.94 -0.24 0.00 -0.26 0.00 0.00 57.72 53.29 1fbx n HIS 219 Cb 0.34 -1.04 -0.07 0.00 1.12 0.00 0.00 29.99 30.34 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 1.91 1.16 -0.31 4.41 -0.00 -1.26 -4.87 115.22 116.25 1fbx n HIS 220 Ca 0.24 0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.47 1fbx n HIS 220 Cb 0.37 -2.47 0.00 0.00 -0.12 0.00 0.00 29.99 27.77 1fbx n HIS 220 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89