#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 -4.55 3.54 2.88 -1.26 -5.16 113.62 109.07 1fbx n SER 2 Ca 0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 1fbx n SER 2 Cb 0.00 0.13 -0.11 0.00 -0.75 0.00 0.00 64.21 63.49 1fbx n SER 2 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1fbx s LEU 3 N -2.81 2.63 0.34 2.46 1.43 -1.26 -4.76 118.68 116.71 1fbx s LEU 3 Ca 0.00 -1.35 0.08 0.00 -1.03 0.00 0.00 54.13 51.83 1fbx s LEU 3 Cb 0.00 -0.73 -0.04 0.00 0.03 0.00 0.00 46.19 45.46 1fbx s LEU 3 CO 0.00 -0.48 0.20 -0.94 0.23 0.00 0.00 176.35 175.36 1fbx s SER 4 N -3.62 4.90 0.00 2.29 1.04 -1.26 -4.97 113.70 112.07 1fbx s SER 4 Ca 0.35 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1fbx s SER 4 Cb 0.09 -0.80 0.00 0.00 0.10 0.00 0.00 66.02 65.41 1fbx s SER 4 CO 0.17 -0.33 0.60 0.29 0.98 0.00 0.00 173.24 174.94 1fbx n LYS 5 N -1.24 0.00 -0.23 4.02 5.02 -1.26 -0.68 118.16 123.79 1fbx n LYS 5 Ca -0.02 0.38 -0.02 0.00 -2.02 0.00 0.00 58.31 56.63 1fbx n LYS 5 Cb 0.61 -1.10 0.04 0.00 -0.02 0.00 0.00 35.03 34.56 1fbx n LYS 5 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1fbx h GLU 6 N 0.00 -0.07 -0.67 1.97 3.07 -1.97 0.21 114.58 117.12 1fbx h GLU 6 Ca 0.00 0.01 0.14 0.00 -0.50 0.00 0.00 59.36 59.01 1fbx h GLU 6 Cb 0.00 0.02 -0.10 0.00 -0.84 0.00 0.00 28.75 27.82 1fbx h GLU 6 CO 0.00 -0.05 0.09 0.00 -1.40 0.00 0.00 179.01 177.65 1fbx h ALA 7 N 1.37 0.77 -0.25 3.43 0.00 -1.86 0.98 119.26 123.70 1fbx h ALA 7 Ca 0.29 0.17 -0.16 0.00 0.00 0.00 0.00 54.91 55.21 1fbx h ALA 7 Cb 0.54 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1fbx h ALA 7 CO -0.71 -0.36 -0.46 0.00 0.00 0.00 0.00 179.25 177.72 1fbx h ALA 8 N 1.57 0.40 -0.25 0.00 0.00 0.95 -1.74 119.26 120.19 1fbx h ALA 8 Ca 0.36 -0.48 0.07 0.00 0.00 0.00 0.00 54.91 54.87 1fbx h ALA 8 Cb 0.60 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1fbx h ALA 8 CO -0.51 0.55 0.19 1.25 0.00 0.00 0.00 179.25 180.73 1fbx h LEU 9 N 0.50 0.00 0.00 0.00 6.46 0.74 -0.88 115.31 122.13 1fbx h LEU 9 Ca 0.01 0.00 -0.08 0.00 -0.12 0.00 0.00 57.88 57.69 1fbx h LEU 9 Cb 1.07 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.99 1fbx h LEU 9 CO 0.10 0.00 -0.62 0.58 -0.62 0.00 0.00 178.44 177.88 1fbx h VAL 10 N 0.00 0.63 -0.14 1.05 2.07 -0.72 -3.12 116.25 116.01 1fbx h VAL 10 Ca 0.12 -1.65 0.04 0.00 0.82 0.00 0.00 66.70 66.03 1fbx h VAL 10 Cb 0.49 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1fbx h VAL 10 CO -0.00 0.21 0.46 -0.74 0.02 0.00 0.00 177.57 177.52 1fbx h HIS 11 N -1.00 0.00 0.03 1.57 -0.00 -1.20 0.38 115.15 114.94 1fbx h HIS 11 Ca -0.13 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.11 1fbx h HIS 11 Cb 0.80 0.00 0.01 0.00 -0.00 0.00 0.00 27.41 28.22 1fbx h HIS 11 CO 0.01 0.00 -0.52 0.93 -0.00 0.00 0.00 177.93 178.35 1fbx h GLU 12 N 0.00 0.29 -0.18 5.26 5.08 -1.25 -2.68 114.58 121.10 1fbx h GLU 12 Ca 0.07 -0.36 -0.08 0.00 -1.00 0.00 0.00 59.36 57.99 1fbx h GLU 12 Cb 0.98 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 1fbx h GLU 12 CO -0.00 1.08 -0.23 0.00 -1.00 0.00 0.00 179.01 178.87 1fbx h ALA 13 N 0.22 1.28 -0.16 3.43 0.00 -0.25 -0.98 119.26 122.80 1fbx h ALA 13 Ca -0.08 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1fbx h ALA 13 Cb 1.29 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1fbx h ALA 13 CO 0.10 0.48 -0.15 -0.07 0.00 0.00 0.00 179.25 179.61 1fbx h LEU 14 N 0.29 0.42 -0.51 0.00 3.38 -1.19 -1.73 115.31 115.98 1fbx h LEU 14 Ca 0.05 -0.47 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 1fbx h LEU 14 Cb 0.57 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1fbx h LEU 14 CO 0.04 0.81 0.28 0.58 0.09 0.00 0.00 178.44 180.24 1fbx h VAL 15 N 0.04 1.17 -0.75 1.22 2.07 -1.25 0.17 116.25 118.91 1fbx h VAL 15 Ca 0.03 -0.42 0.05 0.00 0.82 0.00 0.00 66.70 67.17 1fbx h VAL 15 Cb 0.69 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 1fbx h VAL 15 CO 0.04 0.18 0.46 0.00 0.02 0.00 0.00 177.57 178.26 1fbx h ALA 16 N 1.12 1.00 -0.00 1.67 0.00 -1.15 -1.62 119.26 120.29 1fbx h ALA 16 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1fbx h ALA 16 Cb 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1fbx h ALA 16 CO -0.03 0.20 -0.10 0.54 0.00 0.00 0.00 179.25 179.86 1fbx n ARG 17 N -4.68 0.08 -2.24 0.00 3.00 -0.65 -4.93 116.66 107.24 1fbx n ARG 17 Ca 0.09 -0.01 -0.06 0.00 -0.01 0.00 0.00 57.85 57.86 1fbx n ARG 17 Cb 0.14 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.10 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 1.47 0.22 0.40 -0.13 0.00 0.40 -4.95 105.19 102.60 1fbx n GLY 18 Ca 0.08 -0.61 0.04 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.97 2.09 -4.77 0.99 4.77 -0.14 -5.02 117.00 113.96 1fbx n LEU 19 Ca -0.05 -1.37 -0.34 0.00 -0.03 0.00 0.00 56.01 54.22 1fbx n LEU 19 Cb 0.54 -0.07 0.03 0.00 -2.33 0.00 0.00 43.42 41.60 1fbx n LEU 19 CO 0.09 0.46 0.77 -1.61 -1.33 0.00 0.00 177.39 175.78 1fbx s GLU 20 N -0.82 2.95 0.23 3.23 0.41 -1.23 -4.84 118.70 118.64 1fbx s GLU 20 Ca 0.13 1.53 -0.32 0.00 -0.41 0.00 0.00 54.97 55.90 1fbx s GLU 20 Cb 0.08 -1.96 -0.13 0.00 -1.78 0.00 0.00 34.13 30.35 1fbx s GLU 20 CO 0.11 -1.15 1.58 2.41 -0.49 0.00 0.00 175.26 177.72 1fbx n THR 21 N -2.00 0.56 -1.53 3.63 -1.04 -1.26 -4.74 114.28 107.90 1fbx n THR 21 Ca 0.11 -0.14 -0.39 0.00 -2.04 0.00 0.00 64.05 61.59 1fbx n THR 21 Cb 0.51 -1.78 -0.07 0.00 -1.82 0.00 0.00 70.33 67.17 1fbx n THR 21 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1fbx n PRO 22 N 2.82 0.74 -4.37 -2.82 -0.02 -1.26 -4.89 135.00 125.21 1fbx n PRO 22 Ca 0.13 0.03 -0.25 0.00 -2.02 0.00 0.00 63.50 61.38 1fbx n PRO 22 Cb 0.34 -2.77 -0.10 0.00 -0.02 0.00 0.00 33.50 30.95 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 10.80 2.79 0.06 2.45 1.02 -1.26 -5.14 118.68 129.40 1fbx s LEU 23 Ca 1.11 -0.77 0.09 0.00 0.02 0.00 0.00 54.13 54.58 1fbx s LEU 23 Cb -0.56 -1.41 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 1fbx s LEU 23 CO 0.35 0.08 -0.25 -0.13 0.02 0.00 0.00 176.35 176.41 1fbx s ARG 24 N -3.09 1.76 0.36 1.70 0.52 -1.26 -5.11 118.95 113.84 1fbx s ARG 24 Ca 0.26 -1.14 -0.28 0.00 -0.52 0.00 0.00 55.73 54.05 1fbx s ARG 24 Cb -0.07 -2.00 -0.10 0.00 0.52 0.00 0.00 34.95 33.30 1fbx s ARG 24 CO 0.15 0.50 1.38 -2.14 0.02 0.00 0.00 175.30 175.21 1fbx s PRO 25 N -1.44 4.19 0.00 3.54 0.02 -1.26 -4.82 135.00 135.23 1fbx s PRO 25 Ca 0.13 2.36 0.00 0.00 0.02 0.00 0.00 61.00 63.50 1fbx s PRO 25 Cb -0.10 -2.98 0.00 0.00 0.02 0.00 0.00 34.50 31.44 1fbx s PRO 25 CO 0.03 -0.38 0.82 -2.30 -0.33 0.00 0.00 177.00 174.84 1fbx n PRO 26 N 0.55 0.00 0.00 5.54 -0.02 -1.26 -4.84 135.00 134.97 1fbx n PRO 26 Ca 0.01 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 1fbx n PRO 26 Cb 0.41 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 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 -1.32 0.00 -4.37 -1.45 0.31 -1.26 -4.66 118.33 105.58 1fbx n VAL 27 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.02 1fbx n VAL 27 Cb 0.16 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.99 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 2.78 -0.98 3.52 -3.43 -1.26 -5.02 115.29 110.90 1fbx s HIS 28 Ca 0.00 -0.12 -0.26 0.00 -0.80 0.00 0.00 55.06 53.88 1fbx s HIS 28 Cb 0.00 -1.51 -0.20 0.00 -1.43 0.00 0.00 32.58 29.44 1fbx s HIS 28 CO 0.00 0.38 2.20 0.39 -2.00 0.00 0.00 174.74 175.72 1fbx n GLU 29 N 1.14 0.24 -3.25 -0.38 1.02 -1.26 -4.90 120.64 113.25 1fbx n GLU 29 Ca -0.14 -1.40 -0.39 0.00 -0.02 0.00 0.00 57.16 55.21 1fbx n GLU 29 Cb 0.52 -3.82 -0.07 0.00 -0.02 0.00 0.00 31.44 28.06 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 8.64 4.22 0.60 3.49 1.75 -1.26 -5.04 119.30 131.69 1fbx s MET 30 Ca 0.85 0.44 -0.18 0.00 -1.25 0.00 0.00 55.69 55.55 1fbx s MET 30 Cb -0.08 -3.54 -0.07 0.00 2.84 0.00 0.00 34.83 33.97 1fbx s MET 30 CO 0.15 -0.11 0.60 -3.47 -0.65 0.00 0.00 175.02 171.55 1fbx n ASP 31 N 4.63 -0.74 0.10 1.11 2.03 -1.26 -4.88 116.55 117.54 1fbx n ASP 31 Ca -0.05 0.73 -0.09 0.00 0.52 0.00 0.00 54.79 55.90 1fbx n ASP 31 Cb 0.51 -1.22 -0.06 0.00 -0.72 0.00 0.00 41.12 39.63 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 0.20 -0.29 -0.75 1.67 4.21 -2.00 -2.78 115.58 115.83 1fbx h ASN 32 Ca -0.46 -0.19 0.22 0.00 1.21 0.00 0.00 56.30 57.08 1fbx h ASN 32 Cb 1.39 0.08 -0.03 0.00 -1.12 0.00 0.00 38.32 38.63 1fbx h ASN 32 CO 0.47 0.21 0.59 -0.33 -1.29 0.00 0.00 177.43 177.08 1fbx h GLU 33 N -0.98 0.00 0.54 0.81 5.08 -2.00 0.13 114.58 118.16 1fbx h GLU 33 Ca -0.04 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1fbx h GLU 33 Cb 0.46 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.72 1fbx h GLU 33 CO 0.06 0.00 -0.26 1.15 -1.00 0.00 0.00 179.01 178.96 1fbx h THR 34 N 0.00 0.39 -0.54 1.13 2.02 -1.92 -2.15 112.91 111.84 1fbx h THR 34 Ca 0.36 -0.31 0.11 0.00 0.77 0.00 0.00 66.41 67.34 1fbx h THR 34 Cb 1.54 0.50 -0.11 0.00 -1.74 0.00 0.00 68.15 68.35 1fbx h THR 34 CO -0.00 0.04 -0.16 0.03 0.37 0.00 0.00 175.52 175.80 1fbx h ARG 35 N -0.93 -0.02 -0.43 6.66 3.08 -0.51 0.55 114.38 122.78 1fbx h ARG 35 Ca -0.07 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.05 1fbx h ARG 35 Cb 0.62 0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.58 1fbx h ARG 35 CO 0.12 -0.02 -0.41 0.87 -1.07 0.00 0.00 179.97 179.46 1fbx h LYS 36 N -0.03 -0.29 -0.46 0.04 1.57 -1.16 0.89 116.57 117.13 1fbx h LYS 36 Ca 0.26 0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.96 1fbx h LYS 36 Cb 0.42 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1fbx h LYS 36 CO -0.57 -0.19 -0.10 0.66 -0.57 0.00 0.00 179.45 178.67 1fbx h SER 37 N -0.30 0.83 0.23 0.86 4.64 -0.58 0.69 113.55 119.92 1fbx h SER 37 Ca 0.15 -0.25 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 1fbx h SER 37 Cb 0.58 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1fbx h SER 37 CO -0.59 0.96 -0.18 -0.07 -0.87 0.00 0.00 176.83 176.08 1fbx h LEU 38 N 0.76 0.00 0.02 5.97 3.38 0.18 0.21 115.31 125.83 1fbx h LEU 38 Ca 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.06 1fbx h LEU 38 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1fbx h LEU 38 CO 0.04 0.18 -0.19 0.40 0.09 0.00 0.00 178.44 178.96 1fbx h ILE 39 N 0.00 1.71 -1.05 1.22 2.04 0.16 -3.19 117.51 118.40 1fbx h ILE 39 Ca -0.00 -2.37 0.29 0.00 1.00 0.00 0.00 64.86 63.77 1fbx h ILE 39 Cb 0.35 3.31 -0.12 0.00 -0.74 0.00 0.00 36.82 39.62 1fbx h ILE 39 CO 0.02 0.61 0.64 0.00 0.00 0.00 0.00 178.15 179.43 1fbx h ALA 40 N -0.01 2.06 0.34 1.87 0.00 0.78 -0.42 119.26 123.87 1fbx h ALA 40 Ca -0.04 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1fbx h ALA 40 Cb 1.12 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1fbx h ALA 40 CO 0.01 -0.56 -0.21 0.78 0.00 0.00 0.00 179.25 179.28 1fbx h GLY 41 N 0.42 -0.75 0.41 0.00 0.00 -1.01 -0.02 103.07 102.13 1fbx h GLY 41 Ca 0.67 0.31 0.20 0.00 0.00 0.00 0.00 47.33 48.51 1fbx h GLY 41 CO -0.45 -0.26 0.60 0.45 0.00 0.00 0.00 176.54 176.89 1fbx h HIS 42 N -0.52 0.00 -0.03 5.60 -0.00 -1.13 0.47 115.15 119.54 1fbx h HIS 42 Ca -0.05 0.00 -0.03 0.00 -0.00 0.00 0.00 60.37 60.29 1fbx h HIS 42 Cb 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.82 1fbx h HIS 42 CO 0.01 0.00 -0.11 0.52 -0.00 0.00 0.00 177.93 178.36 1fbx h MET 43 N 0.00 0.13 -0.86 2.45 2.86 -0.57 -2.57 114.93 116.37 1fbx h MET 43 Ca 0.32 -0.09 0.17 0.00 -2.06 0.00 0.00 59.70 58.04 1fbx h MET 43 Cb 1.52 0.02 -0.10 0.00 0.06 0.00 0.00 31.60 33.10 1fbx h MET 43 CO -0.00 0.73 0.42 1.15 1.06 0.00 0.00 176.91 180.26 1fbx h THR 44 N -0.45 0.66 0.00 2.22 2.02 0.99 0.24 112.91 118.59 1fbx h THR 44 Ca -0.00 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1fbx h THR 44 Cb 0.74 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1fbx h THR 44 CO 0.02 0.10 0.00 -0.62 0.37 0.00 0.00 175.52 175.39 1fbx n GLU 45 N -4.92 0.00 -0.32 6.66 -0.58 -0.58 -1.56 120.64 119.34 1fbx n GLU 45 Ca 0.18 0.50 0.14 0.00 -0.42 0.00 0.00 57.16 57.56 1fbx n GLU 45 Cb 0.50 -1.37 0.29 0.00 -0.57 0.00 0.00 31.44 30.28 1fbx n GLU 45 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1fbx h ILE 46 N 0.00 0.13 -0.19 -3.67 2.04 -0.98 0.39 117.51 115.24 1fbx h ILE 46 Ca 0.00 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.87 1fbx h ILE 46 Cb 0.00 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.11 1fbx h ILE 46 CO 0.00 0.01 -0.02 0.24 0.00 0.00 0.00 178.15 178.39 1fbx h MET 47 N 0.07 0.04 -0.77 2.37 2.86 -0.43 -1.35 114.93 117.71 1fbx h MET 47 Ca 0.58 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 58.27 1fbx h MET 47 Cb 1.19 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.79 1fbx h MET 47 CO -0.82 0.02 0.47 1.96 1.06 0.00 0.00 176.91 179.61 1fbx h GLN 48 N 0.04 0.86 0.00 1.72 4.20 0.75 0.15 115.11 122.82 1fbx h GLN 48 Ca 0.09 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1fbx h GLN 48 Cb 0.12 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.71 1fbx h GLN 48 CO -0.16 0.57 0.06 -0.07 -0.67 0.00 0.00 178.83 178.56 1fbx h LEU 49 N 0.88 0.00 -1.71 1.46 3.38 -0.03 1.01 115.31 120.30 1fbx h LEU 49 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1fbx h LEU 49 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1fbx h LEU 49 CO -0.16 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.55 1fbx n LEU 50 N -2.46 2.62 -1.09 1.67 4.77 0.49 -4.93 117.00 118.07 1fbx n LEU 50 Ca -0.02 -0.96 -0.09 0.00 -0.03 0.00 0.00 56.01 54.91 1fbx n LEU 50 Cb 0.11 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1fbx n LEU 50 CO 0.12 0.48 -0.10 0.59 -1.33 0.00 0.00 177.39 177.15 1fbx n ASN 51 N 1.01 -3.18 -4.65 -1.43 3.02 0.35 -4.99 115.26 105.39 1fbx n ASN 51 Ca 0.16 -0.03 -0.41 0.00 -0.03 0.00 0.00 54.58 54.28 1fbx n ASN 51 Cb 0.52 -2.41 -0.05 0.00 -0.61 0.00 0.00 39.78 37.23 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 -2.67 4.12 -1.05 3.41 1.43 -1.07 -4.96 118.68 117.89 1fbx s LEU 52 Ca 0.02 0.92 -0.25 0.00 -1.03 0.00 0.00 54.13 53.79 1fbx s LEU 52 Cb -0.01 -3.01 -0.17 0.00 0.03 0.00 0.00 46.19 43.04 1fbx s LEU 52 CO 0.02 -0.36 1.98 -0.67 0.23 0.00 0.00 176.35 177.56 1fbx n ASP 53 N 5.38 2.27 0.00 2.29 2.03 -1.26 -4.55 116.55 122.71 1fbx n ASP 53 Ca 0.01 -2.61 0.00 0.00 0.52 0.00 0.00 54.79 52.71 1fbx n ASP 53 Cb 0.49 -1.62 0.00 0.00 -0.72 0.00 0.00 41.12 39.27 1fbx n ASP 53 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1fbx n LEU 54 N 15.71 0.00 0.20 -2.67 4.77 -1.26 0.15 117.00 133.90 1fbx n LEU 54 Ca 0.44 0.21 0.08 0.00 -0.03 0.00 0.00 56.01 56.71 1fbx n LEU 54 Cb 0.46 -0.21 0.27 0.00 -2.33 0.00 0.00 43.42 41.61 1fbx n LEU 54 CO 0.70 -0.21 0.70 0.00 -1.33 0.00 0.00 177.39 177.26 1fbx h ALA 55 N 1.23 0.90 -2.19 -1.18 0.00 -1.90 -3.32 119.26 112.80 1fbx h ALA 55 Ca 0.00 -0.25 -0.59 0.00 0.00 0.00 0.00 54.91 54.07 1fbx h ALA 55 Cb 0.26 -0.04 0.12 0.00 0.00 0.00 0.00 17.79 18.13 1fbx h ALA 55 CO 0.00 0.34 0.08 -3.47 0.00 0.00 0.00 179.25 176.20 1fbx n ASP 56 N -3.27 1.03 0.30 0.00 2.03 0.12 -4.83 116.55 111.94 1fbx n ASP 56 Ca 0.01 1.08 0.17 0.00 0.52 0.00 0.00 54.79 56.57 1fbx n ASP 56 Cb 0.55 -1.30 0.94 0.00 -0.72 0.00 0.00 41.12 40.59 1fbx n ASP 56 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 1fbx h ASP 57 N 1.64 0.00 0.10 1.67 2.03 -1.89 -2.47 116.42 117.50 1fbx h ASP 57 Ca -0.42 0.00 -0.35 0.00 -0.73 0.00 0.00 57.03 55.53 1fbx h ASP 57 Cb 1.35 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.78 1fbx h ASP 57 CO 0.58 0.03 -2.25 -0.24 -1.03 0.00 0.00 179.24 176.32 1fbx n SER 58 N -3.56 0.23 -0.58 4.15 2.88 -1.26 -4.38 113.62 111.09 1fbx n SER 58 Ca -0.03 0.08 0.13 0.00 -1.33 0.00 0.00 58.87 57.73 1fbx n SER 58 Cb 0.13 0.75 0.43 0.00 -0.75 0.00 0.00 64.21 64.77 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 -2.82 1.81 -0.06 2.46 4.77 -1.14 -4.27 117.00 117.74 1fbx n LEU 59 Ca -0.30 -0.63 -0.15 0.00 -0.03 0.00 0.00 56.01 54.90 1fbx n LEU 59 Cb 1.13 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 42.17 1fbx n LEU 59 CO 0.43 0.32 0.41 -0.03 -1.33 0.00 0.00 177.39 177.19 1fbx h MET 60 N 2.76 0.83 0.00 3.23 4.05 -1.55 -3.25 114.93 121.00 1fbx h MET 60 Ca 0.00 -0.55 0.00 0.00 -0.28 0.00 0.00 59.70 58.87 1fbx h MET 60 Cb 0.59 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.46 1fbx h MET 60 CO 0.00 1.18 -0.21 0.93 0.23 0.00 0.00 176.91 179.04 1fbx h GLU 61 N 0.63 0.00 -0.49 0.39 4.39 -1.85 -3.40 114.58 114.24 1fbx h GLU 61 Ca 0.00 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.78 1fbx h GLU 61 Cb 1.19 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.74 1fbx h GLU 61 CO 0.13 0.00 -0.47 1.15 -1.16 0.00 0.00 179.01 178.65 1fbx h THR 62 N 0.00 0.06 -0.66 1.13 2.02 -1.78 -1.42 112.91 112.27 1fbx h THR 62 Ca 0.00 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.32 1fbx h THR 62 Cb 0.80 0.06 -0.12 0.00 -1.74 0.00 0.00 68.15 67.16 1fbx h THR 62 CO 0.00 0.00 -0.08 -0.65 0.37 0.00 0.00 175.52 175.16 1fbx h PRO 63 N -0.30 0.05 -0.01 6.66 0.11 -1.82 0.87 132.00 137.56 1fbx h PRO 63 Ca 0.14 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.16 1fbx h PRO 63 Cb 0.58 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1fbx h PRO 63 CO -0.64 0.03 -0.40 1.25 -0.21 0.00 0.00 178.00 178.03 1fbx h HIS 64 N 0.05 0.02 -0.07 0.65 -0.00 -1.78 0.13 115.15 114.15 1fbx h HIS 64 Ca 0.33 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.65 1fbx h HIS 64 Cb 0.54 -0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.95 1fbx h HIS 64 CO -0.46 0.42 -0.17 0.00 -0.00 0.00 0.00 177.93 177.72 1fbx h ARG 65 N 0.01 0.24 -0.65 5.26 3.08 0.10 0.48 114.38 122.91 1fbx h ARG 65 Ca -0.00 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.85 1fbx h ARG 65 Cb 0.72 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 1fbx h ARG 65 CO 0.05 0.76 0.25 0.82 -1.07 0.00 0.00 179.97 180.78 1fbx h ILE 66 N -0.25 1.23 -0.06 2.04 2.04 0.59 -1.25 117.51 121.84 1fbx h ILE 66 Ca -0.00 -0.73 0.01 0.00 1.00 0.00 0.00 64.86 65.13 1fbx h ILE 66 Cb 0.76 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1fbx h ILE 66 CO 0.04 0.29 0.02 0.00 0.00 0.00 0.00 178.15 178.50 1fbx h ALA 67 N 1.33 0.06 0.00 1.87 0.00 -0.83 -1.48 119.26 120.22 1fbx h ALA 67 Ca 0.22 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1fbx h ALA 67 Cb 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1fbx h ALA 67 CO -0.02 -0.46 -0.15 -0.22 0.00 0.00 0.00 179.25 178.40 1fbx h LYS 68 N 0.05 0.00 -0.00 0.00 3.64 -0.60 -2.99 116.57 116.67 1fbx h LYS 68 Ca 0.03 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.18 1fbx h LYS 68 Cb 0.01 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 31.85 1fbx h LYS 68 CO -0.03 0.15 -0.87 1.98 -2.27 0.00 0.00 179.45 178.42 1fbx h MET 69 N 0.00 0.59 -0.45 1.90 4.05 -0.67 -2.16 114.93 118.19 1fbx h MET 69 Ca -0.00 -0.63 0.00 0.00 -0.28 0.00 0.00 59.70 58.79 1fbx h MET 69 Cb 0.56 0.18 -0.02 0.00 -0.80 0.00 0.00 31.60 31.52 1fbx h MET 69 CO 0.02 1.24 0.29 1.88 0.23 0.00 0.00 176.91 180.57 1fbx h TYR 70 N 0.19 0.56 0.01 1.39 -1.99 -1.15 0.62 116.97 116.60 1fbx h TYR 70 Ca -0.11 0.01 -0.19 0.00 2.00 0.00 0.00 58.73 60.44 1fbx h TYR 70 Cb 1.54 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 40.06 1fbx h TYR 70 CO 0.12 0.36 -1.05 0.28 -0.00 0.00 0.00 178.16 177.88 1fbx h VAL 71 N 0.60 1.08 0.00 -2.88 2.07 -1.64 -2.75 116.25 112.73 1fbx h VAL 71 Ca 0.16 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.46 1fbx h VAL 71 Cb -0.06 2.46 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1fbx h VAL 71 CO -0.03 0.39 -0.34 0.44 0.02 0.00 0.00 177.57 178.05 1fbx h ASP 72 N -0.95 0.00 0.00 0.57 5.19 -1.53 -3.27 116.42 116.43 1fbx h ASP 72 Ca -0.29 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.12 1fbx h ASP 72 Cb 1.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.79 1fbx h ASP 72 CO -0.16 0.00 0.00 -0.62 -3.12 0.00 0.00 179.24 175.35 1fbx n GLU 73 N -2.89 0.00 0.27 3.56 1.02 -0.15 -4.61 120.64 117.85 1fbx n GLU 73 Ca 0.03 0.00 0.15 0.00 -0.02 0.00 0.00 57.16 57.32 1fbx n GLU 73 Cb 0.53 0.00 0.82 0.00 -0.02 0.00 0.00 31.44 32.77 1fbx n GLU 73 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 1fbx h ILE 74 N 0.00 0.00 -0.04 -3.67 3.07 -1.19 -1.35 117.51 114.33 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 0.67 0.00 0.00 -0.27 0.00 0.00 36.82 37.22 1fbx h ILE 74 CO 0.00 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.59 1fbx n PHE 75 N -2.67 0.05 0.30 0.16 3.72 -1.03 -3.05 117.46 114.94 1fbx n PHE 75 Ca -0.02 -0.40 0.18 0.00 -0.05 0.00 0.00 57.45 57.16 1fbx n PHE 75 Cb 0.20 -0.04 0.90 0.00 -0.94 0.00 0.00 39.48 39.60 1fbx n PHE 75 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1fbx h SER 76 N 0.28 0.00 0.16 4.37 4.64 -1.29 -0.16 113.55 121.55 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 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1fbx h SER 76 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1fbx n GLY 77 N -1.23 -0.73 0.09 -0.77 0.00 -0.70 -2.40 105.19 99.44 1fbx n GLY 77 Ca -0.01 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.14 0.39 -4.14 0.99 4.77 -0.07 -4.66 117.00 113.14 1fbx n LEU 78 Ca 0.12 0.06 -0.34 0.00 -0.03 0.00 0.00 56.01 55.82 1fbx n LEU 78 Cb 0.10 -0.21 -0.14 0.00 -2.33 0.00 0.00 43.42 40.84 1fbx n LEU 78 CO 0.12 0.07 -0.40 -0.62 -1.33 0.00 0.00 177.39 175.24 1fbx s ASP 79 N -2.52 4.66 0.00 -1.43 2.15 -1.01 -4.96 116.67 113.56 1fbx s ASP 79 Ca 0.28 -1.25 0.01 0.00 0.43 0.00 0.00 52.55 52.01 1fbx s ASP 79 Cb 0.20 -1.65 0.03 0.00 -0.30 0.00 0.00 42.92 41.19 1fbx s ASP 79 CO 0.48 -0.22 0.91 -1.22 -0.17 0.00 0.00 175.17 174.96 1fbx n TYR 80 N 4.57 0.00 0.23 -5.34 4.02 -1.26 -0.51 117.16 118.87 1fbx n TYR 80 Ca -0.14 0.00 0.07 0.00 -0.01 0.00 0.00 57.90 57.82 1fbx n TYR 80 Cb 0.43 -0.39 0.59 0.00 -0.02 0.00 0.00 39.34 39.95 1fbx n TYR 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1fbx h ALA 81 N 2.02 1.91 -0.13 -0.72 0.00 -1.92 -2.03 119.26 118.40 1fbx h ALA 81 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fbx h ALA 81 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1fbx h ALA 81 CO 0.00 0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.41 1fbx n ASN 82 N -4.49 1.51 -4.67 0.00 3.02 0.34 -4.95 115.26 106.02 1fbx n ASN 82 Ca -0.02 -1.64 -0.41 0.00 -0.03 0.00 0.00 54.58 52.47 1fbx n ASN 82 Cb 0.12 -0.08 0.01 0.00 -0.61 0.00 0.00 39.78 39.22 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 0.21 1.77 -1.52 3.10 7.35 -0.76 -4.94 117.46 122.67 1fbx n PHE 83 Ca 0.17 0.52 -0.29 0.00 -0.76 0.00 0.00 57.45 57.09 1fbx n PHE 83 Cb 0.31 -2.32 0.11 0.00 0.35 0.00 0.00 39.48 37.94 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 -2.14 1.69 -0.14 -7.13 0.04 -1.26 -5.01 135.00 121.05 1fbx s PRO 84 Ca 0.62 0.53 -0.19 0.00 0.04 0.00 0.00 61.00 62.01 1fbx s PRO 84 Cb -0.53 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 1fbx s PRO 84 CO 0.57 -1.87 0.51 0.15 0.04 0.00 0.00 177.00 176.40 1fbx s LYS 85 N -5.18 4.29 -0.08 4.56 1.02 -1.26 -4.92 119.74 118.18 1fbx s LYS 85 Ca 0.62 0.46 -0.16 0.00 0.02 0.00 0.00 55.97 56.92 1fbx s LYS 85 Cb -0.15 -3.48 -0.05 0.00 -0.52 0.00 0.00 37.83 33.63 1fbx s LYS 85 CO 0.54 0.04 0.41 0.42 -0.92 0.00 0.00 175.35 175.84 1fbx s ILE 86 N 0.99 5.15 -0.11 2.17 -1.09 -1.26 -4.98 121.20 122.07 1fbx s ILE 86 Ca 0.26 0.82 0.00 0.00 -2.23 0.00 0.00 60.65 59.50 1fbx s ILE 86 Cb -0.15 -3.73 0.02 0.00 -1.58 0.00 0.00 42.46 37.02 1fbx s ILE 86 CO 0.10 0.45 -0.09 0.42 -1.23 0.00 0.00 174.94 174.59 1fbx s THR 87 N -0.13 1.10 -0.25 2.92 -4.23 -1.26 -5.09 115.64 108.70 1fbx s THR 87 Ca 0.23 -0.36 0.02 0.00 -1.18 0.00 0.00 61.69 60.40 1fbx s THR 87 Cb -0.15 -1.08 0.06 0.00 1.34 0.00 0.00 72.50 72.67 1fbx s THR 87 CO 0.10 0.37 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.73 1fbx s LEU 88 N 1.46 2.97 0.81 4.79 1.43 -1.26 -1.48 118.68 127.40 1fbx s LEU 88 Ca 0.01 -1.31 -0.11 0.00 -1.03 0.00 0.00 54.13 51.69 1fbx s LEU 88 Cb -0.13 -1.32 0.10 0.00 0.03 0.00 0.00 46.19 44.86 1fbx s LEU 88 CO -0.06 -0.23 1.16 0.27 0.23 0.00 0.00 176.35 177.73 1fbx s ILE 89 N 1.27 2.06 0.28 -0.59 -4.36 -0.56 -4.77 121.20 114.53 1fbx s ILE 89 Ca -0.06 -0.07 -0.29 0.00 -0.26 0.00 0.00 60.65 59.96 1fbx s ILE 89 Cb -0.19 -2.99 -0.09 0.00 1.25 0.00 0.00 42.46 40.43 1fbx s ILE 89 CO -0.06 0.00 1.08 -0.70 0.24 0.00 0.00 174.94 175.50 1fbx s GLU 90 N -5.55 4.66 -0.07 0.37 2.12 -1.26 -1.74 118.70 117.23 1fbx s GLU 90 Ca 0.64 1.76 -0.02 0.00 0.36 0.00 0.00 54.97 57.71 1fbx s GLU 90 Cb -0.10 -3.19 -0.03 0.00 0.26 0.00 0.00 34.13 31.08 1fbx s GLU 90 CO 0.49 0.25 2.41 -1.71 -0.54 0.00 0.00 175.26 176.15 1fbx n ASN 91 N 1.21 5.55 -0.26 -1.70 2.85 -0.72 -4.45 115.26 117.73 1fbx n ASN 91 Ca -0.01 -2.56 0.18 0.00 -0.11 0.00 0.00 54.58 52.07 1fbx n ASN 91 Cb 0.45 -1.19 0.48 0.00 1.24 0.00 0.00 39.78 40.76 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 1.62 0.45 0.00 1.20 1.57 -1.90 0.35 116.57 119.86 1fbx h LYS 92 Ca 0.11 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1fbx h LYS 92 Cb 1.09 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1fbx h LYS 92 CO 0.21 0.30 0.00 -1.33 -0.57 0.00 0.00 179.45 178.06 1fbx n MET 93 N -4.54 0.13 -3.90 3.15 2.81 -1.26 -4.84 117.12 108.66 1fbx n MET 93 Ca 0.20 0.15 -0.34 0.00 -1.81 0.00 0.00 57.70 55.89 1fbx n MET 93 Cb 0.68 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.70 1fbx n MET 93 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1fbx n LYS 94 N -1.18 -1.45 -2.71 0.03 5.02 0.12 -4.91 118.16 113.08 1fbx n LYS 94 Ca 0.04 0.32 -0.41 0.00 -2.02 0.00 0.00 58.31 56.23 1fbx n LYS 94 Cb 0.04 -3.76 -0.04 0.00 -0.02 0.00 0.00 35.03 31.24 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 -3.67 4.50 -0.00 -0.18 1.01 -1.26 -4.92 120.40 115.87 1fbx s VAL 95 Ca 0.33 2.05 0.00 0.00 0.00 0.00 0.00 61.98 64.36 1fbx s VAL 95 Cb -0.14 -4.31 0.01 0.00 0.00 0.00 0.00 36.38 31.94 1fbx s VAL 95 CO 0.91 0.30 0.73 -0.90 0.00 0.00 0.00 175.10 176.14 1fbx n ASP 96 N 2.87 0.13 -4.59 3.32 5.75 -1.26 -4.49 116.55 118.27 1fbx n ASP 96 Ca 0.03 -1.48 -0.26 0.00 -0.01 0.00 0.00 54.79 53.07 1fbx n ASP 96 Cb 0.49 -0.09 -0.09 0.00 -1.03 0.00 0.00 41.12 40.40 1fbx n ASP 96 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1fbx s GLU 97 N -0.11 2.14 0.64 0.11 0.41 -1.26 -4.95 118.70 115.68 1fbx s GLU 97 Ca 0.01 -1.27 -0.17 0.00 -0.41 0.00 0.00 54.97 53.13 1fbx s GLU 97 Cb 0.01 -2.18 -0.01 0.00 -1.78 0.00 0.00 34.13 30.16 1fbx s GLU 97 CO 0.00 0.43 1.19 0.00 -0.49 0.00 0.00 175.26 176.39 1fbx s MET 98 N -2.97 2.71 -0.20 1.61 0.23 -1.26 -4.55 119.30 114.87 1fbx s MET 98 Ca 0.26 1.75 0.00 0.00 -1.03 0.00 0.00 55.69 56.67 1fbx s MET 98 Cb -0.08 -1.90 0.02 0.00 -1.53 0.00 0.00 34.83 31.33 1fbx s MET 98 CO 0.16 -1.39 -0.16 0.08 -2.03 0.00 0.00 175.02 171.69 1fbx s VAL 99 N -1.80 2.37 -0.14 5.16 1.01 -0.25 -4.94 120.40 121.81 1fbx s VAL 99 Ca 0.75 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 1fbx s VAL 99 Cb -0.29 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1fbx s VAL 99 CO 0.38 0.46 -0.10 -0.89 0.00 0.00 0.00 175.10 174.95 1fbx s THR 100 N 1.32 3.34 -0.28 3.92 2.01 -1.26 -2.47 115.64 122.22 1fbx s THR 100 Ca 0.04 -0.55 -0.02 0.00 0.31 0.00 0.00 61.69 61.46 1fbx s THR 100 Cb -0.14 -2.43 0.04 0.00 0.01 0.00 0.00 72.50 69.98 1fbx s THR 100 CO -0.10 0.51 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.63 1fbx s VAL 101 N 0.39 3.02 0.35 3.82 1.01 0.76 -5.00 120.40 124.76 1fbx s VAL 101 Ca -0.08 -1.18 0.07 0.00 0.00 0.00 0.00 61.98 60.79 1fbx s VAL 101 Cb -0.15 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 1fbx s VAL 101 CO 0.04 0.03 0.32 0.00 0.00 0.00 0.00 175.10 175.50 1fbx s ARG 102 N 1.30 2.70 -1.49 2.72 1.70 -1.26 -1.11 118.95 123.51 1fbx s ARG 102 Ca -0.02 -1.34 -0.07 0.00 -0.47 0.00 0.00 55.73 53.83 1fbx s ARG 102 Cb -0.18 -2.47 0.05 0.00 -0.57 0.00 0.00 34.95 31.78 1fbx s ARG 102 CO -0.02 0.02 0.64 -0.25 -1.08 0.00 0.00 175.30 174.61 1fbx n ASP 103 N -1.43 -1.91 -4.72 -2.89 8.00 -1.17 -4.91 116.55 107.52 1fbx n ASP 103 Ca -0.00 -0.94 -0.42 0.00 0.71 0.00 0.00 54.79 54.13 1fbx n ASP 103 Cb 0.60 -3.25 -0.03 0.00 -0.02 0.00 0.00 41.12 38.41 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 -3.65 3.78 0.01 0.53 1.01 0.60 -4.76 121.20 118.73 1fbx s ILE 104 Ca 0.29 1.34 -0.30 0.00 0.00 0.00 0.00 60.65 61.98 1fbx s ILE 104 Cb -0.16 -3.86 -0.07 0.00 0.01 0.00 0.00 42.46 38.39 1fbx s ILE 104 CO 0.88 0.14 1.70 -0.89 0.00 0.00 0.00 174.94 176.76 1fbx s THR 105 N 0.73 3.28 -0.18 2.92 2.01 -1.26 -0.86 115.64 122.27 1fbx s THR 105 Ca 0.58 0.52 -0.01 0.00 0.31 0.00 0.00 61.69 63.09 1fbx s THR 105 Cb -0.32 -3.33 0.04 0.00 0.01 0.00 0.00 72.50 68.90 1fbx s THR 105 CO 0.32 -0.03 -0.05 -0.22 -0.69 0.00 0.00 174.62 173.95 1fbx s LEU 106 N 3.49 1.69 -0.07 4.42 0.20 -0.60 -4.79 118.68 123.03 1fbx s LEU 106 Ca 0.76 -0.73 0.05 0.00 0.69 0.00 0.00 54.13 54.89 1fbx s LEU 106 Cb -0.37 -0.92 -0.01 0.00 -0.43 0.00 0.00 46.19 44.45 1fbx s LEU 106 CO 0.32 -0.20 -0.22 0.42 -0.29 0.00 0.00 176.35 176.38 1fbx s THR 107 N 1.62 2.27 0.00 3.68 -4.23 -1.26 0.06 115.64 117.78 1fbx s THR 107 Ca -0.00 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 1fbx s THR 107 Cb -0.16 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.83 1fbx s THR 107 CO -0.08 0.57 0.00 -0.24 -0.54 0.00 0.00 174.62 174.33 1fbx n SER 108 N 3.05 0.00 -3.78 3.99 2.88 0.44 -4.54 113.62 115.66 1fbx n SER 108 Ca -0.18 -0.06 -0.13 0.00 -1.33 0.00 0.00 58.87 57.18 1fbx n SER 108 Cb 0.52 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.86 1fbx n SER 108 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1fbx s THR 109 N -1.60 -0.01 0.16 2.46 2.01 -1.26 -0.93 115.64 116.47 1fbx s THR 109 Ca 0.00 0.03 -0.30 0.00 0.31 0.00 0.00 61.69 61.73 1fbx s THR 109 Cb 0.00 -0.35 -0.07 0.00 0.01 0.00 0.00 72.50 72.09 1fbx s THR 109 CO 0.00 0.01 1.06 0.00 -0.69 0.00 0.00 174.62 175.00 1fbx h GLU 111 N 5.26 0.00 0.00 0.00 4.11 -1.32 0.14 114.58 122.77 1fbx h GLU 111 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 1fbx h GLU 111 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1fbx h GLU 111 CO 0.72 0.00 -0.05 0.45 0.07 0.00 0.00 179.01 180.20 1fbx h HIS 112 N 0.00 0.00 0.00 2.06 3.86 -1.90 -3.40 115.15 115.76 1fbx h HIS 112 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1fbx h HIS 112 Cb 0.43 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.90 1fbx h HIS 112 CO 0.00 0.00 0.00 0.72 0.86 0.00 0.00 177.93 179.51 1fbx n HIS 113 N -2.91 0.00 -2.62 2.45 8.25 -1.18 -5.03 115.22 114.18 1fbx n HIS 113 Ca 0.04 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.30 1fbx n HIS 113 Cb 0.51 0.08 0.01 0.00 1.12 0.00 0.00 29.99 31.71 1fbx n HIS 113 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1fbx n PHE 114 N 0.00 -1.30 -4.06 4.41 3.01 0.48 -4.97 117.46 115.02 1fbx n PHE 114 Ca 0.00 0.21 -0.26 0.00 1.01 0.00 0.00 57.45 58.41 1fbx n PHE 114 Cb 0.39 -3.96 -0.05 0.00 -0.01 0.00 0.00 39.48 35.86 1fbx n PHE 114 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1fbx s VAL 115 N -3.03 4.61 0.26 -4.37 1.01 -1.25 -4.79 120.40 112.84 1fbx s VAL 115 Ca 0.12 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 60.75 1fbx s VAL 115 Cb -0.05 -3.37 -0.14 0.00 0.00 0.00 0.00 36.38 32.82 1fbx s VAL 115 CO 0.15 -0.13 1.30 0.41 0.00 0.00 0.00 175.10 176.83 1fbx n THR 116 N -0.45 1.29 -4.75 3.92 -1.04 -1.26 -0.50 114.28 111.48 1fbx n THR 116 Ca -0.08 -0.32 -0.32 0.00 -2.04 0.00 0.00 64.05 61.28 1fbx n THR 116 Cb 0.55 -1.35 -0.17 0.00 -1.82 0.00 0.00 70.33 67.54 1fbx n THR 116 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1fbx s ILE 117 N -0.41 2.08 -0.15 12.58 1.01 -0.11 -2.03 121.20 134.16 1fbx s ILE 117 Ca 0.65 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 60.34 1fbx s ILE 117 Cb -0.66 -1.82 0.01 0.00 0.01 0.00 0.00 42.46 39.99 1fbx s ILE 117 CO 0.54 0.55 -0.20 -0.62 0.00 0.00 0.00 174.94 175.21 1fbx s ASP 118 N 0.74 3.21 0.00 3.58 2.15 -0.07 -0.42 116.67 125.86 1fbx s ASP 118 Ca -0.09 -0.59 0.00 0.00 0.43 0.00 0.00 52.55 52.30 1fbx s ASP 118 Cb -0.16 -1.47 0.00 0.00 -0.30 0.00 0.00 42.92 40.99 1fbx s ASP 118 CO -0.00 0.06 0.00 0.61 -0.17 0.00 0.00 175.17 175.67 1fbx n GLY 119 N 4.20 2.65 2.85 2.66 0.00 0.11 0.02 105.19 117.68 1fbx n GLY 119 Ca -0.20 -1.14 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.59 0.01 0.02 1.61 3.01 -0.24 -1.55 119.74 121.00 1fbx s LYS 120 Ca 0.00 0.10 0.07 0.00 -1.01 0.00 0.00 55.97 55.13 1fbx s LYS 120 Cb 0.00 -0.08 -0.03 0.00 -1.01 0.00 0.00 37.83 36.71 1fbx s LYS 120 CO 0.00 -0.07 -0.21 0.00 0.51 0.00 0.00 175.35 175.59 1fbx s ALA 121 N 0.42 2.46 -0.16 5.17 0.00 -0.04 -1.70 121.76 127.90 1fbx s ALA 121 Ca -0.03 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 50.78 1fbx s ALA 121 Cb -0.05 -0.69 0.02 0.00 0.00 0.00 0.00 23.12 22.40 1fbx s ALA 121 CO -0.01 0.55 -0.19 0.99 0.00 0.00 0.00 175.76 177.10 1fbx s THR 122 N -0.81 1.95 0.05 0.00 2.01 -0.19 -0.29 115.64 118.36 1fbx s THR 122 Ca 0.13 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.32 1fbx s THR 122 Cb -0.10 -1.76 -0.03 0.00 0.01 0.00 0.00 72.50 70.62 1fbx s THR 122 CO 0.03 0.52 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.56 1fbx s VAL 123 N 1.14 1.86 0.08 3.82 1.01 -0.27 -1.35 120.40 126.70 1fbx s VAL 123 Ca 0.00 -1.31 -0.07 0.00 0.00 0.00 0.00 61.98 60.60 1fbx s VAL 123 Cb -0.14 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 1fbx s VAL 123 CO -0.08 0.24 0.16 0.00 0.00 0.00 0.00 175.10 175.41 1fbx s ALA 124 N -0.84 -0.11 0.07 5.51 0.00 -0.81 -0.17 121.76 125.41 1fbx s ALA 124 Ca 0.09 -0.71 -0.26 0.00 0.00 0.00 0.00 51.96 51.08 1fbx s ALA 124 Cb -0.09 0.46 0.09 0.00 0.00 0.00 0.00 23.12 23.57 1fbx s ALA 124 CO 0.02 -0.49 0.78 1.52 0.00 0.00 0.00 175.76 177.59 1fbx s TYR 125 N -3.87 -0.41 -0.25 0.00 1.13 -1.03 -1.74 117.35 111.18 1fbx s TYR 125 Ca 0.05 0.23 -0.04 0.00 -1.41 0.00 0.00 57.07 55.90 1fbx s TYR 125 Cb 0.05 0.55 0.00 0.00 -1.10 0.00 0.00 41.96 41.47 1fbx s TYR 125 CO -0.11 -0.69 -0.01 0.42 -2.51 0.00 0.00 175.55 172.66 1fbx s ILE 126 N -3.39 3.49 0.16 -3.49 1.01 -0.77 -1.09 121.20 117.12 1fbx s ILE 126 Ca 0.04 -0.63 -0.32 0.00 0.00 0.00 0.00 60.65 59.74 1fbx s ILE 126 Cb -0.01 -2.68 -0.12 0.00 0.01 0.00 0.00 42.46 39.66 1fbx s ILE 126 CO -0.10 0.28 1.74 -2.65 0.00 0.00 0.00 174.94 174.22 1fbx n PRO 127 N 4.80 2.65 0.00 2.79 -0.02 -1.26 -4.86 135.00 139.10 1fbx n PRO 127 Ca -0.17 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1fbx n PRO 127 Cb 0.49 -2.81 0.00 0.00 -0.02 0.00 0.00 33.50 31.17 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 4.50 0.00 0.02 -0.52 4.81 -1.26 -4.65 118.16 121.06 1fbx n LYS 128 Ca 0.17 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.47 1fbx n LYS 128 Cb 0.34 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 35.25 1fbx n LYS 128 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 1fbx h ASP 129 N 0.00 0.22 -2.25 3.14 3.32 -1.93 -3.45 116.42 115.47 1fbx h ASP 129 Ca 0.00 -0.38 -0.57 0.00 0.02 0.00 0.00 57.03 56.10 1fbx h ASP 129 Cb 0.00 -0.07 -0.10 0.00 0.22 0.00 0.00 39.33 39.37 1fbx h ASP 129 CO 0.00 1.32 -0.67 -0.44 -1.72 0.00 0.00 179.24 177.74 1fbx s SER 130 N -6.66 4.38 -0.26 6.45 0.01 -1.26 -1.76 113.70 114.60 1fbx s SER 130 Ca -0.09 -0.70 -0.00 0.00 1.31 0.00 0.00 55.95 56.47 1fbx s SER 130 Cb 0.07 -0.76 0.07 0.00 0.21 0.00 0.00 66.02 65.62 1fbx s SER 130 CO 0.83 0.01 0.02 -0.69 0.41 0.00 0.00 173.24 173.82 1fbx s VAL 131 N -2.31 1.19 0.59 3.43 1.01 -0.71 -4.68 120.40 118.91 1fbx s VAL 131 Ca 0.31 -1.23 -0.17 0.00 0.00 0.00 0.00 61.98 60.89 1fbx s VAL 131 Cb -0.06 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1fbx s VAL 131 CO 0.19 -0.33 1.08 -0.51 0.00 0.00 0.00 175.10 175.53 1fbx s ILE 132 N 1.51 3.57 0.23 2.22 2.07 -1.26 -1.49 121.20 128.06 1fbx s ILE 132 Ca 0.01 0.80 -0.30 0.00 -1.41 0.00 0.00 60.65 59.75 1fbx s ILE 132 Cb -0.18 -3.31 -0.10 0.00 0.13 0.00 0.00 42.46 39.00 1fbx s ILE 132 CO -0.12 -0.38 1.46 -0.83 -1.91 0.00 0.00 174.94 173.16 1fbx s GLY 133 N -2.48 2.20 0.13 1.50 0.00 -0.55 -4.89 107.32 103.24 1fbx s GLY 133 Ca 0.66 1.33 -0.20 0.00 0.00 0.00 0.00 44.72 46.51 1fbx s GLY 133 CO 0.34 2.34 1.70 1.41 0.00 0.00 0.00 173.10 178.89 1fbx h LEU 134 N 5.35 -0.24 -2.27 0.66 3.38 -1.93 -0.71 115.31 119.55 1fbx h LEU 134 Ca -0.45 0.07 0.04 0.00 0.09 0.00 0.00 57.88 57.63 1fbx h LEU 134 Cb 1.22 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 42.11 1fbx h LEU 134 CO 0.80 -0.09 0.23 0.77 0.09 0.00 0.00 178.44 180.24 1fbx h SER 135 N -0.02 0.00 -0.67 -0.43 4.64 -2.01 0.14 113.55 115.20 1fbx h SER 135 Ca 0.11 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1fbx h SER 135 Cb 0.18 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.24 1fbx h SER 135 CO -0.24 0.00 0.42 0.11 -0.87 0.00 0.00 176.83 176.26 1fbx h LYS 136 N 0.00 0.91 0.11 4.77 1.79 -1.49 -0.85 116.57 121.81 1fbx h LYS 136 Ca 0.06 -0.07 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1fbx h LYS 136 Cb 0.51 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 1fbx h LYS 136 CO -0.00 0.63 -0.05 0.82 -1.08 0.00 0.00 179.45 179.76 1fbx h ILE 137 N 0.93 0.94 -0.39 1.86 2.04 -0.78 0.11 117.51 122.22 1fbx h ILE 137 Ca 0.25 -0.21 0.08 0.00 1.00 0.00 0.00 64.86 65.98 1fbx h ILE 137 Cb -0.06 1.08 -0.08 0.00 -0.74 0.00 0.00 36.82 37.02 1fbx h ILE 137 CO -0.05 0.05 -0.17 0.78 0.00 0.00 0.00 178.15 178.77 1fbx h ASN 138 N -0.25 -0.57 -0.60 1.72 2.35 -1.26 -2.13 115.58 114.84 1fbx h ASN 138 Ca -0.02 0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.89 1fbx h ASN 138 Cb 0.20 0.32 -0.03 0.00 0.05 0.00 0.00 38.32 38.87 1fbx h ASN 138 CO 0.03 -0.20 0.39 0.03 -1.65 0.00 0.00 177.43 176.03 1fbx h ARG 139 N -0.09 0.77 -0.16 0.81 3.08 -0.84 -1.76 114.38 116.19 1fbx h ARG 139 Ca 0.19 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 1fbx h ARG 139 Cb 0.39 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1fbx h ARG 139 CO -0.45 0.51 -0.10 0.82 -1.07 0.00 0.00 179.97 179.67 1fbx h ILE 140 N 0.79 1.17 0.49 2.04 2.04 -0.55 -0.84 117.51 122.66 1fbx h ILE 140 Ca 0.22 -0.73 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 1fbx h ILE 140 Cb -0.07 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1fbx h ILE 140 CO -0.06 0.23 -0.24 0.58 0.00 0.00 0.00 178.15 178.67 1fbx h VAL 141 N 0.24 0.36 -0.51 1.67 2.07 -0.73 -2.83 116.25 116.52 1fbx h VAL 141 Ca 0.05 -0.45 0.12 0.00 0.82 0.00 0.00 66.70 67.24 1fbx h VAL 141 Cb 0.34 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1fbx h VAL 141 CO 0.02 0.06 0.35 1.56 0.02 0.00 0.00 177.57 179.58 1fbx h GLN 142 N -0.98 0.15 0.04 1.57 1.08 -1.15 -2.05 115.11 113.76 1fbx h GLN 142 Ca -0.07 -0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.14 1fbx h GLN 142 Cb 0.60 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.98 1fbx h GLN 142 CO 0.11 0.10 -0.10 0.35 -0.95 0.00 0.00 178.83 178.34 1fbx h PHE 143 N 0.15 -0.25 -0.00 2.96 3.57 -0.93 -0.73 116.94 121.71 1fbx h PHE 143 Ca 0.24 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1fbx h PHE 143 Cb 0.75 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.59 1fbx h PHE 143 CO -0.00 -0.15 -0.00 1.19 -2.23 0.00 0.00 178.31 177.12 1fbx n PHE 144 N -5.22 0.00 0.07 0.41 3.72 -1.00 -2.91 117.46 112.52 1fbx n PHE 144 Ca -0.06 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.37 1fbx n PHE 144 Cb 0.14 -0.25 -0.04 0.00 -0.94 0.00 0.00 39.48 38.39 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 3.50 0.63 -0.37 4.37 0.00 -0.53 -3.37 119.26 123.49 1fbx h ALA 145 Ca 0.00 -0.59 -0.71 0.00 0.00 0.00 0.00 54.91 53.61 1fbx h ALA 145 Cb 0.26 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1fbx h ALA 145 CO 0.00 0.66 3.00 1.04 0.00 0.00 0.00 179.25 183.95 1fbx n GLN 146 N -2.89 4.06 -3.61 0.00 1.13 -0.40 -4.24 117.38 111.43 1fbx n GLN 146 Ca -0.06 -2.92 -0.16 0.00 -1.94 0.00 0.00 57.00 51.93 1fbx n GLN 146 Cb 0.75 -2.76 -0.07 0.00 0.11 0.00 0.00 30.24 28.28 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 0.55 0.93 -0.27 -1.09 0.52 -1.17 -1.73 118.95 116.69 1fbx s ARG 147 Ca 0.59 0.01 -0.28 0.00 -0.52 0.00 0.00 55.73 55.53 1fbx s ARG 147 Cb 0.17 0.43 -0.03 0.00 0.52 0.00 0.00 34.95 36.04 1fbx s ARG 147 CO -0.07 -0.29 1.88 -2.14 0.02 0.00 0.00 175.30 174.70 1fbx s PRO 148 N -1.49 3.39 0.50 3.54 0.02 -1.26 -4.11 135.00 135.59 1fbx s PRO 148 Ca -0.11 1.67 0.05 0.00 0.02 0.00 0.00 61.00 62.64 1fbx s PRO 148 Cb -0.02 -4.21 0.00 0.00 0.02 0.00 0.00 34.50 30.29 1fbx s PRO 148 CO 0.06 -1.79 0.27 -0.65 -0.33 0.00 0.00 177.00 174.56 1fbx s GLN 149 N 5.62 2.25 -0.05 5.54 -1.52 0.75 -4.52 119.66 127.74 1fbx s GLN 149 Ca 0.84 -2.02 0.02 0.00 -1.95 0.00 0.00 55.36 52.25 1fbx s GLN 149 Cb -0.26 -1.98 0.01 0.00 -0.22 0.00 0.00 33.01 30.56 1fbx s GLN 149 CO 0.34 -0.42 -0.10 0.54 -0.25 0.00 0.00 175.29 175.40 1fbx s VAL 150 N -2.73 0.92 0.21 1.09 0.11 -1.26 -1.04 120.40 117.70 1fbx s VAL 150 Ca 0.31 -0.38 -0.09 0.00 -2.93 0.00 0.00 61.98 58.89 1fbx s VAL 150 Cb -0.00 -0.84 0.15 0.00 -1.53 0.00 0.00 36.38 34.16 1fbx s VAL 150 CO 0.18 0.30 1.83 -0.61 -3.33 0.00 0.00 175.10 173.47 1fbx h GLN 151 N 6.79 0.77 -1.00 1.54 4.15 -1.99 -1.76 115.11 123.61 1fbx h GLN 151 Ca -0.33 -0.05 0.12 0.00 0.77 0.00 0.00 58.65 59.16 1fbx h GLN 151 Cb 1.17 -0.17 -0.09 0.00 0.21 0.00 0.00 27.48 28.60 1fbx h GLN 151 CO 0.48 0.51 0.63 0.93 -1.93 0.00 0.00 178.83 179.45 1fbx h GLU 152 N 0.80 0.96 0.05 1.69 3.07 -2.00 -2.06 114.58 117.09 1fbx h GLU 152 Ca 0.30 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1fbx h GLU 152 Cb 0.12 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1fbx h GLU 152 CO -0.15 0.64 -0.02 -0.09 -1.40 0.00 0.00 179.01 177.98 1fbx h ARG 153 N 0.99 -0.06 -1.01 2.33 2.43 -1.85 -3.08 114.38 114.13 1fbx h ARG 153 Ca 0.50 0.00 0.25 0.00 -0.81 0.00 0.00 59.98 59.92 1fbx h ARG 153 Cb 0.50 0.01 -0.12 0.00 -0.42 0.00 0.00 29.97 29.95 1fbx h ARG 153 CO -0.27 0.55 0.61 1.25 -1.51 0.00 0.00 179.97 180.60 1fbx h LEU 154 N -0.76 0.63 -0.62 3.80 5.85 -1.19 0.30 115.31 123.32 1fbx h LEU 154 Ca -0.01 0.12 -0.14 0.00 0.84 0.00 0.00 57.88 58.70 1fbx h LEU 154 Cb 0.64 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1fbx h LEU 154 CO 0.01 0.10 -0.38 0.74 -0.34 0.00 0.00 178.44 178.58 1fbx h THR 155 N 0.55 1.29 -0.22 1.05 2.02 -1.44 -2.94 112.91 113.21 1fbx h THR 155 Ca 0.64 -1.53 -0.07 0.00 0.77 0.00 0.00 66.41 66.21 1fbx h THR 155 Cb 1.28 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 69.16 1fbx h THR 155 CO -0.44 0.49 -0.13 1.56 0.37 0.00 0.00 175.52 177.38 1fbx h GLN 156 N 0.55 0.48 0.10 6.66 1.08 -0.47 -3.06 115.11 120.47 1fbx h GLN 156 Ca 0.05 -0.22 0.02 0.00 -1.45 0.00 0.00 58.65 57.05 1fbx h GLN 156 Cb 0.90 -0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 28.28 1fbx h GLN 156 CO 0.08 0.77 -0.30 1.96 -0.95 0.00 0.00 178.83 180.39 1fbx h GLN 157 N 0.19 -0.49 -0.86 1.46 4.20 -0.72 -2.27 115.11 116.61 1fbx h GLN 157 Ca 0.05 0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.92 1fbx h GLN 157 Cb 0.64 0.11 -0.09 0.00 0.30 0.00 0.00 27.48 28.44 1fbx h GLN 157 CO 0.04 -0.33 0.48 0.82 -0.67 0.00 0.00 178.83 179.17 1fbx h ILE 158 N -0.51 0.82 -0.22 2.54 2.04 -1.60 0.48 117.51 121.06 1fbx h ILE 158 Ca 0.03 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1fbx h ILE 158 Cb 0.55 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1fbx h ILE 158 CO -0.19 0.13 0.13 0.25 0.00 0.00 0.00 178.15 178.48 1fbx h LEU 159 N 0.74 0.27 0.61 1.44 5.85 -1.35 -1.68 115.31 121.18 1fbx h LEU 159 Ca 0.45 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 59.09 1fbx h LEU 159 Cb 0.53 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 41.50 1fbx h LEU 159 CO -0.31 0.24 -0.29 0.40 -0.34 0.00 0.00 178.44 178.14 1fbx h ILE 160 N 0.27 0.36 -1.02 4.05 1.08 -0.83 -1.18 117.51 120.25 1fbx h ILE 160 Ca 0.08 -0.14 0.29 0.00 -0.39 0.00 0.00 64.86 64.70 1fbx h ILE 160 Cb 0.02 0.42 -0.13 0.00 -3.07 0.00 0.00 36.82 34.05 1fbx h ILE 160 CO -0.01 0.02 0.60 0.00 -0.69 0.00 0.00 178.15 178.07 1fbx h ALA 161 N -0.58 1.95 0.04 1.87 0.00 -0.84 0.10 119.26 121.80 1fbx h ALA 161 Ca -0.08 0.15 -0.23 0.00 0.00 0.00 0.00 54.91 54.75 1fbx h ALA 161 Cb 0.66 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1fbx h ALA 161 CO 0.14 -0.49 -1.01 -0.07 0.00 0.00 0.00 179.25 177.83 1fbx h LEU 162 N 0.43 0.36 -0.41 0.00 3.38 -1.01 -1.86 115.31 116.20 1fbx h LEU 162 Ca 0.69 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 58.29 1fbx h LEU 162 Cb 1.52 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.14 1fbx h LEU 162 CO -0.52 1.16 0.06 1.56 0.09 0.00 0.00 178.44 180.79 1fbx h GLN 163 N 0.12 0.68 -0.48 1.13 4.20 0.36 0.13 115.11 121.24 1fbx h GLN 163 Ca -0.08 -0.19 -0.02 0.00 0.06 0.00 0.00 58.65 58.43 1fbx h GLN 163 Cb 1.68 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 29.36 1fbx h GLN 163 CO 0.16 0.73 0.23 1.15 -0.67 0.00 0.00 178.83 180.43 1fbx h THR 164 N 0.53 1.19 0.01 -0.54 2.02 -0.94 -0.31 112.91 114.87 1fbx h THR 164 Ca 0.12 -0.55 -0.20 0.00 0.77 0.00 0.00 66.41 66.55 1fbx h THR 164 Cb 0.39 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1fbx h THR 164 CO 0.01 0.21 -0.92 -0.07 0.37 0.00 0.00 175.52 175.13 1fbx h LEU 165 N 0.64 0.12 0.00 2.58 3.38 -1.16 -3.32 115.31 117.55 1fbx h LEU 165 Ca 0.17 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1fbx h LEU 165 Cb 0.13 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1fbx h LEU 165 CO -0.02 0.97 -1.00 0.18 0.09 0.00 0.00 178.44 178.65 1fbx n LEU 166 N -3.54 0.62 -0.19 1.67 4.77 0.43 -4.99 117.00 115.77 1fbx n LEU 166 Ca -0.02 -0.03 -0.02 0.00 -0.03 0.00 0.00 56.01 55.90 1fbx n LEU 166 Cb 0.85 -0.10 -0.01 0.00 -2.33 0.00 0.00 43.42 41.83 1fbx n LEU 166 CO 0.47 0.05 -0.02 0.61 -1.33 0.00 0.00 177.39 177.17 1fbx n GLY 167 N 1.38 0.58 3.13 -0.72 0.00 -0.13 -4.61 105.19 104.82 1fbx n GLY 167 Ca 0.02 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.21 1fbx n GLY 167 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fbx s THR 168 N -2.05 0.73 -0.86 2.61 2.01 -1.22 -4.97 115.64 111.89 1fbx s THR 168 Ca 0.00 -1.51 0.26 0.00 0.31 0.00 0.00 61.69 60.75 1fbx s THR 168 Cb 0.00 -1.17 0.12 0.00 0.01 0.00 0.00 72.50 71.46 1fbx s THR 168 CO 0.00 -0.58 1.57 0.59 -0.69 0.00 0.00 174.62 175.52 1fbx n ASN 169 N 0.73 0.48 -4.11 3.53 3.02 -1.26 -4.49 115.26 113.17 1fbx n ASN 169 Ca -0.18 0.17 -0.38 0.00 -0.03 0.00 0.00 54.58 54.16 1fbx n ASN 169 Cb 0.57 -0.13 -0.04 0.00 -0.61 0.00 0.00 39.78 39.58 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 -1.79 3.33 -3.87 6.41 3.02 -1.26 -1.24 115.26 119.86 1fbx n ASN 170 Ca 0.05 -2.75 -0.12 0.00 -0.03 0.00 0.00 54.58 51.73 1fbx n ASN 170 Cb 0.38 -1.51 -0.14 0.00 -0.61 0.00 0.00 39.78 37.91 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 6.49 0.00 0.01 2.41 1.01 -1.25 -1.85 120.40 127.22 1fbx s VAL 171 Ca 0.59 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.57 1fbx s VAL 171 Cb 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 36.38 36.41 1fbx s VAL 171 CO 0.08 -0.01 -0.06 0.00 0.00 0.00 0.00 175.10 175.11 1fbx s ALA 172 N -0.02 0.49 -0.03 5.51 0.00 -0.71 0.27 121.76 127.25 1fbx s ALA 172 Ca -0.00 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.58 1fbx s ALA 172 Cb -0.00 -0.07 0.02 0.00 0.00 0.00 0.00 23.12 23.07 1fbx s ALA 172 CO 0.00 0.08 -0.01 0.08 0.00 0.00 0.00 175.76 175.90 1fbx s VAL 173 N -0.47 0.25 -0.03 0.00 1.01 -0.13 -1.93 120.40 119.10 1fbx s VAL 173 Ca -0.01 0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.04 1fbx s VAL 173 Cb -0.04 -0.33 -0.00 0.00 0.00 0.00 0.00 36.38 36.01 1fbx s VAL 173 CO -0.00 0.16 -0.16 -0.55 0.00 0.00 0.00 175.10 174.55 1fbx s SER 174 N 0.93 1.95 -0.05 3.32 0.15 -0.46 -0.56 113.70 118.99 1fbx s SER 174 Ca -0.10 -0.31 0.03 0.00 0.70 0.00 0.00 55.95 56.27 1fbx s SER 174 Cb -0.13 -0.47 0.01 0.00 -1.71 0.00 0.00 66.02 63.72 1fbx s SER 174 CO -0.01 0.15 -0.12 -0.63 1.20 0.00 0.00 173.24 173.82 1fbx s ILE 175 N -0.03 1.10 -0.14 6.45 1.01 0.38 -1.02 121.20 128.95 1fbx s ILE 175 Ca -0.01 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1fbx s ILE 175 Cb -0.10 -0.98 0.03 0.00 0.01 0.00 0.00 42.46 41.41 1fbx s ILE 175 CO 0.01 0.34 -0.11 -0.62 0.00 0.00 0.00 174.94 174.56 1fbx s ASP 176 N 0.37 2.59 0.19 3.58 3.68 -0.69 -1.00 116.67 125.39 1fbx s ASP 176 Ca -0.08 -0.48 -0.11 0.00 2.13 0.00 0.00 52.55 54.01 1fbx s ASP 176 Cb -0.13 -1.05 -0.00 0.00 -1.45 0.00 0.00 42.92 40.29 1fbx s ASP 176 CO 0.02 -0.10 0.36 0.00 0.13 0.00 0.00 175.17 175.59 1fbx s ALA 177 N 1.57 -0.13 -0.18 3.66 0.00 -0.39 -1.08 121.76 125.22 1fbx s ALA 177 Ca 0.04 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.14 1fbx s ALA 177 Cb -0.13 0.95 -0.01 0.00 0.00 0.00 0.00 23.12 23.92 1fbx s ALA 177 CO -0.09 -0.72 -0.08 0.08 0.00 0.00 0.00 175.76 174.94 1fbx s VAL 178 N -3.98 3.25 -0.35 0.00 1.01 0.10 -1.35 120.40 119.08 1fbx s VAL 178 Ca 0.19 -0.56 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 1fbx s VAL 178 Cb 0.02 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1fbx s VAL 178 CO 0.03 0.47 0.29 -1.00 0.00 0.00 0.00 175.10 174.89 1fbx s HIS 179 N 0.94 3.22 -1.59 5.22 3.76 -1.26 -0.89 115.29 124.69 1fbx s HIS 179 Ca -0.01 -0.18 0.15 0.00 -0.15 0.00 0.00 55.06 54.87 1fbx s HIS 179 Cb -0.15 -2.55 0.80 0.00 1.11 0.00 0.00 32.58 31.79 1fbx s HIS 179 CO 0.00 -0.40 1.39 0.66 -0.85 0.00 0.00 174.74 175.54 1fbx n TYR 180 N 5.20 0.00 1.25 1.40 4.02 -0.86 -0.54 117.16 127.63 1fbx n TYR 180 Ca -0.11 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.90 1fbx n TYR 180 Cb 0.49 -0.20 0.33 0.00 -0.02 0.00 0.00 39.34 39.94 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 -0.23 0.93 -0.07 0.00 0.31 0.30 -4.44 118.33 115.12 1fbx n VAL 182 Ca 0.13 -0.62 -0.06 0.00 -0.01 0.00 0.00 64.34 63.79 1fbx n VAL 182 Cb 0.39 -0.51 -0.02 0.00 -0.91 0.00 0.00 33.84 32.79 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 -2.51 0.47 0.00 5.55 4.81 -0.86 -0.39 118.16 125.23 1fbx n LYS 183 Ca -0.22 0.44 0.12 0.00 -0.87 0.00 0.00 58.31 57.78 1fbx n LYS 183 Cb 0.93 -1.61 0.65 0.00 0.02 0.00 0.00 35.03 35.02 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 -3.84 2.29 -3.62 3.14 0.00 -0.56 -4.13 120.51 113.79 1fbx n ALA 184 Ca -0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 53.44 53.21 1fbx n ALA 184 Cb 0.33 -1.40 0.02 0.00 0.00 0.00 0.00 19.45 18.40 1fbx n ALA 184 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1fbx n ARG 185 N -1.21 0.86 0.00 0.00 0.00 -1.24 -5.00 116.66 110.06 1fbx n ARG 185 Ca 0.13 -1.74 0.00 0.00 -0.00 0.00 0.00 57.85 56.25 1fbx n ARG 185 Cb 0.17 2.14 0.00 0.00 0.00 0.00 0.00 32.46 34.77 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 -0.41 4.09 0.25 5.14 0.00 -1.26 -1.67 105.19 111.33 1fbx n GLY 186 Ca -0.06 0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.32 -5.92 -0.61 6.09 -1.85 -3.47 117.51 112.07 1fbx h ILE 187 Ca 0.00 -0.77 -0.40 0.00 -1.37 0.00 0.00 64.86 62.32 1fbx h ILE 187 Cb 0.00 1.58 0.10 0.00 0.47 0.00 0.00 36.82 38.98 1fbx h ILE 187 CO 0.00 0.11 -0.74 0.54 -3.07 0.00 0.00 178.15 175.00 1fbx n ARG 188 N -3.30 -6.77 -2.57 2.19 1.74 -0.67 -4.94 116.66 102.34 1fbx n ARG 188 Ca -0.00 0.76 -0.43 0.00 -0.77 0.00 0.00 57.85 57.41 1fbx n ARG 188 Cb 0.34 -5.71 -0.02 0.00 -1.02 0.00 0.00 32.46 26.05 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 -3.72 6.88 0.00 0.55 -1.08 0.48 -4.86 116.67 114.92 1fbx s ASP 189 Ca 0.38 1.17 0.29 0.00 -0.52 0.00 0.00 52.55 53.87 1fbx s ASP 189 Cb -0.17 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 40.06 1fbx s ASP 189 CO 0.76 -0.90 1.91 0.00 0.52 0.00 0.00 175.17 177.45 1fbx n ALA 190 N 6.99 2.72 0.00 3.66 0.00 -1.26 -3.66 120.51 128.96 1fbx n ALA 190 Ca 0.13 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1fbx n ALA 190 Cb 0.47 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.57 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 -0.79 0.00 -2.44 0.00 -2.24 -1.26 -5.07 114.28 102.47 1fbx n THR 191 Ca 0.17 -0.16 -0.36 0.00 -2.27 0.00 0.00 64.05 61.43 1fbx n THR 191 Cb 0.26 0.66 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 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 -0.91 6.40 0.13 3.42 1.04 -1.26 -5.06 113.70 117.46 1fbx s SER 192 Ca 0.00 2.10 0.04 0.00 0.48 0.00 0.00 55.95 58.57 1fbx s SER 192 Cb 0.00 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 1fbx s SER 192 CO 0.00 -0.75 -0.11 0.00 0.98 0.00 0.00 173.24 173.37 1fbx s ALA 193 N -1.72 1.37 0.02 5.32 0.00 -1.26 -4.78 121.76 120.70 1fbx s ALA 193 Ca 0.63 -1.39 0.09 0.00 0.00 0.00 0.00 51.96 51.29 1fbx s ALA 193 Cb -0.23 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1fbx s ALA 193 CO 0.27 -0.06 -0.26 0.99 0.00 0.00 0.00 175.76 176.71 1fbx s THR 194 N -2.96 2.09 -0.11 0.00 2.01 -0.46 -4.95 115.64 111.26 1fbx s THR 194 Ca 0.13 -1.26 -0.00 0.00 0.31 0.00 0.00 61.69 60.87 1fbx s THR 194 Cb 0.00 -1.76 0.02 0.00 0.01 0.00 0.00 72.50 70.78 1fbx s THR 194 CO 0.01 0.46 -0.08 -0.89 -0.69 0.00 0.00 174.62 173.42 1fbx s THR 195 N -0.71 1.06 0.19 -0.82 2.01 -1.26 -1.26 115.64 114.86 1fbx s THR 195 Ca 0.11 -0.32 0.11 0.00 0.31 0.00 0.00 61.69 61.89 1fbx s THR 195 Cb -0.10 -1.07 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 1fbx s THR 195 CO 0.01 0.37 -0.20 0.42 -0.69 0.00 0.00 174.62 174.52 1fbx s THR 196 N 1.59 2.56 -0.17 -0.82 -4.23 -0.17 -4.97 115.64 109.43 1fbx s THR 196 Ca 0.03 -1.95 -0.17 0.00 -1.18 0.00 0.00 61.69 58.42 1fbx s THR 196 Cb -0.13 -2.24 0.05 0.00 1.34 0.00 0.00 72.50 71.52 1fbx s THR 196 CO -0.07 -0.12 0.48 0.42 -0.54 0.00 0.00 174.62 174.79 1fbx s THR 197 N -1.69 0.00 -0.04 3.99 -4.23 -1.26 -0.47 115.64 111.94 1fbx s THR 197 Ca 0.22 -0.03 0.04 0.00 -1.18 0.00 0.00 61.69 60.74 1fbx s THR 197 Cb -0.08 -0.69 0.00 0.00 1.34 0.00 0.00 72.50 73.07 1fbx s THR 197 CO 0.11 -0.01 -0.15 -0.44 -0.54 0.00 0.00 174.62 173.59 1fbx s SER 198 N 0.13 1.92 0.02 3.99 0.01 0.28 -4.99 113.70 115.04 1fbx s SER 198 Ca -0.01 -0.31 0.07 0.00 1.31 0.00 0.00 55.95 57.01 1fbx s SER 198 Cb -0.03 -0.58 -0.02 0.00 0.21 0.00 0.00 66.02 65.59 1fbx s SER 198 CO 0.01 0.12 -0.21 -0.76 0.41 0.00 0.00 173.24 172.81 1fbx s LEU 199 N 0.16 2.11 0.25 2.44 1.43 -1.26 -0.96 118.68 122.86 1fbx s LEU 199 Ca -0.05 -0.46 0.08 0.00 -1.03 0.00 0.00 54.13 52.67 1fbx s LEU 199 Cb -0.12 -1.02 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 1fbx s LEU 199 CO 0.02 0.20 -0.12 -0.83 0.23 0.00 0.00 176.35 175.86 1fbx s GLY 200 N -0.88 1.69 0.00 -3.19 0.00 0.14 -4.61 107.32 100.47 1fbx s GLY 200 Ca 0.08 -1.81 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1fbx s GLY 200 CO 0.01 -1.84 0.00 0.61 0.00 0.00 0.00 173.10 171.88 1fbx n GLY 201 N -0.52 1.54 0.49 0.20 0.00 -0.37 -1.18 105.19 105.35 1fbx n GLY 201 Ca -0.06 -0.44 0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 0.22 -2.35 0.99 3.38 -1.94 0.47 115.31 116.07 1fbx h LEU 202 Ca 0.00 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1fbx h LEU 202 Cb 0.00 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1fbx h LEU 202 CO 0.00 -0.01 0.20 -0.26 0.09 0.00 0.00 178.44 178.45 1fbx h PHE 203 N 0.16 0.00 0.00 1.13 0.04 -1.43 0.74 116.94 117.57 1fbx h PHE 203 Ca 0.67 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 61.14 1fbx h PHE 203 Cb 2.21 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 40.30 1fbx h PHE 203 CO -0.00 0.00 -2.14 1.17 -0.60 0.00 0.00 178.31 176.74 1fbx n LYS 204 N -3.33 0.49 -0.05 1.51 4.81 0.16 -4.21 118.16 117.55 1fbx n LYS 204 Ca -0.01 0.12 -0.21 0.00 -0.87 0.00 0.00 58.31 57.35 1fbx n LYS 204 Cb 0.29 -1.38 -0.13 0.00 0.02 0.00 0.00 35.03 33.82 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 -0.07 0.17 -2.95 3.14 4.64 -1.26 -3.44 113.55 113.78 1fbx h SER 205 Ca -0.45 -0.74 -0.57 0.00 -0.47 0.00 0.00 61.79 59.56 1fbx h SER 205 Cb 1.67 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.67 1fbx h SER 205 CO -0.09 1.49 1.11 -0.55 -0.87 0.00 0.00 176.83 177.92 1fbx s SER 206 N -6.84 6.35 0.40 4.97 0.15 0.23 -4.86 113.70 114.11 1fbx s SER 206 Ca -0.24 1.30 0.08 0.00 0.70 0.00 0.00 55.95 57.80 1fbx s SER 206 Cb 0.04 -2.53 0.84 0.00 -1.71 0.00 0.00 66.02 62.65 1fbx s SER 206 CO 0.68 -1.33 2.00 -0.61 1.20 0.00 0.00 173.24 175.18 1fbx h GLN 207 N 10.77 0.40 -0.00 5.44 5.75 -1.86 -0.43 115.11 135.18 1fbx h GLN 207 Ca -0.31 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.14 1fbx h GLN 207 Cb 1.13 -0.08 -0.00 0.00 1.07 0.00 0.00 27.48 29.61 1fbx h GLN 207 CO 1.03 0.36 -0.00 -0.97 -2.65 0.00 0.00 178.83 176.60 1fbx h ASN 208 N 0.40 0.00 0.05 -0.69 -1.24 -1.92 -2.45 115.58 109.73 1fbx h ASN 208 Ca 0.10 -0.33 -0.12 0.00 0.71 0.00 0.00 56.30 56.66 1fbx h ASN 208 Cb 0.13 -0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.17 1fbx h ASN 208 CO -0.01 0.33 -0.40 0.74 -1.29 0.00 0.00 177.43 176.80 1fbx h THR 209 N -0.32 1.30 -0.32 -3.57 2.02 -1.81 -1.80 112.91 108.41 1fbx h THR 209 Ca 0.00 -1.55 0.05 0.00 0.77 0.00 0.00 66.41 65.68 1fbx h THR 209 Cb 0.33 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.28 1fbx h THR 209 CO 0.00 0.48 0.06 -0.09 0.37 0.00 0.00 175.52 176.34 1fbx h ARG 210 N 0.38 0.16 0.00 6.66 2.43 -1.04 -2.28 114.38 120.69 1fbx h ARG 210 Ca 0.03 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.08 1fbx h ARG 210 Cb 0.87 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 1fbx h ARG 210 CO 0.07 0.11 -0.53 0.45 -1.51 0.00 0.00 179.97 178.56 1fbx h HIS 211 N 0.17 0.00 -0.82 2.20 3.86 -1.27 -2.70 115.15 116.59 1fbx h HIS 211 Ca 0.15 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.35 1fbx h HIS 211 Cb 0.17 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.60 1fbx h HIS 211 CO -0.18 0.53 0.48 0.93 0.86 0.00 0.00 177.93 180.55 1fbx h GLU 212 N 0.00 1.12 0.23 2.45 5.08 -0.95 -0.35 114.58 122.15 1fbx h GLU 212 Ca -0.01 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 1fbx h GLU 212 Cb 1.30 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1fbx h GLU 212 CO 0.07 0.80 -0.11 0.35 -1.00 0.00 0.00 179.01 179.12 1fbx h PHE 213 N 1.12 -0.28 -0.95 4.33 3.57 -1.37 -3.06 116.94 120.30 1fbx h PHE 213 Ca 0.29 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.88 1fbx h PHE 213 Cb -0.02 0.09 -0.08 0.00 2.79 0.00 0.00 35.95 38.74 1fbx h PHE 213 CO -0.00 0.09 0.59 -0.07 -2.23 0.00 0.00 178.31 176.69 1fbx h LEU 214 N -0.77 0.89 -2.18 0.59 3.38 -1.37 0.22 115.31 116.06 1fbx h LEU 214 Ca -0.03 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1fbx h LEU 214 Cb 0.50 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1fbx h LEU 214 CO 0.05 0.51 -0.04 -0.09 0.09 0.00 0.00 178.44 178.96 1fbx h ARG 215 N 0.99 0.00 -0.01 1.13 2.43 -1.12 -0.84 114.38 116.97 1fbx h ARG 215 Ca 0.45 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.62 1fbx h ARG 215 Cb 0.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1fbx h ARG 215 CO -0.23 0.04 -0.36 0.00 -1.51 0.00 0.00 179.97 177.91 1fbx n ALA 216 N -2.39 3.30 -1.74 2.80 0.00 0.69 -4.92 120.51 118.25 1fbx n ALA 216 Ca -0.03 -0.45 -0.30 0.00 0.00 0.00 0.00 53.44 52.66 1fbx n ALA 216 Cb 0.13 -1.06 0.06 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.58 3.45 -0.28 0.00 1.01 -0.32 -4.65 120.40 117.03 1fbx s VAL 217 Ca 0.21 0.47 -0.07 0.00 0.00 0.00 0.00 61.98 62.59 1fbx s VAL 217 Cb 0.19 -3.36 0.01 0.00 0.00 0.00 0.00 36.38 33.22 1fbx s VAL 217 CO 0.57 -0.62 0.26 -1.14 0.00 0.00 0.00 175.10 174.18 1fbx n ARG 218 N -3.15 -2.07 -3.62 2.72 3.00 -1.26 -5.00 116.66 107.28 1fbx n ARG 218 Ca 0.07 1.88 -0.29 0.00 -0.00 0.00 0.00 57.85 59.51 1fbx n ARG 218 Cb 0.56 -4.41 -0.09 0.00 0.00 0.00 0.00 32.46 28.52 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 -0.01 3.50 -1.54 -0.14 8.25 -1.26 -5.03 115.22 118.98 1fbx n HIS 219 Ca 0.05 -4.16 -0.22 0.00 -0.26 0.00 0.00 57.72 53.13 1fbx n HIS 219 Cb 0.20 -0.67 -0.09 0.00 1.12 0.00 0.00 29.99 30.55 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 1.44 1.00 -0.38 4.41 -0.00 -1.26 -4.84 115.22 115.60 1fbx n HIS 220 Ca 0.25 0.05 0.00 0.00 0.46 0.00 0.00 57.72 58.48 1fbx n HIS 220 Cb 0.38 -2.27 0.00 0.00 -0.12 0.00 0.00 29.99 27.97 1fbx n HIS 220 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89