#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 -4.45 3.54 2.88 -1.26 -5.17 113.62 109.17 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 0.39 -0.11 0.00 -0.75 0.00 0.00 64.21 63.74 1fbx n SER 2 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1fbx s LEU 3 N -4.36 2.20 0.04 2.46 1.43 -1.26 -4.72 118.68 114.48 1fbx s LEU 3 Ca 0.00 -1.37 0.03 0.00 -1.03 0.00 0.00 54.13 51.76 1fbx s LEU 3 Cb 0.00 -0.40 -0.04 0.00 0.03 0.00 0.00 46.19 45.79 1fbx s LEU 3 CO 0.00 -0.59 0.02 -0.94 0.23 0.00 0.00 176.35 175.06 1fbx s SER 4 N -3.48 5.17 0.18 2.29 1.04 -1.26 -4.97 113.70 112.66 1fbx s SER 4 Ca 0.36 -0.06 -0.25 0.00 0.48 0.00 0.00 55.95 56.49 1fbx s SER 4 Cb 0.09 -1.33 0.04 0.00 0.10 0.00 0.00 66.02 64.92 1fbx s SER 4 CO 0.15 0.23 1.46 0.29 0.98 0.00 0.00 173.24 176.35 1fbx n LYS 5 N 0.98 -0.35 0.03 4.02 5.02 -1.26 -0.25 118.16 126.35 1fbx n LYS 5 Ca -0.12 1.44 -0.12 0.00 -2.02 0.00 0.00 58.31 57.49 1fbx n LYS 5 Cb 0.52 -2.12 -0.07 0.00 -0.02 0.00 0.00 35.03 33.34 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 0.02 -0.68 1.97 3.07 -1.98 -0.46 114.58 116.52 1fbx h GLU 6 Ca 0.22 -0.00 0.09 0.00 -0.50 0.00 0.00 59.36 59.17 1fbx h GLU 6 Cb 0.45 -0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.29 1fbx h GLU 6 CO -0.91 0.01 0.32 0.00 -1.40 0.00 0.00 179.01 177.03 1fbx h ALA 7 N 1.01 0.92 0.66 3.43 0.00 -1.50 0.35 119.26 124.14 1fbx h ALA 7 Ca 0.01 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1fbx h ALA 7 Cb 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1fbx h ALA 7 CO -0.01 -0.09 -0.32 0.00 0.00 0.00 0.00 179.25 178.83 1fbx h ALA 8 N 1.43 -0.88 -0.78 0.00 0.00 -0.28 -1.40 119.26 117.35 1fbx h ALA 8 Ca 0.34 -0.21 0.18 0.00 0.00 0.00 0.00 54.91 55.23 1fbx h ALA 8 Cb 0.38 0.34 -0.13 0.00 0.00 0.00 0.00 17.79 18.38 1fbx h ALA 8 CO -0.28 -0.96 0.08 -0.07 0.00 0.00 0.00 179.25 178.02 1fbx h LEU 9 N -0.96 -0.22 0.11 0.00 3.38 -0.44 -0.75 115.31 116.43 1fbx h LEU 9 Ca -0.09 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1fbx h LEU 9 Cb 0.70 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1fbx h LEU 9 CO 0.15 -0.15 -0.05 0.58 0.09 0.00 0.00 178.44 179.05 1fbx h VAL 10 N 0.15 1.05 -0.90 1.22 2.07 -0.80 -1.92 116.25 117.12 1fbx h VAL 10 Ca 0.44 -0.65 0.14 0.00 0.82 0.00 0.00 66.70 67.46 1fbx h VAL 10 Cb 0.80 1.46 -0.09 0.00 -1.52 0.00 0.00 31.29 31.94 1fbx h VAL 10 CO -0.64 0.16 0.51 -0.74 0.02 0.00 0.00 177.57 176.88 1fbx h HIS 11 N -0.45 0.91 0.22 1.57 -0.00 -0.26 0.17 115.15 117.31 1fbx h HIS 11 Ca -0.02 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.38 1fbx h HIS 11 Cb 0.37 -0.27 0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1fbx h HIS 11 CO 0.02 0.27 -0.11 0.93 -0.00 0.00 0.00 177.93 179.05 1fbx h GLU 12 N 0.75 -0.29 -0.74 5.26 5.08 -1.09 -1.58 114.58 121.96 1fbx h GLU 12 Ca 0.48 0.02 0.09 0.00 -1.00 0.00 0.00 59.36 58.95 1fbx h GLU 12 Cb 0.62 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.87 1fbx h GLU 12 CO -0.33 -0.13 0.40 0.00 -1.00 0.00 0.00 179.01 177.95 1fbx h ALA 13 N 0.38 1.04 -0.63 3.43 0.00 -0.42 0.38 119.26 123.44 1fbx h ALA 13 Ca -0.03 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1fbx h ALA 13 Cb 0.29 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1fbx h ALA 13 CO 0.05 0.01 0.11 -0.07 0.00 0.00 0.00 179.25 179.35 1fbx h LEU 14 N 0.67 1.01 -0.35 0.00 3.38 -0.52 -2.20 115.31 117.31 1fbx h LEU 14 Ca 0.36 -0.26 -0.19 0.00 0.09 0.00 0.00 57.88 57.88 1fbx h LEU 14 Cb 0.35 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1fbx h LEU 14 CO -0.25 1.01 -0.63 0.58 0.09 0.00 0.00 178.44 179.23 1fbx h VAL 15 N 0.96 1.30 -0.68 1.22 2.07 -0.36 0.50 116.25 121.27 1fbx h VAL 15 Ca 0.19 -1.87 0.11 0.00 0.82 0.00 0.00 66.70 65.95 1fbx h VAL 15 Cb 0.43 1.83 -0.08 0.00 -1.52 0.00 0.00 31.29 31.95 1fbx h VAL 15 CO 0.01 0.59 0.28 0.00 0.02 0.00 0.00 177.57 178.47 1fbx h ALA 16 N 0.78 0.91 -0.09 1.67 0.00 -0.07 0.95 119.26 123.40 1fbx h ALA 16 Ca -0.01 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1fbx h ALA 16 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1fbx h ALA 16 CO 0.13 -0.16 0.00 0.54 0.00 0.00 0.00 179.25 179.75 1fbx n ARG 17 N -4.97 1.54 -3.58 0.00 3.00 -0.84 -4.92 116.66 106.90 1fbx n ARG 17 Ca 0.11 -0.81 -0.21 0.00 -0.01 0.00 0.00 57.85 56.94 1fbx n ARG 17 Cb 0.32 -1.41 0.07 0.00 0.00 0.00 0.00 32.46 31.44 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 1.08 -0.39 0.25 -0.13 0.00 0.33 -4.91 105.19 101.41 1fbx n GLY 18 Ca 0.17 0.15 0.03 0.00 0.00 0.00 0.00 46.02 46.36 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 -4.39 1.92 -4.77 0.99 4.77 0.17 -4.99 117.00 110.70 1fbx n LEU 19 Ca -0.20 -1.49 -0.33 0.00 -0.03 0.00 0.00 56.01 53.95 1fbx n LEU 19 Cb 0.64 -0.05 0.05 0.00 -2.33 0.00 0.00 43.42 41.72 1fbx n LEU 19 CO 0.65 0.45 0.75 -1.61 -1.33 0.00 0.00 177.39 176.30 1fbx s GLU 20 N -0.71 2.80 0.37 3.23 0.41 -1.13 -4.86 118.70 118.80 1fbx s GLU 20 Ca 0.08 1.43 -0.28 0.00 -0.41 0.00 0.00 54.97 55.79 1fbx s GLU 20 Cb 0.05 -1.95 -0.11 0.00 -1.78 0.00 0.00 34.13 30.34 1fbx s GLU 20 CO 0.07 -1.26 1.50 2.41 -0.49 0.00 0.00 175.26 177.50 1fbx n THR 21 N -2.35 1.86 -1.67 3.63 -1.04 -1.26 -4.78 114.28 108.67 1fbx n THR 21 Ca 0.11 -0.46 -0.17 0.00 -2.04 0.00 0.00 64.05 61.49 1fbx n THR 21 Cb 0.52 -1.97 -0.06 0.00 -1.82 0.00 0.00 70.33 66.99 1fbx n THR 21 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1fbx s PRO 22 N -1.87 1.80 0.46 -2.82 0.02 -1.26 -4.92 135.00 126.40 1fbx s PRO 22 Ca 0.55 0.36 0.07 0.00 0.02 0.00 0.00 61.00 61.99 1fbx s PRO 22 Cb -0.48 -4.83 -0.01 0.00 0.02 0.00 0.00 34.50 29.20 1fbx s PRO 22 CO 0.62 -4.22 0.33 -0.51 -0.33 0.00 0.00 177.00 172.89 1fbx s LEU 23 N 13.82 3.10 0.15 -5.54 2.01 -1.26 -5.15 118.68 125.80 1fbx s LEU 23 Ca 0.88 -1.00 0.06 0.00 0.01 0.00 0.00 54.13 54.08 1fbx s LEU 23 Cb -0.12 -1.61 -0.04 0.00 0.01 0.00 0.00 46.19 44.44 1fbx s LEU 23 CO 0.07 -0.77 -0.14 -0.13 1.01 0.00 0.00 176.35 176.39 1fbx s ARG 24 N -4.11 1.12 0.70 1.70 0.52 -1.26 -5.13 118.95 112.49 1fbx s ARG 24 Ca 0.42 -1.37 -0.16 0.00 -0.52 0.00 0.00 55.73 54.10 1fbx s ARG 24 Cb -0.01 -0.94 0.02 0.00 0.52 0.00 0.00 34.95 34.54 1fbx s ARG 24 CO 0.24 0.17 1.24 -2.14 0.02 0.00 0.00 175.30 174.83 1fbx s PRO 25 N -3.08 2.28 0.00 3.54 0.02 -1.26 -4.82 135.00 131.68 1fbx s PRO 25 Ca 0.14 1.89 0.01 0.00 0.02 0.00 0.00 61.00 63.06 1fbx s PRO 25 Cb -0.03 -1.83 0.09 0.00 0.02 0.00 0.00 34.50 32.74 1fbx s PRO 25 CO 0.04 -1.76 0.69 -2.30 -0.33 0.00 0.00 177.00 173.33 1fbx n PRO 26 N -2.41 0.62 0.00 5.54 -0.02 -1.26 -4.88 135.00 132.59 1fbx n PRO 26 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 1fbx n PRO 26 Cb 0.49 -1.04 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 1fbx n PRO 26 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1fbx n VAL 27 N -0.54 0.00 -4.31 -1.45 0.31 -1.26 -4.51 118.33 106.57 1fbx n VAL 27 Ca 0.01 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.07 1fbx n VAL 27 Cb 0.00 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.84 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 2.58 -0.81 3.52 -3.43 -1.26 -5.05 115.29 110.84 1fbx s HIS 28 Ca 0.00 -0.24 -0.25 0.00 -0.80 0.00 0.00 55.06 53.77 1fbx s HIS 28 Cb 0.00 -1.26 -0.07 0.00 -1.43 0.00 0.00 32.58 29.82 1fbx s HIS 28 CO 0.00 0.52 2.10 -1.21 -2.00 0.00 0.00 174.74 174.15 1fbx s GLU 29 N -2.84 2.25 -0.25 -0.38 2.02 -1.26 -4.94 118.70 113.30 1fbx s GLU 29 Ca 0.25 0.14 -0.09 0.00 0.02 0.00 0.00 54.97 55.28 1fbx s GLU 29 Cb -0.09 -4.88 -0.04 0.00 0.10 0.00 0.00 34.13 29.22 1fbx s GLU 29 CO 0.15 -3.63 0.13 1.41 0.02 0.00 0.00 175.26 173.33 1fbx s MET 30 N 7.65 3.90 0.76 1.61 1.75 -1.26 -5.08 119.30 128.63 1fbx s MET 30 Ca 0.78 -0.36 -0.16 0.00 -1.25 0.00 0.00 55.69 54.70 1fbx s MET 30 Cb -0.10 -3.46 -0.07 0.00 2.84 0.00 0.00 34.83 34.04 1fbx s MET 30 CO 0.06 -0.05 0.14 -3.47 -0.65 0.00 0.00 175.02 171.04 1fbx n ASP 31 N 4.59 -2.68 0.11 1.11 2.03 -1.26 -4.80 116.55 115.65 1fbx n ASP 31 Ca -0.15 0.50 0.02 0.00 0.52 0.00 0.00 54.79 55.68 1fbx n ASP 31 Cb 0.52 -1.06 -0.01 0.00 -0.72 0.00 0.00 41.12 39.85 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 -0.55 0.00 1.36 1.67 4.21 -1.99 -2.29 115.58 118.00 1fbx h ASN 32 Ca -0.44 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.02 1fbx h ASN 32 Cb 1.35 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.54 1fbx h ASN 32 CO 0.38 0.51 -0.23 -0.33 -1.29 0.00 0.00 177.43 176.47 1fbx h GLU 33 N 0.00 0.00 0.10 0.81 5.08 -1.99 -1.48 114.58 117.11 1fbx h GLU 33 Ca -0.05 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1fbx h GLU 33 Cb 1.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.68 1fbx h GLU 33 CO 0.06 0.23 -0.05 1.15 -1.00 0.00 0.00 179.01 179.40 1fbx h THR 34 N 0.00 0.96 -0.88 1.13 2.02 -1.89 -2.23 112.91 112.03 1fbx h THR 34 Ca -0.00 -1.34 0.18 0.00 0.77 0.00 0.00 66.41 66.01 1fbx h THR 34 Cb 0.97 1.68 -0.11 0.00 -1.74 0.00 0.00 68.15 68.96 1fbx h THR 34 CO 0.03 0.27 0.43 0.03 0.37 0.00 0.00 175.52 176.66 1fbx h ARG 35 N -0.88 0.53 -0.52 6.66 3.08 -1.37 0.11 114.38 121.99 1fbx h ARG 35 Ca -0.01 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 1fbx h ARG 35 Cb 0.56 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1fbx h ARG 35 CO 0.02 0.35 -0.09 0.87 -1.07 0.00 0.00 179.97 180.06 1fbx h LYS 36 N 0.55 0.95 -0.22 0.04 1.57 -1.27 0.63 116.57 118.82 1fbx h LYS 36 Ca 0.51 -0.33 -0.18 0.00 -1.87 0.00 0.00 60.65 58.78 1fbx h LYS 36 Cb 0.83 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.07 1fbx h LYS 36 CO -0.43 0.99 -0.58 0.66 -0.57 0.00 0.00 179.45 179.53 1fbx h SER 37 N 0.85 0.88 -0.07 0.86 4.64 -0.62 -0.19 113.55 119.91 1fbx h SER 37 Ca 0.14 -0.57 0.04 0.00 -0.47 0.00 0.00 61.79 60.92 1fbx h SER 37 Cb 0.62 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.41 1fbx h SER 37 CO 0.04 1.30 -0.18 -0.07 -0.87 0.00 0.00 176.83 177.05 1fbx h LEU 38 N 0.51 -0.54 -1.34 5.97 3.38 -0.67 0.50 115.31 123.13 1fbx h LEU 38 Ca -0.01 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1fbx h LEU 38 Cb 1.19 0.24 -0.05 0.00 0.09 0.00 0.00 40.66 42.14 1fbx h LEU 38 CO 0.12 -0.23 0.49 0.40 0.09 0.00 0.00 178.44 179.31 1fbx h ILE 39 N -0.26 1.05 -0.06 1.22 2.04 -0.72 0.47 117.51 121.26 1fbx h ILE 39 Ca 0.08 -0.28 -0.10 0.00 1.00 0.00 0.00 64.86 65.55 1fbx h ILE 39 Cb 0.37 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1fbx h ILE 39 CO -0.22 0.15 -0.44 0.00 0.00 0.00 0.00 178.15 177.64 1fbx h ALA 40 N 1.59 1.16 0.11 1.87 0.00 -0.20 -1.50 119.26 122.28 1fbx h ALA 40 Ca 0.31 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1fbx h ALA 40 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1fbx h ALA 40 CO -0.10 0.59 -0.10 0.78 0.00 0.00 0.00 179.25 180.41 1fbx h GLY 41 N 1.30 -0.21 1.13 0.00 0.00 0.13 0.17 103.07 105.58 1fbx h GLY 41 Ca 0.01 0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 1fbx h GLY 41 CO 0.06 -0.11 0.38 0.45 0.00 0.00 0.00 176.54 177.33 1fbx h HIS 42 N -0.23 1.13 0.00 5.60 -0.00 -1.18 -1.99 115.15 118.47 1fbx h HIS 42 Ca 0.00 -0.05 -0.05 0.00 -0.00 0.00 0.00 60.37 60.28 1fbx h HIS 42 Cb 0.22 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 27.27 1fbx h HIS 42 CO -0.11 0.82 -0.22 0.52 -0.00 0.00 0.00 177.93 178.93 1fbx h MET 43 N 1.12 0.00 -0.50 2.45 2.86 -0.61 -0.34 114.93 119.91 1fbx h MET 43 Ca 0.27 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.78 1fbx h MET 43 Cb 0.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1fbx h MET 43 CO -0.03 0.22 -0.19 1.15 1.06 0.00 0.00 176.91 179.12 1fbx h THR 44 N 0.00 1.27 0.29 2.22 2.02 0.02 -1.26 112.91 117.47 1fbx h THR 44 Ca -0.00 -1.35 -0.01 0.00 0.77 0.00 0.00 66.41 65.81 1fbx h THR 44 Cb 0.40 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 1fbx h THR 44 CO 0.03 0.47 -0.14 -0.33 0.37 0.00 0.00 175.52 175.92 1fbx h GLU 45 N 0.88 -0.37 -0.48 6.66 4.39 -0.66 -1.57 114.58 123.41 1fbx h GLU 45 Ca 0.12 0.03 0.07 0.00 0.34 0.00 0.00 59.36 59.91 1fbx h GLU 45 Cb 0.77 0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.45 1fbx h GLU 45 CO 0.06 -0.20 0.17 0.82 -1.16 0.00 0.00 179.01 178.70 1fbx h ILE 46 N -0.45 0.83 -0.07 3.13 2.04 -1.08 0.05 117.51 121.96 1fbx h ILE 46 Ca -0.04 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.72 1fbx h ILE 46 Cb 0.34 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1fbx h ILE 46 CO 0.06 0.06 0.05 0.24 0.00 0.00 0.00 178.15 178.57 1fbx h MET 47 N 0.34 0.00 0.09 2.37 2.86 -0.98 -1.75 114.93 117.86 1fbx h MET 47 Ca 0.23 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.61 1fbx h MET 47 Cb 0.24 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1fbx h MET 47 CO -0.24 0.00 -1.26 1.96 1.06 0.00 0.00 176.91 178.43 1fbx h GLN 48 N 0.00 0.19 0.00 1.72 4.20 -0.01 -2.79 115.11 118.43 1fbx h GLN 48 Ca 0.03 -0.33 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1fbx h GLN 48 Cb 0.14 0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1fbx h GLN 48 CO -0.00 1.12 0.00 1.28 -0.67 0.00 0.00 178.83 180.56 1fbx n LEU 49 N -3.45 0.00 -0.10 1.46 4.77 -0.57 -0.82 117.00 118.28 1fbx n LEU 49 Ca -0.08 0.32 0.10 0.00 -0.03 0.00 0.00 56.01 56.32 1fbx n LEU 49 Cb 1.01 -0.32 -0.07 0.00 -2.33 0.00 0.00 43.42 41.70 1fbx n LEU 49 CO 0.51 -0.19 0.05 0.18 -1.33 0.00 0.00 177.39 176.61 1fbx n LEU 50 N -1.32 1.17 -0.20 2.23 4.77 -1.02 -4.96 117.00 117.67 1fbx n LEU 50 Ca 0.05 -0.52 -0.02 0.00 -0.03 0.00 0.00 56.01 55.49 1fbx n LEU 50 Cb 0.10 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.17 1fbx n LEU 50 CO 0.09 0.27 -0.02 0.59 -1.33 0.00 0.00 177.39 176.99 1fbx n ASN 51 N -1.20 -2.48 -4.82 -1.43 3.02 -0.00 -5.03 115.26 103.30 1fbx n ASN 51 Ca 0.05 0.03 -0.33 0.00 -0.03 0.00 0.00 54.58 54.30 1fbx n ASN 51 Cb 0.36 -0.96 -0.04 0.00 -0.61 0.00 0.00 39.78 38.53 1fbx n ASN 51 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1fbx s LEU 52 N -0.55 3.77 -0.70 3.41 1.43 -1.07 -4.98 118.68 120.00 1fbx s LEU 52 Ca 0.00 1.70 -0.18 0.00 -1.03 0.00 0.00 54.13 54.62 1fbx s LEU 52 Cb 0.00 -4.53 0.13 0.00 0.03 0.00 0.00 46.19 41.82 1fbx s LEU 52 CO 0.00 -0.58 0.79 -0.62 0.23 0.00 0.00 176.35 176.17 1fbx s ASP 53 N -2.52 6.38 0.00 2.29 2.15 -1.26 -4.74 116.67 118.97 1fbx s ASP 53 Ca 0.62 -1.81 0.04 0.00 0.43 0.00 0.00 52.55 51.83 1fbx s ASP 53 Cb -0.11 -2.30 0.16 0.00 -0.30 0.00 0.00 42.92 40.37 1fbx s ASP 53 CO 0.23 -0.99 1.06 0.18 -0.17 0.00 0.00 175.17 175.48 1fbx n LEU 54 N 5.86 0.00 0.23 -1.34 4.77 -1.26 -1.50 117.00 123.77 1fbx n LEU 54 Ca 0.01 0.44 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 1fbx n LEU 54 Cb 0.44 -0.44 0.52 0.00 -2.33 0.00 0.00 43.42 41.62 1fbx n LEU 54 CO 0.52 -0.38 0.85 0.00 -1.33 0.00 0.00 177.39 177.04 1fbx h ALA 55 N 2.14 1.05 -2.53 -1.18 0.00 -1.95 -3.19 119.26 113.60 1fbx h ALA 55 Ca 0.00 -0.17 -0.57 0.00 0.00 0.00 0.00 54.91 54.17 1fbx h ALA 55 Cb 0.05 -0.03 0.11 0.00 0.00 0.00 0.00 17.79 17.92 1fbx h ALA 55 CO 0.00 0.23 0.55 -3.47 0.00 0.00 0.00 179.25 176.56 1fbx n ASP 56 N -3.39 2.84 -0.12 0.00 2.03 -0.56 -4.80 116.55 112.55 1fbx n ASP 56 Ca -0.00 1.20 0.16 0.00 0.52 0.00 0.00 54.79 56.66 1fbx n ASP 56 Cb 0.39 -1.49 0.54 0.00 -0.72 0.00 0.00 41.12 39.84 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 2.88 0.31 0.50 1.67 2.03 -1.91 -1.29 116.42 120.61 1fbx h ASP 57 Ca -0.46 0.01 -0.30 0.00 -0.73 0.00 0.00 57.03 55.56 1fbx h ASP 57 Cb 1.28 -0.05 -0.03 0.00 -0.83 0.00 0.00 39.33 39.70 1fbx h ASP 57 CO 0.65 0.17 -1.59 -1.28 -1.03 0.00 0.00 179.24 176.15 1fbx h SER 58 N 0.33 0.18 0.52 4.15 0.87 -1.95 -3.39 113.55 114.27 1fbx h SER 58 Ca 0.33 -0.31 -0.29 0.00 -1.23 0.00 0.00 61.79 60.29 1fbx h SER 58 Cb 0.82 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 62.72 1fbx h SER 58 CO -0.09 1.27 -1.42 -0.07 -0.53 0.00 0.00 176.83 175.99 1fbx h LEU 59 N 0.03 0.40 -0.94 2.23 3.38 -1.74 -3.39 115.31 115.28 1fbx h LEU 59 Ca -0.25 -0.50 0.23 0.00 0.09 0.00 0.00 57.88 57.45 1fbx h LEU 59 Cb 1.98 -0.13 -0.18 0.00 0.09 0.00 0.00 40.66 42.43 1fbx h LEU 59 CO 0.11 1.41 -0.09 0.80 0.09 0.00 0.00 178.44 180.76 1fbx n MET 60 N -3.48 -0.08 0.00 1.13 1.56 -0.54 -0.70 117.12 115.02 1fbx n MET 60 Ca -0.13 1.43 0.14 0.00 -0.27 0.00 0.00 57.70 58.87 1fbx n MET 60 Cb 1.04 -2.22 0.60 0.00 2.15 0.00 0.00 33.22 34.79 1fbx n MET 60 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 1fbx n GLU 61 N -5.45 1.11 -0.22 2.12 -0.58 -1.26 -4.39 120.64 111.96 1fbx n GLU 61 Ca 0.19 -0.49 -0.06 0.00 -0.42 0.00 0.00 57.16 56.38 1fbx n GLU 61 Cb 0.62 -1.49 0.04 0.00 -0.57 0.00 0.00 31.44 30.04 1fbx n GLU 61 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1fbx h THR 62 N 1.19 1.18 -0.85 2.62 2.02 -1.13 -1.72 112.91 116.23 1fbx h THR 62 Ca 0.00 -0.37 0.07 0.00 0.77 0.00 0.00 66.41 66.88 1fbx h THR 62 Cb 0.37 0.29 -0.06 0.00 -1.74 0.00 0.00 68.15 67.01 1fbx h THR 62 CO 0.00 0.18 0.55 -0.65 0.37 0.00 0.00 175.52 175.97 1fbx h PRO 63 N 0.85 0.90 0.03 6.66 0.11 -1.76 0.51 132.00 139.30 1fbx h PRO 63 Ca 0.23 -0.05 -0.22 0.00 0.11 0.00 0.00 66.00 66.06 1fbx h PRO 63 Cb -0.05 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 30.85 1fbx h PRO 63 CO -0.04 0.60 -0.98 1.25 -0.21 0.00 0.00 178.00 178.61 1fbx h HIS 64 N 0.93 0.41 -0.25 0.65 2.76 -1.79 -2.04 115.15 115.82 1fbx h HIS 64 Ca 0.37 -0.24 -0.09 0.00 -2.20 0.00 0.00 60.37 58.21 1fbx h HIS 64 Cb 0.25 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.16 1fbx h HIS 64 CO -0.00 1.09 -0.19 0.00 -1.30 0.00 0.00 177.93 177.53 1fbx h ARG 65 N 0.13 0.57 -0.45 5.26 3.08 -0.42 -1.28 114.38 121.27 1fbx h ARG 65 Ca -0.07 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 59.68 1fbx h ARG 65 Cb 1.64 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.66 1fbx h ARG 65 CO 0.16 0.86 0.20 0.82 -1.07 0.00 0.00 179.97 180.93 1fbx h ILE 66 N 0.28 1.16 -0.39 2.04 2.04 -0.05 -1.04 117.51 121.55 1fbx h ILE 66 Ca 0.05 -0.48 -0.08 0.00 1.00 0.00 0.00 64.86 65.35 1fbx h ILE 66 Cb 0.73 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1fbx h ILE 66 CO 0.05 0.19 -0.07 0.00 0.00 0.00 0.00 178.15 178.32 1fbx h ALA 67 N 1.59 0.54 -0.36 1.87 0.00 -0.94 -2.03 119.26 119.93 1fbx h ALA 67 Ca 0.16 -0.30 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 1fbx h ALA 67 Cb 0.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1fbx h ALA 67 CO -0.02 0.38 -0.37 -0.22 0.00 0.00 0.00 179.25 179.02 1fbx h LYS 68 N 0.55 0.83 -0.36 0.00 3.64 -1.03 -2.74 116.57 117.46 1fbx h LYS 68 Ca 0.10 -0.42 0.01 0.00 -1.27 0.00 0.00 60.65 59.07 1fbx h LYS 68 Cb 0.58 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 1fbx h LYS 68 CO 0.03 1.06 0.21 1.98 -2.27 0.00 0.00 179.45 180.47 1fbx h MET 69 N 0.69 0.43 0.20 1.90 4.05 -1.11 0.20 114.93 121.29 1fbx h MET 69 Ca 0.06 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 1fbx h MET 69 Cb 0.93 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.64 1fbx h MET 69 CO 0.09 0.28 -0.10 1.88 0.23 0.00 0.00 176.91 179.29 1fbx h TYR 70 N 0.44 -0.25 -0.00 1.39 0.05 -1.30 -0.09 116.97 117.20 1fbx h TYR 70 Ca 0.14 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 1fbx h TYR 70 Cb -0.01 0.08 0.00 0.00 1.01 0.00 0.00 36.73 37.82 1fbx h TYR 70 CO -0.07 -0.08 -0.02 0.28 -1.05 0.00 0.00 178.16 177.21 1fbx h VAL 71 N -0.37 1.62 0.00 -2.88 2.07 -1.43 -2.66 116.25 112.60 1fbx h VAL 71 Ca -0.03 -1.84 -0.13 0.00 0.82 0.00 0.00 66.70 65.52 1fbx h VAL 71 Cb 0.29 2.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.90 1fbx h VAL 71 CO 0.05 0.48 -0.86 0.44 0.02 0.00 0.00 177.57 177.69 1fbx h ASP 72 N -0.76 0.00 0.00 0.57 3.32 -0.73 -3.33 116.42 115.49 1fbx h ASP 72 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1fbx h ASP 72 Cb 0.80 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1fbx h ASP 72 CO 0.00 0.55 0.00 -0.62 -1.72 0.00 0.00 179.24 177.45 1fbx n GLU 73 N -3.10 0.00 0.11 3.56 1.02 -0.51 -4.57 120.64 117.15 1fbx n GLU 73 Ca -0.02 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.17 1fbx n GLU 73 Cb 0.78 0.00 0.30 0.00 -0.02 0.00 0.00 31.44 32.50 1fbx n GLU 73 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 1fbx n ILE 74 N 0.00 1.06 -0.19 -3.67 -5.35 -0.16 -0.98 119.36 110.06 1fbx n ILE 74 Ca 0.00 0.66 0.00 0.00 -0.27 0.00 0.00 62.75 63.14 1fbx n ILE 74 Cb 0.00 -1.66 0.00 0.00 -1.74 0.00 0.00 39.64 36.24 1fbx n ILE 74 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1fbx n PHE 75 N -1.88 0.00 0.12 4.28 3.72 -1.00 -3.32 117.46 119.38 1fbx n PHE 75 Ca -0.01 -0.43 0.07 0.00 -0.05 0.00 0.00 57.45 57.04 1fbx n PHE 75 Cb 0.17 -0.04 0.38 0.00 -0.94 0.00 0.00 39.48 39.04 1fbx n PHE 75 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1fbx n SER 76 N -0.43 0.36 0.00 4.37 3.41 -0.15 -1.48 113.62 119.70 1fbx n SER 76 Ca 0.00 0.62 0.14 0.00 -0.26 0.00 0.00 58.87 59.37 1fbx n SER 76 Cb 0.30 -0.64 0.78 0.00 -0.26 0.00 0.00 64.21 64.39 1fbx n SER 76 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fbx n GLY 77 N -1.32 -0.99 0.06 5.00 0.00 -0.63 -2.98 105.19 104.34 1fbx n GLY 77 Ca -0.01 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.10 0.69 -4.24 0.99 4.77 -0.55 -4.67 117.00 112.89 1fbx n LEU 78 Ca 0.18 0.26 -0.39 0.00 -0.03 0.00 0.00 56.01 56.03 1fbx n LEU 78 Cb 0.14 -0.20 -0.11 0.00 -2.33 0.00 0.00 43.42 40.91 1fbx n LEU 78 CO 0.18 -0.06 -0.17 -0.62 -1.33 0.00 0.00 177.39 175.39 1fbx s ASP 79 N -4.18 5.44 0.00 -1.43 -1.08 -1.16 -4.96 116.67 109.30 1fbx s ASP 79 Ca 0.07 -1.49 0.00 0.00 -0.52 0.00 0.00 52.55 50.62 1fbx s ASP 79 Cb 0.14 -1.91 0.02 0.00 -1.46 0.00 0.00 42.92 39.70 1fbx s ASP 79 CO 0.70 -0.47 0.63 -1.22 0.52 0.00 0.00 175.17 175.34 1fbx n TYR 80 N 4.82 0.00 0.25 -5.34 4.02 -1.26 -0.62 117.16 119.03 1fbx n TYR 80 Ca -0.10 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.91 1fbx n TYR 80 Cb 0.43 -0.12 0.65 0.00 -0.02 0.00 0.00 39.34 40.28 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 1.21 -0.01 -0.72 0.00 -1.91 -2.58 119.26 117.27 1fbx h ALA 81 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1fbx h ALA 81 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1fbx h ALA 81 CO 0.00 0.19 -0.05 0.09 0.00 0.00 0.00 179.25 179.48 1fbx n ASN 82 N -3.59 1.18 -4.55 0.00 3.02 0.21 -4.96 115.26 106.58 1fbx n ASN 82 Ca -0.01 -1.27 -0.39 0.00 -0.03 0.00 0.00 54.58 52.87 1fbx n ASN 82 Cb 0.29 0.02 0.03 0.00 -0.61 0.00 0.00 39.78 39.51 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 -0.18 0.23 -2.41 3.10 7.35 -0.97 -4.93 117.46 119.65 1fbx n PHE 83 Ca 0.18 0.48 -0.33 0.00 -0.76 0.00 0.00 57.45 57.02 1fbx n PHE 83 Cb 0.32 -2.08 -0.03 0.00 0.35 0.00 0.00 39.48 38.04 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 -2.24 3.83 0.27 -7.13 0.04 -1.26 -5.01 135.00 123.50 1fbx s PRO 84 Ca 0.69 1.10 -0.30 0.00 0.04 0.00 0.00 61.00 62.54 1fbx s PRO 84 Cb -0.47 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 31.86 1fbx s PRO 84 CO 0.53 -0.38 1.09 0.15 0.04 0.00 0.00 177.00 178.43 1fbx s LYS 85 N -3.79 4.66 -0.04 4.56 1.02 -1.26 -4.95 119.74 119.94 1fbx s LYS 85 Ca 0.62 1.77 0.02 0.00 0.02 0.00 0.00 55.97 58.39 1fbx s LYS 85 Cb -0.12 -3.21 -0.03 0.00 -0.52 0.00 0.00 37.83 33.95 1fbx s LYS 85 CO 0.28 0.23 -0.06 0.42 -0.92 0.00 0.00 175.35 175.29 1fbx s ILE 86 N -1.07 3.76 -0.02 2.17 -1.09 -1.26 -4.99 121.20 118.71 1fbx s ILE 86 Ca 0.45 -0.58 0.04 0.00 -2.23 0.00 0.00 60.65 58.33 1fbx s ILE 86 Cb -0.31 -2.58 -0.01 0.00 -1.58 0.00 0.00 42.46 37.98 1fbx s ILE 86 CO 0.40 0.51 -0.12 0.42 -1.23 0.00 0.00 174.94 174.91 1fbx s THR 87 N -0.90 0.99 -0.04 2.92 -4.23 -1.26 -5.11 115.64 108.01 1fbx s THR 87 Ca 0.15 -0.52 -0.02 0.00 -1.18 0.00 0.00 61.69 60.12 1fbx s THR 87 Cb -0.11 -0.84 0.03 0.00 1.34 0.00 0.00 72.50 72.92 1fbx s THR 87 CO 0.04 0.28 0.05 -0.76 -0.54 0.00 0.00 174.62 173.70 1fbx s LEU 88 N -0.18 0.38 0.24 4.79 1.43 -1.26 -2.41 118.68 121.68 1fbx s LEU 88 Ca 0.03 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.21 1fbx s LEU 88 Cb -0.06 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 46.01 1fbx s LEU 88 CO -0.00 -0.22 0.42 0.27 0.23 0.00 0.00 176.35 177.05 1fbx s ILE 89 N 1.88 5.19 0.37 -0.59 -4.36 0.36 -4.85 121.20 119.19 1fbx s ILE 89 Ca 0.01 -0.47 -0.27 0.00 -0.26 0.00 0.00 60.65 59.66 1fbx s ILE 89 Cb -0.12 -3.78 -0.09 0.00 1.25 0.00 0.00 42.46 39.72 1fbx s ILE 89 CO -0.03 -0.28 1.26 -0.70 0.24 0.00 0.00 174.94 175.43 1fbx s GLU 90 N -3.63 4.18 -1.19 0.37 2.12 -1.26 0.15 118.70 119.44 1fbx s GLU 90 Ca 0.38 2.08 -0.09 0.00 0.36 0.00 0.00 54.97 57.70 1fbx s GLU 90 Cb -0.10 -2.89 -0.07 0.00 0.26 0.00 0.00 34.13 31.33 1fbx s GLU 90 CO 0.30 -0.29 2.40 -1.71 -0.54 0.00 0.00 175.26 175.43 1fbx n ASN 91 N 0.45 6.00 0.21 -1.70 2.85 -0.53 -4.57 115.26 117.97 1fbx n ASN 91 Ca 0.02 -2.47 0.09 0.00 -0.11 0.00 0.00 54.58 52.11 1fbx n ASN 91 Cb 0.44 -1.30 0.39 0.00 1.24 0.00 0.00 39.78 40.55 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 5.97 0.00 0.00 1.20 1.57 -1.90 -2.35 116.57 121.06 1fbx h LYS 92 Ca 0.63 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.41 1fbx h LYS 92 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1fbx h LYS 92 CO 1.64 0.24 0.00 -1.33 -0.57 0.00 0.00 179.45 179.43 1fbx n MET 93 N -3.33 0.05 -3.69 3.15 2.81 -1.26 -4.90 117.12 109.96 1fbx n MET 93 Ca 0.01 0.15 -0.22 0.00 -1.81 0.00 0.00 57.70 55.83 1fbx n MET 93 Cb 0.48 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.52 1fbx n MET 93 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1fbx n LYS 94 N -1.46 -4.57 -2.39 0.03 5.02 -0.88 -4.92 118.16 109.00 1fbx n LYS 94 Ca 0.06 0.62 -0.41 0.00 -2.02 0.00 0.00 58.31 56.55 1fbx n LYS 94 Cb 0.22 -5.13 -0.03 0.00 -0.02 0.00 0.00 35.03 30.06 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 -3.65 3.70 0.00 -0.18 1.01 -1.26 -4.89 120.40 115.12 1fbx s VAL 95 Ca 0.04 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.38 1fbx s VAL 95 Cb -0.01 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1fbx s VAL 95 CO 0.81 0.18 0.61 -0.90 0.00 0.00 0.00 175.10 175.81 1fbx n ASP 96 N 2.97 0.51 -4.72 3.32 5.75 -1.26 -4.55 116.55 118.56 1fbx n ASP 96 Ca 0.06 -1.25 -0.24 0.00 -0.01 0.00 0.00 54.79 53.35 1fbx n ASP 96 Cb 0.45 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.47 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 -0.25 2.25 0.38 0.11 0.41 -1.26 -4.96 118.70 115.38 1fbx s GLU 97 Ca 0.00 -1.71 -0.25 0.00 -0.41 0.00 0.00 54.97 52.60 1fbx s GLU 97 Cb 0.00 -2.05 -0.09 0.00 -1.78 0.00 0.00 34.13 30.21 1fbx s GLU 97 CO 0.00 0.02 1.03 0.00 -0.49 0.00 0.00 175.26 175.81 1fbx s MET 98 N -3.85 4.28 -0.12 1.61 0.23 -1.26 -4.46 119.30 115.73 1fbx s MET 98 Ca 0.39 1.47 -0.04 0.00 -1.03 0.00 0.00 55.69 56.48 1fbx s MET 98 Cb 0.01 -2.61 -0.03 0.00 -1.53 0.00 0.00 34.83 30.66 1fbx s MET 98 CO 0.22 -0.03 0.03 0.08 -2.03 0.00 0.00 175.02 173.29 1fbx s VAL 99 N -1.65 4.52 -0.01 5.16 1.01 -0.25 -4.95 120.40 124.24 1fbx s VAL 99 Ca 0.56 -0.16 0.05 0.00 0.00 0.00 0.00 61.98 62.43 1fbx s VAL 99 Cb -0.21 -2.95 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 1fbx s VAL 99 CO 0.27 0.57 -0.16 -0.89 0.00 0.00 0.00 175.10 174.88 1fbx s THR 100 N -0.52 1.30 -0.28 3.92 2.01 -1.26 -2.07 115.64 118.73 1fbx s THR 100 Ca 0.10 -0.75 0.02 0.00 0.31 0.00 0.00 61.69 61.37 1fbx s THR 100 Cb -0.12 -1.09 0.08 0.00 0.01 0.00 0.00 72.50 71.38 1fbx s THR 100 CO 0.02 0.33 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.57 1fbx s VAL 101 N -0.44 1.90 0.18 3.82 1.01 0.29 -4.99 120.40 122.18 1fbx s VAL 101 Ca 0.06 -1.71 0.04 0.00 0.00 0.00 0.00 61.98 60.37 1fbx s VAL 101 Cb -0.07 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.07 1fbx s VAL 101 CO -0.00 -0.28 0.29 0.00 0.00 0.00 0.00 175.10 175.11 1fbx s ARG 102 N 1.17 3.36 -1.48 2.72 1.70 -1.26 -0.98 118.95 124.17 1fbx s ARG 102 Ca -0.01 -0.70 -0.07 0.00 -0.47 0.00 0.00 55.73 54.49 1fbx s ARG 102 Cb -0.19 -2.89 0.05 0.00 -0.57 0.00 0.00 34.95 31.35 1fbx s ARG 102 CO -0.08 0.48 0.63 -0.25 -1.08 0.00 0.00 175.30 175.01 1fbx n ASP 103 N -0.82 -1.86 -4.68 -2.89 8.00 -1.12 -4.93 116.55 108.25 1fbx n ASP 103 Ca -0.08 -0.94 -0.42 0.00 0.71 0.00 0.00 54.79 54.05 1fbx n ASP 103 Cb 0.55 -3.26 -0.03 0.00 -0.02 0.00 0.00 41.12 38.36 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 -3.66 3.81 0.31 0.53 1.01 0.03 -4.76 121.20 118.47 1fbx s ILE 104 Ca 0.28 1.15 -0.29 0.00 0.00 0.00 0.00 60.65 61.79 1fbx s ILE 104 Cb -0.15 -3.74 -0.11 0.00 0.01 0.00 0.00 42.46 38.47 1fbx s ILE 104 CO 0.88 -0.02 1.51 -0.89 0.00 0.00 0.00 174.94 176.42 1fbx s THR 105 N 2.61 2.24 -0.19 2.92 2.01 -1.26 -0.62 115.64 123.35 1fbx s THR 105 Ca 0.63 0.21 -0.05 0.00 0.31 0.00 0.00 61.69 62.79 1fbx s THR 105 Cb -0.30 -3.13 0.10 0.00 0.01 0.00 0.00 72.50 69.17 1fbx s THR 105 CO 0.25 0.04 0.33 -0.22 -0.69 0.00 0.00 174.62 174.33 1fbx s LEU 106 N -1.01 -0.45 -0.11 4.42 0.20 -0.85 -4.82 118.68 116.06 1fbx s LEU 106 Ca 0.58 0.45 0.03 0.00 0.69 0.00 0.00 54.13 55.88 1fbx s LEU 106 Cb -0.46 0.92 0.01 0.00 -0.43 0.00 0.00 46.19 46.23 1fbx s LEU 106 CO 0.51 -0.27 -0.19 0.42 -0.29 0.00 0.00 176.35 176.53 1fbx s THR 107 N 2.49 1.80 0.00 3.68 -4.23 -1.26 -0.50 115.64 117.62 1fbx s THR 107 Ca 0.05 -0.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.72 1fbx s THR 107 Cb -0.14 -1.60 0.00 0.00 1.34 0.00 0.00 72.50 72.10 1fbx s THR 107 CO -0.12 0.50 0.00 -0.24 -0.54 0.00 0.00 174.62 174.22 1fbx n SER 108 N 3.97 0.41 -3.82 3.99 2.88 -0.18 -4.57 113.62 116.30 1fbx n SER 108 Ca -0.20 -0.06 -0.12 0.00 -1.33 0.00 0.00 58.87 57.16 1fbx n SER 108 Cb 0.52 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.85 1fbx n SER 108 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1fbx s THR 109 N -0.66 -0.01 0.06 2.46 2.01 -1.26 -1.31 115.64 116.93 1fbx s THR 109 Ca 0.00 0.02 -0.30 0.00 0.31 0.00 0.00 61.69 61.72 1fbx s THR 109 Cb 0.00 -0.18 -0.05 0.00 0.01 0.00 0.00 72.50 72.28 1fbx s THR 109 CO 0.00 0.01 1.01 0.00 -0.69 0.00 0.00 174.62 174.95 1fbx h GLU 111 N 6.26 0.00 0.00 0.00 4.11 -0.50 0.18 114.58 124.63 1fbx h GLU 111 Ca -0.42 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.95 1fbx h GLU 111 Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 1fbx h GLU 111 CO 0.75 0.00 -0.28 0.45 0.07 0.00 0.00 179.01 180.00 1fbx h HIS 112 N 0.00 0.00 0.00 2.06 3.86 -1.90 -3.39 115.15 115.78 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 0.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1fbx h HIS 112 CO 0.00 0.28 -0.03 0.72 0.86 0.00 0.00 177.93 179.76 1fbx n HIS 113 N -3.18 0.00 -3.84 2.45 8.25 -1.11 -5.01 115.22 112.79 1fbx n HIS 113 Ca 0.03 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.19 1fbx n HIS 113 Cb 0.63 0.07 0.02 0.00 1.12 0.00 0.00 29.99 31.84 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 -2.23 -4.22 4.41 3.01 0.61 -4.95 117.46 114.08 1fbx n PHE 114 Ca 0.00 0.85 -0.24 0.00 1.01 0.00 0.00 57.45 59.07 1fbx n PHE 114 Cb 0.51 -3.87 -0.07 0.00 -0.01 0.00 0.00 39.48 36.05 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 -3.26 3.80 0.48 -4.37 1.01 -1.25 -4.84 120.40 111.97 1fbx s VAL 115 Ca 0.64 -1.65 -0.24 0.00 0.00 0.00 0.00 61.98 60.73 1fbx s VAL 115 Cb -0.32 -3.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 1fbx s VAL 115 CO 0.78 -0.30 1.30 0.41 0.00 0.00 0.00 175.10 177.29 1fbx n THR 116 N -0.79 3.09 -3.94 3.92 -1.04 -1.26 -0.74 114.28 113.53 1fbx n THR 116 Ca -0.08 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.14 1fbx n THR 116 Cb 0.58 -1.61 -0.16 0.00 -1.82 0.00 0.00 70.33 67.31 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 -1.25 1.33 -0.14 12.58 1.01 -0.43 -1.41 121.20 132.89 1fbx s ILE 117 Ca 0.66 -0.76 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 1fbx s ILE 117 Cb -0.46 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1fbx s ILE 117 CO 0.54 0.17 -0.02 -0.62 0.00 0.00 0.00 174.94 175.01 1fbx s ASP 118 N 1.54 4.98 0.25 3.58 -1.08 -0.09 -1.01 116.67 124.84 1fbx s ASP 118 Ca 0.00 -0.05 -0.11 0.00 -0.52 0.00 0.00 52.55 51.88 1fbx s ASP 118 Cb -0.15 -1.72 0.04 0.00 -1.46 0.00 0.00 42.92 39.63 1fbx s ASP 118 CO -0.08 0.22 0.59 0.61 0.52 0.00 0.00 175.17 177.02 1fbx n GLY 119 N 3.21 1.19 3.07 2.66 0.00 0.35 0.17 105.19 115.84 1fbx n GLY 119 Ca -0.17 -1.16 -0.21 0.00 0.00 0.00 0.00 46.02 44.47 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 -2.06 1.03 -0.03 1.61 3.01 0.39 -2.01 119.74 121.68 1fbx s LYS 120 Ca 0.12 -0.43 0.06 0.00 -1.01 0.00 0.00 55.97 54.71 1fbx s LYS 120 Cb -0.03 -0.99 -0.02 0.00 -1.01 0.00 0.00 37.83 35.78 1fbx s LYS 120 CO 0.07 0.25 -0.21 0.00 0.51 0.00 0.00 175.35 175.97 1fbx s ALA 121 N -0.22 2.36 -0.12 5.17 0.00 0.21 -1.62 121.76 127.53 1fbx s ALA 121 Ca 0.04 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.96 1fbx s ALA 121 Cb -0.05 -0.72 0.01 0.00 0.00 0.00 0.00 23.12 22.35 1fbx s ALA 121 CO -0.00 0.54 -0.21 0.99 0.00 0.00 0.00 175.76 177.08 1fbx s THR 122 N -0.65 1.91 -0.05 0.00 2.01 -0.28 -0.79 115.64 117.79 1fbx s THR 122 Ca 0.10 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.23 1fbx s THR 122 Cb -0.10 -1.68 0.01 0.00 0.01 0.00 0.00 72.50 70.73 1fbx s THR 122 CO -0.00 0.52 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.62 1fbx s VAL 123 N 0.68 1.20 0.04 3.82 1.01 -0.15 -1.36 120.40 125.64 1fbx s VAL 123 Ca -0.11 -0.55 0.03 0.00 0.00 0.00 0.00 61.98 61.35 1fbx s VAL 123 Cb -0.16 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 1fbx s VAL 123 CO 0.02 0.36 -0.10 0.00 0.00 0.00 0.00 175.10 175.38 1fbx s ALA 124 N 0.38 0.77 0.11 5.51 0.00 -0.78 -0.55 121.76 127.20 1fbx s ALA 124 Ca -0.09 -0.71 -0.09 0.00 0.00 0.00 0.00 51.96 51.07 1fbx s ALA 124 Cb -0.13 -0.06 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 1fbx s ALA 124 CO 0.03 0.09 0.23 1.52 0.00 0.00 0.00 175.76 177.62 1fbx s TYR 125 N -1.00 0.20 -0.34 0.00 1.13 -0.88 -0.38 117.35 116.08 1fbx s TYR 125 Ca -0.04 -0.61 -0.06 0.00 -1.41 0.00 0.00 57.07 54.95 1fbx s TYR 125 Cb -0.08 -0.04 0.04 0.00 -1.10 0.00 0.00 41.96 40.78 1fbx s TYR 125 CO 0.01 -0.60 0.11 0.42 -2.51 0.00 0.00 175.55 172.98 1fbx s ILE 126 N -3.89 3.76 0.36 -3.49 1.01 -0.72 -1.09 121.20 117.14 1fbx s ILE 126 Ca 0.08 -1.17 -0.26 0.00 0.00 0.00 0.00 60.65 59.30 1fbx s ILE 126 Cb 0.04 -3.14 -0.12 0.00 0.01 0.00 0.00 42.46 39.25 1fbx s ILE 126 CO -0.08 -0.20 1.03 -2.65 0.00 0.00 0.00 174.94 173.04 1fbx n PRO 127 N 4.80 1.42 0.00 2.79 -0.02 -1.26 -4.89 135.00 137.84 1fbx n PRO 127 Ca -0.12 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 1fbx n PRO 127 Cb 0.44 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1fbx n PRO 127 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1fbx n LYS 128 N 0.45 0.00 0.07 -0.52 4.81 -1.26 -4.71 118.16 116.99 1fbx n LYS 128 Ca 0.09 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.62 1fbx n LYS 128 Cb 0.36 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.36 1fbx n LYS 128 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1fbx n ASP 129 N 0.00 0.68 -4.11 3.14 8.00 -1.26 -4.74 116.55 118.26 1fbx n ASP 129 Ca 0.00 0.27 -0.12 0.00 0.71 0.00 0.00 54.79 55.65 1fbx n ASP 129 Cb 0.00 0.69 -0.11 0.00 -0.02 0.00 0.00 41.12 41.68 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 -5.28 0.98 -0.16 -2.24 1.04 -1.26 -1.45 113.70 105.32 1fbx s SER 130 Ca -0.03 -0.76 -0.01 0.00 0.48 0.00 0.00 55.95 55.64 1fbx s SER 130 Cb 0.10 0.06 -0.01 0.00 0.10 0.00 0.00 66.02 66.28 1fbx s SER 130 CO 0.82 -0.32 -0.11 -0.69 0.98 0.00 0.00 173.24 173.91 1fbx s VAL 131 N -2.40 3.04 0.30 5.02 1.01 0.12 -4.76 120.40 122.73 1fbx s VAL 131 Ca -0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 61.98 61.21 1fbx s VAL 131 Cb -0.03 -2.31 -0.08 0.00 0.00 0.00 0.00 36.38 33.95 1fbx s VAL 131 CO -0.02 0.50 0.68 -0.51 0.00 0.00 0.00 175.10 175.75 1fbx s ILE 132 N 0.77 4.76 0.28 2.22 2.07 -1.26 -0.49 121.20 129.55 1fbx s ILE 132 Ca -0.04 0.78 -0.30 0.00 -1.41 0.00 0.00 60.65 59.68 1fbx s ILE 132 Cb -0.15 -3.62 -0.11 0.00 0.13 0.00 0.00 42.46 38.71 1fbx s ILE 132 CO 0.01 -0.17 1.59 -0.83 -1.91 0.00 0.00 174.94 173.64 1fbx s GLY 133 N -2.35 2.03 0.20 1.50 0.00 -1.01 -4.89 107.32 102.80 1fbx s GLY 133 Ca 0.52 1.55 -0.11 0.00 0.00 0.00 0.00 44.72 46.68 1fbx s GLY 133 CO 0.19 2.56 1.85 1.41 0.00 0.00 0.00 173.10 179.12 1fbx h LEU 134 N 5.10 0.73 -2.03 0.66 3.38 -1.95 -2.26 115.31 118.95 1fbx h LEU 134 Ca -0.46 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1fbx h LEU 134 Cb 1.22 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 1fbx h LEU 134 CO 0.81 0.52 -0.03 0.77 0.09 0.00 0.00 178.44 180.59 1fbx h SER 135 N 0.86 0.00 -0.52 -0.43 4.64 -2.01 -2.20 113.55 113.89 1fbx h SER 135 Ca 0.26 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.63 1fbx h SER 135 Cb -0.05 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 1fbx h SER 135 CO -0.08 0.03 0.35 0.11 -0.87 0.00 0.00 176.83 176.37 1fbx h LYS 136 N 0.00 0.47 -0.36 4.77 1.79 -1.78 -0.66 116.57 120.81 1fbx h LYS 136 Ca -0.00 -0.03 -0.05 0.00 -2.18 0.00 0.00 60.65 58.39 1fbx h LYS 136 Cb 0.06 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.59 1fbx h LYS 136 CO 0.00 0.31 0.04 0.82 -1.08 0.00 0.00 179.45 179.55 1fbx h ILE 137 N 0.49 1.25 -0.93 1.86 2.04 -1.48 0.19 117.51 120.93 1fbx h ILE 137 Ca 0.22 -0.89 0.05 0.00 1.00 0.00 0.00 64.86 65.24 1fbx h ILE 137 Cb 0.26 1.13 -0.06 0.00 -0.74 0.00 0.00 36.82 37.41 1fbx h ILE 137 CO -0.06 0.30 0.60 0.78 0.00 0.00 0.00 178.15 179.77 1fbx h ASN 138 N 0.44 0.97 -0.14 1.72 2.35 -1.27 -0.00 115.58 119.65 1fbx h ASN 138 Ca 0.11 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.66 1fbx h ASN 138 Cb 0.39 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1fbx h ASN 138 CO 0.01 0.64 -0.65 0.03 -1.65 0.00 0.00 177.43 175.81 1fbx h ARG 139 N 1.12 0.76 -0.56 0.81 3.08 -0.85 -1.12 114.38 117.62 1fbx h ARG 139 Ca 0.39 -0.55 -0.08 0.00 0.07 0.00 0.00 59.98 59.82 1fbx h ARG 139 Cb 0.09 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1fbx h ARG 139 CO -0.15 1.17 0.05 0.82 -1.07 0.00 0.00 179.97 180.79 1fbx h ILE 140 N 0.56 1.25 -0.07 2.04 2.04 -0.18 -1.36 117.51 121.78 1fbx h ILE 140 Ca -0.02 -1.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.83 1fbx h ILE 140 Cb 1.26 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1fbx h ILE 140 CO 0.14 0.37 0.03 0.58 0.00 0.00 0.00 178.15 179.27 1fbx h VAL 141 N 0.87 1.11 0.00 1.67 2.07 -0.86 -2.77 116.25 118.35 1fbx h VAL 141 Ca 0.17 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 1fbx h VAL 141 Cb 0.44 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1fbx h VAL 141 CO 0.02 0.09 -0.14 1.56 0.02 0.00 0.00 177.57 179.12 1fbx h GLN 142 N -0.01 0.00 0.83 1.57 1.08 -0.96 -2.24 115.11 115.38 1fbx h GLN 142 Ca 0.02 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.18 1fbx h GLN 142 Cb 0.12 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.56 1fbx h GLN 142 CO -0.00 0.14 -0.40 0.35 -0.95 0.00 0.00 178.83 177.96 1fbx h PHE 143 N 0.00 -1.04 0.00 2.96 3.57 -0.97 -1.87 116.94 119.59 1fbx h PHE 143 Ca -0.00 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1fbx h PHE 143 Cb 0.28 0.34 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 1fbx h PHE 143 CO 0.00 -0.63 -0.06 0.74 -2.23 0.00 0.00 178.31 176.12 1fbx h PHE 144 N -1.20 0.00 0.00 0.41 0.04 -1.41 -1.98 116.94 112.80 1fbx h PHE 144 Ca -0.11 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.55 1fbx h PHE 144 Cb 0.87 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.00 1fbx h PHE 144 CO -0.01 0.06 -0.50 0.00 -0.60 0.00 0.00 178.31 177.27 1fbx h ALA 145 N 1.94 1.04 -0.24 2.45 0.00 -1.04 -3.29 119.26 120.11 1fbx h ALA 145 Ca -0.00 -0.45 -0.62 0.00 0.00 0.00 0.00 54.91 53.84 1fbx h ALA 145 Cb 0.32 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1fbx h ALA 145 CO 0.01 0.62 2.64 1.04 0.00 0.00 0.00 179.25 183.56 1fbx n GLN 146 N -3.74 3.68 -3.71 0.00 1.13 -0.74 -4.31 117.38 109.69 1fbx n GLN 146 Ca -0.01 -2.45 -0.14 0.00 -1.94 0.00 0.00 57.00 52.45 1fbx n GLN 146 Cb 0.55 -2.60 -0.08 0.00 0.11 0.00 0.00 30.24 28.22 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 0.70 0.75 0.23 -1.09 0.52 -1.21 -1.60 118.95 117.25 1fbx s ARG 147 Ca 0.64 -0.12 -0.31 0.00 -0.52 0.00 0.00 55.73 55.42 1fbx s ARG 147 Cb 0.21 0.34 -0.12 0.00 0.52 0.00 0.00 34.95 35.91 1fbx s ARG 147 CO -0.08 -0.22 1.68 -2.14 0.02 0.00 0.00 175.30 174.57 1fbx s PRO 148 N -1.34 4.13 0.21 3.54 0.02 -1.26 -4.28 135.00 136.02 1fbx s PRO 148 Ca -0.13 2.58 -0.00 0.00 0.02 0.00 0.00 61.00 63.47 1fbx s PRO 148 Cb -0.04 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.37 1fbx s PRO 148 CO 0.05 -0.71 0.13 -0.65 -0.33 0.00 0.00 177.00 175.49 1fbx s GLN 149 N 0.74 1.24 -0.09 5.54 -1.52 0.19 -4.70 119.66 121.06 1fbx s GLN 149 Ca 0.71 -1.66 0.02 0.00 -1.95 0.00 0.00 55.36 52.48 1fbx s GLN 149 Cb -0.49 0.19 0.02 0.00 -0.22 0.00 0.00 33.01 32.51 1fbx s GLN 149 CO 0.36 -0.38 -0.13 0.54 -0.25 0.00 0.00 175.29 175.43 1fbx s VAL 150 N -4.08 1.27 0.33 1.09 0.11 -1.26 0.23 120.40 118.09 1fbx s VAL 150 Ca 0.39 -0.51 0.11 0.00 -2.93 0.00 0.00 61.98 59.03 1fbx s VAL 150 Cb 0.07 -1.18 0.32 0.00 -1.53 0.00 0.00 36.38 34.07 1fbx s VAL 150 CO 0.13 0.39 1.74 -0.61 -3.33 0.00 0.00 175.10 173.42 1fbx h GLN 151 N 7.37 0.55 -0.69 1.54 4.15 -2.00 -1.37 115.11 124.66 1fbx h GLN 151 Ca -0.31 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.03 1fbx h GLN 151 Cb 1.17 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.71 1fbx h GLN 151 CO 0.47 0.36 0.23 0.93 -1.93 0.00 0.00 178.83 178.89 1fbx h GLU 152 N 0.56 1.05 -0.53 1.69 3.07 -2.00 -2.32 114.58 116.11 1fbx h GLU 152 Ca 0.64 -0.22 -0.12 0.00 -0.50 0.00 0.00 59.36 59.16 1fbx h GLU 152 Cb 1.26 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 28.99 1fbx h GLU 152 CO -0.45 0.90 -0.14 -0.09 -1.40 0.00 0.00 179.01 177.84 1fbx h ARG 153 N 1.00 1.03 0.05 2.33 2.43 -1.70 -2.98 114.38 116.54 1fbx h ARG 153 Ca 0.22 -0.40 0.02 0.00 -0.81 0.00 0.00 59.98 59.02 1fbx h ARG 153 Cb 0.27 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 1fbx h ARG 153 CO -0.01 1.09 -0.18 1.25 -1.51 0.00 0.00 179.97 180.60 1fbx h LEU 154 N 0.90 -0.52 -0.69 3.80 5.85 -1.25 -0.62 115.31 122.78 1fbx h LEU 154 Ca 0.13 0.07 0.08 0.00 0.84 0.00 0.00 57.88 59.00 1fbx h LEU 154 Cb 0.72 0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.89 1fbx h LEU 154 CO 0.05 -0.25 0.36 0.74 -0.34 0.00 0.00 178.44 179.00 1fbx h THR 155 N -0.33 0.89 -0.39 1.05 2.02 -1.43 -2.59 112.91 112.13 1fbx h THR 155 Ca 0.04 -0.22 -0.12 0.00 0.77 0.00 0.00 66.41 66.88 1fbx h THR 155 Cb 0.37 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 1fbx h THR 155 CO -0.14 0.11 -0.26 1.56 0.37 0.00 0.00 175.52 177.17 1fbx h GLN 156 N 0.63 0.81 -0.22 6.66 1.08 -1.31 -2.92 115.11 119.83 1fbx h GLN 156 Ca 0.33 -0.35 0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1fbx h GLN 156 Cb 0.30 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 1fbx h GLN 156 CO -0.24 0.97 0.13 1.96 -0.95 0.00 0.00 178.83 180.70 1fbx h GLN 157 N 0.70 0.25 -0.58 1.46 4.20 -0.75 -2.10 115.11 118.30 1fbx h GLN 157 Ca 0.09 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.84 1fbx h GLN 157 Cb 0.79 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.46 1fbx h GLN 157 CO 0.06 0.17 0.30 0.82 -0.67 0.00 0.00 178.83 179.51 1fbx h ILE 158 N 0.26 0.94 0.59 2.54 2.04 -1.48 0.18 117.51 122.59 1fbx h ILE 158 Ca 0.09 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 1fbx h ILE 158 Cb 0.00 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 1fbx h ILE 158 CO -0.05 0.10 -0.49 0.25 0.00 0.00 0.00 178.15 177.96 1fbx h LEU 159 N 0.56 -1.32 -0.13 1.44 5.85 -1.29 -0.69 115.31 119.72 1fbx h LEU 159 Ca 0.26 0.10 0.05 0.00 0.84 0.00 0.00 57.88 59.12 1fbx h LEU 159 Cb 0.17 0.42 -0.06 0.00 0.37 0.00 0.00 40.66 41.56 1fbx h LEU 159 CO -0.18 -0.69 -0.33 0.40 -0.34 0.00 0.00 178.44 177.31 1fbx h ILE 160 N -1.06 0.28 -0.24 4.05 1.08 -1.04 0.28 117.51 120.85 1fbx h ILE 160 Ca -0.07 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.45 1fbx h ILE 160 Cb 0.90 0.28 -0.06 0.00 -3.07 0.00 0.00 36.82 34.86 1fbx h ILE 160 CO -0.01 0.00 -0.19 0.00 -0.69 0.00 0.00 178.15 177.26 1fbx h ALA 161 N 0.40 -0.04 -0.51 1.87 0.00 -0.81 0.37 119.26 120.53 1fbx h ALA 161 Ca 0.09 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1fbx h ALA 161 Cb 0.55 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 1fbx h ALA 161 CO -0.35 -0.61 0.22 -0.07 0.00 0.00 0.00 179.25 178.44 1fbx h LEU 162 N -0.19 0.69 -0.59 0.00 3.38 -0.74 -0.82 115.31 117.04 1fbx h LEU 162 Ca 0.13 -0.15 0.10 0.00 0.09 0.00 0.00 57.88 58.06 1fbx h LEU 162 Cb 0.39 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.89 1fbx h LEU 162 CO -0.35 0.65 0.15 1.56 0.09 0.00 0.00 178.44 180.54 1fbx h GLN 163 N 0.68 0.28 -0.13 1.13 4.20 0.38 0.91 115.11 122.56 1fbx h GLN 163 Ca 0.17 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 1fbx h GLN 163 Cb 0.16 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1fbx h GLN 163 CO -0.02 0.19 0.07 1.15 -0.67 0.00 0.00 178.83 179.55 1fbx h THR 164 N 0.29 1.09 0.00 -0.54 2.02 0.28 -2.65 112.91 113.40 1fbx h THR 164 Ca 0.30 -0.25 -0.06 0.00 0.77 0.00 0.00 66.41 67.17 1fbx h THR 164 Cb 0.43 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1fbx h THR 164 CO -0.37 0.08 -0.31 -0.07 0.37 0.00 0.00 175.52 175.23 1fbx h LEU 165 N 0.12 0.00 0.00 2.58 3.38 -0.57 -3.30 115.31 117.52 1fbx h LEU 165 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 1fbx h LEU 165 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1fbx h LEU 165 CO -0.01 0.31 -1.29 0.18 0.09 0.00 0.00 178.44 177.72 1fbx n LEU 166 N -3.35 0.84 0.00 1.67 4.77 0.26 -4.99 117.00 116.19 1fbx n LEU 166 Ca 0.01 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1fbx n LEU 166 Cb 0.53 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1fbx n LEU 166 CO 0.36 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1fbx n GLY 167 N 1.32 0.60 3.23 -0.72 0.00 -1.00 -4.63 105.19 103.99 1fbx n GLY 167 Ca -0.06 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 1fbx n GLY 167 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fbx s THR 168 N -2.00 0.13 -2.06 2.61 -4.23 -1.24 -4.95 115.64 103.91 1fbx s THR 168 Ca 0.00 -1.24 0.24 0.00 -1.18 0.00 0.00 61.69 59.50 1fbx s THR 168 Cb 0.00 -1.45 0.07 0.00 1.34 0.00 0.00 72.50 72.47 1fbx s THR 168 CO 0.00 -0.59 1.21 0.59 -0.54 0.00 0.00 174.62 175.30 1fbx n ASN 169 N -0.09 1.88 -3.66 3.99 3.02 -1.26 -4.47 115.26 114.68 1fbx n ASN 169 Ca -0.13 -1.42 -0.42 0.00 -0.03 0.00 0.00 54.58 52.57 1fbx n ASN 169 Cb 0.62 0.37 -0.02 0.00 -0.61 0.00 0.00 39.78 40.14 1fbx n ASN 169 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1fbx n ASN 170 N -0.05 3.57 -4.10 6.41 3.02 -1.26 -0.84 115.26 122.01 1fbx n ASN 170 Ca 0.10 -2.75 -0.14 0.00 -0.03 0.00 0.00 54.58 51.76 1fbx n ASN 170 Cb 0.45 -1.43 -0.11 0.00 -0.61 0.00 0.00 39.78 38.07 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 3.85 0.71 -0.01 2.41 1.01 -1.26 -1.76 120.40 125.36 1fbx s VAL 171 Ca 0.52 -1.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 1fbx s VAL 171 Cb 0.14 -0.82 -0.00 0.00 0.00 0.00 0.00 36.38 35.70 1fbx s VAL 171 CO -0.01 -0.38 0.04 0.00 0.00 0.00 0.00 175.10 174.76 1fbx s ALA 172 N -1.53 -0.09 -0.01 5.51 0.00 0.49 -1.16 121.76 124.97 1fbx s ALA 172 Ca -0.06 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.80 1fbx s ALA 172 Cb -0.09 0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.05 1fbx s ALA 172 CO 0.01 -0.09 -0.01 0.08 0.00 0.00 0.00 175.76 175.75 1fbx s VAL 173 N -0.61 0.09 -0.01 0.00 1.01 0.51 -1.86 120.40 119.53 1fbx s VAL 173 Ca -0.07 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 61.93 1fbx s VAL 173 Cb -0.04 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.22 1fbx s VAL 173 CO -0.00 0.05 -0.06 -0.55 0.00 0.00 0.00 175.10 174.55 1fbx s SER 174 N 0.25 0.72 -0.03 3.32 0.15 -0.46 -0.02 113.70 117.63 1fbx s SER 174 Ca -0.02 -0.11 0.03 0.00 0.70 0.00 0.00 55.95 56.55 1fbx s SER 174 Cb -0.04 -0.13 0.01 0.00 -1.71 0.00 0.00 66.02 64.14 1fbx s SER 174 CO -0.01 0.05 -0.10 -0.63 1.20 0.00 0.00 173.24 173.76 1fbx s ILE 175 N 0.04 0.86 -0.14 6.45 1.01 0.53 -1.12 121.20 128.83 1fbx s ILE 175 Ca -0.00 -0.39 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1fbx s ILE 175 Cb -0.04 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.67 1fbx s ILE 175 CO -0.00 0.27 -0.16 -0.62 0.00 0.00 0.00 174.94 174.43 1fbx s ASP 176 N 0.29 2.74 0.22 3.58 2.15 -0.64 -1.14 116.67 123.87 1fbx s ASP 176 Ca -0.05 -0.51 -0.08 0.00 0.43 0.00 0.00 52.55 52.34 1fbx s ASP 176 Cb -0.10 -1.23 -0.02 0.00 -0.30 0.00 0.00 42.92 41.27 1fbx s ASP 176 CO 0.01 -0.02 0.33 0.00 -0.17 0.00 0.00 175.17 175.32 1fbx s ALA 177 N 1.29 0.30 -0.13 3.66 0.00 -0.44 -0.46 121.76 125.98 1fbx s ALA 177 Ca 0.02 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.81 1fbx s ALA 177 Cb -0.13 1.17 -0.00 0.00 0.00 0.00 0.00 23.12 24.15 1fbx s ALA 177 CO -0.08 -0.74 -0.17 0.08 0.00 0.00 0.00 175.76 174.84 1fbx s VAL 178 N -4.07 2.58 -0.36 0.00 1.01 0.45 -1.19 120.40 118.83 1fbx s VAL 178 Ca 0.28 -0.82 -0.13 0.00 0.00 0.00 0.00 61.98 61.32 1fbx s VAL 178 Cb 0.03 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1fbx s VAL 178 CO 0.09 0.53 0.24 -1.00 0.00 0.00 0.00 175.10 174.96 1fbx s HIS 179 N 0.53 3.23 -0.78 5.22 3.76 -1.26 -0.92 115.29 125.07 1fbx s HIS 179 Ca -0.11 -0.50 0.16 0.00 -0.15 0.00 0.00 55.06 54.45 1fbx s HIS 179 Cb -0.16 -2.48 0.69 0.00 1.11 0.00 0.00 32.58 31.74 1fbx s HIS 179 CO 0.04 -0.49 1.49 0.66 -0.85 0.00 0.00 174.74 175.60 1fbx n TYR 180 N 5.08 0.31 1.84 1.40 4.02 -0.50 -0.88 117.16 128.43 1fbx n TYR 180 Ca -0.12 0.13 0.12 0.00 -0.01 0.00 0.00 57.90 58.02 1fbx n TYR 180 Cb 0.48 -0.71 0.67 0.00 -0.02 0.00 0.00 39.34 39.77 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 -0.61 0.22 -0.10 0.00 0.31 -0.06 -4.55 118.33 113.54 1fbx n VAL 182 Ca 0.18 -0.15 -0.22 0.00 -0.01 0.00 0.00 64.34 64.15 1fbx n VAL 182 Cb 0.15 -0.64 -0.12 0.00 -0.91 0.00 0.00 33.84 32.32 1fbx n VAL 182 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1fbx h LYS 183 N 0.00 0.00 -0.00 5.55 3.64 -1.24 0.64 116.57 125.17 1fbx h LYS 183 Ca -0.09 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1fbx h LYS 183 Cb 1.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1fbx h LYS 183 CO 0.00 1.00 -0.21 0.00 -2.27 0.00 0.00 179.45 177.98 1fbx n ALA 184 N -3.38 2.90 -3.67 5.00 0.00 0.17 -4.01 120.51 117.53 1fbx n ALA 184 Ca -0.31 -0.26 -0.09 0.00 0.00 0.00 0.00 53.44 52.78 1fbx n ALA 184 Cb 0.68 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.81 1fbx n ALA 184 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1fbx s ARG 185 N -2.77 1.59 6.34 0.00 3.00 -1.25 -4.96 118.95 120.89 1fbx s ARG 185 Ca 0.19 -0.82 0.00 0.00 -1.00 0.00 0.00 55.73 54.10 1fbx s ARG 185 Cb 0.19 0.59 0.00 0.00 0.00 0.00 0.00 34.95 35.73 1fbx s ARG 185 CO 0.56 -0.72 0.00 0.41 0.00 0.00 0.00 175.30 175.55 1fbx n GLY 186 N -0.42 0.99 0.32 8.12 0.00 -1.26 -3.00 105.19 109.94 1fbx n GLY 186 Ca -0.08 -0.58 0.21 0.00 0.00 0.00 0.00 46.02 45.57 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 0.04 -6.28 -0.61 6.09 -1.88 -3.47 117.51 111.41 1fbx h ILE 187 Ca 0.00 -0.11 -0.46 0.00 -1.37 0.00 0.00 64.86 62.92 1fbx h ILE 187 Cb 0.00 1.11 0.00 0.00 0.47 0.00 0.00 36.82 38.40 1fbx h ILE 187 CO 0.00 0.00 -0.85 0.54 -3.07 0.00 0.00 178.15 174.77 1fbx n ARG 188 N -3.13 -4.24 -2.72 2.19 1.74 -0.93 -4.93 116.66 104.64 1fbx n ARG 188 Ca -0.02 0.53 -0.43 0.00 -0.77 0.00 0.00 57.85 57.16 1fbx n ARG 188 Cb 0.12 -4.92 -0.03 0.00 -1.02 0.00 0.00 32.46 26.61 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 -4.30 6.89 0.04 0.55 -1.08 0.17 -4.88 116.67 114.05 1fbx s ASP 189 Ca 0.04 1.00 0.26 0.00 -0.52 0.00 0.00 52.55 53.34 1fbx s ASP 189 Cb -0.02 -2.51 0.67 0.00 -1.46 0.00 0.00 42.92 39.60 1fbx s ASP 189 CO 0.85 -0.77 1.54 0.00 0.52 0.00 0.00 175.17 177.31 1fbx n ALA 190 N 6.60 3.05 0.21 3.66 0.00 -1.26 -3.90 120.51 128.86 1fbx n ALA 190 Ca 0.10 -0.25 0.04 0.00 0.00 0.00 0.00 53.44 53.33 1fbx n ALA 190 Cb 0.47 -1.24 -0.06 0.00 0.00 0.00 0.00 19.45 18.63 1fbx n ALA 190 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fbx n THR 191 N -1.67 0.00 -2.08 0.00 -2.24 -1.26 -5.05 114.28 101.98 1fbx n THR 191 Ca 0.05 -0.25 -0.32 0.00 -2.27 0.00 0.00 64.05 61.26 1fbx n THR 191 Cb 0.36 0.66 -0.00 0.00 -2.10 0.00 0.00 70.33 69.25 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 -2.39 6.16 0.04 3.42 1.04 -1.26 -5.08 113.70 115.62 1fbx s SER 192 Ca 0.00 1.61 -0.01 0.00 0.48 0.00 0.00 55.95 58.03 1fbx s SER 192 Cb 0.06 -2.51 -0.03 0.00 0.10 0.00 0.00 66.02 63.65 1fbx s SER 192 CO 0.36 -0.91 -0.01 0.00 0.98 0.00 0.00 173.24 173.66 1fbx s ALA 193 N -2.75 0.30 0.08 5.32 0.00 -1.26 -4.79 121.76 118.66 1fbx s ALA 193 Ca 0.59 -0.92 0.09 0.00 0.00 0.00 0.00 51.96 51.72 1fbx s ALA 193 Cb -0.12 0.24 -0.03 0.00 0.00 0.00 0.00 23.12 23.20 1fbx s ALA 193 CO 0.41 -0.30 -0.22 0.99 0.00 0.00 0.00 175.76 176.63 1fbx s THR 194 N -3.00 2.50 -0.08 0.00 2.01 -0.33 -4.94 115.64 111.80 1fbx s THR 194 Ca -0.02 -1.43 0.00 0.00 0.31 0.00 0.00 61.69 60.56 1fbx s THR 194 Cb 0.01 -2.07 0.02 0.00 0.01 0.00 0.00 72.50 70.48 1fbx s THR 194 CO -0.07 0.25 -0.06 -0.89 -0.69 0.00 0.00 174.62 173.15 1fbx s THR 195 N -0.96 0.82 0.08 -0.82 2.01 -1.26 -1.33 115.64 114.17 1fbx s THR 195 Ca 0.14 -0.22 0.09 0.00 0.31 0.00 0.00 61.69 62.02 1fbx s THR 195 Cb -0.10 -0.84 -0.03 0.00 0.01 0.00 0.00 72.50 71.54 1fbx s THR 195 CO 0.05 0.31 -0.24 0.42 -0.69 0.00 0.00 174.62 174.48 1fbx s THR 196 N 1.35 1.98 -0.06 -0.82 -4.23 -0.30 -4.97 115.64 108.59 1fbx s THR 196 Ca -0.03 -1.48 -0.04 0.00 -1.18 0.00 0.00 61.69 58.96 1fbx s THR 196 Cb -0.14 -1.73 0.02 0.00 1.34 0.00 0.00 72.50 71.99 1fbx s THR 196 CO -0.03 0.17 0.14 0.42 -0.54 0.00 0.00 174.62 174.78 1fbx s THR 197 N -0.95 -0.02 -0.14 3.99 -4.23 -1.26 -0.34 115.64 112.69 1fbx s THR 197 Ca 0.10 0.08 0.01 0.00 -1.18 0.00 0.00 61.69 60.70 1fbx s THR 197 Cb -0.10 -0.22 -0.00 0.00 1.34 0.00 0.00 72.50 73.52 1fbx s THR 197 CO 0.04 0.03 -0.17 -0.44 -0.54 0.00 0.00 174.62 173.54 1fbx s SER 198 N 0.57 3.60 -0.16 3.99 0.01 0.98 -4.97 113.70 117.72 1fbx s SER 198 Ca -0.04 -0.46 0.01 0.00 1.31 0.00 0.00 55.95 56.77 1fbx s SER 198 Cb -0.06 -1.54 0.02 0.00 0.21 0.00 0.00 66.02 64.65 1fbx s SER 198 CO -0.03 0.12 -0.20 -0.76 0.41 0.00 0.00 173.24 172.79 1fbx s LEU 199 N 0.60 2.04 0.43 2.44 1.43 -1.26 -0.36 118.68 124.00 1fbx s LEU 199 Ca -0.10 -0.60 0.07 0.00 -1.03 0.00 0.00 54.13 52.48 1fbx s LEU 199 Cb -0.16 -1.41 -0.02 0.00 0.03 0.00 0.00 46.19 44.64 1fbx s LEU 199 CO 0.03 0.02 0.36 -0.83 0.23 0.00 0.00 176.35 176.17 1fbx s GLY 200 N 1.13 2.18 0.00 -3.19 0.00 -0.31 -4.43 107.32 102.71 1fbx s GLY 200 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.87 1fbx s GLY 200 CO -0.08 -1.76 0.00 0.61 0.00 0.00 0.00 173.10 171.87 1fbx n GLY 201 N -1.55 1.26 0.43 0.20 0.00 -0.02 -1.93 105.19 103.58 1fbx n GLY 201 Ca 0.03 -0.45 0.25 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 0.00 -2.01 0.99 3.38 -1.94 0.72 115.31 116.44 1fbx h LEU 202 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1fbx h LEU 202 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1fbx h LEU 202 CO 0.00 0.00 -0.02 -0.26 0.09 0.00 0.00 178.44 178.25 1fbx h PHE 203 N 0.00 0.00 0.00 1.13 0.04 -1.70 -1.32 116.94 115.10 1fbx h PHE 203 Ca 0.32 0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.64 1fbx h PHE 203 Cb 1.50 0.00 -0.07 0.00 2.20 0.00 0.00 35.95 39.58 1fbx h PHE 203 CO 0.00 0.02 -2.50 1.17 -0.60 0.00 0.00 178.31 176.40 1fbx n LYS 204 N -3.15 0.57 -0.01 1.51 4.81 0.24 -4.22 118.16 117.91 1fbx n LYS 204 Ca -0.01 0.24 -0.13 0.00 -0.87 0.00 0.00 58.31 57.54 1fbx n LYS 204 Cb 0.22 -1.46 -0.10 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 -0.87 -0.05 -2.98 3.14 4.64 -1.17 -3.44 113.55 112.82 1fbx h SER 205 Ca -0.67 -0.56 -0.57 0.00 -0.47 0.00 0.00 61.79 59.51 1fbx h SER 205 Cb 1.62 0.01 -0.10 0.00 -0.31 0.00 0.00 62.40 63.63 1fbx h SER 205 CO -0.38 0.56 0.83 -0.55 -0.87 0.00 0.00 176.83 176.42 1fbx s SER 206 N -5.74 6.33 0.29 4.97 0.15 -0.50 -4.95 113.70 114.25 1fbx s SER 206 Ca -0.16 -0.24 -0.02 0.00 0.70 0.00 0.00 55.95 56.23 1fbx s SER 206 Cb 0.00 -2.51 0.63 0.00 -1.71 0.00 0.00 66.02 62.43 1fbx s SER 206 CO 0.63 -1.47 1.58 -0.61 1.20 0.00 0.00 173.24 174.56 1fbx h GLN 207 N 9.57 0.02 -0.10 5.44 5.75 -1.86 0.13 115.11 134.07 1fbx h GLN 207 Ca -0.26 -0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.24 1fbx h GLN 207 Cb 1.06 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.60 1fbx h GLN 207 CO 1.18 0.01 0.06 -0.97 -2.65 0.00 0.00 178.83 176.46 1fbx h ASN 208 N 0.02 0.12 -0.33 -0.69 -1.24 -1.93 -1.94 115.58 109.59 1fbx h ASN 208 Ca 0.54 -0.04 -0.03 0.00 0.71 0.00 0.00 56.30 57.48 1fbx h ASN 208 Cb 1.02 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 40.03 1fbx h ASN 208 CO -0.92 0.13 0.10 0.74 -1.29 0.00 0.00 177.43 176.19 1fbx h THR 209 N 0.10 1.21 -0.82 -3.57 2.02 -1.22 -2.34 112.91 108.28 1fbx h THR 209 Ca 0.03 -0.67 0.17 0.00 0.77 0.00 0.00 66.41 66.72 1fbx h THR 209 Cb 0.03 1.03 -0.11 0.00 -1.74 0.00 0.00 68.15 67.36 1fbx h THR 209 CO -0.01 0.23 0.33 -0.09 0.37 0.00 0.00 175.52 176.35 1fbx h ARG 210 N 0.37 0.41 0.00 6.66 2.43 -0.65 -2.55 114.38 121.05 1fbx h ARG 210 Ca 0.10 -0.02 -0.23 0.00 -0.81 0.00 0.00 59.98 59.02 1fbx h ARG 210 Cb 0.25 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 1fbx h ARG 210 CO -0.00 0.27 -1.18 0.45 -1.51 0.00 0.00 179.97 178.00 1fbx h HIS 211 N 0.43 0.00 -0.64 2.20 3.86 -1.13 -2.16 115.15 117.70 1fbx h HIS 211 Ca 0.47 -0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.75 1fbx h HIS 211 Cb 0.79 -0.00 -0.06 0.00 1.06 0.00 0.00 27.41 29.20 1fbx h HIS 211 CO -0.16 1.00 0.33 0.93 0.86 0.00 0.00 177.93 180.88 1fbx h GLU 212 N 0.00 0.57 0.16 2.45 5.08 -1.02 0.30 114.58 122.13 1fbx h GLU 212 Ca -0.08 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1fbx h GLU 212 Cb 1.83 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.96 1fbx h GLU 212 CO 0.12 0.38 -0.08 0.35 -1.00 0.00 0.00 179.01 178.78 1fbx h PHE 213 N 0.59 -0.20 0.00 4.33 3.57 -1.52 -2.24 116.94 121.47 1fbx h PHE 213 Ca 0.30 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.79 1fbx h PHE 213 Cb 0.25 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.06 1fbx h PHE 213 CO -0.10 0.09 -0.05 -0.07 -2.23 0.00 0.00 178.31 175.95 1fbx h LEU 214 N -0.50 0.00 -0.87 0.59 3.38 -1.07 -0.71 115.31 116.14 1fbx h LEU 214 Ca -0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1fbx h LEU 214 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1fbx h LEU 214 CO 0.04 0.05 -0.42 -0.09 0.09 0.00 0.00 178.44 178.10 1fbx h ARG 215 N 0.00 0.00 0.04 1.13 2.43 -0.28 -3.17 114.38 114.53 1fbx h ARG 215 Ca -0.00 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 58.88 1fbx h ARG 215 Cb 0.09 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 1fbx h ARG 215 CO 0.01 0.42 -1.58 0.00 -1.51 0.00 0.00 179.97 177.30 1fbx h ALA 216 N 1.58 0.54 -2.72 2.80 0.00 -0.55 -3.47 119.26 117.44 1fbx h ALA 216 Ca -0.00 -1.28 -0.54 0.00 0.00 0.00 0.00 54.91 53.08 1fbx h ALA 216 Cb 0.95 0.36 0.18 0.00 0.00 0.00 0.00 17.79 19.28 1fbx h ALA 216 CO 0.05 1.39 0.34 0.28 0.00 0.00 0.00 179.25 181.31 1fbx n VAL 217 N -3.25 2.73 -1.44 0.00 0.31 -0.51 -4.50 118.33 111.67 1fbx n VAL 217 Ca -0.16 -0.29 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 1fbx n VAL 217 Cb 1.03 -1.25 0.00 0.00 -0.91 0.00 0.00 33.84 32.71 1fbx n VAL 217 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1fbx n ARG 218 N -2.82 0.00 -3.68 5.55 3.00 -1.26 -5.00 116.66 112.45 1fbx n ARG 218 Ca 0.14 0.48 -0.29 0.00 -0.00 0.00 0.00 57.85 58.18 1fbx n ARG 218 Cb 0.50 -1.44 -0.10 0.00 0.00 0.00 0.00 32.46 31.42 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 -0.58 3.47 -1.55 -0.14 8.25 -1.26 -5.04 115.22 118.37 1fbx n HIS 219 Ca 0.00 -4.20 -0.24 0.00 -0.26 0.00 0.00 57.72 53.02 1fbx n HIS 219 Cb 0.10 -0.66 -0.08 0.00 1.12 0.00 0.00 29.99 30.48 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 1.54 1.11 -0.38 4.41 -0.00 -1.26 -4.84 115.22 115.79 1fbx n HIS 220 Ca 0.24 0.06 0.00 0.00 0.46 0.00 0.00 57.72 58.48 1fbx n HIS 220 Cb 0.37 -2.41 0.00 0.00 -0.12 0.00 0.00 29.99 27.83 1fbx n HIS 220 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89