#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tqx s LYS 5 N 0.00 1.33 -0.33 3.23 -0.14 -1.26 -5.10 119.74 117.47 1tqx s LYS 5 Ca 0.00 -1.34 -0.26 0.00 -1.36 0.00 0.00 55.97 53.01 1tqx s LYS 5 Cb 0.00 -1.65 0.01 0.00 -1.68 0.00 0.00 37.83 34.51 1tqx s LYS 5 CO 0.00 0.37 0.91 0.00 -0.76 0.00 0.00 175.35 175.88 1tqx s ALA 6 N -1.39 3.48 -0.08 5.17 0.00 -1.26 -4.67 121.76 123.02 1tqx s ALA 6 Ca 0.14 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.81 1tqx s ALA 6 Cb -0.09 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1tqx s ALA 6 CO 0.06 -1.41 -0.19 0.42 0.00 0.00 0.00 175.76 174.65 1tqx s ILE 7 N 3.31 1.64 -0.19 0.00 1.01 -0.15 -5.03 121.20 121.80 1tqx s ILE 7 Ca 0.38 -0.78 -0.06 0.00 0.00 0.00 0.00 60.65 60.19 1tqx s ILE 7 Cb -0.13 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 1tqx s ILE 7 CO 0.15 0.47 0.02 -0.63 0.00 0.00 0.00 174.94 174.95 1tqx s ILE 8 N 0.43 4.26 -0.47 2.92 -1.09 -1.26 -0.58 121.20 125.40 1tqx s ILE 8 Ca -0.15 -0.22 0.03 0.00 -2.23 0.00 0.00 60.65 58.08 1tqx s ILE 8 Cb -0.16 -2.92 0.14 0.00 -1.58 0.00 0.00 42.46 37.93 1tqx s ILE 8 CO 0.06 0.44 0.25 0.00 -1.23 0.00 0.00 174.94 174.47 1tqx s ALA 9 N 0.69 2.46 0.28 9.38 0.00 0.76 -3.13 121.76 132.20 1tqx s ALA 9 Ca 0.01 -2.79 -0.30 0.00 0.00 0.00 0.00 51.96 48.88 1tqx s ALA 9 Cb -0.14 -1.96 -0.13 0.00 0.00 0.00 0.00 23.12 20.90 1tqx s ALA 9 CO 0.02 -2.05 1.34 -2.30 0.00 0.00 0.00 175.76 172.77 1tqx n PRO 10 N 3.37 2.03 -3.13 0.00 -0.02 -1.25 -3.40 135.00 132.61 1tqx n PRO 10 Ca 0.09 0.72 -0.43 0.00 -2.02 0.00 0.00 63.50 61.85 1tqx n PRO 10 Cb 0.34 -2.33 -0.06 0.00 -0.02 0.00 0.00 33.50 31.43 1tqx n PRO 10 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1tqx s SER 11 N 0.02 6.26 0.44 2.55 0.15 -0.10 -0.66 113.70 122.35 1tqx s SER 11 Ca 0.63 -0.70 0.28 0.00 0.70 0.00 0.00 55.95 56.86 1tqx s SER 11 Cb -0.62 -2.31 1.55 0.00 -1.71 0.00 0.00 66.02 62.93 1tqx s SER 11 CO 0.55 -0.87 1.86 -0.37 1.20 0.00 0.00 173.24 175.61 1tqx h VAL 12 N 5.87 0.00 -0.57 4.45 -1.51 -1.81 -2.20 116.25 120.48 1tqx h VAL 12 Ca -0.27 0.00 0.07 0.00 -1.23 0.00 0.00 66.70 65.27 1tqx h VAL 12 Cb 1.09 0.63 -0.03 0.00 -2.13 0.00 0.00 31.29 30.85 1tqx h VAL 12 CO 0.95 0.00 0.38 0.25 -1.23 0.00 0.00 177.57 177.92 1tqx h LEU 13 N 0.00 0.46 -0.68 4.19 7.12 -1.91 -0.80 115.31 123.68 1tqx h LEU 13 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1tqx h LEU 13 Cb 0.06 -0.10 0.00 0.00 -0.53 0.00 0.00 40.66 40.10 1tqx h LEU 13 CO 0.00 0.30 -0.00 0.00 -0.13 0.00 0.00 178.44 178.60 1tqx n ALA 14 N -2.49 2.61 -2.62 1.25 0.00 -0.83 -4.85 120.51 113.59 1tqx n ALA 14 Ca 0.08 -0.37 -0.02 0.00 0.00 0.00 0.00 53.44 53.12 1tqx n ALA 14 Cb 0.26 -1.27 0.01 0.00 0.00 0.00 0.00 19.45 18.45 1tqx n ALA 14 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1tqx n SER 15 N -0.17 0.17 -4.52 0.00 3.41 -0.31 -4.81 113.62 107.38 1tqx n SER 15 Ca 0.20 -1.13 -0.43 0.00 -0.26 0.00 0.00 58.87 57.26 1tqx n SER 15 Cb 0.29 -0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.16 1tqx n SER 15 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1tqx s ASN 16 N -1.38 6.68 0.30 4.04 0.01 -1.26 -4.83 114.94 118.50 1tqx s ASN 16 Ca 0.06 -2.01 0.21 0.00 -0.71 0.00 0.00 52.86 50.40 1tqx s ASN 16 Cb -0.00 -2.50 1.11 0.00 0.41 0.00 0.00 41.25 40.26 1tqx s ASN 16 CO 0.04 -1.22 1.63 -0.38 -1.51 0.00 0.00 177.10 175.66 1tqx n ILE 17 N 6.12 1.08 1.85 0.60 -0.00 -1.26 -0.83 119.36 126.92 1tqx n ILE 17 Ca 0.34 0.71 0.16 0.00 -0.00 0.00 0.00 62.75 63.96 1tqx n ILE 17 Cb 0.48 -1.71 0.89 0.00 -0.00 0.00 0.00 39.64 39.30 1tqx n ILE 17 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1tqx n SER 18 N -2.22 0.07 -2.60 4.38 3.41 -1.26 -3.10 113.62 112.31 1tqx n SER 18 Ca -0.01 -0.84 -0.15 0.00 -0.26 0.00 0.00 58.87 57.61 1tqx n SER 18 Cb 0.04 -0.06 0.02 0.00 -0.26 0.00 0.00 64.21 63.95 1tqx n SER 18 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1tqx n LYS 19 N -1.01 1.96 -0.08 4.33 5.02 -0.01 -4.95 118.16 123.42 1tqx n LYS 19 Ca 0.22 -3.69 -0.06 0.00 -2.02 0.00 0.00 58.31 52.75 1tqx n LYS 19 Cb 0.15 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 1tqx n LYS 19 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1tqx h LEU 20 N 2.83 -0.16 -0.24 -0.35 6.46 -1.64 -0.32 115.31 121.91 1tqx h LEU 20 Ca 0.04 0.07 0.03 0.00 -0.12 0.00 0.00 57.88 57.91 1tqx h LEU 20 Cb 1.10 0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 41.14 1tqx h LEU 20 CO 0.61 -0.04 0.04 0.00 -0.62 0.00 0.00 178.44 178.43 1tqx h ALA 21 N 1.28 0.24 -0.22 1.25 0.00 -1.92 0.14 119.26 120.02 1tqx h ALA 21 Ca 0.15 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1tqx h ALA 21 Cb 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1tqx h ALA 21 CO -0.26 -0.38 0.13 0.93 0.00 0.00 0.00 179.25 179.66 1tqx h GLU 22 N 0.13 0.30 -0.63 0.00 5.08 -1.89 -0.48 114.58 117.10 1tqx h GLU 22 Ca 0.11 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1tqx h GLU 22 Cb 0.11 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1tqx h GLU 22 CO -0.15 0.25 0.26 0.93 -1.00 0.00 0.00 179.01 179.31 1tqx h GLU 23 N 0.26 0.91 -0.21 2.33 4.39 -0.76 -0.39 114.58 121.10 1tqx h GLU 23 Ca 0.08 -0.14 -0.19 0.00 0.34 0.00 0.00 59.36 59.45 1tqx h GLU 23 Cb 0.03 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1tqx h GLU 23 CO -0.01 0.73 -0.64 1.15 -1.16 0.00 0.00 179.01 179.08 1tqx h THR 24 N 0.90 1.29 -0.46 1.13 2.02 -0.50 -2.15 112.91 115.15 1tqx h THR 24 Ca 0.21 -1.85 -0.07 0.00 0.77 0.00 0.00 66.41 65.47 1tqx h THR 24 Cb 0.15 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.34 1tqx h THR 24 CO -0.02 0.59 0.00 1.56 0.37 0.00 0.00 175.52 178.02 1tqx h GLN 25 N 0.56 0.75 -0.27 6.66 4.20 -0.76 -1.19 115.11 125.04 1tqx h GLN 25 Ca -0.01 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 1tqx h GLN 25 Cb 1.24 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.92 1tqx h GLN 25 CO 0.13 0.76 0.13 -0.09 -0.67 0.00 0.00 178.83 179.09 1tqx h ARG 26 N 0.70 0.39 -0.75 1.46 2.43 -0.95 -0.08 114.38 117.59 1tqx h ARG 26 Ca 0.14 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.20 1tqx h ARG 26 Cb 0.43 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 1tqx h ARG 26 CO 0.02 0.38 0.25 0.52 -1.51 0.00 0.00 179.97 179.63 1tqx h MET 27 N 0.31 1.15 -0.25 0.20 2.86 -1.11 -1.89 114.93 116.21 1tqx h MET 27 Ca 0.09 -0.24 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1tqx h MET 27 Cb 0.12 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 1tqx h MET 27 CO -0.01 0.97 0.14 1.49 1.06 0.00 0.00 176.91 180.56 1tqx h GLU 28 N 1.10 0.29 0.00 1.72 4.81 -0.96 -1.81 114.58 119.73 1tqx h GLU 28 Ca 0.24 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.44 1tqx h GLU 28 Cb 0.28 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1tqx h GLU 28 CO -0.01 0.19 -0.08 0.66 -0.73 0.00 0.00 179.01 179.04 1tqx h SER 29 N 0.30 0.00 0.55 1.04 4.64 -0.71 -1.82 113.55 117.54 1tqx h SER 29 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1tqx h SER 29 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1tqx h SER 29 CO -0.04 0.08 -0.12 0.18 -0.87 0.00 0.00 176.83 176.06 1tqx n LEU 30 N -3.32 0.29 0.00 5.97 4.77 -0.74 -4.92 117.00 119.06 1tqx n LEU 30 Ca -0.01 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 1tqx n LEU 30 Cb 0.27 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1tqx n LEU 30 CO 0.28 0.06 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1tqx n GLY 31 N 1.35 0.74 3.73 -0.72 0.00 -0.68 -4.90 105.19 104.70 1tqx n GLY 31 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 1tqx n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tqx s ALA 32 N -2.09 3.74 0.09 4.61 0.00 -0.74 -4.91 121.76 122.45 1tqx s ALA 32 Ca 0.00 1.40 -0.08 0.00 0.00 0.00 0.00 51.96 53.28 1tqx s ALA 32 Cb 0.00 -3.61 -0.20 0.00 0.00 0.00 0.00 23.12 19.31 1tqx s ALA 32 CO 0.00 -0.81 1.20 0.93 0.00 0.00 0.00 175.76 177.09 1tqx h GLU 33 N 5.92 0.46 -6.11 0.00 3.07 -1.88 -3.42 114.58 112.62 1tqx h GLU 33 Ca -0.44 -0.58 -0.57 0.00 -0.50 0.00 0.00 59.36 57.27 1tqx h GLU 33 Cb 1.21 0.19 -0.16 0.00 -0.84 0.00 0.00 28.75 29.15 1tqx h GLU 33 CO 0.85 1.22 -0.77 -1.58 -1.40 0.00 0.00 179.01 177.33 1tqx s TRP 34 N -3.05 2.06 -0.14 4.33 0.52 -1.18 -1.97 118.94 119.51 1tqx s TRP 34 Ca -0.07 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 55.66 1tqx s TRP 34 Cb 0.07 -0.97 0.01 0.00 -1.15 0.00 0.00 33.47 31.44 1tqx s TRP 34 CO 0.89 0.50 -0.21 -1.50 0.02 0.00 0.00 176.95 176.66 1tqx s ILE 35 N -2.29 1.97 -0.33 2.03 1.10 0.15 -3.76 121.20 120.08 1tqx s ILE 35 Ca 0.23 -0.92 -0.19 0.00 -0.51 0.00 0.00 60.65 59.26 1tqx s ILE 35 Cb -0.05 -1.76 -0.01 0.00 0.15 0.00 0.00 42.46 40.80 1tqx s ILE 35 CO 0.10 0.53 0.54 -2.28 -2.11 0.00 0.00 174.94 171.72 1tqx s HIS 36 N 0.91 3.20 -0.38 3.50 5.65 0.16 -1.64 115.29 126.69 1tqx s HIS 36 Ca -0.05 0.34 -0.07 0.00 0.25 0.00 0.00 55.06 55.53 1tqx s HIS 36 Cb -0.15 -2.92 0.07 0.00 -1.18 0.00 0.00 32.58 28.40 1tqx s HIS 36 CO -0.03 -0.49 0.18 -0.51 -0.65 0.00 0.00 174.74 173.24 1tqx s LEU 37 N 2.44 4.79 -0.37 8.88 1.43 0.45 -2.38 118.68 133.92 1tqx s LEU 37 Ca 0.21 -1.42 -0.25 0.00 -1.03 0.00 0.00 54.13 51.64 1tqx s LEU 37 Cb -0.15 -1.91 0.01 0.00 0.03 0.00 0.00 46.19 44.17 1tqx s LEU 37 CO 0.13 -0.44 0.88 -1.81 0.23 0.00 0.00 176.35 175.33 1tqx s ASP 38 N 1.76 6.63 -0.25 2.29 1.01 -1.26 -0.58 116.67 126.27 1tqx s ASP 38 Ca 0.02 0.49 -0.09 0.00 0.71 0.00 0.00 52.55 53.68 1tqx s ASP 38 Cb -0.21 -2.44 -0.04 0.00 1.01 0.00 0.00 42.92 41.23 1tqx s ASP 38 CO 0.01 -0.82 0.13 -0.69 0.21 0.00 0.00 175.17 174.01 1tqx s VAL 39 N 3.36 4.88 -0.00 -1.27 1.01 -0.13 -4.41 120.40 123.84 1tqx s VAL 39 Ca 0.36 0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.40 1tqx s VAL 39 Cb -0.12 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 32.95 1tqx s VAL 39 CO 0.18 0.32 -0.12 -0.04 0.00 0.00 0.00 175.10 175.44 1tqx s MET 40 N 1.48 0.92 -0.11 2.72 -1.94 -1.26 -0.41 119.30 120.71 1tqx s MET 40 Ca 0.06 -0.46 0.14 0.00 -1.71 0.00 0.00 55.69 53.72 1tqx s MET 40 Cb -0.15 -0.89 0.35 0.00 2.01 0.00 0.00 34.83 36.14 1tqx s MET 40 CO 0.06 0.24 1.26 -0.40 -0.01 0.00 0.00 175.02 176.17 1tqx n ASP 41 N 2.65 3.03 0.00 3.03 5.75 -1.22 -2.86 116.55 126.94 1tqx n ASP 41 Ca -0.15 -2.69 0.00 0.00 -0.01 0.00 0.00 54.79 51.94 1tqx n ASP 41 Cb 0.56 -0.38 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1tqx n ASP 41 CO 0.00 0.00 0.00 0.80 -0.11 0.00 0.00 177.20 177.89 1tqx n MET 42 N -0.55 -0.29 -0.01 0.11 0.00 0.32 -4.73 117.12 111.97 1tqx n MET 42 Ca 0.15 0.07 -0.05 0.00 -0.00 0.00 0.00 57.70 57.87 1tqx n MET 42 Cb 0.65 -3.94 -0.02 0.00 0.00 0.00 0.00 33.22 29.91 1tqx n MET 42 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 175.97 176.69 1tqx n HIS 43 N -2.07 0.00 -0.02 1.12 8.25 -1.26 -4.60 115.22 116.63 1tqx n HIS 43 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.44 1tqx n HIS 43 Cb 0.07 -0.21 0.24 0.00 1.12 0.00 0.00 29.99 31.21 1tqx n HIS 43 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1tqx h PHE 44 N -0.32 0.60 -3.91 4.41 3.57 -1.85 -3.43 116.94 116.01 1tqx h PHE 44 Ca -0.07 -0.08 -0.28 0.00 3.53 0.00 0.00 57.97 61.07 1tqx h PHE 44 Cb 0.61 -0.17 -0.20 0.00 2.79 0.00 0.00 35.95 38.98 1tqx h PHE 44 CO -0.10 0.63 -0.73 0.14 -2.23 0.00 0.00 178.31 176.02 1tqx s VAL 45 N -4.84 0.65 0.00 1.41 -7.23 -1.26 -5.00 120.40 104.13 1tqx s VAL 45 Ca -0.08 -1.33 -0.05 0.00 -1.81 0.00 0.00 61.98 58.71 1tqx s VAL 45 Cb 0.15 -0.94 -0.24 0.00 0.56 0.00 0.00 36.38 35.91 1tqx s VAL 45 CO 0.78 -0.49 3.30 -0.81 -0.31 0.00 0.00 175.10 177.57 1tqx n PRO 46 N 1.05 1.79 -3.61 4.82 -0.04 -1.26 -3.08 135.00 134.67 1tqx n PRO 46 Ca -0.20 -0.87 -0.16 0.00 -0.04 0.00 0.00 63.50 62.23 1tqx n PRO 46 Cb 0.56 -1.92 -0.07 0.00 -0.04 0.00 0.00 33.50 32.04 1tqx n PRO 46 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1tqx s ASN 47 N 2.08 -0.45 -0.19 3.54 3.04 -1.26 -4.95 114.94 116.75 1tqx s ASN 47 Ca 0.59 0.39 -0.01 0.00 0.04 0.00 0.00 52.86 53.86 1tqx s ASN 47 Cb 0.28 0.45 0.05 0.00 -1.54 0.00 0.00 41.25 40.49 1tqx s ASN 47 CO 0.00 -0.58 -0.03 -0.22 -3.04 0.00 0.00 177.10 173.22 1tqx s LEU 48 N -1.42 1.77 0.00 3.21 0.20 -1.26 -0.52 118.68 120.66 1tqx s LEU 48 Ca -0.10 -0.83 0.00 0.00 0.69 0.00 0.00 54.13 53.89 1tqx s LEU 48 Cb -0.02 -0.91 0.00 0.00 -0.43 0.00 0.00 46.19 44.83 1tqx s LEU 48 CO 0.05 -0.22 0.00 -1.54 -0.29 0.00 0.00 176.35 174.35 1tqx n SER 49 N 4.86 0.00 -3.45 3.68 3.41 -1.13 -4.97 113.62 116.02 1tqx n SER 49 Ca -0.11 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.37 1tqx n SER 49 Cb 0.47 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.39 1tqx n SER 49 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1tqx s PHE 50 N 0.00 -0.54 0.00 7.33 -0.12 -1.26 -4.98 117.98 118.41 1tqx s PHE 50 Ca 0.00 0.45 0.00 0.00 -0.05 0.00 0.00 56.93 57.33 1tqx s PHE 50 Cb 0.00 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 42.92 1tqx s PHE 50 CO 0.00 -0.78 0.00 0.41 -0.05 0.00 0.00 175.22 174.80 1tqx n GLY 51 N -0.15 5.59 0.31 1.99 0.00 -1.26 -4.29 105.19 107.38 1tqx n GLY 51 Ca -0.16 -2.13 0.14 0.00 0.00 0.00 0.00 46.02 43.87 1tqx n GLY 51 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1tqx h PRO 52 N 0.00 0.29 -0.66 1.61 0.11 -1.97 -0.99 132.00 130.40 1tqx h PRO 52 Ca 0.00 -0.02 0.09 0.00 0.11 0.00 0.00 66.00 66.18 1tqx h PRO 52 Cb 0.00 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.00 1tqx h PRO 52 CO 0.00 0.19 0.44 -1.35 -0.21 0.00 0.00 178.00 177.07 1tqx h PRO 53 N 0.30 0.55 -0.01 1.05 0.11 -1.96 0.44 132.00 132.47 1tqx h PRO 53 Ca 0.57 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.59 1tqx h PRO 53 Cb 1.13 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1tqx h PRO 53 CO -0.59 0.36 -0.23 0.28 -0.21 0.00 0.00 178.00 177.61 1tqx h VAL 54 N 0.56 1.53 -0.53 3.15 2.07 -1.58 -2.84 116.25 118.62 1tqx h VAL 54 Ca 0.30 -1.87 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 1tqx h VAL 54 Cb 0.43 2.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.86 1tqx h VAL 54 CO -0.09 0.51 0.28 0.40 0.02 0.00 0.00 177.57 178.69 1tqx h ILE 55 N -0.48 1.18 -0.38 4.57 2.04 -1.03 -1.14 117.51 122.27 1tqx h ILE 55 Ca -0.03 -0.47 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 1tqx h ILE 55 Cb 0.96 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.55 1tqx h ILE 55 CO 0.04 0.20 0.13 0.78 0.00 0.00 0.00 178.15 179.30 1tqx h ASN 56 N 0.70 0.50 -0.17 1.72 -0.26 -0.23 -2.55 115.58 115.30 1tqx h ASN 56 Ca 0.18 -0.06 -0.21 0.00 -0.56 0.00 0.00 56.30 55.66 1tqx h ASN 56 Cb 0.06 -0.13 0.01 0.00 -1.06 0.00 0.00 38.32 37.20 1tqx h ASN 56 CO -0.03 0.48 -0.71 -1.13 -1.06 0.00 0.00 177.43 174.98 1tqx h ASN 57 N 0.55 0.94 -0.85 5.81 -0.73 -1.19 -3.23 115.58 116.87 1tqx h ASN 57 Ca 0.13 -0.58 0.06 0.00 1.87 0.00 0.00 56.30 57.78 1tqx h ASN 57 Cb 0.16 -0.27 -0.06 0.00 0.27 0.00 0.00 38.32 38.41 1tqx h ASN 57 CO -0.01 1.38 0.52 0.25 -0.37 0.00 0.00 177.43 179.20 1tqx h LEU 58 N 0.57 0.82 -2.14 0.34 5.85 -0.83 -2.18 115.31 117.74 1tqx h LEU 58 Ca -0.03 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.76 1tqx h LEU 58 Cb 1.33 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 1tqx h LEU 58 CO 0.15 0.53 0.30 0.50 -0.34 0.00 0.00 178.44 179.57 1tqx h LYS 59 N 0.96 0.00 0.00 1.25 1.63 -1.48 -0.48 116.57 118.45 1tqx h LYS 59 Ca 0.37 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 60.10 1tqx h LYS 59 Cb 0.17 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.79 1tqx h LYS 59 CO -0.17 0.00 -0.33 -0.22 -3.45 0.00 0.00 179.45 175.28 1tqx h LYS 60 N 0.00 0.00 -0.26 1.90 3.64 -1.53 -3.23 116.57 117.09 1tqx h LYS 60 Ca 0.10 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1tqx h LYS 60 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1tqx h LYS 60 CO -0.00 0.33 0.00 0.66 -2.27 0.00 0.00 179.45 178.17 1tqx n TYR 61 N -3.97 0.34 -3.58 1.91 4.02 -0.20 -5.00 117.16 110.68 1tqx n TYR 61 Ca -0.02 -0.26 -0.20 0.00 -0.01 0.00 0.00 57.90 57.42 1tqx n TYR 61 Cb 0.39 -0.01 -0.02 0.00 -0.02 0.00 0.00 39.34 39.68 1tqx n TYR 61 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 1tqx s THR 62 N -1.14 3.59 0.00 -0.72 -4.23 -1.19 -4.90 115.64 107.04 1tqx s THR 62 Ca 0.26 -1.19 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1tqx s THR 62 Cb 0.15 -3.23 0.00 0.00 1.34 0.00 0.00 72.50 70.76 1tqx s THR 62 CO 0.21 -0.13 0.00 0.29 -0.54 0.00 0.00 174.62 174.45 1tqx n LYS 63 N -1.54 0.00 0.00 3.99 5.02 -1.26 -4.97 118.16 119.40 1tqx n LYS 63 Ca 0.00 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.40 1tqx n LYS 63 Cb 0.59 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.59 1tqx n LYS 63 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1tqx n SER 64 N 0.00 1.95 -4.74 4.39 2.88 -1.26 -4.99 113.62 111.85 1tqx n SER 64 Ca 0.00 -1.48 -0.42 0.00 -1.33 0.00 0.00 58.87 55.65 1tqx n SER 64 Cb 0.00 0.51 -0.02 0.00 -0.75 0.00 0.00 64.21 63.95 1tqx n SER 64 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 1tqx s ILE 65 N -2.49 2.38 -0.06 2.46 2.07 -1.26 -4.95 121.20 119.36 1tqx s ILE 65 Ca 0.17 0.31 -0.30 0.00 -1.41 0.00 0.00 60.65 59.43 1tqx s ILE 65 Cb 0.18 -3.20 -0.04 0.00 0.13 0.00 0.00 42.46 39.53 1tqx s ILE 65 CO 0.59 0.05 1.32 0.12 -1.91 0.00 0.00 174.94 175.10 1tqx s PHE 66 N 0.17 2.91 -0.54 3.50 5.36 -0.83 -4.86 117.98 123.69 1tqx s PHE 66 Ca 0.63 0.96 -0.26 0.00 -0.96 0.00 0.00 56.93 57.30 1tqx s PHE 66 Cb -0.45 -3.56 0.04 0.00 -0.34 0.00 0.00 43.02 38.71 1tqx s PHE 66 CO 0.43 -1.98 1.01 -0.06 -1.46 0.00 0.00 175.22 173.16 1tqx s PHE 67 N 2.66 2.76 -0.45 10.12 0.40 -1.26 -0.67 117.98 131.55 1tqx s PHE 67 Ca 0.60 0.18 -0.09 0.00 -0.60 0.00 0.00 56.93 57.01 1tqx s PHE 67 Cb -0.27 -4.18 0.10 0.00 0.51 0.00 0.00 43.02 39.17 1tqx s PHE 67 CO 0.23 -1.37 0.31 0.34 0.70 0.00 0.00 175.22 175.42 1tqx s ASP 68 N 2.77 5.69 -0.30 1.36 2.15 -0.65 -1.22 116.67 126.47 1tqx s ASP 68 Ca 0.35 -1.70 -0.14 0.00 0.43 0.00 0.00 52.55 51.50 1tqx s ASP 68 Cb -0.11 -2.01 -0.03 0.00 -0.30 0.00 0.00 42.92 40.47 1tqx s ASP 68 CO 0.22 -0.62 0.31 -0.69 -0.17 0.00 0.00 175.17 174.22 1tqx s VAL 69 N 1.40 5.22 -0.47 1.11 1.01 -0.01 -0.41 120.40 128.25 1tqx s VAL 69 Ca 0.04 0.27 -0.17 0.00 0.00 0.00 0.00 61.98 62.13 1tqx s VAL 69 Cb -0.25 -3.68 0.05 0.00 0.00 0.00 0.00 36.38 32.50 1tqx s VAL 69 CO 0.01 0.11 0.47 -2.28 0.00 0.00 0.00 175.10 173.40 1tqx s HIS 70 N 1.95 3.17 -0.96 5.22 2.46 0.25 -0.51 115.29 126.87 1tqx s HIS 70 Ca 0.11 -0.66 -0.20 0.00 0.47 0.00 0.00 55.06 54.78 1tqx s HIS 70 Cb -0.16 -3.17 0.10 0.00 -0.13 0.00 0.00 32.58 29.22 1tqx s HIS 70 CO 0.11 -0.83 1.24 -0.51 -2.47 0.00 0.00 174.74 172.28 1tqx s LEU 71 N 2.05 4.49 -1.19 8.88 1.43 0.84 -0.96 118.68 134.22 1tqx s LEU 71 Ca 0.09 -1.83 -0.05 0.00 -1.03 0.00 0.00 54.13 51.31 1tqx s LEU 71 Cb -0.21 -2.46 0.22 0.00 0.03 0.00 0.00 46.19 43.77 1tqx s LEU 71 CO 0.10 -1.23 1.91 0.23 0.23 0.00 0.00 176.35 177.59 1tqx n MET 72 N 7.40 4.50 -4.14 1.70 2.81 0.46 -4.00 117.12 125.84 1tqx n MET 72 Ca 0.27 -4.01 -0.09 0.00 -1.81 0.00 0.00 57.70 52.05 1tqx n MET 72 Cb 0.50 -2.64 -0.10 0.00 -0.71 0.00 0.00 33.22 30.26 1tqx n MET 72 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1tqx s VAL 73 N -1.84 0.12 0.45 2.03 -7.23 -1.26 -3.51 120.40 109.17 1tqx s VAL 73 Ca 0.41 -1.90 -0.03 0.00 -1.81 0.00 0.00 61.98 58.65 1tqx s VAL 73 Cb 0.13 -1.99 -0.03 0.00 0.56 0.00 0.00 36.38 35.05 1tqx s VAL 73 CO -0.02 -0.52 0.72 -1.61 -0.31 0.00 0.00 175.10 173.36 1tqx s GLU 74 N -4.03 3.42 -1.36 4.82 2.02 -1.26 -4.27 118.70 118.04 1tqx s GLU 74 Ca 0.22 -0.03 -0.03 0.00 0.02 0.00 0.00 54.97 55.15 1tqx s GLU 74 Cb 0.08 -2.46 0.02 0.00 0.10 0.00 0.00 34.13 31.87 1tqx s GLU 74 CO 0.01 -0.17 0.78 0.66 0.02 0.00 0.00 175.26 176.56 1tqx n TYR 75 N -2.15 -2.03 0.17 1.61 0.53 -1.26 -4.86 117.16 109.15 1tqx n TYR 75 Ca -0.00 0.86 0.18 0.00 -1.02 0.00 0.00 57.90 57.91 1tqx n TYR 75 Cb 0.56 -4.34 0.79 0.00 -1.03 0.00 0.00 39.34 35.31 1tqx n TYR 75 CO 0.00 0.00 0.00 -1.00 -1.02 0.00 0.00 176.86 174.84 1tqx h PRO 76 N -1.94 0.00 0.00 -0.72 0.13 -1.91 -1.31 132.00 126.25 1tqx h PRO 76 Ca -0.60 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.51 1tqx h PRO 76 Cb 1.36 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.49 1tqx h PRO 76 CO 0.59 0.00 -0.08 1.05 -0.23 0.00 0.00 178.00 179.33 1tqx h GLU 77 N 0.00 0.00 0.00 0.86 9.09 -1.96 -2.05 114.58 120.51 1tqx h GLU 77 Ca 0.12 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.50 1tqx h GLU 77 Cb 0.62 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.71 1tqx h GLU 77 CO -0.00 0.08 -0.13 0.87 0.05 0.00 0.00 179.01 179.88 1tqx h LYS 78 N 0.00 0.00 0.00 1.06 1.79 -1.60 -3.16 116.57 114.66 1tqx h LYS 78 Ca -0.00 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.33 1tqx h LYS 78 Cb 0.30 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.93 1tqx h LYS 78 CO 0.01 0.13 -0.93 1.88 -1.08 0.00 0.00 179.45 179.46 1tqx h TYR 79 N 0.00 0.00 -0.29 -1.35 -1.99 -1.51 -3.39 116.97 108.44 1tqx h TYR 79 Ca -0.00 0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.80 1tqx h TYR 79 Cb 0.71 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 39.37 1tqx h TYR 79 CO 0.00 0.57 -0.18 0.28 -0.00 0.00 0.00 178.16 178.82 1tqx h VAL 80 N 0.00 0.48 0.00 -2.88 2.07 -1.58 -0.95 116.25 113.40 1tqx h VAL 80 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1tqx h VAL 80 Cb 1.50 0.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 1tqx h VAL 80 CO 0.06 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.84 1tqx n PRO 81 N -5.35 0.12 0.00 1.57 -0.04 -1.26 -2.24 135.00 127.80 1tqx n PRO 81 Ca 0.00 0.41 0.12 0.00 -0.04 0.00 0.00 63.50 63.99 1tqx n PRO 81 Cb 0.26 -1.75 0.14 0.00 -0.04 0.00 0.00 33.50 32.11 1tqx n PRO 81 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1tqx n LEU 82 N -1.97 1.35 -2.07 1.53 4.77 -0.40 -4.34 117.00 115.87 1tqx n LEU 82 Ca 0.02 -0.46 -0.16 0.00 -0.03 0.00 0.00 56.01 55.37 1tqx n LEU 82 Cb 0.17 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 41.23 1tqx n LEU 82 CO 0.15 0.27 0.15 0.18 -1.33 0.00 0.00 177.39 176.81 1tqx n LEU 83 N -0.63 4.02 0.28 2.23 4.77 -0.95 -4.83 117.00 121.89 1tqx n LEU 83 Ca 0.09 -4.29 0.13 0.00 -0.03 0.00 0.00 56.01 51.91 1tqx n LEU 83 Cb 0.39 -0.19 0.80 0.00 -2.33 0.00 0.00 43.42 42.10 1tqx n LEU 83 CO 0.31 1.81 1.04 0.11 -1.33 0.00 0.00 177.39 179.32 1tqx h LYS 84 N 2.15 0.00 -0.00 3.23 1.57 -1.76 -2.50 116.57 119.26 1tqx h LYS 84 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1tqx h LYS 84 Cb 1.45 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.76 1tqx h LYS 84 CO 0.58 0.07 -0.16 0.25 -0.57 0.00 0.00 179.45 179.62 1tqx n THR 85 N -3.74 0.00 -1.68 -0.16 -2.24 -1.26 -4.89 114.28 100.31 1tqx n THR 85 Ca -0.02 -0.07 -0.22 0.00 -2.27 0.00 0.00 64.05 61.47 1tqx n THR 85 Cb 0.17 0.01 0.16 0.00 -2.10 0.00 0.00 70.33 68.57 1tqx n THR 85 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1tqx n SER 86 N -0.95 0.03 -0.05 3.42 7.64 -0.94 -4.95 113.62 117.82 1tqx n SER 86 Ca 0.13 -1.36 -0.06 0.00 1.01 0.00 0.00 58.87 58.59 1tqx n SER 86 Cb 0.30 -0.77 -0.05 0.00 -1.01 0.00 0.00 64.21 62.68 1tqx n SER 86 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1tqx n ASN 87 N -3.67 3.23 -3.89 6.43 3.02 -0.35 -4.93 115.26 115.09 1tqx n ASN 87 Ca 0.13 -0.04 -0.15 0.00 -0.03 0.00 0.00 54.58 54.49 1tqx n ASN 87 Cb 0.44 0.03 -0.15 0.00 -0.61 0.00 0.00 39.78 39.49 1tqx n ASN 87 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1tqx s GLN 88 N -2.19 0.23 -0.18 3.52 0.74 -0.57 -0.55 119.66 120.66 1tqx s GLN 88 Ca -0.11 -0.05 0.01 0.00 0.05 0.00 0.00 55.36 55.26 1tqx s GLN 88 Cb 0.03 -0.28 0.02 0.00 1.10 0.00 0.00 33.01 33.88 1tqx s GLN 88 CO 0.24 0.01 -0.20 -0.51 -0.55 0.00 0.00 175.29 174.28 1tqx s LEU 89 N 0.22 2.16 -0.26 3.68 1.43 -0.85 -0.83 118.68 124.23 1tqx s LEU 89 Ca -0.02 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.37 1tqx s LEU 89 Cb -0.04 -1.48 0.01 0.00 0.03 0.00 0.00 46.19 44.71 1tqx s LEU 89 CO -0.01 -0.01 0.00 -0.89 0.23 0.00 0.00 176.35 175.68 1tqx s THR 90 N 1.29 3.45 0.36 5.49 2.01 0.34 -1.65 115.64 126.92 1tqx s THR 90 Ca 0.05 -0.76 0.08 0.00 0.31 0.00 0.00 61.69 61.36 1tqx s THR 90 Cb -0.13 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.63 1tqx s THR 90 CO -0.13 0.20 0.29 0.72 -0.69 0.00 0.00 174.62 175.02 1tqx s PHE 91 N 1.43 2.83 -0.04 4.92 -0.12 -0.83 -0.11 117.98 126.06 1tqx s PHE 91 Ca 0.02 -0.36 -0.13 0.00 -0.05 0.00 0.00 56.93 56.41 1tqx s PHE 91 Cb -0.16 -1.87 -0.05 0.00 -0.63 0.00 0.00 43.02 40.31 1tqx s PHE 91 CO -0.01 0.13 0.36 -1.01 -0.05 0.00 0.00 175.22 174.64 1tqx s HIS 92 N -2.36 3.68 0.23 3.49 3.76 -1.26 -0.69 115.29 122.14 1tqx s HIS 92 Ca 0.42 0.88 -0.07 0.00 -0.15 0.00 0.00 55.06 56.14 1tqx s HIS 92 Cb -0.05 -2.24 0.20 0.00 1.11 0.00 0.00 32.58 31.60 1tqx s HIS 92 CO 0.26 0.61 1.86 0.35 -0.85 0.00 0.00 174.74 176.97 1tqx h PHE 93 N 5.00 1.20 0.00 1.40 3.57 -1.73 -1.91 116.94 124.47 1tqx h PHE 93 Ca -0.51 -0.02 -0.04 0.00 3.53 0.00 0.00 57.97 60.93 1tqx h PHE 93 Cb 1.22 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 1tqx h PHE 93 CO 0.71 0.82 -0.18 0.93 -2.23 0.00 0.00 178.31 178.35 1tqx h GLU 94 N 1.23 0.00 0.00 1.11 3.07 -1.94 -1.17 114.58 116.89 1tqx h GLU 94 Ca 0.31 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.15 1tqx h GLU 94 Cb 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1tqx h GLU 94 CO -0.05 0.18 -0.11 0.00 -1.40 0.00 0.00 179.01 177.63 1tqx h ALA 95 N 1.82 1.08 -0.59 3.43 0.00 -1.67 -2.09 119.26 121.24 1tqx h ALA 95 Ca -0.00 -0.10 -0.34 0.00 0.00 0.00 0.00 54.91 54.47 1tqx h ALA 95 Cb 0.59 -0.02 -0.20 0.00 0.00 0.00 0.00 17.79 18.17 1tqx h ALA 95 CO 0.02 0.14 0.10 1.28 0.00 0.00 0.00 179.25 180.80 1tqx n LEU 96 N -3.35 5.12 -1.21 0.00 4.32 -1.08 -4.67 117.00 116.13 1tqx n LEU 96 Ca -0.01 -3.90 -0.13 0.00 -0.02 0.00 0.00 56.01 51.96 1tqx n LEU 96 Cb 0.31 -0.69 -0.06 0.00 -1.62 0.00 0.00 43.42 41.37 1tqx n LEU 96 CO 0.30 1.33 -0.13 -3.20 -1.22 0.00 0.00 177.39 174.46 1tqx n ASN 97 N -1.08 -4.37 -0.75 -1.43 4.05 -0.78 -2.47 115.26 108.44 1tqx n ASN 97 Ca 0.43 0.33 -0.08 0.00 0.45 0.00 0.00 54.58 55.71 1tqx n ASN 97 Cb 1.13 -3.71 -0.02 0.00 1.23 0.00 0.00 39.78 38.41 1tqx n ASN 97 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1tqx n GLU 98 N -1.56 -0.58 -3.64 1.20 1.02 -0.46 -4.98 120.64 111.63 1tqx n GLU 98 Ca -0.13 0.56 -0.36 0.00 -0.02 0.00 0.00 57.16 57.20 1tqx n GLU 98 Cb 0.51 -4.44 -0.09 0.00 -0.02 0.00 0.00 31.44 27.40 1tqx n GLU 98 CO 0.00 0.00 0.00 0.16 1.18 0.00 0.00 177.13 178.47 1tqx s ASP 99 N -2.77 6.20 0.14 1.62 -4.77 -1.03 -5.01 116.67 111.05 1tqx s ASP 99 Ca 0.00 0.21 -0.18 0.00 -3.30 0.00 0.00 52.55 49.29 1tqx s ASP 99 Cb 0.00 -2.12 0.02 0.00 -1.09 0.00 0.00 42.92 39.73 1tqx s ASP 99 CO 0.00 0.09 1.74 0.74 0.70 0.00 0.00 175.17 178.43 1tqx h THR 100 N 4.89 0.88 -0.88 2.11 2.02 -1.92 -2.98 112.91 117.04 1tqx h THR 100 Ca -0.39 -0.06 0.03 0.00 0.77 0.00 0.00 66.41 66.75 1tqx h THR 100 Cb 1.16 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 68.20 1tqx h THR 100 CO 0.70 0.03 0.57 -0.33 0.37 0.00 0.00 175.52 176.86 1tqx h GLU 101 N 0.18 1.10 -0.24 6.66 4.39 -1.99 -0.38 114.58 124.30 1tqx h GLU 101 Ca 0.13 -0.07 -0.14 0.00 0.34 0.00 0.00 59.36 59.63 1tqx h GLU 101 Cb 0.13 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.53 1tqx h GLU 101 CO -0.17 0.73 -0.43 0.00 -1.16 0.00 0.00 179.01 177.98 1tqx h ARG 102 N 1.13 0.58 -0.49 2.33 3.08 -1.94 -1.34 114.38 117.74 1tqx h ARG 102 Ca 0.34 -0.31 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1tqx h ARG 102 Cb -0.04 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1tqx h ARG 102 CO -0.10 0.90 0.14 0.00 -1.07 0.00 0.00 179.97 179.84 1tqx h ILE 104 N 0.65 1.20 -0.37 0.00 2.04 -0.91 -0.79 117.51 119.33 1tqx h ILE 104 Ca 0.16 -0.72 -0.09 0.00 1.00 0.00 0.00 64.86 65.20 1tqx h ILE 104 Cb 0.28 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1tqx h ILE 104 CO -0.00 0.26 -0.11 -0.61 0.00 0.00 0.00 178.15 177.68 1tqx h GLN 105 N 0.60 0.73 -0.25 2.37 -0.00 -0.75 -2.27 115.11 115.54 1tqx h GLN 105 Ca 0.13 -0.29 -0.04 0.00 -0.00 0.00 0.00 58.65 58.45 1tqx h GLN 105 Cb 0.27 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.71 1tqx h GLN 105 CO 0.00 0.89 -0.01 1.25 0.00 0.00 0.00 178.83 180.96 1tqx h LEU 106 N 0.52 0.43 -0.72 -2.39 6.46 -0.89 -2.57 115.31 116.15 1tqx h LEU 106 Ca 0.09 -0.32 0.13 0.00 -0.12 0.00 0.00 57.88 57.67 1tqx h LEU 106 Cb 0.64 -0.12 -0.09 0.00 -0.73 0.00 0.00 40.66 40.36 1tqx h LEU 106 CO 0.04 0.65 0.26 0.00 -0.62 0.00 0.00 178.44 178.77 1tqx h ALA 107 N 0.80 0.98 -0.91 1.25 0.00 -1.09 0.72 119.26 121.02 1tqx h ALA 107 Ca 0.07 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1tqx h ALA 107 Cb 0.43 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1tqx h ALA 107 CO 0.01 -0.23 0.53 0.87 0.00 0.00 0.00 179.25 180.43 1tqx h LYS 108 N 0.40 1.24 -0.36 0.00 1.57 -1.22 0.40 116.57 118.60 1tqx h LYS 108 Ca 0.39 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1tqx h LYS 108 Cb 0.59 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 1tqx h LYS 108 CO -0.40 0.88 0.21 0.93 -0.57 0.00 0.00 179.45 180.50 1tqx h GLU 109 N 1.25 0.50 -0.02 3.15 5.08 -0.52 0.11 114.58 124.13 1tqx h GLU 109 Ca 0.32 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1tqx h GLU 109 Cb -0.03 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 1tqx h GLU 109 CO -0.06 0.38 0.01 0.82 -1.00 0.00 0.00 179.01 179.17 1tqx h ILE 110 N 0.47 1.13 -0.14 3.13 2.04 -0.61 -2.75 117.51 120.78 1tqx h ILE 110 Ca 0.13 -0.38 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 1tqx h ILE 110 Cb 0.02 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1tqx h ILE 110 CO -0.02 0.10 -0.11 0.03 0.00 0.00 0.00 178.15 178.15 1tqx h ARG 111 N -0.12 0.21 0.00 2.37 2.47 -0.81 -1.49 114.38 117.00 1tqx h ARG 111 Ca 0.01 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.68 1tqx h ARG 111 Cb 0.16 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.45 1tqx h ARG 111 CO -0.00 0.33 -0.01 -0.44 0.56 0.00 0.00 179.97 180.41 1tqx h ASP 112 N 0.20 0.00 -0.28 7.04 3.45 -0.50 -0.63 116.42 125.69 1tqx h ASP 112 Ca 0.04 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.50 1tqx h ASP 112 Cb 0.33 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.10 1tqx h ASP 112 CO 0.02 0.01 0.00 0.59 -1.57 0.00 0.00 179.24 178.29 1tqx n ASN 113 N -3.12 2.00 -1.94 6.45 5.03 -0.58 -4.91 115.26 118.19 1tqx n ASN 113 Ca -0.01 -1.85 -0.13 0.00 0.87 0.00 0.00 54.58 53.46 1tqx n ASN 113 Cb 0.22 -0.18 0.03 0.00 -1.02 0.00 0.00 39.78 38.82 1tqx n ASN 113 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1tqx n ASN 114 N 0.56 -4.29 -4.39 6.41 3.02 -0.24 -5.04 115.26 111.29 1tqx n ASN 114 Ca 0.15 -0.20 -0.28 0.00 -0.03 0.00 0.00 54.58 54.23 1tqx n ASN 114 Cb 0.35 -3.11 -0.13 0.00 -0.61 0.00 0.00 39.78 36.28 1tqx n ASN 114 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1tqx s LEU 115 N -4.21 2.35 0.55 3.41 1.02 -1.12 -5.04 118.68 115.64 1tqx s LEU 115 Ca 0.21 -0.78 -0.19 0.00 0.02 0.00 0.00 54.13 53.40 1tqx s LEU 115 Cb -0.09 -1.17 -0.05 0.00 0.02 0.00 0.00 46.19 44.90 1tqx s LEU 115 CO 0.26 0.15 1.10 0.26 0.02 0.00 0.00 176.35 178.14 1tqx s TRP 116 N -1.25 2.77 -0.06 0.29 0.52 0.29 -3.84 118.94 117.66 1tqx s TRP 116 Ca 0.15 1.55 0.05 0.00 0.02 0.00 0.00 56.10 57.87 1tqx s TRP 116 Cb -0.09 -3.19 -0.00 0.00 -1.15 0.00 0.00 33.47 29.03 1tqx s TRP 116 CO 0.07 -1.38 -0.21 0.00 0.02 0.00 0.00 176.95 175.45 1tqx s GLY 118 N 0.04 1.41 -0.01 0.00 0.00 -0.66 -0.02 107.32 108.07 1tqx s GLY 118 Ca -0.07 -1.59 0.01 0.00 0.00 0.00 0.00 44.72 43.07 1tqx s GLY 118 CO 0.04 -1.67 -0.04 -1.50 0.00 0.00 0.00 173.10 169.93 1tqx s ILE 119 N -2.62 0.38 0.19 0.90 2.07 -0.56 -1.97 121.20 119.60 1tqx s ILE 119 Ca 0.20 -0.15 0.10 0.00 -1.41 0.00 0.00 60.65 59.38 1tqx s ILE 119 Cb -0.03 -0.36 -0.04 0.00 0.13 0.00 0.00 42.46 42.16 1tqx s ILE 119 CO 0.07 0.14 -0.12 -0.55 -1.91 0.00 0.00 174.94 172.56 1tqx s SER 120 N 0.24 4.08 -0.03 4.50 0.15 0.13 -0.87 113.70 121.91 1tqx s SER 120 Ca -0.02 -0.66 0.02 0.00 0.70 0.00 0.00 55.95 55.98 1tqx s SER 120 Cb -0.06 -0.62 0.01 0.00 -1.71 0.00 0.00 66.02 63.64 1tqx s SER 120 CO -0.00 0.10 -0.07 0.27 1.20 0.00 0.00 173.24 174.74 1tqx s ILE 121 N -1.78 0.62 0.79 6.45 -4.36 -0.91 -1.78 121.20 120.22 1tqx s ILE 121 Ca 0.25 -0.25 -0.11 0.00 -0.26 0.00 0.00 60.65 60.28 1tqx s ILE 121 Cb -0.08 -0.58 0.06 0.00 1.25 0.00 0.00 42.46 43.11 1tqx s ILE 121 CO 0.14 0.21 1.09 -0.54 0.24 0.00 0.00 174.94 176.08 1tqx s LYS 122 N 0.37 2.16 0.27 0.37 1.02 -1.26 -2.51 119.74 120.17 1tqx s LYS 122 Ca -0.05 0.75 -0.00 0.00 0.02 0.00 0.00 55.97 56.68 1tqx s LYS 122 Cb -0.09 -1.92 0.62 0.00 -0.52 0.00 0.00 37.83 35.92 1tqx s LYS 122 CO 0.00 -1.59 1.67 -1.35 -0.92 0.00 0.00 175.35 173.16 1tqx h PRO 123 N -1.07 0.25 0.00 -1.68 0.11 -1.82 -1.38 132.00 126.41 1tqx h PRO 123 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1tqx h PRO 123 Cb 1.26 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1tqx h PRO 123 CO 0.58 0.17 0.00 1.63 -0.21 0.00 0.00 178.00 180.16 1tqx n LYS 124 N -5.18 0.91 -3.39 1.05 5.02 -1.26 -4.83 118.16 110.49 1tqx n LYS 124 Ca 0.19 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 56.10 1tqx n LYS 124 Cb 0.59 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.04 1tqx n LYS 124 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1tqx s THR 125 N -2.09 5.00 -0.02 -0.18 2.01 -0.52 -5.05 115.64 114.79 1tqx s THR 125 Ca 0.45 0.97 -0.30 0.00 0.31 0.00 0.00 61.69 63.12 1tqx s THR 125 Cb 0.22 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.90 1tqx s THR 125 CO 0.38 0.50 1.17 -0.62 -0.69 0.00 0.00 174.62 175.36 1tqx s ASP 126 N -0.60 7.10 0.34 3.53 3.68 -1.26 -4.84 116.67 124.62 1tqx s ASP 126 Ca 0.26 1.85 0.03 0.00 2.13 0.00 0.00 52.55 56.82 1tqx s ASP 126 Cb -0.17 -2.57 0.62 0.00 -1.45 0.00 0.00 42.92 39.36 1tqx s ASP 126 CO 0.14 -0.52 1.94 0.58 0.13 0.00 0.00 175.17 177.45 1tqx h VAL 127 N 4.85 1.17 0.00 1.11 2.07 -1.96 -2.60 116.25 120.88 1tqx h VAL 127 Ca -0.37 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1tqx h VAL 127 Cb 1.18 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1tqx h VAL 127 CO 0.85 0.21 0.00 1.56 0.02 0.00 0.00 177.57 180.21 1tqx h GLN 128 N 0.68 0.00 0.00 1.57 4.20 -1.99 -0.77 115.11 118.81 1tqx h GLN 128 Ca 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 1tqx h GLN 128 Cb 0.11 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 1tqx h GLN 128 CO -0.02 0.00 -0.02 0.87 -0.67 0.00 0.00 178.83 178.99 1tqx h LYS 129 N 0.00 0.00 0.00 1.46 1.57 -1.88 -2.86 116.57 114.86 1tqx h LYS 129 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1tqx h LYS 129 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1tqx h LYS 129 CO 0.00 0.02 -0.06 -0.07 -0.57 0.00 0.00 179.45 178.77 1tqx h LEU 130 N 0.00 0.00 -0.81 2.94 3.38 -1.32 -3.38 115.31 116.12 1tqx h LEU 130 Ca -0.00 -0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.15 1tqx h LEU 130 Cb 0.55 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.15 1tqx h LEU 130 CO 0.00 0.00 -0.11 0.58 0.09 0.00 0.00 178.44 179.00 1tqx h VAL 131 N 0.00 0.22 -0.43 1.22 2.07 -1.62 0.16 116.25 117.86 1tqx h VAL 131 Ca 0.00 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1tqx h VAL 131 Cb 1.00 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 1tqx h VAL 131 CO 0.00 0.01 0.29 -0.65 0.02 0.00 0.00 177.57 177.23 1tqx h PRO 132 N 0.03 0.53 0.04 1.57 0.11 -1.82 -1.52 132.00 130.95 1tqx h PRO 132 Ca 0.42 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.34 1tqx h PRO 132 Cb 0.70 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.71 1tqx h PRO 132 CO -0.79 0.35 -0.65 0.82 -0.21 0.00 0.00 178.00 177.52 1tqx h ILE 133 N 0.55 1.45 0.00 4.15 2.04 -1.06 -3.31 117.51 121.33 1tqx h ILE 133 Ca 0.17 -2.20 -0.03 0.00 1.00 0.00 0.00 64.86 63.80 1tqx h ILE 133 Cb -0.00 2.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.84 1tqx h ILE 133 CO -0.04 0.63 -0.14 -0.07 0.00 0.00 0.00 178.15 178.54 1tqx h LEU 134 N -0.19 0.00 -0.31 1.44 3.38 -0.67 -2.48 115.31 116.48 1tqx h LEU 134 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1tqx h LEU 134 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1tqx h LEU 134 CO 0.13 0.14 0.00 0.47 0.09 0.00 0.00 178.44 179.26 1tqx n ASP 135 N -3.81 0.45 0.08 -0.43 8.00 -0.60 -2.61 116.55 117.63 1tqx n ASP 135 Ca -0.02 0.59 0.13 0.00 0.71 0.00 0.00 54.79 56.20 1tqx n ASP 135 Cb 0.24 -0.69 0.46 0.00 -0.02 0.00 0.00 41.12 41.11 1tqx n ASP 135 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1tqx n THR 136 N -1.97 0.49 -1.62 -3.53 -2.24 -0.93 -4.92 114.28 99.57 1tqx n THR 136 Ca 0.04 -0.16 -0.16 0.00 -2.27 0.00 0.00 64.05 61.50 1tqx n THR 136 Cb 0.26 -0.63 -0.06 0.00 -2.10 0.00 0.00 70.33 67.81 1tqx n THR 136 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1tqx n ASN 137 N -2.06 -4.85 0.06 3.42 3.02 -1.07 -4.86 115.26 108.92 1tqx n ASN 137 Ca 0.06 0.31 0.11 0.00 -0.03 0.00 0.00 54.58 55.03 1tqx n ASN 137 Cb 0.38 -3.77 -0.03 0.00 -0.61 0.00 0.00 39.78 35.75 1tqx n ASN 137 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1tqx n LEU 138 N -1.87 0.62 -4.65 3.41 4.77 -1.26 -4.86 117.00 113.15 1tqx n LEU 138 Ca -0.16 0.20 -0.40 0.00 -0.03 0.00 0.00 56.01 55.61 1tqx n LEU 138 Cb 0.54 -0.06 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 1tqx n LEU 138 CO 0.23 -0.10 0.40 -0.63 -1.33 0.00 0.00 177.39 175.96 1tqx s ILE 139 N -3.36 5.00 -0.03 -0.08 -1.09 -1.26 -4.54 121.20 115.84 1tqx s ILE 139 Ca -0.01 1.20 -0.01 0.00 -2.23 0.00 0.00 60.65 59.60 1tqx s ILE 139 Cb 0.11 -3.95 -0.26 0.00 -1.58 0.00 0.00 42.46 36.78 1tqx s ILE 139 CO 0.82 0.08 0.74 0.78 -1.23 0.00 0.00 174.94 176.12 1tqx h ASN 140 N 7.61 0.32 -4.73 3.58 2.35 -0.77 -3.47 115.58 120.47 1tqx h ASN 140 Ca -0.30 -0.51 -0.17 0.00 -0.55 0.00 0.00 56.30 54.77 1tqx h ASN 140 Cb 1.13 -0.10 -0.22 0.00 0.05 0.00 0.00 38.32 39.18 1tqx h ASN 140 CO 0.78 1.44 -0.62 -0.89 -1.65 0.00 0.00 177.43 176.48 1tqx s THR 141 N -2.60 0.08 -0.21 2.81 2.01 -1.03 -2.35 115.64 114.34 1tqx s THR 141 Ca -0.10 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.26 1tqx s THR 141 Cb 0.07 -0.28 0.04 0.00 0.01 0.00 0.00 72.50 72.34 1tqx s THR 141 CO 0.83 -0.36 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.56 1tqx s VAL 142 N -1.13 2.03 -0.48 3.82 1.01 -0.57 -1.50 120.40 123.59 1tqx s VAL 142 Ca -0.12 -1.19 -0.20 0.00 0.00 0.00 0.00 61.98 60.47 1tqx s VAL 142 Cb -0.07 -1.98 0.04 0.00 0.00 0.00 0.00 36.38 34.37 1tqx s VAL 142 CO 0.00 0.29 0.66 -0.22 0.00 0.00 0.00 175.10 175.83 1tqx s LEU 143 N 1.24 4.67 -0.53 3.92 0.20 -0.05 -1.50 118.68 126.64 1tqx s LEU 143 Ca -0.01 -0.60 -0.21 0.00 0.69 0.00 0.00 54.13 54.00 1tqx s LEU 143 Cb -0.16 -2.60 0.05 0.00 -0.43 0.00 0.00 46.19 43.05 1tqx s LEU 143 CO -0.09 -0.87 0.75 -0.69 -0.29 0.00 0.00 176.35 175.16 1tqx s VAL 144 N 2.83 4.69 0.20 1.68 1.01 0.11 -2.13 120.40 128.79 1tqx s VAL 144 Ca 0.20 -0.23 -0.31 0.00 0.00 0.00 0.00 61.98 61.63 1tqx s VAL 144 Cb -0.16 -4.40 -0.11 0.00 0.00 0.00 0.00 36.38 31.71 1tqx s VAL 144 CO 0.16 -0.94 1.58 -0.04 0.00 0.00 0.00 175.10 175.86 1tqx s MET 145 N 3.13 4.20 -0.19 2.72 -1.94 -1.04 -3.14 119.30 123.03 1tqx s MET 145 Ca 0.20 2.42 0.16 0.00 -1.71 0.00 0.00 55.69 56.77 1tqx s MET 145 Cb -0.17 -3.12 0.56 0.00 2.01 0.00 0.00 34.83 34.11 1tqx s MET 145 CO 0.14 -0.61 1.46 0.25 -0.01 0.00 0.00 175.02 176.25 1tqx n THR 146 N 3.52 2.35 -3.50 2.05 -2.24 -0.24 -4.40 114.28 111.82 1tqx n THR 146 Ca 0.12 -1.85 -0.09 0.00 -2.27 0.00 0.00 64.05 59.96 1tqx n THR 146 Cb 0.38 -0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 68.33 1tqx n THR 146 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1tqx s VAL 147 N -2.84 0.00 -0.19 2.28 0.11 -1.25 -1.38 120.40 117.13 1tqx s VAL 147 Ca 0.44 -0.07 -0.29 0.00 -2.93 0.00 0.00 61.98 59.13 1tqx s VAL 147 Cb 0.35 -1.09 -0.03 0.00 -1.53 0.00 0.00 36.38 34.09 1tqx s VAL 147 CO 0.09 0.00 1.55 -1.61 -3.33 0.00 0.00 175.10 171.80 1tqx s GLU 148 N -3.33 3.93 0.49 1.54 0.41 -1.26 -4.61 118.70 115.87 1tqx s GLU 148 Ca 0.04 1.72 -0.22 0.00 -0.41 0.00 0.00 54.97 56.10 1tqx s GLU 148 Cb -0.01 -3.98 -0.08 0.00 -1.78 0.00 0.00 34.13 28.28 1tqx s GLU 148 CO -0.09 -1.13 1.12 -0.35 -0.49 0.00 0.00 175.26 174.32 1tqx n PRO 149 N 7.40 1.42 0.00 0.39 -0.04 -1.26 -4.34 135.00 138.57 1tqx n PRO 149 Ca 0.18 0.52 0.00 0.00 -0.04 0.00 0.00 63.50 64.15 1tqx n PRO 149 Cb 0.45 -2.25 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1tqx n PRO 149 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1tqx n GLY 150 N 1.05 3.94 3.15 0.55 0.00 -1.26 -4.77 105.19 107.87 1tqx n GLY 150 Ca 0.10 -0.62 -0.10 0.00 0.00 0.00 0.00 46.02 45.39 1tqx n GLY 150 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tqx s PHE 151 N 0.00 0.84 0.63 1.61 0.40 -1.26 -4.76 117.98 115.44 1tqx s PHE 151 Ca 0.00 -0.89 0.07 0.00 -0.60 0.00 0.00 56.93 55.51 1tqx s PHE 151 Cb 0.00 -0.50 0.11 0.00 0.51 0.00 0.00 43.02 43.14 1tqx s PHE 151 CO 0.00 -0.16 0.87 0.41 0.70 0.00 0.00 175.22 177.04 1tqx n GLY 152 N 0.09 1.60 2.73 4.36 0.00 -1.26 -4.58 105.19 108.13 1tqx n GLY 152 Ca -0.13 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.71 1tqx n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tqx n GLY 153 N -2.33 0.86 3.92 -0.02 0.00 -1.26 -5.03 105.19 101.33 1tqx n GLY 153 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 1tqx n GLY 153 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tqx s GLN 154 N -0.01 2.90 0.07 1.61 -0.21 -1.26 -5.02 119.66 117.74 1tqx s GLN 154 Ca 0.00 -0.09 -0.26 0.00 0.02 0.00 0.00 55.36 55.03 1tqx s GLN 154 Cb 0.00 -2.31 -0.06 0.00 1.00 0.00 0.00 33.01 31.64 1tqx s GLN 154 CO 0.00 -0.67 0.80 -1.54 -2.12 0.00 0.00 175.29 171.76 1tqx s SER 155 N -4.31 7.28 0.21 5.90 1.04 -1.26 -3.64 113.70 118.93 1tqx s SER 155 Ca 0.54 1.53 -0.32 0.00 0.48 0.00 0.00 55.95 58.18 1tqx s SER 155 Cb -0.10 -2.49 -0.14 0.00 0.10 0.00 0.00 66.02 63.38 1tqx s SER 155 CO 0.44 0.02 1.43 0.33 0.98 0.00 0.00 173.24 176.44 1tqx n PHE 156 N 2.67 2.12 -3.20 5.02 7.35 -1.26 -4.79 117.46 125.37 1tqx n PHE 156 Ca -0.02 0.42 -0.45 0.00 -0.76 0.00 0.00 57.45 56.63 1tqx n PHE 156 Cb 0.50 -2.46 -0.04 0.00 0.35 0.00 0.00 39.48 37.82 1tqx n PHE 156 CO 0.00 0.00 0.00 -1.64 -0.76 0.00 0.00 176.76 174.36 1tqx s MET 157 N -0.09 3.14 0.53 -4.13 -1.94 -0.48 -4.91 119.30 111.42 1tqx s MET 157 Ca 0.71 -1.65 0.20 0.00 -1.71 0.00 0.00 55.69 53.25 1tqx s MET 157 Cb -0.68 -4.34 1.34 0.00 2.01 0.00 0.00 34.83 33.16 1tqx s MET 157 CO 0.47 -1.45 2.09 1.25 -0.01 0.00 0.00 175.02 177.37 1tqx h HIS 158 N 8.86 0.00 0.00 -0.03 2.76 -1.92 -1.54 115.15 123.28 1tqx h HIS 158 Ca -0.21 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.96 1tqx h HIS 158 Cb 1.08 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.04 1tqx h HIS 158 CO 0.85 0.00 0.00 -0.40 -1.30 0.00 0.00 177.93 177.08 1tqx n ASP 159 N -4.45 0.00 0.03 3.26 5.75 -1.26 -1.91 116.55 117.97 1tqx n ASP 159 Ca 0.02 0.12 0.12 0.00 -0.01 0.00 0.00 54.79 55.04 1tqx n ASP 159 Cb 0.30 -0.27 0.20 0.00 -1.03 0.00 0.00 41.12 40.32 1tqx n ASP 159 CO 0.00 0.00 0.00 0.23 -0.11 0.00 0.00 177.20 177.32 1tqx n MET 160 N -1.27 0.17 0.27 0.11 2.81 -0.58 -4.07 117.12 114.56 1tqx n MET 160 Ca 0.05 0.04 0.16 0.00 -1.81 0.00 0.00 57.70 56.14 1tqx n MET 160 Cb 0.07 -1.60 0.90 0.00 -0.71 0.00 0.00 33.22 31.89 1tqx n MET 160 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 1tqx h MET 161 N 0.00 0.00 -0.58 0.03 2.86 -1.57 -0.87 114.93 114.81 1tqx h MET 161 Ca 0.00 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1tqx h MET 161 Cb 0.64 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 1tqx h MET 161 CO 0.00 0.00 0.38 0.78 1.06 0.00 0.00 176.91 179.13 1tqx h GLY 162 N 0.00 0.81 1.00 8.32 0.00 -1.81 -1.74 103.07 109.65 1tqx h GLY 162 Ca 0.03 -0.30 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 1tqx h GLY 162 CO -0.00 0.30 -0.03 0.50 0.00 0.00 0.00 176.54 177.30 1tqx h LYS 163 N 0.78 0.84 -0.15 4.80 1.57 -1.44 -2.42 116.57 120.55 1tqx h LYS 163 Ca 0.21 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1tqx h LYS 163 Cb -0.09 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1tqx h LYS 163 CO -0.05 0.91 0.08 0.28 -0.57 0.00 0.00 179.45 180.11 1tqx h VAL 164 N 0.69 1.10 -0.87 0.50 2.07 -1.38 -1.98 116.25 116.38 1tqx h VAL 164 Ca 0.13 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.41 1tqx h VAL 164 Cb 0.55 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 1tqx h VAL 164 CO 0.03 0.09 0.56 0.28 0.02 0.00 0.00 177.57 178.55 1tqx h SER 165 N 0.14 0.93 0.10 0.57 0.02 -1.27 -0.89 113.55 113.15 1tqx h SER 165 Ca 0.05 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1tqx h SER 165 Cb 0.07 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 1tqx h SER 165 CO -0.01 0.64 -0.06 0.15 -1.14 0.00 0.00 176.83 176.42 1tqx h PHE 166 N 1.09 -0.14 -0.65 3.45 3.57 -1.17 -0.96 116.94 122.12 1tqx h PHE 166 Ca 0.35 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.82 1tqx h PHE 166 Cb 0.01 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1tqx h PHE 166 CO -0.02 -0.09 0.31 -0.07 -2.23 0.00 0.00 178.31 176.22 1tqx h LEU 167 N -0.15 0.84 -0.49 0.59 3.38 -1.07 -1.89 115.31 116.52 1tqx h LEU 167 Ca -0.01 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 1tqx h LEU 167 Cb 0.12 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1tqx h LEU 167 CO 0.02 0.74 -0.08 -0.09 0.09 0.00 0.00 178.44 179.11 1tqx h ARG 168 N 0.89 0.92 -0.52 1.13 9.65 -1.06 0.15 114.38 125.53 1tqx h ARG 168 Ca 0.22 -0.34 -0.10 0.00 -1.10 0.00 0.00 59.98 58.67 1tqx h ARG 168 Cb 0.11 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.61 1tqx h ARG 168 CO -0.03 0.99 -0.07 -0.22 2.80 0.00 0.00 179.97 183.44 1tqx h LYS 169 N 0.77 0.94 0.15 0.20 3.64 -1.07 -3.28 116.57 117.92 1tqx h LYS 169 Ca 0.13 -0.32 -0.31 0.00 -1.27 0.00 0.00 60.65 58.88 1tqx h LYS 169 Cb 0.63 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1tqx h LYS 169 CO 0.04 0.97 -1.53 -0.22 -2.27 0.00 0.00 179.45 176.45 1tqx h LYS 170 N 0.85 0.32 -4.54 1.90 3.64 -1.27 -3.43 116.57 114.04 1tqx h LYS 170 Ca 0.14 -0.54 -0.64 0.00 -1.27 0.00 0.00 60.65 58.34 1tqx h LYS 170 Cb 0.60 0.20 -0.38 0.00 -0.41 0.00 0.00 32.23 32.24 1tqx h LYS 170 CO 0.04 1.21 -0.77 0.71 -2.27 0.00 0.00 179.45 178.36 1tqx s TYR 171 N -2.61 2.92 0.19 1.91 1.51 0.51 -5.01 117.35 116.76 1tqx s TYR 171 Ca -0.10 -2.20 -0.05 0.00 -1.01 0.00 0.00 57.07 53.72 1tqx s TYR 171 Cb 0.06 -1.98 0.12 0.00 -0.11 0.00 0.00 41.96 40.05 1tqx s TYR 171 CO 0.87 -0.85 1.54 0.87 -1.11 0.00 0.00 175.55 176.87 1tqx h LYS 172 N 7.83 0.69 -0.53 -0.62 1.57 -1.81 -3.27 116.57 120.43 1tqx h LYS 172 Ca -0.15 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 1tqx h LYS 172 Cb 1.05 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.37 1tqx h LYS 172 CO 0.45 0.98 0.00 0.09 -0.57 0.00 0.00 179.45 180.40 1tqx n ASN 173 N -4.03 3.56 -4.71 0.86 3.02 -1.26 -4.92 115.26 107.78 1tqx n ASN 173 Ca -0.02 -1.99 -0.42 0.00 -0.03 0.00 0.00 54.58 52.12 1tqx n ASN 173 Cb 0.54 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 39.33 1tqx n ASN 173 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1tqx s LEU 174 N -1.28 4.40 -0.00 3.41 2.96 -1.23 -4.87 118.68 122.07 1tqx s LEU 174 Ca 0.43 1.70 -0.30 0.00 -0.22 0.00 0.00 54.13 55.73 1tqx s LEU 174 Cb 0.24 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.30 1tqx s LEU 174 CO 0.32 -0.21 1.27 0.20 -1.32 0.00 0.00 176.35 176.61 1tqx s ASN 175 N 0.75 6.99 -0.23 3.68 0.01 -0.99 -4.97 114.94 120.17 1tqx s ASN 175 Ca 0.51 1.97 -0.03 0.00 -0.71 0.00 0.00 52.86 54.60 1tqx s ASN 175 Cb -0.22 -2.56 0.01 0.00 0.41 0.00 0.00 41.25 38.89 1tqx s ASN 175 CO 0.28 -0.60 -0.06 -0.63 -1.51 0.00 0.00 177.10 174.58 1tqx s ILE 176 N 1.96 3.08 -0.10 0.60 1.01 -1.26 -1.50 121.20 124.98 1tqx s ILE 176 Ca 0.59 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 60.52 1tqx s ILE 176 Cb -0.28 -2.46 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 1tqx s ILE 176 CO 0.25 0.34 -0.12 -1.58 0.00 0.00 0.00 174.94 173.83 1tqx s GLN 177 N 1.41 3.05 0.06 2.79 0.74 -0.56 -1.58 119.66 125.58 1tqx s GLN 177 Ca 0.04 -0.67 0.05 0.00 0.05 0.00 0.00 55.36 54.83 1tqx s GLN 177 Cb -0.15 -2.56 -0.04 0.00 1.10 0.00 0.00 33.01 31.36 1tqx s GLN 177 CO -0.05 0.39 -0.05 0.14 -0.55 0.00 0.00 175.29 175.18 1tqx s VAL 178 N -0.12 3.71 -0.19 1.34 -7.23 -0.97 0.08 120.40 117.02 1tqx s VAL 178 Ca -0.01 -0.98 -0.05 0.00 -1.81 0.00 0.00 61.98 59.13 1tqx s VAL 178 Cb -0.14 -2.71 0.09 0.00 0.56 0.00 0.00 36.38 34.19 1tqx s VAL 178 CO 0.03 0.22 0.36 -0.62 -0.31 0.00 0.00 175.10 174.79 1tqx s ASP 179 N -1.95 0.08 0.00 4.85 3.68 -1.19 -2.05 116.67 120.09 1tqx s ASP 179 Ca 0.21 0.66 0.00 0.00 2.13 0.00 0.00 52.55 55.56 1tqx s ASP 179 Cb -0.11 1.09 0.00 0.00 -1.45 0.00 0.00 42.92 42.45 1tqx s ASP 179 CO 0.13 -0.25 0.00 0.61 0.13 0.00 0.00 175.17 175.79 1tqx n GLY 180 N 5.37 2.67 2.29 2.66 0.00 -1.26 -1.08 105.19 115.85 1tqx n GLY 180 Ca -0.07 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 1tqx n GLY 180 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tqx n GLY 181 N 0.00 1.10 3.71 -0.02 0.00 -1.24 -4.26 105.19 104.47 1tqx n GLY 181 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1tqx n GLY 181 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tqx s LEU 182 N -2.39 4.35 0.00 0.99 2.01 -1.26 -4.29 118.68 118.09 1tqx s LEU 182 Ca 0.00 1.88 0.01 0.00 0.01 0.00 0.00 54.13 56.03 1tqx s LEU 182 Cb 0.00 -3.57 -0.00 0.00 0.01 0.00 0.00 46.19 42.62 1tqx s LEU 182 CO 0.00 -0.44 0.15 -0.46 1.01 0.00 0.00 176.35 176.61 1tqx n ASN 183 N 4.19 -0.41 -0.11 2.29 2.04 -1.26 -4.48 115.26 117.52 1tqx n ASN 183 Ca 0.09 -1.82 -0.05 0.00 -0.44 0.00 0.00 54.58 52.35 1tqx n ASN 183 Cb 0.47 0.84 0.01 0.00 -2.53 0.00 0.00 39.78 38.58 1tqx n ASN 183 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 1tqx h ILE 184 N 1.42 0.68 0.29 1.53 2.04 -1.95 0.50 117.51 122.03 1tqx h ILE 184 Ca -0.10 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1tqx h ILE 184 Cb 0.48 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 1tqx h ILE 184 CO 0.14 0.01 -0.14 -0.33 0.00 0.00 0.00 178.15 177.83 1tqx h GLU 185 N 0.06 -0.38 0.00 2.37 5.08 -1.97 -2.75 114.58 116.98 1tqx h GLU 185 Ca 0.18 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1tqx h GLU 185 Cb 0.26 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1tqx h GLU 185 CO -0.33 -0.22 0.00 1.79 -1.00 0.00 0.00 179.01 179.25 1tqx h THR 186 N -0.45 0.00 -0.16 1.13 1.35 -1.84 -2.59 112.91 110.35 1tqx h THR 186 Ca -0.04 -0.46 -0.19 0.00 -0.55 0.00 0.00 66.41 65.17 1tqx h THR 186 Cb 0.34 1.38 0.01 0.00 -1.73 0.00 0.00 68.15 68.15 1tqx h THR 186 CO 0.07 0.00 -0.63 0.74 -0.25 0.00 0.00 175.52 175.44 1tqx h THR 187 N 0.00 1.31 -0.38 6.82 2.02 -0.75 -0.23 112.91 121.69 1tqx h THR 187 Ca 0.00 -1.87 0.00 0.00 0.77 0.00 0.00 66.41 65.32 1tqx h THR 187 Cb 0.52 2.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 1tqx h THR 187 CO 0.00 0.58 0.25 -0.08 0.37 0.00 0.00 175.52 176.64 1tqx h GLU 188 N 0.40 0.51 0.01 6.66 4.57 -1.20 0.16 114.58 125.69 1tqx h GLU 188 Ca -0.03 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1tqx h GLU 188 Cb 1.26 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.74 1tqx h GLU 188 CO 0.13 0.34 -0.01 0.82 -1.18 0.00 0.00 179.01 179.12 1tqx h ILE 189 N 0.52 0.97 -0.82 2.32 2.04 -1.41 -1.35 117.51 119.78 1tqx h ILE 189 Ca 0.14 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 1tqx h ILE 189 Cb -0.05 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 36.96 1tqx h ILE 189 CO -0.03 0.00 0.43 0.28 0.00 0.00 0.00 178.15 178.83 1tqx h SER 190 N -0.02 1.04 -0.62 1.72 0.02 -0.72 -2.81 113.55 112.16 1tqx h SER 190 Ca 0.00 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 60.80 1tqx h SER 190 Cb 0.02 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 1tqx h SER 190 CO -0.01 0.85 0.22 0.00 -1.14 0.00 0.00 176.83 176.76 1tqx h ALA 191 N 1.23 0.81 0.00 3.77 0.00 -0.48 -2.18 119.26 122.41 1tqx h ALA 191 Ca 0.29 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1tqx h ALA 191 Cb 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1tqx h ALA 191 CO -0.04 0.46 0.00 0.66 0.00 0.00 0.00 179.25 180.32 1tqx h SER 192 N 0.88 0.00 0.18 0.00 4.64 -0.98 -0.89 113.55 117.37 1tqx h SER 192 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1tqx h SER 192 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1tqx h SER 192 CO -0.01 0.00 -0.81 1.41 -0.87 0.00 0.00 176.83 176.55 1tqx n HIS 193 N -2.77 0.00 0.00 4.77 8.25 -0.87 -4.97 115.22 119.63 1tqx n HIS 193 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1tqx n HIS 193 Cb 0.11 -0.09 0.00 0.00 1.12 0.00 0.00 29.99 31.13 1tqx n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1tqx n GLY 194 N 1.50 1.13 3.77 -1.41 0.00 -0.34 -3.06 105.19 106.77 1tqx n GLY 194 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 1tqx n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tqx s ALA 195 N -1.21 3.47 0.00 4.61 0.00 -0.92 -4.71 121.76 123.01 1tqx s ALA 195 Ca 0.00 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1tqx s ALA 195 Cb 0.00 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1tqx s ALA 195 CO 0.00 -0.65 0.05 0.27 0.00 0.00 0.00 175.76 175.43 1tqx n ASN 196 N 0.73 0.10 -4.09 0.00 6.94 -0.61 -4.37 115.26 113.96 1tqx n ASN 196 Ca 0.00 -0.48 -0.31 0.00 -0.02 0.00 0.00 54.58 53.77 1tqx n ASN 196 Cb 0.42 0.70 -0.16 0.00 -2.36 0.00 0.00 39.78 38.38 1tqx n ASN 196 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1tqx s ILE 197 N -0.70 1.83 -0.24 1.53 1.01 -0.92 -0.97 121.20 122.73 1tqx s ILE 197 Ca 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 60.65 59.80 1tqx s ILE 197 Cb 0.00 -1.66 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 1tqx s ILE 197 CO 0.00 0.50 -0.01 -0.63 0.00 0.00 0.00 174.94 174.81 1tqx s ILE 198 N 1.23 3.58 -0.25 2.92 -1.09 0.25 -2.29 121.20 125.55 1tqx s ILE 198 Ca 0.01 -0.52 -0.10 0.00 -2.23 0.00 0.00 60.65 57.82 1tqx s ILE 198 Cb -0.14 -2.69 -0.04 0.00 -1.58 0.00 0.00 42.46 38.01 1tqx s ILE 198 CO -0.09 0.33 0.14 -0.69 -1.23 0.00 0.00 174.94 173.40 1tqx s VAL 199 N 1.49 5.04 -0.00 2.92 1.01 -0.87 -0.17 120.40 129.82 1tqx s VAL 199 Ca 0.05 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1tqx s VAL 199 Cb -0.15 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.87 1tqx s VAL 199 CO -0.01 0.33 -0.00 0.00 0.00 0.00 0.00 175.10 175.41 1tqx s ALA 200 N 1.30 0.06 0.00 5.51 0.00 -1.22 -4.25 121.76 123.17 1tqx s ALA 200 Ca 0.06 0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1tqx s ALA 200 Cb -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1tqx s ALA 200 CO 0.06 -0.00 0.00 0.41 0.00 0.00 0.00 175.76 176.23 1tqx n GLY 201 N 3.20 0.01 0.27 0.00 0.00 -1.26 -0.93 105.19 106.48 1tqx n GLY 201 Ca -0.14 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.90 1tqx n GLY 201 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1tqx h THR 202 N 0.00 0.80 0.00 2.61 2.02 -1.88 -0.92 112.91 115.54 1tqx h THR 202 Ca 0.00 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 66.99 1tqx h THR 202 Cb 0.00 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1tqx h THR 202 CO 0.00 0.10 -0.01 0.77 0.37 0.00 0.00 175.52 176.75 1tqx h SER 203 N 0.56 0.00 0.00 4.18 4.64 -1.89 -1.89 113.55 119.14 1tqx h SER 203 Ca 0.36 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.50 1tqx h SER 203 Cb 0.43 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.49 1tqx h SER 203 CO -0.30 0.01 -1.55 -0.38 -0.87 0.00 0.00 176.83 173.74 1tqx n ILE 204 N -3.37 1.40 0.29 0.95 5.41 -0.81 -4.08 119.36 119.15 1tqx n ILE 204 Ca -0.03 -0.06 0.17 0.00 1.00 0.00 0.00 62.75 63.84 1tqx n ILE 204 Cb 0.09 -2.05 0.85 0.00 -0.71 0.00 0.00 39.64 37.82 1tqx n ILE 204 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 176.55 176.29 1tqx h PHE 205 N -0.86 0.00 -0.34 1.39 -1.00 -1.25 -2.58 116.94 112.31 1tqx h PHE 205 Ca -0.28 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.50 1tqx h PHE 205 Cb 1.17 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.73 1tqx h PHE 205 CO -0.23 0.04 0.00 0.09 -1.61 0.00 0.00 178.31 176.60 1tqx n ASN 206 N -3.26 3.00 -4.81 2.17 3.02 -0.71 -4.98 115.26 109.69 1tqx n ASN 206 Ca -0.01 -1.89 -0.34 0.00 -0.03 0.00 0.00 54.58 52.31 1tqx n ASN 206 Cb 0.22 -0.22 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1tqx n ASN 206 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1tqx s ALA 207 N -1.12 3.02 0.33 5.41 0.00 -0.97 -4.95 121.76 123.48 1tqx s ALA 207 Ca 0.29 0.50 0.15 0.00 0.00 0.00 0.00 51.96 52.89 1tqx s ALA 207 Cb 0.16 -3.19 0.72 0.00 0.00 0.00 0.00 23.12 20.81 1tqx s ALA 207 CO 0.22 -0.01 1.80 0.93 0.00 0.00 0.00 175.76 178.70 1tqx h GLU 208 N 2.02 0.00 -2.59 0.00 3.07 -1.93 -3.36 114.58 111.79 1tqx h GLU 208 Ca -0.49 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 57.78 1tqx h GLU 208 Cb 1.20 0.00 -0.39 0.00 -0.84 0.00 0.00 28.75 28.72 1tqx h GLU 208 CO 0.61 0.39 -0.86 0.34 -1.40 0.00 0.00 179.01 178.08 1tqx s ASP 209 N -6.77 2.57 0.27 1.42 2.15 -1.26 -5.01 116.67 110.05 1tqx s ASP 209 Ca -0.02 -2.74 0.00 0.00 0.43 0.00 0.00 52.55 50.22 1tqx s ASP 209 Cb 0.13 -0.60 0.52 0.00 -0.30 0.00 0.00 42.92 42.67 1tqx s ASP 209 CO 0.71 -0.23 1.83 -0.65 -0.17 0.00 0.00 175.17 176.66 1tqx h PRO 210 N 6.28 0.91 -0.45 4.34 0.11 -1.79 -2.55 132.00 138.86 1tqx h PRO 210 Ca 0.14 -0.05 0.07 0.00 0.11 0.00 0.00 66.00 66.27 1tqx h PRO 210 Cb 0.92 -0.21 -0.06 0.00 0.11 0.00 0.00 31.00 31.77 1tqx h PRO 210 CO 0.38 0.60 0.09 -0.22 -0.21 0.00 0.00 178.00 178.64 1tqx h LYS 211 N 0.94 0.22 -0.32 1.05 1.63 -1.93 0.18 116.57 118.34 1tqx h LYS 211 Ca 0.48 -0.01 0.02 0.00 -0.85 0.00 0.00 60.65 60.28 1tqx h LYS 211 Cb 0.47 -0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 1tqx h LYS 211 CO -0.27 0.14 0.17 -0.92 -3.45 0.00 0.00 179.45 175.13 1tqx h TYR 212 N 0.22 0.32 -0.04 1.91 3.20 -1.88 0.61 116.97 121.32 1tqx h TYR 212 Ca 0.22 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1tqx h TYR 212 Cb 0.28 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 1tqx h TYR 212 CO -0.21 0.19 0.03 0.28 -1.64 0.00 0.00 178.16 176.80 1tqx h VAL 213 N 0.36 1.02 -0.04 1.81 2.07 -1.28 0.44 116.25 120.63 1tqx h VAL 213 Ca 0.13 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.63 1tqx h VAL 213 Cb 0.02 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 1tqx h VAL 213 CO -0.07 0.02 -0.10 0.40 0.02 0.00 0.00 177.57 177.83 1tqx h ILE 214 N 0.05 0.74 -0.74 4.57 2.04 -0.73 -1.36 117.51 122.08 1tqx h ILE 214 Ca 0.02 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 1tqx h ILE 214 Cb 0.00 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1tqx h ILE 214 CO -0.00 0.00 0.29 0.44 0.00 0.00 0.00 178.15 178.87 1tqx h ASP 215 N -0.15 1.03 -0.45 1.72 3.32 -0.74 -1.52 116.42 119.63 1tqx h ASP 215 Ca 0.05 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 56.86 1tqx h ASP 215 Cb 0.22 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 1tqx h ASP 215 CO -0.13 0.93 0.05 0.74 -1.72 0.00 0.00 179.24 179.12 1tqx h THR 216 N 1.07 1.24 -0.03 0.35 2.02 -0.71 -1.44 112.91 115.42 1tqx h THR 216 Ca 0.25 -0.94 -0.00 0.00 0.77 0.00 0.00 66.41 66.49 1tqx h THR 216 Cb 0.23 0.79 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1tqx h THR 216 CO -0.02 0.34 -0.00 0.24 0.37 0.00 0.00 175.52 176.45 1tqx h MET 217 N 0.78 0.05 -0.65 6.66 2.86 -1.00 -2.69 114.93 120.94 1tqx h MET 217 Ca 0.16 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.83 1tqx h MET 217 Cb 0.39 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.00 1tqx h MET 217 CO 0.01 0.35 0.38 -0.09 1.06 0.00 0.00 176.91 178.62 1tqx h ARG 218 N -0.27 0.71 -0.42 1.72 2.43 -1.09 -2.19 114.38 115.26 1tqx h ARG 218 Ca 0.01 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.17 1tqx h ARG 218 Cb 0.33 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 1tqx h ARG 218 CO 0.00 0.47 0.21 0.28 -1.51 0.00 0.00 179.97 179.42 1tqx h VAL 219 N 0.73 0.96 0.00 0.20 2.07 -1.24 0.17 116.25 119.14 1tqx h VAL 219 Ca 0.28 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.64 1tqx h VAL 219 Cb 0.11 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1tqx h VAL 219 CO -0.14 0.08 -0.07 0.77 0.02 0.00 0.00 177.57 178.22 1tqx h SER 220 N 0.42 0.00 0.17 0.57 4.64 -1.08 -1.40 113.55 116.87 1tqx h SER 220 Ca 0.18 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.27 1tqx h SER 220 Cb 0.10 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.21 1tqx h SER 220 CO -0.13 0.07 -1.03 0.58 -0.87 0.00 0.00 176.83 175.45 1tqx h VAL 221 N 0.00 1.41 0.00 0.95 2.07 -0.70 -3.29 116.25 116.69 1tqx h VAL 221 Ca -0.00 -2.56 -0.00 0.00 0.82 0.00 0.00 66.70 64.96 1tqx h VAL 221 Cb 0.14 3.12 -0.00 0.00 -1.52 0.00 0.00 31.29 33.03 1tqx h VAL 221 CO 0.01 0.74 -0.01 1.56 0.02 0.00 0.00 177.57 179.88 1tqx h GLN 222 N -0.25 0.00 0.00 1.57 4.20 -0.23 -1.34 115.11 119.06 1tqx h GLN 222 Ca -0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1tqx h GLN 222 Cb 1.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.56 1tqx h GLN 222 CO 0.17 0.01 0.00 0.87 -0.67 0.00 0.00 178.83 179.21 1tqx h LYS 223 N 0.00 0.00 -0.02 1.46 1.57 -1.34 -3.51 116.57 114.73 1tqx h LYS 223 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1tqx h LYS 223 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1tqx h LYS 223 CO 0.00 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.54