#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tql s GLU 2 N 0.00 0.15 -0.21 0.00 2.12 -0.42 -0.89 118.70 119.45 1tql s GLU 2 Ca 0.00 0.30 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 1tql s GLU 2 Cb 0.00 -0.03 0.00 0.00 0.26 0.00 0.00 34.13 34.36 1tql s GLU 2 CO 0.00 -0.09 1.11 0.42 -0.54 0.00 0.00 175.26 176.16 1tql s ILE 3 N 0.61 4.56 0.06 -3.70 1.01 -1.26 -0.30 121.20 122.18 1tql s ILE 3 Ca -0.04 1.88 -0.17 0.00 0.00 0.00 0.00 60.65 62.32 1tql s ILE 3 Cb -0.06 -4.22 -0.15 0.00 0.01 0.00 0.00 42.46 38.04 1tql s ILE 3 CO -0.03 -0.17 1.30 1.56 0.00 0.00 0.00 174.94 177.60 1tql h GLN 4 N 7.68 0.59 -2.71 2.79 1.08 -1.95 -3.48 115.11 119.11 1tql h GLN 4 Ca -0.21 -0.42 0.04 0.00 -1.45 0.00 0.00 58.65 56.61 1tql h GLN 4 Cb 1.07 0.07 -0.13 0.00 -0.05 0.00 0.00 27.48 28.44 1tql h GLN 4 CO 0.98 1.04 0.32 1.67 -0.95 0.00 0.00 178.83 181.89 1tql s TRP 5 N -3.90 -0.44 -0.12 2.96 1.48 -1.26 -5.12 118.94 112.53 1tql s TRP 5 Ca -0.12 0.24 -0.10 0.00 -1.06 0.00 0.00 56.10 55.06 1tql s TRP 5 Cb 0.07 0.56 0.04 0.00 -1.16 0.00 0.00 33.47 32.97 1tql s TRP 5 CO 0.83 -0.75 0.32 1.41 -4.06 0.00 0.00 176.95 174.70 1tql s MET 6 N -3.51 0.36 0.02 3.25 1.75 -1.26 -4.48 119.30 115.43 1tql s MET 6 Ca 0.03 0.48 -0.28 0.00 -1.25 0.00 0.00 55.69 54.67 1tql s MET 6 Cb -0.01 0.13 0.10 0.00 2.84 0.00 0.00 34.83 37.89 1tql s MET 6 CO -0.10 -0.07 0.95 -0.98 -0.65 0.00 0.00 175.02 174.17 1tql s ARG 7 N 0.39 0.86 -0.23 4.11 1.70 -0.63 -5.00 118.95 120.14 1tql s ARG 7 Ca -0.02 -0.37 -0.41 0.00 -0.47 0.00 0.00 55.73 54.46 1tql s ARG 7 Cb -0.04 0.36 -0.18 0.00 -0.57 0.00 0.00 34.95 34.53 1tql s ARG 7 CO -0.02 -0.38 1.55 -2.30 -1.08 0.00 0.00 175.30 173.07 1tql n PRO 8 N -0.30 0.70 -0.28 3.89 -0.02 -1.26 -1.21 135.00 136.52 1tql n PRO 8 Ca -0.07 0.26 0.13 0.00 -2.02 0.00 0.00 63.50 61.79 1tql n PRO 8 Cb 0.61 -1.86 0.38 0.00 -0.02 0.00 0.00 33.50 32.62 1tql n PRO 8 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1tql h SER 9 N 5.60 0.65 -0.76 2.55 0.02 -0.41 -1.00 113.55 120.19 1tql h SER 9 Ca -0.47 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 60.57 1tql h SER 9 Cb 1.35 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 63.76 1tql h SER 9 CO 0.89 0.31 0.47 0.07 -1.14 0.00 0.00 176.83 177.43 1tql h LYS 10 N 0.67 0.88 -1.00 3.45 2.10 -1.74 0.28 116.57 121.21 1tql h LYS 10 Ca 0.47 -0.05 0.22 0.00 -2.00 0.00 0.00 60.65 59.28 1tql h LYS 10 Cb 0.79 -0.20 -0.12 0.00 -0.90 0.00 0.00 32.23 31.81 1tql h LYS 10 CO -0.22 0.58 0.60 0.93 -2.00 0.00 0.00 179.45 179.34 1tql h GLU 11 N 0.91 0.65 -0.58 0.07 5.08 -1.52 -1.50 114.58 117.69 1tql h GLU 11 Ca 0.31 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1tql h GLU 11 Cb 0.06 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1tql h GLU 11 CO -0.13 0.43 0.00 1.33 -1.00 0.00 0.00 179.01 179.64 1tql n VAL 12 N -4.83 0.94 -0.92 3.13 0.24 -0.90 -4.98 118.33 111.01 1tql n VAL 12 Ca 0.25 -0.97 0.00 0.00 -2.04 0.00 0.00 64.34 61.58 1tql n VAL 12 Cb 0.66 0.55 0.00 0.00 -1.47 0.00 0.00 33.84 33.58 1tql n VAL 12 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tql n GLY 13 N 1.27 0.95 3.39 7.63 0.00 -0.56 -5.09 105.19 112.78 1tql n GLY 13 Ca 0.20 -0.53 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 1tql n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tql s TYR 14 N -2.00 2.59 0.58 1.61 1.51 0.89 -4.98 117.35 117.55 1tql s TYR 14 Ca 0.00 -0.37 -0.17 0.00 -1.01 0.00 0.00 57.07 55.51 1tql s TYR 14 Cb 0.00 -1.62 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 1tql s TYR 14 CO 0.00 0.02 1.10 -1.25 -1.11 0.00 0.00 175.55 174.31 1tql s PRO 15 N -0.48 3.23 0.34 -1.71 0.04 -1.26 -3.13 135.00 132.03 1tql s PRO 15 Ca 0.06 1.42 -0.27 0.00 0.04 0.00 0.00 61.00 62.25 1tql s PRO 15 Cb -0.12 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 1tql s PRO 15 CO 0.01 -0.91 1.12 0.42 0.04 0.00 0.00 177.00 177.69 1tql s ILE 16 N -2.12 3.38 -0.26 0.56 1.01 -1.26 -4.93 121.20 117.58 1tql s ILE 16 Ca 0.68 1.26 -0.07 0.00 0.00 0.00 0.00 60.65 62.52 1tql s ILE 16 Cb -0.20 -3.75 -0.01 0.00 0.01 0.00 0.00 42.46 38.51 1tql s ILE 16 CO 0.33 0.20 0.06 -0.63 0.00 0.00 0.00 174.94 174.89 1tql s ILE 17 N -1.33 4.08 -0.26 2.92 -1.09 0.35 -4.95 121.20 120.91 1tql s ILE 17 Ca 0.51 -0.37 -0.16 0.00 -2.23 0.00 0.00 60.65 58.40 1tql s ILE 17 Cb -0.30 -2.96 -0.03 0.00 -1.58 0.00 0.00 42.46 37.59 1tql s ILE 17 CO 0.39 0.27 0.43 0.20 -1.23 0.00 0.00 174.94 175.00 1tql s ASN 18 N 1.56 6.33 0.01 3.58 0.01 -1.26 -3.87 114.94 121.31 1tql s ASN 18 Ca 0.05 0.39 0.04 0.00 -0.71 0.00 0.00 52.86 52.64 1tql s ASN 18 Cb -0.16 -2.24 -0.03 0.00 0.41 0.00 0.00 41.25 39.23 1tql s ASN 18 CO 0.02 -0.22 -0.09 0.00 -1.51 0.00 0.00 177.10 175.30 1tql s ALA 19 N 2.15 2.92 0.94 0.60 0.00 -1.26 -5.10 121.76 122.02 1tql s ALA 19 Ca 0.18 -1.06 -0.14 0.00 0.00 0.00 0.00 51.96 50.93 1tql s ALA 19 Cb -0.16 -1.04 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 1tql s ALA 19 CO 0.10 0.61 0.00 -2.30 0.00 0.00 0.00 175.76 174.16 1tql n PRO 20 N 1.53 -0.15 0.00 0.00 -0.02 -1.26 -4.93 135.00 130.17 1tql n PRO 20 Ca -0.15 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 1tql n PRO 20 Cb 0.52 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 1tql n PRO 20 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1tql n SER 21 N 0.42 0.13 -4.29 2.55 3.41 -1.26 -4.94 113.62 109.64 1tql n SER 21 Ca 0.04 -0.49 -0.34 0.00 -0.26 0.00 0.00 58.87 57.82 1tql n SER 21 Cb 0.54 0.64 -0.15 0.00 -0.26 0.00 0.00 64.21 64.98 1tql n SER 21 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1tql s LYS 22 N -0.64 3.30 0.48 4.33 1.02 -1.26 -4.67 119.74 122.30 1tql s LYS 22 Ca 0.00 -0.69 -0.23 0.00 0.02 0.00 0.00 55.97 55.07 1tql s LYS 22 Cb 0.00 -2.77 -0.07 0.00 -0.52 0.00 0.00 37.83 34.47 1tql s LYS 22 CO 0.00 -0.04 1.28 -0.08 -0.92 0.00 0.00 175.35 175.59 1tql s THR 23 N 1.00 2.58 -2.38 2.17 -1.32 -1.26 -4.91 115.64 111.52 1tql s THR 23 Ca -0.01 0.46 0.28 0.00 -1.21 0.00 0.00 61.69 61.21 1tql s THR 23 Cb -0.15 -3.24 0.53 0.00 -1.51 0.00 0.00 72.50 68.13 1tql s THR 23 CO -0.02 0.02 1.74 0.29 -2.21 0.00 0.00 174.62 174.44 1tql n LYS 24 N -0.53 1.53 -3.14 7.08 5.02 -1.26 -4.87 118.16 121.99 1tql n LYS 24 Ca 0.07 -0.86 -0.33 0.00 -2.02 0.00 0.00 58.31 55.17 1tql n LYS 24 Cb 0.46 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.92 1tql n LYS 24 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1tql s LEU 25 N -2.07 4.14 -0.14 -0.35 1.43 -1.26 -4.18 118.68 116.26 1tql s LEU 25 Ca 0.37 1.30 -0.30 0.00 -1.03 0.00 0.00 54.13 54.46 1tql s LEU 25 Cb 0.21 -3.93 0.13 0.00 0.03 0.00 0.00 46.19 42.63 1tql s LEU 25 CO 0.36 -0.13 1.03 -1.83 0.23 0.00 0.00 176.35 176.00 1tql s GLU 26 N -2.70 0.57 0.24 1.70 -1.05 -1.09 -4.96 118.70 111.42 1tql s GLU 26 Ca 0.51 0.01 -0.29 0.00 -0.15 0.00 0.00 54.97 55.04 1tql s GLU 26 Cb -0.12 0.26 -0.15 0.00 -0.44 0.00 0.00 34.13 33.68 1tql s GLU 26 CO 0.18 -0.20 0.94 -2.30 0.95 0.00 0.00 175.26 174.83 1tql n PRO 27 N 0.41 0.99 -3.54 -4.83 -0.02 -1.26 -1.66 135.00 125.08 1tql n PRO 27 Ca -0.08 0.35 -0.22 0.00 -2.02 0.00 0.00 63.50 61.53 1tql n PRO 27 Cb 0.59 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1tql n PRO 27 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1tql s SER 28 N -0.52 4.92 0.61 2.55 1.04 -0.84 -4.69 113.70 116.77 1tql s SER 28 Ca 0.64 -0.95 0.21 0.00 0.48 0.00 0.00 55.95 56.32 1tql s SER 28 Cb -0.79 0.00 1.12 0.00 0.10 0.00 0.00 66.02 66.45 1tql s SER 28 CO 0.57 -0.99 1.61 0.00 0.98 0.00 0.00 173.24 175.41 1tql h ALA 29 N 0.71 1.47 -0.33 5.32 0.00 -1.90 0.35 119.26 124.88 1tql h ALA 29 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1tql h ALA 29 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1tql h ALA 29 CO 0.53 -0.47 0.00 1.19 0.00 0.00 0.00 179.25 180.50 1tql n PHE 30 N -2.67 0.68 -0.24 0.00 3.01 -1.26 -4.69 117.46 112.29 1tql n PHE 30 Ca -0.01 -0.64 0.03 0.00 1.01 0.00 0.00 57.45 57.84 1tql n PHE 30 Cb 0.52 -0.14 0.15 0.00 -0.01 0.00 0.00 39.48 40.00 1tql n PHE 30 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1tql h HIS 31 N 2.04 0.49 -0.10 1.38 2.76 -0.45 -2.28 115.15 119.00 1tql h HIS 31 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1tql h HIS 31 Cb 1.02 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.86 1tql h HIS 31 CO 0.35 0.11 0.00 0.66 -1.30 0.00 0.00 177.93 177.75 1tql n TYR 32 N -4.97 0.10 0.12 5.26 4.02 -1.26 -4.15 117.16 116.28 1tql n TYR 32 Ca 0.12 -0.05 0.06 0.00 -0.01 0.00 0.00 57.90 58.02 1tql n TYR 32 Cb 0.34 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.68 1tql n TYR 32 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1tql h VAL 33 N 4.49 0.39 -2.93 -0.72 2.07 -1.71 -3.47 116.25 114.37 1tql h VAL 33 Ca 0.00 -1.63 -0.44 0.00 0.82 0.00 0.00 66.70 65.46 1tql h VAL 33 Cb 0.96 2.02 -0.14 0.00 -1.52 0.00 0.00 31.29 32.60 1tql h VAL 33 CO 0.00 0.22 -0.71 -0.36 0.02 0.00 0.00 177.57 176.74 1tql s PHE 34 N -3.10 1.69 0.08 1.57 0.08 -1.17 -5.04 117.98 112.09 1tql s PHE 34 Ca 0.02 -0.65 -0.23 0.00 0.12 0.00 0.00 56.93 56.19 1tql s PHE 34 Cb 0.08 -0.85 -0.06 0.00 -0.57 0.00 0.00 43.02 41.62 1tql s PHE 34 CO 0.76 0.27 0.69 -1.21 -0.10 0.00 0.00 175.22 175.63 1tql s GLU 35 N -3.69 4.42 -0.18 0.44 2.02 -1.26 -4.91 118.70 115.54 1tql s GLU 35 Ca 0.24 0.95 -0.22 0.00 0.02 0.00 0.00 54.97 55.96 1tql s GLU 35 Cb 0.01 -3.30 0.06 0.00 0.10 0.00 0.00 34.13 31.00 1tql s GLU 35 CO 0.07 0.46 0.60 0.20 0.02 0.00 0.00 175.26 176.61 1tql s GLY 36 N -0.62 -0.45 0.00 -1.39 0.00 -1.26 -4.22 107.32 99.37 1tql s GLY 36 Ca 0.34 1.52 0.00 0.00 0.00 0.00 0.00 44.72 46.58 1tql s GLY 36 CO 0.22 1.26 0.00 3.33 0.00 0.00 0.00 173.10 177.91 1tql n VAL 37 N 2.28 0.00 -3.18 1.40 0.24 -1.26 -5.04 118.33 112.76 1tql n VAL 37 Ca -0.15 -0.47 -0.32 0.00 -2.04 0.00 0.00 64.34 61.36 1tql n VAL 37 Cb 0.56 0.97 -0.06 0.00 -1.47 0.00 0.00 33.84 33.84 1tql n VAL 37 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1tql s LYS 38 N -1.06 3.97 0.20 7.34 1.02 -1.26 -4.19 119.74 125.75 1tql s LYS 38 Ca 0.00 0.61 -0.06 0.00 0.02 0.00 0.00 55.97 56.54 1tql s LYS 38 Cb 0.00 -2.47 -0.02 0.00 -0.52 0.00 0.00 37.83 34.82 1tql s LYS 38 CO 0.00 0.18 0.25 -1.83 -0.92 0.00 0.00 175.35 173.03 1tql s GLU 39 N -2.95 1.26 0.33 1.68 -1.05 -0.35 -4.84 118.70 112.77 1tql s GLU 39 Ca 0.53 -1.42 -0.27 0.00 -0.15 0.00 0.00 54.97 53.66 1tql s GLU 39 Cb -0.10 0.34 -0.13 0.00 -0.44 0.00 0.00 34.13 33.80 1tql s GLU 39 CO 0.18 -0.45 1.08 -2.30 0.95 0.00 0.00 175.26 174.72 1tql n PRO 40 N -0.27 1.55 -1.32 -4.83 -0.02 -1.26 -0.21 135.00 128.64 1tql n PRO 40 Ca -0.02 0.55 -0.31 0.00 -2.02 0.00 0.00 63.50 61.70 1tql n PRO 40 Cb 0.64 -2.01 0.09 0.00 -0.02 0.00 0.00 33.50 32.20 1tql n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tql s ALA 41 N -1.12 2.18 0.06 3.55 0.00 -0.45 -4.74 121.76 121.23 1tql s ALA 41 Ca 0.59 0.13 -0.31 0.00 0.00 0.00 0.00 51.96 52.37 1tql s ALA 41 Cb -0.63 -3.23 -0.06 0.00 0.00 0.00 0.00 23.12 19.19 1tql s ALA 41 CO 0.60 -1.80 1.36 0.08 0.00 0.00 0.00 175.76 176.00 1tql s VAL 42 N -2.95 3.61 -0.70 0.00 1.01 -1.26 -4.91 120.40 115.20 1tql s VAL 42 Ca 0.61 1.10 0.11 0.00 0.00 0.00 0.00 61.98 63.79 1tql s VAL 42 Cb -0.17 -3.70 -0.07 0.00 0.00 0.00 0.00 36.38 32.44 1tql s VAL 42 CO 0.56 0.05 0.53 0.18 0.00 0.00 0.00 175.10 176.42 1tql n LEU 43 N 4.55 0.80 -3.97 3.92 4.32 -1.26 -4.76 117.00 120.61 1tql n LEU 43 Ca 0.12 -0.60 -0.10 0.00 -0.02 0.00 0.00 56.01 55.41 1tql n LEU 43 Cb 0.44 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.17 1tql n LEU 43 CO 0.58 0.17 0.07 0.42 -1.22 0.00 0.00 177.39 177.41 1tql s THR 44 N -1.78 0.03 0.32 -5.08 -4.23 -1.26 -4.85 115.64 98.79 1tql s THR 44 Ca 0.06 -1.37 0.13 0.00 -1.18 0.00 0.00 61.69 59.33 1tql s THR 44 Cb 0.08 -2.00 0.06 0.00 1.34 0.00 0.00 72.50 71.98 1tql s THR 44 CO 0.37 -0.14 1.74 0.11 -0.54 0.00 0.00 174.62 176.16 1tql h LYS 45 N 2.40 0.00 -2.08 3.99 6.56 -1.99 -3.28 116.57 122.17 1tql h LYS 45 Ca -0.30 0.00 -0.40 0.00 -1.06 0.00 0.00 60.65 58.89 1tql h LYS 45 Cb 1.24 0.00 -0.12 0.00 -0.57 0.00 0.00 32.23 32.78 1tql h LYS 45 CO 0.43 0.46 0.36 0.09 -2.06 0.00 0.00 179.45 178.73 1tql n ASN 46 N -3.91 6.19 -4.21 0.86 3.02 -1.26 -4.87 115.26 111.07 1tql n ASN 46 Ca -0.01 -2.90 -0.36 0.00 -0.03 0.00 0.00 54.58 51.28 1tql n ASN 46 Cb 0.49 -1.33 -0.13 0.00 -0.61 0.00 0.00 39.78 38.20 1tql n ASN 46 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1tql s ASP 47 N 1.06 4.91 0.43 6.41 -1.08 -1.24 -4.99 116.67 122.18 1tql s ASP 47 Ca 0.62 -1.13 0.35 0.00 -0.52 0.00 0.00 52.55 51.88 1tql s ASP 47 Cb 0.34 -1.75 1.41 0.00 -1.46 0.00 0.00 42.92 41.45 1tql s ASP 47 CO -0.12 -0.25 1.37 -2.65 0.52 0.00 0.00 175.17 174.04 1tql n PRO 48 N 4.69 -0.02 0.20 4.34 -0.02 -1.26 -0.15 135.00 142.79 1tql n PRO 48 Ca -0.14 1.04 0.12 0.00 -2.02 0.00 0.00 63.50 62.51 1tql n PRO 48 Cb 0.45 -2.19 0.22 0.00 -0.02 0.00 0.00 33.50 31.96 1tql n PRO 48 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tql h ARG 49 N 0.00 0.00 -6.73 -0.52 3.08 -1.94 -3.47 114.38 104.81 1tql h ARG 49 Ca 0.80 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 60.27 1tql h ARG 49 Cb 2.86 0.00 0.16 0.00 0.08 0.00 0.00 29.97 33.07 1tql h ARG 49 CO -0.24 0.00 0.04 1.28 -1.07 0.00 0.00 179.97 179.98 1tql n LEU 50 N -2.96 2.91 -2.23 3.04 4.77 0.79 -4.36 117.00 118.96 1tql n LEU 50 Ca 0.04 0.85 0.01 0.00 -0.03 0.00 0.00 56.01 56.87 1tql n LEU 50 Cb 0.51 -1.34 0.04 0.00 -2.33 0.00 0.00 43.42 40.29 1tql n LEU 50 CO 0.33 -1.98 0.11 0.29 -1.33 0.00 0.00 177.39 174.81 1tql n LYS 51 N -0.56 0.98 0.00 3.23 5.02 0.19 -5.01 118.16 122.01 1tql n LYS 51 Ca 0.12 -2.56 0.00 0.00 -2.02 0.00 0.00 58.31 53.86 1tql n LYS 51 Cb 0.45 -0.68 0.00 0.00 -0.02 0.00 0.00 35.03 34.78 1tql n LYS 51 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1tql n THR 52 N -0.30 0.00 -1.68 -0.18 5.66 -1.26 -4.89 114.28 111.63 1tql n THR 52 Ca 0.01 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.56 1tql n THR 52 Cb 0.92 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.66 1tql n THR 52 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1tql n ASP 53 N 0.00 3.67 0.25 1.09 -0.08 -1.26 -4.84 116.55 115.39 1tql n ASP 53 Ca 0.00 1.00 -0.10 0.00 -1.51 0.00 0.00 54.79 54.18 1tql n ASP 53 Cb 0.00 -1.47 -0.05 0.00 2.34 0.00 0.00 41.12 41.94 1tql n ASP 53 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 1tql h PHE 54 N 8.29 -0.59 -0.99 -0.67 3.57 -1.92 -1.98 116.94 122.64 1tql h PHE 54 Ca -0.47 -0.01 0.37 0.00 3.53 0.00 0.00 57.97 61.39 1tql h PHE 54 Cb 1.24 0.20 -0.17 0.00 2.79 0.00 0.00 35.95 40.01 1tql h PHE 54 CO 0.79 -0.37 0.47 0.93 -2.23 0.00 0.00 178.31 177.90 1tql h GLU 55 N -0.65 0.08 -0.39 1.11 4.39 -1.94 0.57 114.58 117.75 1tql h GLU 55 Ca -0.07 -0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.50 1tql h GLU 55 Cb 0.49 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 1tql h GLU 55 CO 0.11 0.05 -0.29 1.49 -1.16 0.00 0.00 179.01 179.21 1tql h GLU 56 N 0.08 0.85 -0.18 2.33 4.81 -1.91 -3.24 114.58 117.32 1tql h GLU 56 Ca 0.78 -0.39 -0.17 0.00 -0.13 0.00 0.00 59.36 59.45 1tql h GLU 56 Cb 1.94 -0.02 0.01 0.00 0.63 0.00 0.00 28.75 31.31 1tql h GLU 56 CO -0.75 1.03 -0.57 0.00 -0.73 0.00 0.00 179.01 177.99 1tql h ALA 57 N 0.95 0.31 0.00 2.92 0.00 0.90 -2.85 119.26 121.49 1tql h ALA 57 Ca 0.08 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1tql h ALA 57 Cb 0.84 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1tql h ALA 57 CO 0.07 0.54 0.00 -0.84 0.00 0.00 0.00 179.25 179.02 1tql h ILE 58 N 0.41 0.00 -0.20 0.00 3.07 -1.36 -2.10 117.51 117.34 1tql h ILE 58 Ca -0.02 -0.25 0.00 0.00 1.55 0.00 0.00 64.86 66.14 1tql h ILE 58 Cb 1.19 1.15 0.00 0.00 -0.27 0.00 0.00 36.82 38.90 1tql h ILE 58 CO 0.12 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.71 1tql n PHE 59 N -2.87 0.24 0.55 0.16 3.01 -1.21 -4.43 117.46 112.91 1tql n PHE 59 Ca -0.01 -0.17 0.07 0.00 1.01 0.00 0.00 57.45 58.35 1tql n PHE 59 Cb 0.19 -0.01 0.33 0.00 -0.01 0.00 0.00 39.48 39.98 1tql n PHE 59 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1tql n SER 60 N 0.97 0.00 0.16 4.37 3.41 -0.79 -2.47 113.62 119.27 1tql n SER 60 Ca 0.12 0.41 0.13 0.00 -0.26 0.00 0.00 58.87 59.27 1tql n SER 60 Cb 0.45 -0.45 0.53 0.00 -0.26 0.00 0.00 64.21 64.47 1tql n SER 60 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1tql h LYS 61 N 0.00 0.00 -5.40 4.33 2.10 -1.77 -3.40 116.57 112.42 1tql h LYS 61 Ca 0.00 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 58.01 1tql h LYS 61 Cb 0.23 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 31.42 1tql h LYS 61 CO 0.00 0.00 0.08 0.71 -2.00 0.00 0.00 179.45 178.24 1tql s TYR 62 N -3.38 3.16 -0.03 0.07 1.51 -1.03 -4.72 117.35 112.93 1tql s TYR 62 Ca 0.04 0.27 0.07 0.00 -1.01 0.00 0.00 57.07 56.44 1tql s TYR 62 Cb 0.09 -3.08 0.11 0.00 -0.11 0.00 0.00 41.96 38.97 1tql s TYR 62 CO 0.43 -0.61 1.05 1.33 -1.11 0.00 0.00 175.55 176.64 1tql n VAL 63 N 5.55 0.37 0.00 0.71 0.24 -0.97 -4.94 118.33 119.28 1tql n VAL 63 Ca -0.02 -0.58 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 1tql n VAL 63 Cb 0.49 0.42 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 1tql n VAL 63 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1tql n GLY 64 N -0.20 0.53 2.97 7.63 0.00 -0.07 -4.93 105.19 111.12 1tql n GLY 64 Ca 0.04 -2.10 -0.29 0.00 0.00 0.00 0.00 46.02 43.67 1tql n GLY 64 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1tql s ASN 65 N -0.02 2.87 0.52 1.61 0.01 -1.26 -2.03 114.94 116.63 1tql s ASN 65 Ca 0.00 -0.62 0.32 0.00 -0.71 0.00 0.00 52.86 51.85 1tql s ASN 65 Cb 0.00 -1.11 1.23 0.00 0.41 0.00 0.00 41.25 41.78 1tql s ASN 65 CO 0.00 -0.11 1.93 0.50 -1.51 0.00 0.00 177.10 177.90 1tql h LYS 66 N 8.06 0.00 -3.91 -0.60 3.64 -1.92 -3.45 116.57 118.38 1tql h LYS 66 Ca -0.31 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 58.96 1tql h LYS 66 Cb 1.12 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 32.78 1tql h LYS 66 CO 0.47 0.00 -0.50 0.96 -2.27 0.00 0.00 179.45 178.11 1tql s ILE 67 N -3.59 0.16 -0.43 2.00 -4.36 -1.26 -4.93 121.20 108.79 1tql s ILE 67 Ca 0.02 -1.30 0.08 0.00 -0.26 0.00 0.00 60.65 59.19 1tql s ILE 67 Cb 0.09 -1.22 0.35 0.00 1.25 0.00 0.00 42.46 42.93 1tql s ILE 67 CO 0.55 -0.72 1.15 0.35 0.24 0.00 0.00 174.94 176.51 1tql n THR 68 N 0.29 0.04 -3.55 8.37 -2.24 -1.26 -4.23 114.28 111.68 1tql n THR 68 Ca -0.16 -1.84 -0.01 0.00 -2.27 0.00 0.00 64.05 59.77 1tql n THR 68 Cb 0.61 1.15 -0.06 0.00 -2.10 0.00 0.00 70.33 69.93 1tql n THR 68 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1tql s GLU 69 N -0.16 0.34 -0.41 -0.78 2.56 -1.26 -4.89 118.70 114.10 1tql s GLU 69 Ca 0.24 0.67 -0.28 0.00 0.00 0.00 0.00 54.97 55.60 1tql s GLU 69 Cb 0.34 0.21 0.02 0.00 2.00 0.00 0.00 34.13 36.70 1tql s GLU 69 CO -0.06 -0.09 1.07 0.08 -0.56 0.00 0.00 175.26 175.70 1tql s VAL 70 N 1.75 4.38 0.52 3.70 1.01 -1.26 -4.91 120.40 125.59 1tql s VAL 70 Ca -0.07 1.35 -0.07 0.00 0.00 0.00 0.00 61.98 63.19 1tql s VAL 70 Cb -0.04 -4.49 0.12 0.00 0.00 0.00 0.00 36.38 31.96 1tql s VAL 70 CO -0.16 -0.75 0.71 -0.90 0.00 0.00 0.00 175.10 174.00 1tql n ASP 71 N 7.31 0.23 -0.29 3.32 5.68 -1.26 -4.85 116.55 126.71 1tql n ASP 71 Ca 0.11 -1.37 -0.03 0.00 -0.50 0.00 0.00 54.79 53.00 1tql n ASP 71 Cb 0.48 -0.52 0.09 0.00 -1.14 0.00 0.00 41.12 40.02 1tql n ASP 71 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1tql h GLU 72 N 0.00 0.99 0.06 0.11 4.11 -1.99 -1.88 114.58 115.97 1tql h GLU 72 Ca -0.23 -0.06 -0.00 0.00 0.07 0.00 0.00 59.36 59.14 1tql h GLU 72 Cb 0.68 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1tql h GLU 72 CO 0.18 0.65 -0.03 1.88 0.07 0.00 0.00 179.01 181.77 1tql h TYR 73 N 1.02 -0.07 -0.90 2.06 -1.99 -1.94 -2.01 116.97 113.14 1tql h TYR 73 Ca 0.31 -0.00 0.09 0.00 2.00 0.00 0.00 58.73 61.12 1tql h TYR 73 Cb -0.04 0.02 -0.06 0.00 2.00 0.00 0.00 36.73 38.65 1tql h TYR 73 CO -0.02 0.14 0.58 0.52 -0.00 0.00 0.00 178.16 179.38 1tql h MET 74 N -0.27 0.91 -0.46 4.88 2.86 -1.86 0.17 114.93 121.15 1tql h MET 74 Ca -0.01 -0.05 -0.11 0.00 -2.06 0.00 0.00 59.70 57.46 1tql h MET 74 Cb 0.24 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 1tql h MET 74 CO 0.01 0.60 -0.17 0.87 1.06 0.00 0.00 176.91 179.29 1tql h LYS 75 N 0.94 0.90 -0.30 1.72 1.57 -1.11 -0.00 116.57 120.29 1tql h LYS 75 Ca 0.41 -0.35 -0.17 0.00 -1.87 0.00 0.00 60.65 58.67 1tql h LYS 75 Cb 0.33 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1tql h LYS 75 CO -0.17 0.99 -0.49 1.49 -0.57 0.00 0.00 179.45 180.70 1tql h GLU 76 N 0.79 0.82 -0.39 3.15 4.81 -0.56 -2.01 114.58 121.19 1tql h GLU 76 Ca 0.12 -0.49 0.02 0.00 -0.13 0.00 0.00 59.36 58.88 1tql h GLU 76 Cb 0.70 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 1tql h GLU 76 CO 0.05 1.12 0.21 0.00 -0.73 0.00 0.00 179.01 179.67 1tql h ALA 77 N 0.79 0.49 -0.52 2.92 0.00 -0.49 -1.23 119.26 121.22 1tql h ALA 77 Ca 0.03 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.01 1tql h ALA 77 Cb 1.08 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.73 1tql h ALA 77 CO 0.11 -0.13 0.20 0.28 0.00 0.00 0.00 179.25 179.71 1tql h VAL 78 N 0.44 0.84 -0.51 0.00 2.07 -0.72 -1.79 116.25 116.57 1tql h VAL 78 Ca 0.16 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 1tql h VAL 78 Cb 0.04 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1tql h VAL 78 CO -0.09 0.07 0.21 0.44 0.02 0.00 0.00 177.57 178.22 1tql h ASP 79 N 0.39 0.70 -0.15 0.57 3.32 -0.83 -0.17 116.42 120.25 1tql h ASP 79 Ca 0.25 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 1tql h ASP 79 Cb 0.26 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 1tql h ASP 79 CO -0.24 0.67 0.04 -0.74 -1.72 0.00 0.00 179.24 177.24 1tql h HIS 80 N 0.68 0.26 -0.08 4.55 2.76 -0.88 0.17 115.15 122.60 1tql h HIS 80 Ca 0.17 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 1tql h HIS 80 Cb 0.18 -0.07 -0.00 0.00 1.55 0.00 0.00 27.41 29.07 1tql h HIS 80 CO 0.00 0.39 0.02 -0.92 -1.30 0.00 0.00 177.93 176.13 1tql h TYR 81 N 0.05 0.14 -0.95 5.26 3.20 -1.31 -1.01 116.97 122.34 1tql h TYR 81 Ca 0.05 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.02 1tql h TYR 81 Cb 0.26 -0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.41 1tql h TYR 81 CO 0.01 0.30 0.58 0.00 -1.64 0.00 0.00 178.16 177.41 1tql h ALA 82 N 0.82 1.41 -0.47 1.82 0.00 -1.02 -0.80 119.26 121.01 1tql h ALA 82 Ca 0.03 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1tql h ALA 82 Cb 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1tql h ALA 82 CO -0.00 0.19 0.28 0.78 0.00 0.00 0.00 179.25 180.50 1tql h GLY 83 N 0.93 0.69 0.89 0.00 0.00 -0.41 -1.60 103.07 103.57 1tql h GLY 83 Ca 0.47 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1tql h GLY 83 CO -0.26 0.28 -0.09 1.46 0.00 0.00 0.00 176.54 177.93 1tql h GLN 84 N 0.63 -0.19 -0.15 4.80 4.20 0.12 -2.75 115.11 121.77 1tql h GLN 84 Ca 0.17 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1tql h GLN 84 Cb -0.00 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 1tql h GLN 84 CO -0.03 -0.13 0.10 -0.07 -0.67 0.00 0.00 178.83 178.03 1tql h LEU 85 N -0.20 0.16 -1.51 1.46 3.38 -1.04 -2.25 115.31 115.32 1tql h LEU 85 Ca 0.01 -0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.10 1tql h LEU 85 Cb 0.19 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1tql h LEU 85 CO -0.03 0.12 0.50 -0.03 0.09 0.00 0.00 178.44 179.09 1tql h MET 86 N 0.19 0.49 0.00 1.13 4.05 -0.97 -0.75 114.93 119.06 1tql h MET 86 Ca 0.06 -0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1tql h MET 86 Cb -0.00 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.69 1tql h MET 86 CO -0.01 0.32 0.00 -1.13 0.23 0.00 0.00 176.91 176.32 1tql n SER 87 N -4.49 0.00 0.10 1.39 3.41 -0.85 -2.38 113.62 110.81 1tql n SER 87 Ca 0.14 0.43 0.04 0.00 -0.26 0.00 0.00 58.87 59.22 1tql n SER 87 Cb 0.47 -0.46 -0.01 0.00 -0.26 0.00 0.00 64.21 63.95 1tql n SER 87 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1tql h LEU 88 N 0.00 0.00 -0.63 1.04 3.38 -1.29 -3.48 115.31 114.33 1tql h LEU 88 Ca 0.00 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.76 1tql h LEU 88 Cb 0.20 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.02 1tql h LEU 88 CO 0.00 0.39 -0.35 0.47 0.09 0.00 0.00 178.44 179.03 1tql n ASP 89 N -2.98 -4.27 -4.64 -0.43 8.00 -1.00 -4.94 116.55 106.29 1tql n ASP 89 Ca -0.03 -0.26 -0.48 0.00 0.71 0.00 0.00 54.79 54.74 1tql n ASP 89 Cb 0.72 -2.92 -0.04 0.00 -0.02 0.00 0.00 41.12 38.86 1tql n ASP 89 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1tql n ILE 90 N -3.86 0.26 -1.87 0.53 5.41 -1.26 -4.86 119.36 113.72 1tql n ILE 90 Ca -0.01 -0.07 -0.42 0.00 1.00 0.00 0.00 62.75 63.25 1tql n ILE 90 Cb 0.54 -1.26 -0.03 0.00 -0.71 0.00 0.00 39.64 38.18 1tql n ILE 90 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1tql s ASN 91 N 0.59 6.31 0.00 4.38 3.84 -1.26 -4.85 114.94 123.95 1tql s ASN 91 Ca 0.78 2.13 0.20 0.00 0.21 0.00 0.00 52.86 56.18 1tql s ASN 91 Cb -0.76 -2.53 0.91 0.00 -0.55 0.00 0.00 41.25 38.32 1tql s ASN 91 CO 0.44 -1.24 1.62 0.35 -2.79 0.00 0.00 177.10 175.48 1tql n THR 92 N 6.16 0.11 -1.31 -5.21 -2.24 -1.26 -4.49 114.28 106.04 1tql n THR 92 Ca 0.21 -0.18 -0.31 0.00 -2.27 0.00 0.00 64.05 61.49 1tql n THR 92 Cb 0.43 0.07 0.08 0.00 -2.10 0.00 0.00 70.33 68.81 1tql n THR 92 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1tql s GLU 93 N -1.89 2.37 0.54 -0.78 2.02 -1.26 -4.91 118.70 114.79 1tql s GLU 93 Ca 0.30 1.14 -0.10 0.00 0.02 0.00 0.00 54.97 56.33 1tql s GLU 93 Cb 0.15 -1.91 -0.05 0.00 0.10 0.00 0.00 34.13 32.42 1tql s GLU 93 CO 0.24 -1.56 0.93 -1.14 0.02 0.00 0.00 175.26 173.75 1tql s GLN 94 N -4.92 3.65 0.00 1.61 0.74 -1.26 -4.58 119.66 114.90 1tql s GLN 94 Ca 0.61 0.59 0.00 0.00 0.05 0.00 0.00 55.36 56.61 1tql s GLN 94 Cb -0.17 -2.20 0.00 0.00 1.10 0.00 0.00 33.01 31.74 1tql s GLN 94 CO 0.56 -0.37 0.00 -0.12 -0.55 0.00 0.00 175.29 174.81 1tql n MET 95 N -2.31 1.90 -0.03 1.67 0.00 0.97 -4.97 117.12 114.35 1tql n MET 95 Ca 0.04 0.00 -0.11 0.00 -0.00 0.00 0.00 57.70 57.63 1tql n MET 95 Cb 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 33.22 33.62 1tql n MET 95 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 1tql n LEU 97 N 0.00 1.03 0.19 -0.89 7.94 -1.26 -4.52 117.00 119.49 1tql n LEU 97 Ca 0.00 0.31 -0.14 0.00 -1.11 0.00 0.00 56.01 55.07 1tql n LEU 97 Cb 0.00 0.02 -0.08 0.00 0.53 0.00 0.00 43.42 43.89 1tql n LEU 97 CO 0.00 0.48 0.56 -0.08 -1.11 0.00 0.00 177.39 177.24 1tql h GLU 98 N 0.01 -0.47 -0.25 1.96 4.81 -1.99 -1.96 114.58 116.69 1tql h GLU 98 Ca -0.35 0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 58.83 1tql h GLU 98 Cb 2.05 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 31.52 1tql h GLU 98 CO 0.07 -0.17 -0.18 -0.44 -0.73 0.00 0.00 179.01 177.55 1tql h ASP 99 N -0.78 0.43 0.46 1.04 3.32 -1.92 0.21 116.42 119.19 1tql h ASP 99 Ca -0.05 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1tql h ASP 99 Cb 0.52 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1tql h ASP 99 CO 0.08 0.63 0.00 0.00 -1.72 0.00 0.00 179.24 178.24 1tql h ALA 100 N 1.41 1.00 0.00 3.45 0.00 -1.82 0.01 119.26 123.30 1tql h ALA 100 Ca 0.07 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1tql h ALA 100 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1tql h ALA 100 CO 0.04 0.00 -1.39 -1.33 0.00 0.00 0.00 179.25 176.57 1tql n MET 101 N -2.78 0.54 -0.39 0.00 2.81 -0.55 -4.69 117.12 112.06 1tql n MET 101 Ca -0.01 0.24 0.11 0.00 -1.81 0.00 0.00 57.70 56.23 1tql n MET 101 Cb 0.17 -1.46 0.31 0.00 -0.71 0.00 0.00 33.22 31.53 1tql n MET 101 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1tql n TYR 102 N -4.41 1.01 -0.22 2.03 4.02 -0.05 -2.02 117.16 117.52 1tql n TYR 102 Ca -0.25 -0.52 0.03 0.00 -0.01 0.00 0.00 57.90 57.15 1tql n TYR 102 Cb 0.61 -0.05 -0.01 0.00 -0.02 0.00 0.00 39.34 39.86 1tql n TYR 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1tql n GLY 103 N 1.39 -2.57 0.00 2.72 0.00 -0.01 -4.12 105.19 102.61 1tql n GLY 103 Ca 0.23 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1tql n GLY 103 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1tql n THR 104 N -2.46 0.00 -2.15 2.61 5.66 -0.63 -4.66 114.28 112.65 1tql n THR 104 Ca -0.01 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.57 1tql n THR 104 Cb 0.10 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.85 1tql n THR 104 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1tql s ASP 105 N 0.38 6.80 0.00 1.09 2.15 -1.26 -2.33 116.67 123.50 1tql s ASP 105 Ca 0.00 2.30 0.00 0.00 0.43 0.00 0.00 52.55 55.28 1tql s ASP 105 Cb 0.00 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 1tql s ASP 105 CO 0.00 -0.71 0.00 0.61 -0.17 0.00 0.00 175.17 174.90 1tql n GLY 106 N 3.61 1.07 2.81 2.66 0.00 -1.26 -4.90 105.19 109.18 1tql n GLY 106 Ca 0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 1tql n GLY 106 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1tql s LEU 107 N 0.00 -0.07 1.09 0.99 2.96 -0.98 -4.04 118.68 118.64 1tql s LEU 107 Ca 0.00 0.14 -0.13 0.00 -0.22 0.00 0.00 54.13 53.92 1tql s LEU 107 Cb 0.00 0.29 0.24 0.00 0.50 0.00 0.00 46.19 47.23 1tql s LEU 107 CO 0.00 -0.27 1.06 -1.61 -1.32 0.00 0.00 176.35 174.21 1tql s GLU 108 N 2.30 -0.35 0.82 1.98 2.02 -1.26 -1.61 118.70 122.60 1tql s GLU 108 Ca 0.04 0.63 -0.12 0.00 0.02 0.00 0.00 54.97 55.54 1tql s GLU 108 Cb -0.13 -1.64 0.10 0.00 0.10 0.00 0.00 34.13 32.56 1tql s GLU 108 CO -0.08 -3.29 1.18 0.00 0.02 0.00 0.00 175.26 173.09 1tql s ALA 109 N -2.72 2.67 0.38 5.21 0.00 -1.26 -4.16 121.76 121.88 1tql s ALA 109 Ca 0.67 -0.84 -0.27 0.00 0.00 0.00 0.00 51.96 51.52 1tql s ALA 109 Cb -0.22 -2.84 -0.10 0.00 0.00 0.00 0.00 23.12 19.97 1tql s ALA 109 CO 0.61 -1.78 1.38 -0.51 0.00 0.00 0.00 175.76 175.46 1tql s LEU 110 N -5.58 4.29 -0.57 0.00 1.43 -0.86 -4.89 118.68 112.50 1tql s LEU 110 Ca 0.64 2.83 -0.28 0.00 -1.03 0.00 0.00 54.13 56.29 1tql s LEU 110 Cb -0.09 -3.77 0.01 0.00 0.03 0.00 0.00 46.19 42.38 1tql s LEU 110 CO 0.49 -0.82 1.41 -0.62 0.23 0.00 0.00 176.35 177.04 1tql s ASP 111 N -0.45 6.11 0.54 2.29 -1.08 -1.26 -4.90 116.67 117.92 1tql s ASP 111 Ca 0.54 0.24 0.27 0.00 -0.52 0.00 0.00 52.55 53.08 1tql s ASP 111 Cb -0.42 -2.55 1.52 0.00 -1.46 0.00 0.00 42.92 40.02 1tql s ASP 111 CO 0.56 -1.73 2.12 -0.07 0.52 0.00 0.00 175.17 176.57 1tql h LEU 112 N 13.16 0.00 -0.55 -1.34 3.38 -2.00 -2.92 115.31 125.03 1tql h LEU 112 Ca -0.27 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.60 1tql h LEU 112 Cb 1.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 1tql h LEU 112 CO 1.18 0.09 -0.50 0.77 0.09 0.00 0.00 178.44 180.07 1tql h SER 113 N 0.00 0.00 -3.97 -0.43 4.64 -2.03 -3.45 113.55 108.31 1tql h SER 113 Ca -0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1tql h SER 113 Cb 0.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1tql h SER 113 CO 0.01 0.50 0.37 0.42 -0.87 0.00 0.00 176.83 177.27 1tql s THR 114 N -3.32 4.02 0.27 2.95 -4.23 -1.11 -4.99 115.64 109.23 1tql s THR 114 Ca 0.01 1.49 -0.27 0.00 -1.18 0.00 0.00 61.69 61.74 1tql s THR 114 Cb 0.10 -3.74 -0.15 0.00 1.34 0.00 0.00 72.50 70.05 1tql s THR 114 CO 0.72 -0.05 0.80 -0.24 -0.54 0.00 0.00 174.62 175.31 1tql n SER 115 N -0.09 0.22 -0.94 3.99 2.88 -1.26 -4.87 113.62 113.55 1tql n SER 115 Ca 0.05 1.13 0.09 0.00 -1.33 0.00 0.00 58.87 58.81 1tql n SER 115 Cb 0.51 -1.16 0.25 0.00 -0.75 0.00 0.00 64.21 63.06 1tql n SER 115 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tql n ALA 116 N 0.03 2.43 -0.42 -1.46 0.00 -1.26 -4.81 120.51 115.00 1tql n ALA 116 Ca 0.13 -0.88 0.05 0.00 0.00 0.00 0.00 53.44 52.73 1tql n ALA 116 Cb 0.30 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.78 1tql n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tql n GLY 117 N 1.33 -0.53 3.67 0.00 0.00 -1.26 -1.89 105.19 106.51 1tql n GLY 117 Ca 0.18 -0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.46 1tql n GLY 117 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1tql n TYR 118 N -1.47 1.58 1.00 1.61 9.36 -1.26 -1.84 117.16 126.13 1tql n TYR 118 Ca 0.00 0.45 0.10 0.00 3.32 0.00 0.00 57.90 61.77 1tql n TYR 118 Cb 0.17 -2.26 0.31 0.00 -0.63 0.00 0.00 39.34 36.93 1tql n TYR 118 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1tql n PRO 119 N -0.84 1.87 0.09 2.98 -0.04 -1.26 -4.45 135.00 133.35 1tql n PRO 119 Ca 0.12 -1.32 0.11 0.00 -0.04 0.00 0.00 63.50 62.37 1tql n PRO 119 Cb 0.45 -1.39 0.45 0.00 -0.04 0.00 0.00 33.50 32.97 1tql n PRO 119 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1tql n TYR 120 N 0.55 0.61 0.85 0.54 0.53 -0.77 -2.23 117.16 117.24 1tql n TYR 120 Ca 0.16 0.22 0.12 0.00 -1.02 0.00 0.00 57.90 57.38 1tql n TYR 120 Cb 0.36 -0.85 0.28 0.00 -1.03 0.00 0.00 39.34 38.10 1tql n TYR 120 CO 0.00 0.00 0.00 1.55 -1.02 0.00 0.00 176.86 177.39 1tql n VAL 121 N -2.04 0.13 -0.17 -0.72 3.14 -1.10 -1.84 118.33 115.74 1tql n VAL 121 Ca 0.04 -0.10 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 1tql n VAL 121 Cb 0.27 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.06 1tql n VAL 121 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1tql n ALA 122 N -1.61 1.84 -0.03 1.55 0.00 -1.18 -4.41 120.51 116.67 1tql n ALA 122 Ca 0.05 -0.93 0.01 0.00 0.00 0.00 0.00 53.44 52.58 1tql n ALA 122 Cb 0.37 -0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.86 1tql n ALA 122 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1tql n MET 123 N -0.42 2.51 -0.73 0.00 0.00 -0.95 -4.99 117.12 112.54 1tql n MET 123 Ca 0.00 -1.52 -0.01 0.00 0.00 0.00 0.00 57.70 56.17 1tql n MET 123 Cb 0.29 -1.07 -0.00 0.00 0.00 0.00 0.00 33.22 32.44 1tql n MET 123 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1tql n GLY 124 N -0.18 0.05 3.76 -5.12 0.00 -1.13 -4.94 105.19 97.64 1tql n GLY 124 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 1tql n GLY 124 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1tql s LYS 125 N -1.48 4.27 0.55 1.61 2.20 -0.76 -5.04 119.74 121.09 1tql s LYS 125 Ca 0.00 0.61 0.08 0.00 -0.36 0.00 0.00 55.97 56.31 1tql s LYS 125 Cb 0.00 -3.35 0.07 0.00 -1.51 0.00 0.00 37.83 33.03 1tql s LYS 125 CO 0.00 0.35 0.66 0.15 -0.36 0.00 0.00 175.35 176.15 1tql s LYS 126 N -0.07 2.34 0.13 4.03 3.01 -1.26 -4.52 119.74 123.41 1tql s LYS 126 Ca 0.29 -1.70 -0.09 0.00 -1.01 0.00 0.00 55.97 53.45 1tql s LYS 126 Cb -0.17 -2.51 -0.08 0.00 -1.01 0.00 0.00 37.83 34.05 1tql s LYS 126 CO 0.15 -0.73 1.36 0.87 0.51 0.00 0.00 175.35 177.51 1tql h LYS 127 N 0.39 0.71 0.00 1.68 1.57 -1.91 -3.08 116.57 115.92 1tql h LYS 127 Ca -0.33 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 57.90 1tql h LYS 127 Cb 1.29 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.71 1tql h LYS 127 CO 0.46 1.17 0.00 0.54 -0.57 0.00 0.00 179.45 181.05 1tql n ARG 128 N -3.92 0.16 -0.05 3.15 3.00 -1.26 -0.88 116.66 116.86 1tql n ARG 128 Ca -0.06 0.58 0.10 0.00 -0.01 0.00 0.00 57.85 58.46 1tql n ARG 128 Cb 0.72 -1.94 0.45 0.00 0.00 0.00 0.00 32.46 31.68 1tql n ARG 128 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1tql n ASP 129 N -2.27 1.07 0.00 0.55 8.00 -1.16 -4.04 116.55 118.70 1tql n ASP 129 Ca -0.00 -1.59 0.00 0.00 0.71 0.00 0.00 54.79 53.91 1tql n ASP 129 Cb 0.09 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 1tql n ASP 129 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1tql n ILE 130 N -0.08 0.00 -3.95 0.53 5.41 -0.06 -5.01 119.36 116.21 1tql n ILE 130 Ca 0.16 0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.81 1tql n ILE 130 Cb 0.24 -0.11 -0.10 0.00 -0.71 0.00 0.00 39.64 38.96 1tql n ILE 130 CO 0.00 0.00 0.00 -1.48 0.00 0.00 0.00 176.55 175.07 1tql s LEU 131 N -2.68 1.92 -0.09 1.39 2.34 -1.12 -4.25 118.68 116.19 1tql s LEU 131 Ca 0.00 -0.53 -0.01 0.00 0.06 0.00 0.00 54.13 53.65 1tql s LEU 131 Cb 0.00 0.48 0.03 0.00 -0.56 0.00 0.00 46.19 46.14 1tql s LEU 131 CO 0.00 -0.46 -0.04 0.20 -1.06 0.00 0.00 176.35 174.98 1tql s ASN 132 N -1.99 1.85 0.51 1.48 0.01 -1.26 -4.66 114.94 110.88 1tql s ASN 132 Ca -0.07 -0.20 0.25 0.00 -0.71 0.00 0.00 52.86 52.13 1tql s ASN 132 Cb -0.03 -0.65 1.35 0.00 0.41 0.00 0.00 41.25 42.33 1tql s ASN 132 CO -0.04 -0.14 1.93 0.11 -1.51 0.00 0.00 177.10 177.45 1tql h LYS 133 N 8.15 0.10 0.00 -0.60 1.79 -2.00 -1.72 116.57 122.29 1tql h LYS 133 Ca -0.26 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.19 1tql h LYS 133 Cb 1.13 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 31.76 1tql h LYS 133 CO 0.35 0.07 -1.56 0.00 -1.08 0.00 0.00 179.45 177.23 1tql n GLN 134 N -4.37 0.64 -0.05 3.15 0.00 -1.26 -4.46 117.38 111.03 1tql n GLN 134 Ca 0.15 -0.04 -0.12 0.00 0.00 0.00 0.00 57.00 56.99 1tql n GLN 134 Cb 0.74 -1.66 -0.11 0.00 0.00 0.00 0.00 30.24 29.21 1tql n GLN 134 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 1tql h THR 135 N 0.00 1.45 -3.45 -0.39 2.02 -1.77 -3.48 112.91 107.29 1tql h THR 135 Ca -0.02 -1.95 -0.16 0.00 0.77 0.00 0.00 66.41 65.05 1tql h THR 135 Cb 1.06 2.68 0.07 0.00 -1.74 0.00 0.00 68.15 70.21 1tql h THR 135 CO 0.00 0.47 -0.33 0.54 0.37 0.00 0.00 175.52 176.57 1tql n ARG 136 N -4.68 -3.18 -3.14 6.66 1.74 -0.73 -4.99 116.66 108.34 1tql n ARG 136 Ca -0.08 0.37 -0.42 0.00 -0.77 0.00 0.00 57.85 56.95 1tql n ARG 136 Cb 0.38 -4.00 -0.07 0.00 -1.02 0.00 0.00 32.46 27.75 1tql n ARG 136 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1tql s ASP 137 N -3.43 6.35 -0.02 0.55 2.15 -1.26 -4.91 116.67 116.10 1tql s ASP 137 Ca 0.10 -0.14 -0.10 0.00 0.43 0.00 0.00 52.55 52.84 1tql s ASP 137 Cb -0.04 -2.31 -0.31 0.00 -0.30 0.00 0.00 42.92 39.96 1tql s ASP 137 CO 0.32 -0.67 0.76 0.71 -0.17 0.00 0.00 175.17 176.13 1tql h THR 138 N 5.77 1.04 -0.42 1.71 1.35 -1.94 -3.40 112.91 117.01 1tql h THR 138 Ca -0.26 -2.61 0.05 0.00 -0.55 0.00 0.00 66.41 63.04 1tql h THR 138 Cb 1.11 2.80 -0.06 0.00 -1.73 0.00 0.00 68.15 70.27 1tql h THR 138 CO 0.85 0.84 -0.22 0.29 -0.25 0.00 0.00 175.52 177.04 1tql n LYS 139 N -3.58 -0.15 0.32 4.72 5.02 -1.26 0.07 118.16 123.29 1tql n LYS 139 Ca -0.22 0.64 -0.17 0.00 -2.02 0.00 0.00 58.31 56.54 1tql n LYS 139 Cb 1.07 -0.94 -0.09 0.00 -0.02 0.00 0.00 35.03 35.05 1tql n LYS 139 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1tql h GLU 140 N 0.00 -0.77 -0.45 1.97 4.57 -1.84 -2.25 114.58 115.81 1tql h GLU 140 Ca 0.10 0.05 0.09 0.00 -1.18 0.00 0.00 59.36 58.42 1tql h GLU 140 Cb 0.20 0.18 -0.09 0.00 -0.16 0.00 0.00 28.75 28.88 1tql h GLU 140 CO -0.40 -0.52 -0.16 0.52 -1.18 0.00 0.00 179.01 177.27 1tql h MET 141 N -0.80 -0.06 -0.74 1.92 2.86 -0.54 -1.71 114.93 115.86 1tql h MET 141 Ca -0.07 0.00 0.14 0.00 -2.06 0.00 0.00 59.70 57.72 1tql h MET 141 Cb 0.64 0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.21 1tql h MET 141 CO 0.10 -0.04 0.27 0.37 1.06 0.00 0.00 176.91 178.66 1tql h GLN 142 N -0.07 0.39 -0.67 1.72 5.75 -0.56 0.10 115.11 121.77 1tql h GLN 142 Ca 0.22 -0.02 -0.07 0.00 -0.15 0.00 0.00 58.65 58.62 1tql h GLN 142 Cb 0.40 -0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.83 1tql h GLN 142 CO -0.50 0.26 0.14 -0.22 -2.65 0.00 0.00 178.83 175.86 1tql h LYS 143 N 0.40 1.09 -0.20 1.69 3.64 -0.73 -1.07 116.57 121.38 1tql h LYS 143 Ca 0.41 -0.27 -0.06 0.00 -1.27 0.00 0.00 60.65 59.46 1tql h LYS 143 Cb 0.63 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.29 1tql h LYS 143 CO -0.42 0.97 -0.14 -0.07 -2.27 0.00 0.00 179.45 177.53 1tql h LEU 144 N 1.03 0.31 0.33 5.20 3.38 -0.26 0.05 115.31 125.35 1tql h LEU 144 Ca 0.21 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1tql h LEU 144 Cb 0.39 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1tql h LEU 144 CO 0.01 0.48 -0.16 -0.07 0.09 0.00 0.00 178.44 178.78 1tql h LEU 145 N 0.31 -0.38 -2.03 1.67 3.38 -0.41 -2.25 115.31 115.60 1tql h LEU 145 Ca 0.06 -0.14 0.14 0.00 0.09 0.00 0.00 57.88 58.02 1tql h LEU 145 Cb 0.43 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1tql h LEU 145 CO 0.03 0.08 0.38 0.44 0.09 0.00 0.00 178.44 179.45 1tql h ASP 146 N -0.99 0.00 0.00 -0.43 3.32 -1.11 1.23 116.42 118.44 1tql h ASP 146 Ca -0.05 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1tql h ASP 146 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1tql h ASP 146 CO 0.07 0.00 -0.00 0.74 -1.72 0.00 0.00 179.24 178.33 1tql h THR 147 N 0.00 1.70 -0.01 0.35 2.02 -0.95 -3.39 112.91 112.64 1tql h THR 147 Ca 0.22 -2.23 0.00 0.00 0.77 0.00 0.00 66.41 65.17 1tql h THR 147 Cb 0.98 3.19 0.00 0.00 -1.74 0.00 0.00 68.15 70.58 1tql h THR 147 CO -0.00 0.57 -0.42 -1.22 0.37 0.00 0.00 175.52 174.82 1tql n TYR 148 N -4.63 0.00 -2.51 3.16 4.02 -0.85 -5.08 117.16 111.26 1tql n TYR 148 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 1tql n TYR 148 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.77 1tql n TYR 148 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1tql n GLY 149 N 1.19 2.49 0.83 2.72 0.00 0.42 -4.92 105.19 107.93 1tql n GLY 149 Ca 0.06 -0.40 -0.05 0.00 0.00 0.00 0.00 46.02 45.63 1tql n GLY 149 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1tql n ILE 150 N 0.00 0.00 -3.55 -0.61 -5.35 -1.26 -4.73 119.36 103.86 1tql n ILE 150 Ca 0.00 -0.59 -0.21 0.00 -0.27 0.00 0.00 62.75 61.68 1tql n ILE 150 Cb 0.00 0.31 0.07 0.00 -1.74 0.00 0.00 39.64 38.28 1tql n ILE 150 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 1tql n ASN 151 N -2.52 -3.38 -4.88 7.28 2.85 -1.26 -4.98 115.26 108.37 1tql n ASN 151 Ca 0.02 -0.64 -0.31 0.00 -0.11 0.00 0.00 54.58 53.54 1tql n ASN 151 Cb 0.15 -4.86 -0.04 0.00 1.24 0.00 0.00 39.78 36.27 1tql n ASN 151 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1tql s LEU 152 N -6.75 4.03 0.74 1.20 1.43 -1.26 -5.04 118.68 113.03 1tql s LEU 152 Ca 0.22 0.99 -0.16 0.00 -1.03 0.00 0.00 54.13 54.15 1tql s LEU 152 Cb -0.10 -3.80 -0.02 0.00 0.03 0.00 0.00 46.19 42.30 1tql s LEU 152 CO 0.75 -0.22 0.66 -2.65 0.23 0.00 0.00 176.35 175.13 1tql n PRO 153 N -0.70 0.31 -3.42 1.29 -0.02 -1.26 -4.69 135.00 126.50 1tql n PRO 153 Ca 0.01 0.15 -0.38 0.00 -2.02 0.00 0.00 63.50 61.26 1tql n PRO 153 Cb 0.53 -1.96 -0.07 0.00 -0.02 0.00 0.00 33.50 31.98 1tql n PRO 153 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1tql s LEU 154 N -1.24 4.17 -0.23 2.45 1.43 0.49 -4.34 118.68 121.42 1tql s LEU 154 Ca 0.67 0.51 -0.29 0.00 -1.03 0.00 0.00 54.13 53.99 1tql s LEU 154 Cb -0.34 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.42 1tql s LEU 154 CO 0.56 -0.03 1.04 -0.69 0.23 0.00 0.00 176.35 177.46 1tql s VAL 155 N 1.12 4.67 -0.24 -1.59 1.01 0.28 -1.05 120.40 124.60 1tql s VAL 155 Ca 0.18 2.02 -0.14 0.00 0.00 0.00 0.00 61.98 64.05 1tql s VAL 155 Cb -0.14 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 1tql s VAL 155 CO 0.07 -0.18 0.30 -0.89 0.00 0.00 0.00 175.10 174.41 1tql s THR 156 N 3.19 5.25 0.26 3.92 2.01 -0.01 -0.84 115.64 129.42 1tql s THR 156 Ca 0.44 0.47 0.11 0.00 0.31 0.00 0.00 61.69 63.03 1tql s THR 156 Cb -0.15 -3.63 -0.05 0.00 0.01 0.00 0.00 72.50 68.67 1tql s THR 156 CO 0.06 0.26 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.74 1tql s TYR 157 N 1.46 2.23 0.14 4.92 4.12 -0.05 -4.56 117.35 125.61 1tql s TYR 157 Ca 0.13 -0.36 -0.18 0.00 0.02 0.00 0.00 57.07 56.69 1tql s TYR 157 Cb -0.15 -0.98 -0.07 0.00 -1.52 0.00 0.00 41.96 39.24 1tql s TYR 157 CO 0.08 0.66 0.61 0.08 0.02 0.00 0.00 175.55 176.99 1tql s VAL 158 N -2.46 4.73 -0.08 0.71 1.01 -1.26 0.24 120.40 123.29 1tql s VAL 158 Ca 0.28 1.09 -0.23 0.00 0.00 0.00 0.00 61.98 63.12 1tql s VAL 158 Cb -0.05 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1tql s VAL 158 CO 0.14 0.34 0.71 -0.75 0.00 0.00 0.00 175.10 175.53 1tql s LYS 159 N -1.68 4.42 -0.74 2.72 2.20 0.19 -4.77 119.74 122.08 1tql s LYS 159 Ca 0.36 0.88 -0.25 0.00 -0.36 0.00 0.00 55.97 56.61 1tql s LYS 159 Cb -0.17 -3.46 0.05 0.00 -1.51 0.00 0.00 37.83 32.74 1tql s LYS 159 CO 0.20 0.02 1.17 0.34 -0.36 0.00 0.00 175.35 176.72 1tql s ASP 160 N 0.84 6.21 0.20 1.43 2.15 -1.26 -4.63 116.67 121.61 1tql s ASP 160 Ca 0.37 -0.81 -0.20 0.00 0.43 0.00 0.00 52.55 52.34 1tql s ASP 160 Cb -0.18 -2.50 0.04 0.00 -0.30 0.00 0.00 42.92 39.99 1tql s ASP 160 CO 0.17 -1.63 0.59 -1.83 -0.17 0.00 0.00 175.17 172.31 1tql s GLU 161 N 4.90 1.42 0.41 4.34 -1.05 -1.26 -5.01 118.70 122.45 1tql s GLU 161 Ca 0.31 -0.73 -0.25 0.00 -0.15 0.00 0.00 54.97 54.15 1tql s GLU 161 Cb -0.11 0.57 -0.08 0.00 -0.44 0.00 0.00 34.13 34.07 1tql s GLU 161 CO 0.10 -0.62 1.14 -0.51 0.95 0.00 0.00 175.26 176.32 1tql s LEU 162 N -2.83 4.16 0.03 1.83 1.43 -1.26 -1.34 118.68 120.70 1tql s LEU 162 Ca 0.06 2.28 -0.08 0.00 -1.03 0.00 0.00 54.13 55.36 1tql s LEU 162 Cb -0.02 -4.08 0.00 0.00 0.03 0.00 0.00 46.19 42.12 1tql s LEU 162 CO -0.05 -0.67 0.17 -0.13 0.23 0.00 0.00 176.35 175.90 1tql s ARG 163 N -2.38 0.64 1.12 1.70 1.81 0.71 -4.84 118.95 117.70 1tql s ARG 163 Ca 0.58 -0.62 -0.13 0.00 -1.72 0.00 0.00 55.73 53.84 1tql s ARG 163 Cb -0.29 0.26 0.26 0.00 -0.45 0.00 0.00 34.95 34.73 1tql s ARG 163 CO 0.36 -0.18 1.05 -1.54 -0.68 0.00 0.00 175.30 174.31 1tql s SER 164 N -1.99 1.45 0.09 0.23 1.04 -1.26 -1.21 113.70 112.04 1tql s SER 164 Ca -0.06 1.44 -0.23 0.00 0.48 0.00 0.00 55.95 57.58 1tql s SER 164 Cb -0.02 -2.19 -0.14 0.00 0.10 0.00 0.00 66.02 63.77 1tql s SER 164 CO -0.03 -3.90 1.73 0.50 0.98 0.00 0.00 173.24 172.52 1tql h LYS 165 N -2.42 -0.01 -0.08 4.02 1.63 -1.94 -2.85 116.57 114.92 1tql h LYS 165 Ca -0.59 0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.22 1tql h LYS 165 Cb 1.33 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.93 1tql h LYS 165 CO 0.52 -0.01 -0.26 1.15 -3.45 0.00 0.00 179.45 177.40 1tql h THR 166 N -0.01 0.00 0.00 1.00 2.02 -1.96 -0.39 112.91 113.57 1tql h THR 166 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.19 1tql h THR 166 Cb 0.02 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.43 1tql h THR 166 CO -0.02 0.00 0.17 0.29 0.37 0.00 0.00 175.52 176.33 1tql n LYS 167 N -3.95 0.09 0.01 6.66 5.02 -1.21 -0.59 118.16 124.18 1tql n LYS 167 Ca -0.03 0.55 -0.21 0.00 -2.02 0.00 0.00 58.31 56.60 1tql n LYS 167 Cb 0.18 -1.96 -0.14 0.00 -0.02 0.00 0.00 35.03 33.09 1tql n LYS 167 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1tql h VAL 168 N 0.00 1.07 0.00 -0.18 2.07 -0.86 -0.04 116.25 118.31 1tql h VAL 168 Ca 0.00 -2.41 -0.05 0.00 0.82 0.00 0.00 66.70 65.06 1tql h VAL 168 Cb 0.34 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 1tql h VAL 168 CO 0.00 0.70 -0.23 -0.33 0.02 0.00 0.00 177.57 177.73 1tql h GLU 169 N -0.32 0.00 -0.55 1.57 5.08 0.16 -2.62 114.58 117.90 1tql h GLU 169 Ca -0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1tql h GLU 169 Cb 1.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.99 1tql h GLU 169 CO 0.06 0.23 0.00 1.04 -1.00 0.00 0.00 179.01 179.34 1tql n GLN 170 N -3.46 4.40 -2.08 2.33 6.02 -0.39 -0.64 117.38 123.57 1tql n GLN 170 Ca -0.00 -3.06 -0.08 0.00 -0.01 0.00 0.00 57.00 53.84 1tql n GLN 170 Cb 0.40 -2.13 -0.01 0.00 1.02 0.00 0.00 30.24 29.52 1tql n GLN 170 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1tql n GLY 171 N 0.57 -0.10 2.26 1.08 0.00 -0.99 -4.80 105.19 103.21 1tql n GLY 171 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.08 1tql n GLY 171 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1tql n LYS 172 N -2.35 2.35 -2.51 1.61 4.76 -0.03 -3.85 118.16 118.14 1tql n LYS 172 Ca -0.09 -1.36 -0.32 0.00 -2.87 0.00 0.00 58.31 53.66 1tql n LYS 172 Cb 0.48 -2.28 -0.04 0.00 -1.84 0.00 0.00 35.03 31.35 1tql n LYS 172 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1tql s SER 173 N 2.42 6.69 0.20 4.39 0.01 -1.26 -4.88 113.70 121.27 1tql s SER 173 Ca 0.56 1.58 -0.03 0.00 1.31 0.00 0.00 55.95 59.38 1tql s SER 173 Cb 0.21 -2.51 -0.05 0.00 0.21 0.00 0.00 66.02 63.88 1tql s SER 173 CO -0.02 -0.53 0.42 -0.13 0.41 0.00 0.00 173.24 173.38 1tql s ARG 174 N -3.86 3.57 -0.07 12.44 0.52 -1.26 -4.78 118.95 125.51 1tql s ARG 174 Ca 0.59 -0.21 -0.01 0.00 -0.52 0.00 0.00 55.73 55.59 1tql s ARG 174 Cb -0.10 -2.81 -0.03 0.00 0.52 0.00 0.00 34.95 32.53 1tql s ARG 174 CO 0.27 0.38 -0.01 -0.51 0.02 0.00 0.00 175.30 175.46 1tql s LEU 175 N -3.18 3.52 -0.33 2.53 1.43 -1.26 0.55 118.68 121.95 1tql s LEU 175 Ca 0.40 0.10 -0.08 0.00 -1.03 0.00 0.00 54.13 53.52 1tql s LEU 175 Cb -0.11 -1.83 0.02 0.00 0.03 0.00 0.00 46.19 44.29 1tql s LEU 175 CO 0.28 0.36 0.13 -0.63 0.23 0.00 0.00 176.35 176.72 1tql s ILE 176 N -0.91 4.22 -1.04 -0.59 1.01 0.14 -4.76 121.20 119.27 1tql s ILE 176 Ca 0.14 -0.76 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 1tql s ILE 176 Cb -0.11 -3.26 0.25 0.00 0.01 0.00 0.00 42.46 39.35 1tql s ILE 176 CO 0.03 -0.05 1.05 -1.61 0.00 0.00 0.00 174.94 174.36 1tql s GLU 177 N 1.52 4.02 0.27 2.79 8.01 -1.26 -0.87 118.70 133.18 1tql s GLU 177 Ca 0.02 -2.91 -0.29 0.00 0.01 0.00 0.00 54.97 51.79 1tql s GLU 177 Cb -0.18 -4.58 -0.10 0.00 -4.31 0.00 0.00 34.13 24.96 1tql s GLU 177 CO 0.04 -1.32 1.28 0.00 0.01 0.00 0.00 175.26 175.27 1tql s ALA 178 N -0.49 3.50 0.15 5.21 0.00 -0.02 -2.54 121.76 127.56 1tql s ALA 178 Ca 0.28 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.39 1tql s ALA 178 Cb -0.09 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.53 1tql s ALA 178 CO -0.08 -0.52 0.32 -1.54 0.00 0.00 0.00 175.76 173.94 1tql s SER 179 N -0.22 6.37 0.44 0.00 1.04 -1.11 -0.56 113.70 119.66 1tql s SER 179 Ca 0.51 0.31 -0.26 0.00 0.48 0.00 0.00 55.95 57.00 1tql s SER 179 Cb -0.37 -1.97 -0.08 0.00 0.10 0.00 0.00 66.02 63.69 1tql s SER 179 CO 0.45 0.04 1.41 -0.55 0.98 0.00 0.00 173.24 175.57 1tql s SER 180 N -3.00 5.97 0.61 7.02 0.15 -1.26 -4.06 113.70 119.12 1tql s SER 180 Ca 0.37 2.89 0.30 0.00 0.70 0.00 0.00 55.95 60.20 1tql s SER 180 Cb -0.11 -2.65 1.62 0.00 -1.71 0.00 0.00 66.02 63.16 1tql s SER 180 CO 0.28 -1.11 2.00 0.25 1.20 0.00 0.00 173.24 175.86 1tql h LEU 181 N 2.42 0.00 0.30 3.45 5.85 -1.61 -1.34 115.31 124.38 1tql h LEU 181 Ca -0.51 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 1tql h LEU 181 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1tql h LEU 181 CO 0.61 0.00 -0.14 0.78 -0.34 0.00 0.00 178.44 179.35 1tql h ASN 182 N 0.00 -0.34 -0.11 1.25 4.21 -1.88 -2.24 115.58 116.47 1tql h ASN 182 Ca 0.11 -0.17 0.00 0.00 1.21 0.00 0.00 56.30 57.46 1tql h ASN 182 Cb 0.75 0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 38.04 1tql h ASN 182 CO -0.00 0.00 0.06 0.44 -1.29 0.00 0.00 177.43 176.64 1tql h ASP 183 N -0.72 0.10 -0.92 5.81 3.32 -1.56 -0.55 116.42 121.91 1tql h ASP 183 Ca -0.04 0.00 0.20 0.00 0.02 0.00 0.00 57.03 57.21 1tql h ASP 183 Cb 0.49 -0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.94 1tql h ASP 183 CO 0.07 0.08 0.60 -1.28 -1.72 0.00 0.00 179.24 176.98 1tql h SER 184 N 0.13 0.48 0.02 6.45 0.87 -1.43 0.19 113.55 120.26 1tql h SER 184 Ca 0.04 0.05 -0.18 0.00 -1.23 0.00 0.00 61.79 60.47 1tql h SER 184 Cb -0.00 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1tql h SER 184 CO -0.02 0.19 -0.72 0.58 -0.53 0.00 0.00 176.83 176.33 1tql h VAL 185 N 0.48 1.40 -0.06 2.23 2.07 -0.74 -2.74 116.25 118.89 1tql h VAL 185 Ca 0.48 -2.17 0.01 0.00 0.82 0.00 0.00 66.70 65.84 1tql h VAL 185 Cb 1.11 2.62 -0.01 0.00 -1.52 0.00 0.00 31.29 33.50 1tql h VAL 185 CO -0.21 0.64 0.02 0.00 0.02 0.00 0.00 177.57 178.04 1tql h ALA 186 N 0.31 0.06 -0.24 1.67 0.00 0.24 -2.42 119.26 118.88 1tql h ALA 186 Ca -0.10 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1tql h ALA 186 Cb 1.44 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1tql h ALA 186 CO 0.14 -0.45 0.07 0.52 0.00 0.00 0.00 179.25 179.52 1tql h MET 187 N 0.05 0.34 0.00 0.00 2.86 -0.76 0.36 114.93 117.78 1tql h MET 187 Ca 0.03 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1tql h MET 187 Cb 0.01 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 1tql h MET 187 CO -0.03 0.31 -0.03 0.00 1.06 0.00 0.00 176.91 178.23 1tql h ARG 188 N 0.34 0.00 0.16 1.72 3.08 -1.20 0.32 114.38 118.80 1tql h ARG 188 Ca 0.08 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.81 1tql h ARG 188 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1tql h ARG 188 CO -0.01 0.03 -1.60 0.52 -1.07 0.00 0.00 179.97 177.84 1tql h MET 189 N 0.00 0.34 -0.15 0.04 2.86 -0.74 0.96 114.93 118.23 1tql h MET 189 Ca -0.00 -0.57 -0.09 0.00 -2.06 0.00 0.00 59.70 56.98 1tql h MET 189 Cb 0.78 0.21 -0.00 0.00 0.06 0.00 0.00 31.60 32.65 1tql h MET 189 CO 0.00 1.23 -0.25 0.00 1.06 0.00 0.00 176.91 178.95 1tql h ALA 190 N 0.32 0.24 -0.18 6.32 0.00 -0.73 0.28 119.26 125.50 1tql h ALA 190 Ca -0.28 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1tql h ALA 190 Cb 2.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1tql h ALA 190 CO 0.18 0.22 0.00 1.19 0.00 0.00 0.00 179.25 180.84 1tql n PHE 191 N -4.43 0.24 -0.31 0.00 3.72 0.11 -4.78 117.46 112.01 1tql n PHE 191 Ca -0.06 -0.38 0.15 0.00 -0.05 0.00 0.00 57.45 57.10 1tql n PHE 191 Cb 0.44 -0.03 0.32 0.00 -0.94 0.00 0.00 39.48 39.27 1tql n PHE 191 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1tql h GLY 192 N 1.38 1.45 2.00 1.37 0.00 -0.90 0.74 103.07 109.10 1tql h GLY 192 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 47.33 47.15 1tql h GLY 192 CO 0.00 -0.41 -0.67 3.43 0.00 0.00 0.00 176.54 178.89 1tql h ASN 193 N 0.19 0.00 0.08 0.19 2.35 -1.81 -2.37 115.58 114.21 1tql h ASN 193 Ca 0.58 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.33 1tql h ASN 193 Cb 1.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.59 1tql h ASN 193 CO -0.68 0.67 -0.04 0.25 -1.65 0.00 0.00 177.43 175.98 1tql h LEU 194 N 0.00 -0.09 -0.35 1.61 5.85 -1.12 -1.23 115.31 119.97 1tql h LEU 194 Ca -0.01 -0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.63 1tql h LEU 194 Cb 1.27 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.26 1tql h LEU 194 CO 0.09 0.10 -0.13 1.88 -0.34 0.00 0.00 178.44 180.04 1tql h TYR 195 N -0.29 -0.30 -0.41 1.25 0.05 -1.21 -1.50 116.97 114.57 1tql h TYR 195 Ca -0.01 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1tql h TYR 195 Cb 0.25 0.18 -0.02 0.00 1.01 0.00 0.00 36.73 38.15 1tql h TYR 195 CO -0.01 -0.20 0.27 0.00 -1.05 0.00 0.00 178.16 177.16 1tql h ALA 196 N 1.25 0.52 -0.99 3.88 0.00 -1.35 -0.19 119.26 122.38 1tql h ALA 196 Ca 0.17 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.12 1tql h ALA 196 Cb 0.32 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.88 1tql h ALA 196 CO -0.39 -0.02 0.64 0.00 0.00 0.00 0.00 179.25 179.48 1tql h ALA 197 N 1.14 1.38 -0.04 0.00 0.00 -0.54 -0.42 119.26 120.78 1tql h ALA 197 Ca 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1tql h ALA 197 Cb -0.05 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1tql h ALA 197 CO -0.03 0.41 -0.04 0.74 0.00 0.00 0.00 179.25 180.34 1tql h PHE 198 N 1.14 0.12 -0.55 0.00 -1.00 -0.87 -2.35 116.94 113.44 1tql h PHE 198 Ca 0.43 -0.03 0.12 0.00 2.81 0.00 0.00 57.97 61.29 1tql h PHE 198 Cb 0.19 -0.03 -0.03 0.00 3.61 0.00 0.00 35.95 39.69 1tql h PHE 198 CO -0.01 0.54 0.38 0.45 -1.61 0.00 0.00 178.31 178.06 1tql h HIS 199 N -0.34 0.27 -0.00 -0.55 3.86 -0.52 -0.43 115.15 117.44 1tql h HIS 199 Ca 0.01 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1tql h HIS 199 Cb 0.52 -0.09 0.00 0.00 1.06 0.00 0.00 27.41 28.90 1tql h HIS 199 CO 0.09 0.12 -0.35 1.63 0.86 0.00 0.00 177.93 180.27 1tql n LYS 200 N -4.45 0.30 -3.14 2.45 5.02 -0.22 -4.41 118.16 113.72 1tql n LYS 200 Ca 0.09 -0.16 -0.23 0.00 -2.02 0.00 0.00 58.31 56.00 1tql n LYS 200 Cb 0.45 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.92 1tql n LYS 200 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1tql n ASN 201 N -1.21 2.19 -4.73 4.39 3.02 -0.17 -5.08 115.26 113.66 1tql n ASN 201 Ca 0.08 -3.22 -0.41 0.00 -0.03 0.00 0.00 54.58 51.00 1tql n ASN 201 Cb 0.33 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 38.86 1tql n ASN 201 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1tql s PRO 202 N -2.57 4.47 0.00 3.52 0.04 -1.22 -4.40 135.00 134.84 1tql s PRO 202 Ca 0.42 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.35 1tql s PRO 202 Cb 0.28 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.57 1tql s PRO 202 CO -0.10 -0.14 0.00 0.41 0.04 0.00 0.00 177.00 177.22 1tql n GLY 203 N 2.37 -0.28 0.79 0.56 0.00 0.26 -4.95 105.19 103.93 1tql n GLY 203 Ca 0.05 -1.08 0.12 0.00 0.00 0.00 0.00 46.02 45.11 1tql n GLY 203 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1tql n VAL 204 N 9.00 0.19 -0.05 1.61 0.24 -1.26 -1.55 118.33 126.51 1tql n VAL 204 Ca 0.00 -0.46 -0.22 0.00 -2.04 0.00 0.00 64.34 61.62 1tql n VAL 204 Cb 0.00 0.81 -0.13 0.00 -1.47 0.00 0.00 33.84 33.05 1tql n VAL 204 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1tql n ILE 205 N 0.83 1.67 0.14 1.34 2.08 -1.26 -4.01 119.36 120.15 1tql n ILE 205 Ca 0.17 -0.47 0.11 0.00 0.56 0.00 0.00 62.75 63.12 1tql n ILE 205 Cb 0.47 -1.79 0.05 0.00 -0.75 0.00 0.00 39.64 37.62 1tql n ILE 205 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 1tql h THR 206 N -0.28 0.07 -1.37 1.39 1.35 -1.77 -3.38 112.91 108.92 1tql h THR 206 Ca -0.44 -1.12 -0.29 0.00 -0.55 0.00 0.00 66.41 64.01 1tql h THR 206 Cb 1.81 1.75 -0.06 0.00 -1.73 0.00 0.00 68.15 69.91 1tql h THR 206 CO -0.04 0.04 -0.32 0.61 -0.25 0.00 0.00 175.52 175.56 1tql n GLY 207 N 1.17 0.62 3.27 5.82 0.00 -0.60 -4.92 105.19 110.56 1tql n GLY 207 Ca 0.01 -0.32 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 1tql n GLY 207 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1tql s SER 208 N -2.60 2.27 0.00 1.61 0.15 -0.91 -0.86 113.70 113.36 1tql s SER 208 Ca 0.00 -0.76 0.03 0.00 0.70 0.00 0.00 55.95 55.92 1tql s SER 208 Cb 0.00 -0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.18 1tql s SER 208 CO 0.00 -0.05 0.21 0.00 1.20 0.00 0.00 173.24 174.60 1tql n ALA 209 N 0.72 2.45 -1.61 5.45 0.00 0.46 -0.58 120.51 127.40 1tql n ALA 209 Ca -0.17 -0.16 -0.49 0.00 0.00 0.00 0.00 53.44 52.62 1tql n ALA 209 Cb 0.56 -0.12 -0.05 0.00 0.00 0.00 0.00 19.45 19.84 1tql n ALA 209 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1tql n VAL 210 N -0.89 0.49 -0.65 0.00 0.31 -1.26 -4.85 118.33 111.47 1tql n VAL 210 Ca 0.01 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1tql n VAL 210 Cb 0.06 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 1tql n VAL 210 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1tql n GLY 211 N 2.37 1.22 2.97 2.92 0.00 -1.26 -4.31 105.19 109.10 1tql n GLY 211 Ca 0.16 -0.22 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 1tql n GLY 211 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tql s ASP 213 N -2.29 -0.10 0.51 1.61 2.15 -1.26 -5.04 116.67 112.24 1tql s ASP 213 Ca 0.00 -0.19 0.34 0.00 0.43 0.00 0.00 52.55 53.13 1tql s ASP 213 Cb 0.00 1.33 1.48 0.00 -0.30 0.00 0.00 42.92 45.44 1tql s ASP 213 CO 0.00 -0.34 1.75 -0.65 -0.17 0.00 0.00 175.17 175.77 1tql h PRO 214 N 8.12 0.08 -0.18 4.34 0.11 -1.98 -0.32 132.00 142.17 1tql h PRO 214 Ca -0.08 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 1tql h PRO 214 Cb 1.14 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1tql h PRO 214 CO 0.24 0.05 -0.05 -0.44 -0.21 0.00 0.00 178.00 177.59 1tql h ASP 215 N 0.08 0.25 0.00 -2.05 3.32 -1.96 -2.77 116.42 113.29 1tql h ASP 215 Ca 0.64 -0.04 -0.42 0.00 0.02 0.00 0.00 57.03 57.23 1tql h ASP 215 Cb 2.34 -0.06 -0.07 0.00 0.22 0.00 0.00 39.33 41.76 1tql h ASP 215 CO -0.10 0.35 -2.47 0.18 -1.72 0.00 0.00 179.24 175.48 1tql n LEU 216 N -4.33 2.32 0.07 1.55 4.77 -0.44 -4.60 117.00 116.34 1tql n LEU 216 Ca -0.00 0.14 0.10 0.00 -0.03 0.00 0.00 56.01 56.22 1tql n LEU 216 Cb 0.22 -0.82 0.57 0.00 -2.33 0.00 0.00 43.42 41.05 1tql n LEU 216 CO 0.37 0.70 1.14 0.15 -1.33 0.00 0.00 177.39 178.43 1tql h PHE 217 N -0.58 0.22 -0.02 -1.77 3.57 -1.19 -2.85 116.94 114.31 1tql h PHE 217 Ca -0.63 0.01 0.01 0.00 3.53 0.00 0.00 57.97 60.88 1tql h PHE 217 Cb 1.70 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 40.37 1tql h PHE 217 CO -0.04 0.12 0.02 -1.49 -2.23 0.00 0.00 178.31 174.69 1tql h TRP 218 N 0.22 0.00 0.00 0.41 -0.00 -1.73 -1.62 115.95 113.24 1tql h TRP 218 Ca 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 59.02 1tql h TRP 218 Cb 0.31 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.47 1tql h TRP 218 CO -0.00 0.00 -0.06 0.77 -0.00 0.00 0.00 178.44 179.15 1tql h SER 219 N 0.00 0.00 0.81 -3.49 0.02 -1.68 -3.24 113.55 105.96 1tql h SER 219 Ca 0.01 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.77 1tql h SER 219 Cb 0.05 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1tql h SER 219 CO -0.00 0.06 -1.29 0.11 -1.14 0.00 0.00 176.83 174.57 1tql h LYS 220 N 0.00 0.00 -0.03 3.45 1.57 -1.44 -3.41 116.57 116.71 1tql h LYS 220 Ca -0.00 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1tql h LYS 220 Cb 0.89 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.17 1tql h LYS 220 CO 0.01 0.43 -0.11 0.82 -0.57 0.00 0.00 179.45 180.03 1tql h ILE 221 N 0.00 0.72 -0.60 1.86 2.04 -1.52 -2.65 117.51 117.36 1tql h ILE 221 Ca -0.15 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.82 1tql h ILE 221 Cb 1.66 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 1tql h ILE 221 CO 0.06 0.00 0.41 -0.65 0.00 0.00 0.00 178.15 177.97 1tql h PRO 222 N -0.17 0.34 0.00 2.37 0.11 -1.78 -0.51 132.00 132.36 1tql h PRO 222 Ca 0.05 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 66.03 1tql h PRO 222 Cb 0.24 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.25 1tql h PRO 222 CO -0.13 0.23 -0.53 0.28 -0.21 0.00 0.00 178.00 177.64 1tql h VAL 223 N 0.35 1.26 0.00 3.15 2.07 -1.72 -3.13 116.25 118.24 1tql h VAL 223 Ca 0.28 -1.88 -0.07 0.00 0.82 0.00 0.00 66.70 65.86 1tql h VAL 223 Cb 0.63 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1tql h VAL 223 CO -0.07 0.52 -0.59 -0.07 0.02 0.00 0.00 177.57 177.37 1tql h LEU 224 N 0.00 0.00-10.14 2.57 3.38 -0.79 -3.47 115.31 106.86 1tql h LEU 224 Ca -0.01 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 1tql h LEU 224 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1tql h LEU 224 CO 0.07 0.28 0.33 -0.04 0.09 0.00 0.00 178.44 179.17 1tql s MET 225 N -3.10 4.01 0.77 1.13 -1.94 -0.76 -4.88 119.30 114.55 1tql s MET 225 Ca 0.03 0.94 -0.08 0.00 -1.71 0.00 0.00 55.69 54.88 1tql s MET 225 Cb 0.07 -2.19 0.11 0.00 2.01 0.00 0.00 34.83 34.84 1tql s MET 225 CO 0.74 -0.16 1.09 -1.21 -0.01 0.00 0.00 175.02 175.47 1tql s GLU 226 N -3.75 1.69 0.17 2.03 0.41 -1.26 -5.00 118.70 112.98 1tql s GLU 226 Ca 0.59 -0.48 -0.20 0.00 -0.41 0.00 0.00 54.97 54.46 1tql s GLU 226 Cb -0.10 -2.12 0.10 0.00 -1.78 0.00 0.00 34.13 30.22 1tql s GLU 226 CO 0.26 -1.58 1.62 1.49 -0.49 0.00 0.00 175.26 176.55 1tql h GLU 227 N -0.85 -0.16 -4.97 1.61 4.57 -1.84 -3.42 114.58 109.52 1tql h GLU 227 Ca -0.43 0.01 -0.64 0.00 -1.18 0.00 0.00 59.36 57.13 1tql h GLU 227 Cb 1.28 0.04 -0.18 0.00 -0.16 0.00 0.00 28.75 29.74 1tql h GLU 227 CO 0.50 -0.11 -0.54 0.15 -1.18 0.00 0.00 179.01 177.83 1tql s LYS 228 N -6.09 3.91 0.31 1.92 -0.14 -0.31 -4.95 119.74 114.39 1tql s LYS 228 Ca -0.15 -0.35 -0.09 0.00 -1.36 0.00 0.00 55.97 54.03 1tql s LYS 228 Cb 0.15 -3.54 -0.07 0.00 -1.68 0.00 0.00 37.83 32.69 1tql s LYS 228 CO 0.69 -0.11 0.64 -0.51 -0.76 0.00 0.00 175.35 175.30 1tql s LEU 229 N 1.51 4.02 -0.14 3.17 1.43 -1.26 0.05 118.68 127.46 1tql s LEU 229 Ca 0.07 0.96 -0.21 0.00 -1.03 0.00 0.00 54.13 53.92 1tql s LEU 229 Cb -0.15 -3.78 0.05 0.00 0.03 0.00 0.00 46.19 42.34 1tql s LEU 229 CO 0.08 -0.22 0.54 0.72 0.23 0.00 0.00 176.35 177.69 1tql s PHE 230 N -2.08 -0.54 0.33 0.29 -0.71 -0.30 -4.38 117.98 110.58 1tql s PHE 230 Ca 0.48 1.20 -0.12 0.00 -1.04 0.00 0.00 56.93 57.45 1tql s PHE 230 Cb -0.11 0.23 0.02 0.00 -1.21 0.00 0.00 43.02 41.96 1tql s PHE 230 CO 0.26 -0.38 0.64 0.00 -1.34 0.00 0.00 175.22 174.40 1tql s ALA 231 N -0.30 -0.32 -0.16 1.99 0.00 -1.26 -2.93 121.76 118.78 1tql s ALA 231 Ca -0.05 -0.91 -0.34 0.00 0.00 0.00 0.00 51.96 50.66 1tql s ALA 231 Cb -0.03 0.90 0.14 0.00 0.00 0.00 0.00 23.12 24.13 1tql s ALA 231 CO 0.03 -0.92 1.22 -0.59 0.00 0.00 0.00 175.76 175.51 1tql s PHE 232 N -3.08 -0.11 0.29 0.00 -0.12 -1.26 -4.40 117.98 109.31 1tql s PHE 232 Ca 0.20 0.05 0.06 0.00 -0.05 0.00 0.00 56.93 57.20 1tql s PHE 232 Cb -0.03 0.52 -0.02 0.00 -0.63 0.00 0.00 43.02 42.85 1tql s PHE 232 CO 0.13 -0.21 0.35 -0.51 -0.05 0.00 0.00 175.22 174.92 1tql s ASP 233 N -2.32 5.82 0.15 1.98 1.01 0.75 -4.79 116.67 119.28 1tql s ASP 233 Ca 0.10 -0.20 0.10 0.00 0.71 0.00 0.00 52.55 53.25 1tql s ASP 233 Cb -0.00 -1.37 -0.04 0.00 1.01 0.00 0.00 42.92 42.52 1tql s ASP 233 CO -0.04 -0.24 -0.17 -0.31 0.21 0.00 0.00 175.17 174.61 1tql s TYR 234 N -2.15 2.50 -0.13 4.23 1.51 -1.26 -0.94 117.35 121.11 1tql s TYR 234 Ca 0.39 -0.28 0.00 0.00 -1.01 0.00 0.00 57.07 56.18 1tql s TYR 234 Cb -0.08 -1.28 -0.01 0.00 -0.11 0.00 0.00 41.96 40.48 1tql s TYR 234 CO 0.28 0.44 -0.15 0.99 -1.11 0.00 0.00 175.55 176.01 1tql s THR 235 N -1.40 2.83 -1.41 -0.71 2.01 -0.76 -4.68 115.64 111.52 1tql s THR 235 Ca 0.20 -0.73 -0.04 0.00 0.31 0.00 0.00 61.69 61.43 1tql s THR 235 Cb -0.09 -2.18 0.03 0.00 0.01 0.00 0.00 72.50 70.26 1tql s THR 235 CO 0.11 0.52 0.67 0.61 -0.69 0.00 0.00 174.62 175.84 1tql n GLY 236 N 3.68 -0.32 0.26 4.40 0.00 -1.26 -4.52 105.19 107.43 1tql n GLY 236 Ca -0.18 0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 1tql n GLY 236 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1tql h TYR 237 N -1.87 -0.86 -0.31 1.61 3.20 -1.95 -0.76 116.97 116.03 1tql h TYR 237 Ca -0.61 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.33 1tql h TYR 237 Cb 1.37 0.38 -0.08 0.00 1.54 0.00 0.00 36.73 39.94 1tql h TYR 237 CO 0.51 -0.31 -0.55 -0.44 -1.64 0.00 0.00 178.16 175.73 1tql h ASP 238 N -0.35 -1.81 -0.18 -2.11 3.32 -1.91 -0.36 116.42 113.03 1tql h ASP 238 Ca 0.01 0.23 0.05 0.00 0.02 0.00 0.00 57.03 57.34 1tql h ASP 238 Cb 0.38 0.73 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 1tql h ASP 238 CO -0.20 -0.43 0.13 0.00 -1.72 0.00 0.00 179.24 177.01 1tql h ALA 239 N -0.12 2.14 0.00 3.45 0.00 -1.78 -1.49 119.26 121.46 1tql h ALA 239 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1tql h ALA 239 Cb 0.63 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1tql h ALA 239 CO -0.54 -0.22 0.00 -1.13 0.00 0.00 0.00 179.25 177.36 1tql n SER 240 N -4.44 0.34 -4.63 0.00 3.41 -0.16 0.12 113.62 108.26 1tql n SER 240 Ca 0.01 0.55 -0.43 0.00 -0.26 0.00 0.00 58.87 58.75 1tql n SER 240 Cb 0.26 -0.64 -0.03 0.00 -0.26 0.00 0.00 64.21 63.55 1tql n SER 240 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1tql s LEU 241 N -3.69 3.90 0.69 1.04 1.43 -1.02 -4.63 118.68 116.41 1tql s LEU 241 Ca 0.10 1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 54.69 1tql s LEU 241 Cb 0.13 -3.53 0.01 0.00 0.03 0.00 0.00 46.19 42.83 1tql s LEU 241 CO 0.46 -1.25 1.07 -0.44 0.23 0.00 0.00 176.35 176.42 1tql s SER 242 N 4.16 5.28 0.48 2.29 0.01 -1.26 -0.79 113.70 123.87 1tql s SER 242 Ca 0.71 1.68 0.24 0.00 1.31 0.00 0.00 55.95 59.89 1tql s SER 242 Cb -0.25 -2.51 1.28 0.00 0.21 0.00 0.00 66.02 64.76 1tql s SER 242 CO 0.29 -1.51 1.89 -0.65 0.41 0.00 0.00 173.24 173.66 1tql h PRO 243 N -0.63 0.19 -0.89 12.44 0.11 -1.91 -1.60 132.00 139.71 1tql h PRO 243 Ca -0.44 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.71 1tql h PRO 243 Cb 1.22 -0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.23 1tql h PRO 243 CO 0.56 0.13 0.58 0.00 -0.21 0.00 0.00 178.00 179.06 1tql h ALA 244 N 1.60 1.49 0.00 -0.75 0.00 -1.90 -0.81 119.26 118.90 1tql h ALA 244 Ca 0.43 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.28 1tql h ALA 244 Cb 1.36 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1tql h ALA 244 CO -0.09 0.39 -0.14 -1.49 0.00 0.00 0.00 179.25 177.92 1tql h TRP 245 N 1.05 0.00 0.04 0.00 4.06 -1.64 0.12 115.95 119.57 1tql h TRP 245 Ca 0.37 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 61.09 1tql h TRP 245 Cb 0.13 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.29 1tql h TRP 245 CO -0.00 0.14 -1.02 0.74 -3.56 0.00 0.00 178.44 174.74 1tql h PHE 246 N 0.00 0.50 -0.18 0.49 0.04 -1.26 -1.23 116.94 115.30 1tql h PHE 246 Ca -0.00 -0.30 -0.04 0.00 2.80 0.00 0.00 57.97 60.43 1tql h PHE 246 Cb 0.31 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.41 1tql h PHE 246 CO 0.00 1.15 -0.06 0.93 -0.60 0.00 0.00 178.31 179.73 1tql h GLU 247 N 0.15 0.36 -0.85 1.51 4.39 -0.45 -0.61 114.58 119.07 1tql h GLU 247 Ca -0.09 -0.14 0.06 0.00 0.34 0.00 0.00 59.36 59.53 1tql h GLU 247 Cb 1.68 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 30.26 1tql h GLU 247 CO 0.17 0.64 0.55 0.00 -1.16 0.00 0.00 179.01 179.21 1tql h ALA 248 N 0.71 1.56 -0.67 3.43 0.00 -0.82 0.11 119.26 123.58 1tql h ALA 248 Ca 0.04 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1tql h ALA 248 Cb 0.52 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1tql h ALA 248 CO 0.02 0.31 0.28 1.25 0.00 0.00 0.00 179.25 181.11 1tql h LEU 249 N 0.95 0.92 -0.59 0.00 5.85 -0.80 -1.58 115.31 120.07 1tql h LEU 249 Ca 0.36 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1tql h LEU 249 Cb 0.20 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1tql h LEU 249 CO -0.13 0.83 0.26 0.11 -0.34 0.00 0.00 178.44 179.17 1tql h LYS 250 N 0.95 0.86 -0.83 1.25 1.57 0.44 -0.56 116.57 120.25 1tql h LYS 250 Ca 0.22 -0.14 0.07 0.00 -1.87 0.00 0.00 60.65 58.93 1tql h LYS 250 Cb 0.19 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 32.29 1tql h LYS 250 CO -0.02 0.72 0.50 0.52 -0.57 0.00 0.00 179.45 180.60 1tql h MET 251 N 0.80 0.88 -0.19 3.15 2.86 -0.42 0.36 114.93 122.37 1tql h MET 251 Ca 0.20 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.77 1tql h MET 251 Cb 0.16 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1tql h MET 251 CO -0.02 0.58 0.07 0.28 1.06 0.00 0.00 176.91 178.88 1tql h VAL 252 N 0.90 1.17 -0.74 -2.22 2.07 -0.69 -1.33 116.25 115.40 1tql h VAL 252 Ca 0.37 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1tql h VAL 252 Cb 0.22 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1tql h VAL 252 CO -0.19 0.16 0.43 -0.07 0.02 0.00 0.00 177.57 177.93 1tql h LEU 253 N 0.15 0.91 0.12 2.57 3.38 -0.23 -2.27 115.31 119.94 1tql h LEU 253 Ca 0.06 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1tql h LEU 253 Cb 0.19 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1tql h LEU 253 CO -0.00 0.72 -0.16 -0.33 0.09 0.00 0.00 178.44 178.76 1tql h GLU 254 N 1.02 -0.31 0.00 1.13 5.08 -0.15 0.97 114.58 122.32 1tql h GLU 254 Ca 0.27 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1tql h GLU 254 Cb -0.01 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1tql h GLU 254 CO -0.05 -0.21 0.00 0.87 -1.00 0.00 0.00 179.01 178.62 1tql h LYS 255 N -0.32 0.00 -0.50 2.33 1.57 -0.91 -2.52 116.57 116.22 1tql h LYS 255 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1tql h LYS 255 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1tql h LYS 255 CO -0.07 0.00 0.00 0.44 -0.57 0.00 0.00 179.45 179.25 1tql n ILE 256 N -3.04 1.30 0.00 1.86 -5.35 -0.88 -4.96 119.36 108.28 1tql n ILE 256 Ca -0.02 -1.13 0.00 0.00 -0.27 0.00 0.00 62.75 61.33 1tql n ILE 256 Cb 0.11 0.35 0.00 0.00 -1.74 0.00 0.00 39.64 38.36 1tql n ILE 256 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1tql n GLY 257 N 0.83 1.00 0.46 3.28 0.00 -0.95 -4.86 105.19 104.95 1tql n GLY 257 Ca 0.19 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.28 1tql n GLY 257 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1tql n PHE 258 N -1.29 0.15 0.28 1.61 3.01 0.29 -4.57 117.46 116.94 1tql n PHE 258 Ca 0.00 -1.28 0.15 0.00 1.01 0.00 0.00 57.45 57.33 1tql n PHE 258 Cb 0.00 -0.24 0.76 0.00 -0.01 0.00 0.00 39.48 39.99 1tql n PHE 258 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1tql h GLY 259 N 0.66 0.00 -0.01 1.37 0.00 -1.68 -2.58 103.07 100.83 1tql h GLY 259 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.37 1tql h GLY 259 CO 0.05 0.00 -0.51 -1.80 0.00 0.00 0.00 176.54 174.27 1tql h ASP 260 N 0.00 -1.59 -1.08 0.19 1.82 -1.91 -3.29 116.42 110.56 1tql h ASP 260 Ca 0.00 0.18 -0.58 0.00 -0.39 0.00 0.00 57.03 56.23 1tql h ASP 260 Cb 0.16 0.60 -0.41 0.00 0.68 0.00 0.00 39.33 40.36 1tql h ASP 260 CO 0.00 -0.50 -0.57 -2.11 -1.61 0.00 0.00 179.24 174.45 1tql n ARG 261 N -5.31 3.44 0.05 0.28 0.00 -0.97 -4.77 116.66 109.39 1tql n ARG 261 Ca -0.07 -4.18 0.11 0.00 -0.00 0.00 0.00 57.85 53.71 1tql n ARG 261 Cb 0.38 -2.27 0.44 0.00 -0.00 0.00 0.00 32.46 31.01 1tql n ARG 261 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1tql n VAL 262 N -0.64 0.68 -0.01 8.89 0.24 -1.21 -3.05 118.33 123.22 1tql n VAL 262 Ca 0.44 0.11 0.02 0.00 -2.04 0.00 0.00 64.34 62.88 1tql n VAL 262 Cb 0.81 -0.88 0.37 0.00 -1.47 0.00 0.00 33.84 32.68 1tql n VAL 262 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1tql h ASP 263 N 0.00 0.50 -0.98 -1.34 5.19 -1.88 -0.93 116.42 116.98 1tql h ASP 263 Ca 0.00 -0.04 0.17 0.00 -0.62 0.00 0.00 57.03 56.54 1tql h ASP 263 Cb 0.41 -0.13 -0.09 0.00 0.18 0.00 0.00 39.33 39.70 1tql h ASP 263 CO 0.00 0.43 0.61 1.88 -3.12 0.00 0.00 179.24 179.04 1tql h TYR 264 N 0.57 0.99 0.00 4.55 0.05 -1.95 0.32 116.97 121.50 1tql h TYR 264 Ca 0.15 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 1tql h TYR 264 Cb 0.05 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.49 1tql h TYR 264 CO 0.00 0.29 -0.05 0.82 -1.05 0.00 0.00 178.16 178.17 1tql h ILE 265 N 0.77 0.57 -0.13 -2.88 1.08 -1.39 -0.96 117.51 114.57 1tql h ILE 265 Ca 0.53 -0.23 -0.11 0.00 -0.39 0.00 0.00 64.86 64.66 1tql h ILE 265 Cb 0.82 1.15 -0.01 0.00 -3.07 0.00 0.00 36.82 35.70 1tql h ILE 265 CO -0.31 0.05 -0.38 0.44 -0.69 0.00 0.00 178.15 177.26 1tql h ASP 266 N 0.00 0.30 0.84 1.72 3.32 -0.41 -2.66 116.42 119.53 1tql h ASP 266 Ca -0.00 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 1tql h ASP 266 Cb 0.14 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1tql h ASP 266 CO 0.01 0.66 -0.35 1.88 -1.72 0.00 0.00 179.24 179.72 1tql h TYR 267 N 0.25 0.00 -0.08 4.55 0.99 -1.14 0.38 116.97 121.91 1tql h TYR 267 Ca 0.03 0.00 -0.06 0.00 2.00 0.00 0.00 58.73 60.69 1tql h TYR 267 Cb 0.79 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.52 1tql h TYR 267 CO 0.02 0.35 -0.20 -0.07 -0.00 0.00 0.00 178.16 178.26 1tql h LEU 268 N 0.00 0.32 0.57 3.88 3.38 -1.46 -3.27 115.31 118.74 1tql h LEU 268 Ca -0.00 -0.58 -0.03 0.00 0.09 0.00 0.00 57.88 57.36 1tql h LEU 268 Cb 0.86 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.53 1tql h LEU 268 CO 0.05 0.84 -0.28 -1.13 0.09 0.00 0.00 178.44 178.01 1tql h ASN 269 N -0.19 -0.65 -3.84 -0.43 -1.24 -1.24 -3.38 115.58 104.61 1tql h ASN 269 Ca -0.00 -0.02 -0.75 0.00 0.71 0.00 0.00 56.30 56.24 1tql h ASN 269 Cb 0.79 0.17 -0.29 0.00 0.73 0.00 0.00 38.32 39.72 1tql h ASN 269 CO 0.04 -0.27 -0.13 -2.28 -1.29 0.00 0.00 177.43 173.50 1tql s HIS 270 N -4.47 3.58 0.16 0.67 2.46 0.13 -0.68 115.29 117.14 1tql s HIS 270 Ca -0.13 -2.19 0.05 0.00 0.47 0.00 0.00 55.06 53.26 1tql s HIS 270 Cb 0.01 -3.57 -0.04 0.00 -0.13 0.00 0.00 32.58 28.85 1tql s HIS 270 CO 0.42 -0.94 0.13 -1.54 -2.47 0.00 0.00 174.74 170.34 1tql s SER 271 N 1.79 5.48 -0.22 9.88 1.04 -0.65 -4.41 113.70 126.62 1tql s SER 271 Ca 0.15 -0.14 -0.08 0.00 0.48 0.00 0.00 55.95 56.37 1tql s SER 271 Cb -0.16 -1.42 -0.04 0.00 0.10 0.00 0.00 66.02 64.50 1tql s SER 271 CO -0.05 0.07 0.07 -2.28 0.98 0.00 0.00 173.24 172.03 1tql s HIS 272 N -1.73 3.16 0.18 5.02 2.46 -1.26 -0.58 115.29 122.54 1tql s HIS 272 Ca 0.31 -0.16 0.10 0.00 0.47 0.00 0.00 55.06 55.79 1tql s HIS 272 Cb -0.10 -2.17 -0.04 0.00 -0.13 0.00 0.00 32.58 30.13 1tql s HIS 272 CO 0.23 -0.11 -0.22 -1.01 -2.47 0.00 0.00 174.74 171.16 1tql s HIS 273 N 1.05 2.14 -0.25 3.88 3.76 0.14 -0.38 115.29 125.64 1tql s HIS 273 Ca 0.04 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.56 1tql s HIS 273 Cb -0.14 -1.06 0.07 0.00 1.11 0.00 0.00 32.58 32.56 1tql s HIS 273 CO 0.03 0.45 -0.00 -0.51 -0.85 0.00 0.00 174.74 173.85 1tql s LEU 274 N -2.66 2.47 -0.28 0.89 1.43 -0.22 -1.54 118.68 118.77 1tql s LEU 274 Ca 0.19 -1.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.02 1tql s LEU 274 Cb -0.07 -1.06 0.08 0.00 0.03 0.00 0.00 46.19 45.16 1tql s LEU 274 CO 0.09 -0.29 0.00 -0.47 0.23 0.00 0.00 176.35 175.91 1tql s TYR 275 N 1.47 2.67 0.00 0.29 5.04 -0.62 -0.83 117.35 125.37 1tql s TYR 275 Ca -0.01 -2.12 0.00 0.00 -2.44 0.00 0.00 57.07 52.50 1tql s TYR 275 Cb -0.18 -1.99 0.00 0.00 0.35 0.00 0.00 41.96 40.14 1tql s TYR 275 CO -0.10 -0.85 0.00 1.17 -1.34 0.00 0.00 175.55 174.43 1tql n LYS 276 N 4.58 0.00 -0.00 4.97 3.00 -1.25 -2.05 118.16 127.41 1tql n LYS 276 Ca -0.06 0.00 0.07 0.00 -0.00 0.00 0.00 58.31 58.32 1tql n LYS 276 Cb 0.43 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.38 1tql n LYS 276 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1tql n ASN 277 N 9.80 0.71 -4.96 3.14 0.23 -1.26 0.13 115.26 123.04 1tql n ASN 277 Ca 0.00 -0.81 -0.22 0.00 -0.53 0.00 0.00 54.58 53.03 1tql n ASN 277 Cb 0.00 1.02 0.01 0.00 -2.08 0.00 0.00 39.78 38.74 1tql n ASN 277 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 1tql s LYS 278 N -2.37 3.00 -0.01 -3.83 1.02 -0.87 0.28 119.74 116.96 1tql s LYS 278 Ca 0.05 -0.64 -0.00 0.00 0.02 0.00 0.00 55.97 55.39 1tql s LYS 278 Cb 0.11 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.83 1tql s LYS 278 CO 0.59 -0.27 0.02 -0.08 -0.92 0.00 0.00 175.35 174.69 1tql s THR 279 N -2.51 -0.02 0.00 2.17 -1.32 -0.35 -1.59 115.64 112.02 1tql s THR 279 Ca 0.49 0.09 0.00 0.00 -1.21 0.00 0.00 61.69 61.06 1tql s THR 279 Cb -0.10 -0.05 0.00 0.00 -1.51 0.00 0.00 72.50 70.84 1tql s THR 279 CO 0.37 0.04 0.00 0.00 -2.21 0.00 0.00 174.62 172.81 1tql n TYR 280 N 3.52 0.00 -3.65 9.09 0.18 -0.59 -1.60 117.16 124.12 1tql n TYR 280 Ca -0.18 0.00 -0.02 0.00 1.88 0.00 0.00 57.90 59.58 1tql n TYR 280 Cb 0.56 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.46 1tql n TYR 280 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 1tql s VAL 282 N 1.38 0.00 -0.31 -3.48 1.01 0.26 0.25 120.40 119.50 1tql s VAL 282 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1tql s VAL 282 Cb 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.39 1tql s VAL 282 CO 0.00 0.00 0.11 -0.75 0.00 0.00 0.00 175.10 174.46 1tql s LYS 283 N 1.10 3.07 0.00 2.72 2.20 0.58 -1.64 119.74 127.78 1tql s LYS 283 Ca -0.07 -0.88 0.00 0.00 -0.36 0.00 0.00 55.97 54.66 1tql s LYS 283 Cb -0.03 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.83 1tql s LYS 283 CO -0.13 -0.48 0.00 0.41 -0.36 0.00 0.00 175.35 174.79 1tql n GLY 284 N 4.90 0.37 0.53 5.54 0.00 0.14 -1.30 105.19 115.38 1tql n GLY 284 Ca -0.14 -1.98 0.01 0.00 0.00 0.00 0.00 46.02 43.91 1tql n GLY 284 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tql n GLY 285 N 0.35 -3.16 3.80 -0.02 0.00 0.03 -4.72 105.19 101.47 1tql n GLY 285 Ca 0.00 -1.18 -0.37 0.00 0.00 0.00 0.00 46.02 44.47 1tql n GLY 285 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1tql s MET 286 N -4.28 3.93 0.22 1.61 1.75 -0.59 -4.40 119.30 117.54 1tql s MET 286 Ca 0.00 0.03 -0.28 0.00 -1.25 0.00 0.00 55.69 54.19 1tql s MET 286 Cb 0.00 -3.31 -0.09 0.00 2.84 0.00 0.00 34.83 34.27 1tql s MET 286 CO 0.00 0.50 0.89 -2.14 -0.65 0.00 0.00 175.02 173.62 1tql s PRO 287 N -0.31 4.76 0.46 4.11 0.02 -1.26 -4.56 135.00 138.22 1tql s PRO 287 Ca 0.16 1.38 0.24 0.00 0.02 0.00 0.00 61.00 62.80 1tql s PRO 287 Cb -0.13 -3.25 1.07 0.00 0.02 0.00 0.00 34.50 32.21 1tql s PRO 287 CO 0.05 0.52 1.90 0.66 -0.33 0.00 0.00 177.00 179.80 1tql h SER 288 N 4.15 0.00 -4.28 2.53 4.64 -1.86 -3.46 113.55 115.27 1tql h SER 288 Ca -0.46 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.21 1tql h SER 288 Cb 1.20 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.90 1tql h SER 288 CO 0.67 0.21 -0.57 -0.83 -0.87 0.00 0.00 176.83 175.45 1tql s GLY 289 N -4.26 2.43 -0.25 -0.77 0.00 -1.05 -4.88 107.32 98.54 1tql s GLY 289 Ca -0.01 -3.23 -0.11 0.00 0.00 0.00 0.00 44.72 41.37 1tql s GLY 289 CO 0.63 1.03 0.17 -0.45 0.00 0.00 0.00 173.10 174.47 1tql s SER 291 N 0.02 6.08 0.00 1.64 0.15 -1.26 -2.76 113.70 117.57 1tql s SER 291 Ca 0.17 0.07 0.00 0.00 0.70 0.00 0.00 55.95 56.89 1tql s SER 291 Cb -0.24 -2.11 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 1tql s SER 291 CO -0.01 0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.07 1tql n GLY 292 N 4.54 1.38 0.34 9.45 0.00 -1.26 -4.95 105.19 114.69 1tql n GLY 292 Ca -0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.98 1tql n GLY 292 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1tql n THR 293 N -2.00 -0.40 -0.08 2.61 -1.04 -1.26 -0.39 114.28 111.71 1tql n THR 293 Ca 0.00 2.16 -0.09 0.00 -2.04 0.00 0.00 64.05 64.08 1tql n THR 293 Cb 0.00 -3.08 -0.02 0.00 -1.82 0.00 0.00 70.33 65.41 1tql n THR 293 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1tql h SER 294 N 0.00 0.35 -0.32 8.00 0.87 -1.93 -0.99 113.55 119.52 1tql h SER 294 Ca 0.53 -0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.94 1tql h SER 294 Cb 0.98 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.84 1tql h SER 294 CO -0.95 0.31 -0.15 0.40 -0.53 0.00 0.00 176.83 175.92 1tql h ILE 295 N 0.36 1.29 -0.14 2.23 2.04 -1.14 -2.64 117.51 119.52 1tql h ILE 295 Ca 0.10 -1.25 -0.11 0.00 1.00 0.00 0.00 64.86 64.60 1tql h ILE 295 Cb 0.03 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1tql h ILE 295 CO -0.02 0.41 -0.38 -0.26 0.00 0.00 0.00 178.15 177.90 1tql h PHE 296 N 0.44 0.34 -0.36 1.37 0.04 -0.78 -0.47 116.94 117.53 1tql h PHE 296 Ca 0.07 -0.09 -0.09 0.00 2.80 0.00 0.00 57.97 60.66 1tql h PHE 296 Cb 0.68 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.73 1tql h PHE 296 CO 0.06 0.64 -0.17 -0.91 -0.60 0.00 0.00 178.31 177.33 1tql h ASN 297 N 0.25 0.65 -0.05 2.17 2.35 -1.14 -1.38 115.58 118.42 1tql h ASN 297 Ca 0.03 -0.20 -0.20 0.00 -0.55 0.00 0.00 56.30 55.38 1tql h ASN 297 Cb 0.79 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1tql h ASN 297 CO 0.06 0.83 -0.69 0.28 -1.65 0.00 0.00 177.43 176.26 1tql h SER 298 N 0.59 0.79 -0.57 5.81 0.02 -1.09 -1.53 113.55 117.56 1tql h SER 298 Ca 0.09 -0.49 -0.10 0.00 -0.84 0.00 0.00 61.79 60.46 1tql h SER 298 Cb 0.62 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1tql h SER 298 CO 0.04 1.26 -0.02 0.24 -1.14 0.00 0.00 176.83 177.21 1tql h MET 299 N 0.49 1.02 -0.03 3.45 2.86 -0.92 -1.91 114.93 119.89 1tql h MET 299 Ca -0.02 -0.34 -0.10 0.00 -2.06 0.00 0.00 59.70 57.18 1tql h MET 299 Cb 1.28 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.85 1tql h MET 299 CO 0.14 1.02 -0.45 0.82 1.06 0.00 0.00 176.91 179.50 1tql h ILE 300 N 0.91 1.33 -0.28 -1.22 2.04 -1.22 -2.08 117.51 116.98 1tql h ILE 300 Ca 0.16 -1.58 -0.12 0.00 1.00 0.00 0.00 64.86 64.32 1tql h ILE 300 Cb 0.58 1.81 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 1tql h ILE 300 CO 0.03 0.46 -0.31 -1.13 0.00 0.00 0.00 178.15 177.20 1tql h ASN 301 N 0.07 0.61 -0.59 1.72 -0.73 -0.83 0.23 115.58 116.06 1tql h ASN 301 Ca 0.00 -0.24 -0.06 0.00 1.87 0.00 0.00 56.30 57.88 1tql h ASN 301 Cb 0.83 -0.17 -0.02 0.00 0.27 0.00 0.00 38.32 39.22 1tql h ASN 301 CO 0.06 0.88 0.14 0.78 -0.37 0.00 0.00 177.43 178.93 1tql h ASN 302 N 0.51 0.89 -0.53 1.15 2.35 -1.00 -0.19 115.58 118.76 1tql h ASN 302 Ca 0.06 -0.23 -0.07 0.00 -0.55 0.00 0.00 56.30 55.51 1tql h ASN 302 Cb 0.79 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.90 1tql h ASN 302 CO 0.06 0.89 0.06 -0.07 -1.65 0.00 0.00 177.43 176.72 1tql h LEU 303 N 0.85 0.87 0.75 1.61 3.38 -0.85 -2.60 115.31 119.32 1tql h LEU 303 Ca 0.18 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1tql h LEU 303 Cb 0.35 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.87 1tql h LEU 303 CO 0.00 0.93 -0.36 0.40 0.09 0.00 0.00 178.44 179.50 1tql h ILE 304 N 0.78 0.25 -0.57 1.22 2.04 -0.14 -0.89 117.51 120.19 1tql h ILE 304 Ca 0.16 -0.03 0.09 0.00 1.00 0.00 0.00 64.86 66.08 1tql h ILE 304 Cb 0.45 0.26 -0.07 0.00 -0.74 0.00 0.00 36.82 36.72 1tql h ILE 304 CO 0.02 0.00 0.19 0.40 0.00 0.00 0.00 178.15 178.76 1tql h ILE 305 N -1.03 0.77 -0.55 -0.67 1.08 -1.09 -1.36 117.51 114.65 1tql h ILE 305 Ca -0.10 -0.13 0.01 0.00 -0.39 0.00 0.00 64.86 64.25 1tql h ILE 305 Cb 0.78 0.37 -0.03 0.00 -3.07 0.00 0.00 36.82 34.87 1tql h ILE 305 CO 0.17 0.07 0.37 0.03 -0.69 0.00 0.00 178.15 178.09 1tql h ARG 306 N 0.37 0.73 -0.01 2.37 3.08 -1.37 -2.38 114.38 117.16 1tql h ARG 306 Ca 0.29 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1tql h ARG 306 Cb 0.36 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 1tql h ARG 306 CO -0.30 0.48 0.01 1.15 -1.07 0.00 0.00 179.97 180.23 1tql h THR 307 N 0.75 1.02 -0.19 2.04 2.02 -0.38 -1.25 112.91 116.92 1tql h THR 307 Ca 0.20 -0.06 -0.02 0.00 0.77 0.00 0.00 66.41 67.30 1tql h THR 307 Cb -0.09 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 1tql h THR 307 CO -0.04 0.02 0.01 -0.07 0.37 0.00 0.00 175.52 175.80 1tql h LEU 308 N -0.01 0.24 -0.37 2.58 3.38 -1.19 -1.56 115.31 118.39 1tql h LEU 308 Ca 0.00 -0.03 -0.19 0.00 0.09 0.00 0.00 57.88 57.76 1tql h LEU 308 Cb 0.02 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 1tql h LEU 308 CO -0.00 0.29 -0.74 -0.07 0.09 0.00 0.00 178.44 178.01 1tql h LEU 309 N 0.27 0.55 -0.62 1.67 3.38 -1.12 -2.19 115.31 117.24 1tql h LEU 309 Ca 0.06 -0.36 -0.14 0.00 0.09 0.00 0.00 57.88 57.53 1tql h LEU 309 Cb 0.17 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1tql h LEU 309 CO 0.00 1.11 -0.46 -0.07 0.09 0.00 0.00 178.44 179.11 1tql h LEU 310 N 0.31 0.59 -0.16 1.67 3.38 -0.64 0.76 115.31 121.23 1tql h LEU 310 Ca -0.03 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1tql h LEU 310 Cb 1.32 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1tql h LEU 310 CO 0.13 0.96 -0.15 0.50 0.09 0.00 0.00 178.44 179.98 1tql h LYS 311 N 0.44 0.00 0.00 1.13 3.64 -1.29 -3.29 116.57 117.20 1tql h LYS 311 Ca 0.03 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.08 1tql h LYS 311 Cb 0.97 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.73 1tql h LYS 311 CO 0.09 0.15 -2.24 2.41 -2.27 0.00 0.00 179.45 177.59 1tql n THR 312 N -3.15 1.24 -3.23 1.00 -1.04 -0.83 -4.77 114.28 103.50 1tql n THR 312 Ca 0.03 -0.60 -0.25 0.00 -2.04 0.00 0.00 64.05 61.19 1tql n THR 312 Cb 0.57 -0.96 -0.06 0.00 -1.82 0.00 0.00 70.33 68.05 1tql n THR 312 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1tql n TYR 313 N -2.93 2.61 -1.57 -1.42 4.01 0.25 -5.08 117.16 113.02 1tql n TYR 313 Ca -0.35 -3.97 -0.46 0.00 -0.16 0.00 0.00 57.90 52.97 1tql n TYR 313 Cb 0.99 -0.49 -0.02 0.00 -0.31 0.00 0.00 39.34 39.51 1tql n TYR 313 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1tql n LYS 314 N 0.63 1.21 -0.32 -0.72 4.81 -1.24 -1.05 118.16 121.48 1tql n LYS 314 Ca 0.28 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 1tql n LYS 314 Cb 0.45 -1.80 0.00 0.00 0.02 0.00 0.00 35.03 33.71 1tql n LYS 314 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1tql n GLY 315 N 1.48 0.97 3.75 3.14 0.00 -1.26 -5.04 105.19 108.22 1tql n GLY 315 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 1tql n GLY 315 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1tql s ILE 316 N -2.80 2.38 -0.61 -0.61 2.07 -0.21 -4.97 121.20 116.46 1tql s ILE 316 Ca 0.00 0.26 -0.15 0.00 -1.41 0.00 0.00 60.65 59.35 1tql s ILE 316 Cb 0.00 -3.12 0.15 0.00 0.13 0.00 0.00 42.46 39.62 1tql s ILE 316 CO 0.00 -0.03 0.55 -0.62 -1.91 0.00 0.00 174.94 172.93 1tql s ASP 317 N -1.32 6.28 0.45 4.50 2.15 -1.26 -4.91 116.67 122.56 1tql s ASP 317 Ca 0.75 -2.03 0.14 0.00 0.43 0.00 0.00 52.55 51.84 1tql s ASP 317 Cb -0.35 -2.19 1.05 0.00 -0.30 0.00 0.00 42.92 41.13 1tql s ASP 317 CO 0.39 -0.77 2.02 -0.07 -0.17 0.00 0.00 175.17 176.57 1tql h LEU 318 N 8.57 0.32 -1.18 -1.34 3.38 -1.95 0.13 115.31 123.23 1tql h LEU 318 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1tql h LEU 318 Cb 1.08 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1tql h LEU 318 CO 0.95 0.20 0.07 0.47 0.09 0.00 0.00 178.44 180.22 1tql n ASP 319 N -4.47 0.46 -0.64 -0.43 9.92 -1.26 0.91 116.55 121.04 1tql n ASP 319 Ca 0.07 0.69 0.07 0.00 -0.53 0.00 0.00 54.79 55.09 1tql n ASP 319 Cb 0.30 -0.73 0.18 0.00 -0.64 0.00 0.00 41.12 40.22 1tql n ASP 319 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1tql n HIS 320 N -2.14 0.57 -3.15 1.24 8.25 0.45 -4.88 115.22 115.56 1tql n HIS 320 Ca -0.01 -0.68 -0.40 0.00 -0.26 0.00 0.00 57.72 56.37 1tql n HIS 320 Cb 0.09 -0.15 -0.06 0.00 1.12 0.00 0.00 29.99 30.99 1tql n HIS 320 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1tql s LEU 321 N -1.83 4.13 -0.27 2.41 2.96 0.26 -4.20 118.68 122.14 1tql s LEU 321 Ca 0.29 0.76 0.03 0.00 -0.22 0.00 0.00 54.13 54.99 1tql s LEU 321 Cb 0.21 -2.83 0.07 0.00 0.50 0.00 0.00 46.19 44.13 1tql s LEU 321 CO 0.11 -0.27 -0.07 -0.54 -1.32 0.00 0.00 176.35 174.26 1tql s LYS 322 N 1.95 1.95 0.07 1.98 -0.14 -0.94 -5.01 119.74 119.60 1tql s LYS 322 Ca 0.27 -1.35 0.01 0.00 -1.36 0.00 0.00 55.97 53.54 1tql s LYS 322 Cb -0.16 -2.85 -0.04 0.00 -1.68 0.00 0.00 37.83 33.10 1tql s LYS 322 CO 0.10 -0.64 -0.05 0.00 -0.76 0.00 0.00 175.35 173.99 1tql s MET 323 N 1.15 0.69 -0.03 1.68 0.23 -1.26 -0.56 119.30 121.20 1tql s MET 323 Ca -0.05 -1.18 -0.01 0.00 -1.03 0.00 0.00 55.69 53.42 1tql s MET 323 Cb -0.20 -0.07 0.03 0.00 -1.53 0.00 0.00 34.83 33.06 1tql s MET 323 CO -0.06 -0.04 0.05 0.42 -2.03 0.00 0.00 175.02 173.36 1tql s ILE 324 N -3.29 -0.09 0.25 3.16 1.01 0.03 -4.40 121.20 117.88 1tql s ILE 324 Ca 0.06 0.34 0.10 0.00 0.00 0.00 0.00 60.65 61.15 1tql s ILE 324 Cb 0.03 -0.13 -0.05 0.00 0.01 0.00 0.00 42.46 42.33 1tql s ILE 324 CO -0.05 0.14 -0.11 0.00 0.00 0.00 0.00 174.94 174.92 1tql s ALA 325 N 1.71 2.93 -0.39 9.38 0.00 -0.04 -1.39 121.76 133.97 1tql s ALA 325 Ca -0.01 -1.71 0.03 0.00 0.00 0.00 0.00 51.96 50.27 1tql s ALA 325 Cb -0.12 -0.55 0.16 0.00 0.00 0.00 0.00 23.12 22.60 1tql s ALA 325 CO -0.03 0.31 0.33 -0.47 0.00 0.00 0.00 175.76 175.90 1tql s TYR 326 N -2.25 0.38 0.00 0.00 6.14 0.33 -0.41 117.35 121.56 1tql s TYR 326 Ca 0.29 -1.54 0.00 0.00 0.64 0.00 0.00 57.07 56.46 1tql s TYR 326 Cb -0.06 -0.68 0.00 0.00 0.42 0.00 0.00 41.96 41.63 1tql s TYR 326 CO 0.17 -0.90 0.00 0.41 0.64 0.00 0.00 175.55 175.87 1tql n GLY 327 N 3.66 1.36 0.07 8.97 0.00 -1.26 -2.48 105.19 115.51 1tql n GLY 327 Ca 0.18 -0.52 -0.06 0.00 0.00 0.00 0.00 46.02 45.62 1tql n GLY 327 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1tql h ASP 328 N 0.00 0.00 -3.92 1.61 2.03 -1.94 -3.36 116.42 110.84 1tql h ASP 328 Ca 0.00 0.00 -0.53 0.00 -0.73 0.00 0.00 57.03 55.77 1tql h ASP 328 Cb 0.00 0.00 0.08 0.00 -0.83 0.00 0.00 39.33 38.58 1tql h ASP 328 CO 0.00 0.96 0.66 -0.62 -1.03 0.00 0.00 179.24 179.22 1tql s ASP 329 N -6.63 6.49 -0.04 4.15 -1.08 -1.04 -4.86 116.67 113.68 1tql s ASP 329 Ca 0.01 2.77 -0.21 0.00 -0.52 0.00 0.00 52.55 54.60 1tql s ASP 329 Cb 0.10 -2.65 0.04 0.00 -1.46 0.00 0.00 42.92 38.95 1tql s ASP 329 CO 0.82 -0.74 0.46 0.54 0.52 0.00 0.00 175.17 176.77 1tql s VAL 330 N -1.18 0.03 -0.10 1.11 0.11 -1.26 -0.51 120.40 118.61 1tql s VAL 330 Ca 0.53 -0.27 0.00 0.00 -2.93 0.00 0.00 61.98 59.30 1tql s VAL 330 Cb -0.41 -0.76 0.02 0.00 -1.53 0.00 0.00 36.38 33.70 1tql s VAL 330 CO 0.54 -0.15 -0.08 -0.51 -3.33 0.00 0.00 175.10 171.57 1tql s ILE 331 N -1.20 1.03 0.20 7.04 2.07 -0.48 -4.76 121.20 125.09 1tql s ILE 331 Ca -0.12 -0.32 0.04 0.00 -1.41 0.00 0.00 60.65 58.84 1tql s ILE 331 Cb -0.03 -1.02 -0.05 0.00 0.13 0.00 0.00 42.46 41.48 1tql s ILE 331 CO 0.06 0.36 -0.03 0.00 -1.91 0.00 0.00 174.94 173.42 1tql s ALA 332 N 1.47 1.64 0.15 1.50 0.00 -1.15 -0.79 121.76 124.59 1tql s ALA 332 Ca 0.00 -1.66 -0.18 0.00 0.00 0.00 0.00 51.96 50.12 1tql s ALA 332 Cb -0.13 0.37 0.04 0.00 0.00 0.00 0.00 23.12 23.40 1tql s ALA 332 CO -0.05 -0.21 0.48 -1.54 0.00 0.00 0.00 175.76 174.43 1tql s SER 333 N -3.25 -0.31 -0.01 0.00 1.04 0.28 -1.16 113.70 110.29 1tql s SER 333 Ca 0.24 -0.30 -0.18 0.00 0.48 0.00 0.00 55.95 56.19 1tql s SER 333 Cb 0.05 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.73 1tql s SER 333 CO 0.06 -0.93 0.39 -0.47 0.98 0.00 0.00 173.24 173.26 1tql s TYR 334 N -3.81 -0.27 0.58 5.02 5.04 0.11 -2.20 117.35 121.81 1tql s TYR 334 Ca 0.04 0.40 0.28 0.00 -2.44 0.00 0.00 57.07 55.35 1tql s TYR 334 Cb 0.00 0.17 1.65 0.00 0.35 0.00 0.00 41.96 44.13 1tql s TYR 334 CO -0.10 -0.46 2.12 -1.35 -1.34 0.00 0.00 175.55 174.43 1tql h PRO 335 N 3.58 0.00 -6.51 4.97 0.11 -1.85 -0.81 132.00 131.50 1tql h PRO 335 Ca -0.29 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.18 1tql h PRO 335 Cb 1.17 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.12 1tql h PRO 335 CO 0.41 0.00 -0.79 -1.01 -0.21 0.00 0.00 178.00 176.40 1tql s HIS 336 N -4.68 2.39 0.57 0.65 3.76 -1.26 -4.35 115.29 112.36 1tql s HIS 336 Ca -0.05 -0.32 -0.20 0.00 -0.15 0.00 0.00 55.06 54.35 1tql s HIS 336 Cb 0.16 -1.15 -0.04 0.00 1.11 0.00 0.00 32.58 32.65 1tql s HIS 336 CO 0.56 0.54 1.22 -2.00 -0.85 0.00 0.00 174.74 174.21 1tql s GLU 337 N -2.85 3.10 0.10 1.40 2.12 -1.26 -4.79 118.70 116.51 1tql s GLU 337 Ca 0.23 1.87 0.03 0.00 0.36 0.00 0.00 54.97 57.46 1tql s GLU 337 Cb -0.08 -2.03 -0.04 0.00 0.26 0.00 0.00 34.13 32.25 1tql s GLU 337 CO 0.12 -1.12 -0.08 0.14 -0.54 0.00 0.00 175.26 173.78 1tql s VAL 338 N -1.55 0.84 -0.62 3.70 -7.23 -1.26 -5.12 120.40 109.15 1tql s VAL 338 Ca 0.75 -1.79 -0.16 0.00 -1.81 0.00 0.00 61.98 58.97 1tql s VAL 338 Cb -0.31 -1.51 0.15 0.00 0.56 0.00 0.00 36.38 35.26 1tql s VAL 338 CO 0.35 -0.71 0.60 -0.62 -0.31 0.00 0.00 175.10 174.41 1tql s ASP 339 N -2.74 6.33 0.36 4.85 2.15 -1.26 -4.91 116.67 121.44 1tql s ASP 339 Ca 0.09 -1.97 0.12 0.00 0.43 0.00 0.00 52.55 51.22 1tql s ASP 339 Cb 0.01 -2.23 0.92 0.00 -0.30 0.00 0.00 42.92 41.32 1tql s ASP 339 CO -0.02 -0.83 1.79 0.00 -0.17 0.00 0.00 175.17 175.95 1tql h ALA 340 N 8.66 1.94 -0.74 3.66 0.00 -1.95 0.10 119.26 130.93 1tql h ALA 340 Ca -0.19 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.79 1tql h ALA 340 Cb 1.08 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.79 1tql h ALA 340 CO 0.98 -0.31 0.48 1.03 0.00 0.00 0.00 179.25 181.44 1tql h SER 341 N 0.58 0.83 0.28 0.00 0.87 -1.92 0.25 113.55 114.43 1tql h SER 341 Ca 0.56 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 61.09 1tql h SER 341 Cb 1.12 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.89 1tql h SER 341 CO -0.31 0.59 -0.14 -0.07 -0.53 0.00 0.00 176.83 176.37 1tql h LEU 342 N 0.98 -0.32 -0.94 2.23 3.38 -1.25 -2.60 115.31 116.78 1tql h LEU 342 Ca 0.28 -0.11 0.18 0.00 0.09 0.00 0.00 57.88 58.32 1tql h LEU 342 Cb -0.08 0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.65 1tql h LEU 342 CO -0.07 -0.07 0.53 -0.07 0.09 0.00 0.00 178.44 178.84 1tql h LEU 343 N -0.57 0.64 -1.86 1.67 3.38 -0.93 0.45 115.31 118.10 1tql h LEU 343 Ca -0.04 0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1tql h LEU 343 Cb 0.41 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1tql h LEU 343 CO 0.06 0.22 -0.09 0.00 0.09 0.00 0.00 178.44 178.72 1tql h ALA 344 N 1.63 1.81 0.18 1.53 0.00 -0.29 -1.03 119.26 123.09 1tql h ALA 344 Ca 0.54 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.37 1tql h ALA 344 Cb 0.86 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1tql h ALA 344 CO -0.40 0.11 -0.09 0.37 0.00 0.00 0.00 179.25 179.24 1tql h GLN 345 N 0.00 -0.23 -0.75 0.00 4.15 0.25 -2.92 115.11 115.60 1tql h GLN 345 Ca -0.00 0.02 0.10 0.00 0.77 0.00 0.00 58.65 59.54 1tql h GLN 345 Cb 0.16 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 27.83 1tql h GLN 345 CO 0.01 0.18 0.39 0.77 -1.93 0.00 0.00 178.83 178.24 1tql h SER 346 N -0.79 0.51 -0.55 -0.69 0.02 -1.05 -0.76 113.55 110.24 1tql h SER 346 Ca -0.02 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.06 1tql h SER 346 Cb 0.52 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1tql h SER 346 CO 0.04 0.28 0.37 1.23 -1.14 0.00 0.00 176.83 177.61 1tql h GLY 347 N 0.64 0.60 2.00 -3.77 0.00 -1.22 -0.16 103.07 101.16 1tql h GLY 347 Ca 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.51 1tql h GLY 347 CO -0.28 0.14 -0.04 1.70 0.00 0.00 0.00 176.54 178.06 1tql h LYS 348 N 0.47 0.00 0.00 4.80 3.64 -0.93 0.71 116.57 125.26 1tql h LYS 348 Ca 0.24 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.55 1tql h LYS 348 Cb 0.35 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1tql h LYS 348 CO -0.07 0.04 -0.32 -0.44 -2.27 0.00 0.00 179.45 176.39 1tql h ASP 349 N 0.00 0.00 -0.52 4.20 3.32 -1.01 -2.85 116.42 119.56 1tql h ASP 349 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1tql h ASP 349 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1tql h ASP 349 CO 0.01 0.32 0.00 -1.22 -1.72 0.00 0.00 179.24 176.62 1tql n TYR 350 N -3.42 0.68 -0.11 4.55 4.01 0.10 -4.79 117.16 118.18 1tql n TYR 350 Ca 0.00 -0.34 0.00 0.00 -0.16 0.00 0.00 57.90 57.40 1tql n TYR 350 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.53 1tql n TYR 350 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1tql n GLY 351 N 1.41 1.12 3.80 2.72 0.00 -0.95 -4.71 105.19 108.59 1tql n GLY 351 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1tql n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tql s LEU 352 N 0.00 4.38 -0.63 0.99 1.43 -0.36 -4.87 118.68 119.61 1tql s LEU 352 Ca 0.00 1.50 -0.02 0.00 -1.03 0.00 0.00 54.13 54.59 1tql s LEU 352 Cb 0.00 -3.58 0.16 0.00 0.03 0.00 0.00 46.19 42.80 1tql s LEU 352 CO 0.00 0.05 0.44 -0.89 0.23 0.00 0.00 176.35 176.18 1tql s THR 353 N -1.47 3.57 -0.13 5.49 2.01 -1.26 -2.93 115.64 120.92 1tql s THR 353 Ca 0.43 -3.13 -0.14 0.00 0.31 0.00 0.00 61.69 59.15 1tql s THR 353 Cb -0.18 -3.34 -0.05 0.00 0.01 0.00 0.00 72.50 68.95 1tql s THR 353 CO 0.22 -0.89 0.32 -0.04 -0.69 0.00 0.00 174.62 173.55 1tql s MET 354 N -0.25 4.15 0.22 4.92 -1.94 -1.26 -1.83 119.30 123.31 1tql s MET 354 Ca 0.18 0.17 0.02 0.00 -1.71 0.00 0.00 55.69 54.35 1tql s MET 354 Cb -0.20 -3.38 -0.05 0.00 2.01 0.00 0.00 34.83 33.22 1tql s MET 354 CO -0.04 0.34 0.05 0.95 -0.01 0.00 0.00 175.02 176.32 1tql s THR 355 N 0.13 0.65 0.17 2.05 -4.23 -0.12 -4.83 115.64 109.47 1tql s THR 355 Ca 0.19 -2.00 -0.32 0.00 -1.18 0.00 0.00 61.69 58.38 1tql s THR 355 Cb -0.14 -2.42 -0.16 0.00 1.34 0.00 0.00 72.50 71.12 1tql s THR 355 CO 0.06 -0.21 1.00 -2.65 -0.54 0.00 0.00 174.62 172.28 1tql n PRO 356 N -0.38 0.81 -1.65 3.99 -0.02 -1.26 -0.18 135.00 136.31 1tql n PRO 356 Ca -0.03 0.29 -0.47 0.00 -2.02 0.00 0.00 63.50 61.27 1tql n PRO 356 Cb 0.65 -1.67 -0.04 0.00 -0.02 0.00 0.00 33.50 32.42 1tql n PRO 356 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tql n ALA 357 N 1.00 0.82 -3.67 3.55 0.00 -1.26 -3.07 120.51 117.87 1tql n ALA 357 Ca 0.15 0.46 -0.29 0.00 0.00 0.00 0.00 53.44 53.76 1tql n ALA 357 Cb 0.24 -2.28 0.04 0.00 0.00 0.00 0.00 19.45 17.45 1tql n ALA 357 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1tql n ASP 358 N 3.06 -4.82 -3.88 0.00 8.00 -1.26 -2.74 116.55 114.91 1tql n ASP 358 Ca 0.17 -0.98 -0.30 0.00 0.71 0.00 0.00 54.79 54.38 1tql n ASP 358 Cb 0.27 -3.52 -0.03 0.00 -0.02 0.00 0.00 41.12 37.81 1tql n ASP 358 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1tql n LYS 359 N -4.14 -2.53 -1.42 -1.24 5.02 -1.18 -4.94 118.16 107.73 1tql n LYS 359 Ca -0.12 0.29 -0.31 0.00 -2.02 0.00 0.00 58.31 56.15 1tql n LYS 359 Cb 0.60 -4.95 0.07 0.00 -0.02 0.00 0.00 35.03 30.73 1tql n LYS 359 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1tql s SER 360 N -2.97 4.93 0.13 4.39 0.01 -1.11 -4.95 113.70 114.14 1tql s SER 360 Ca 0.59 1.73 -0.14 0.00 1.31 0.00 0.00 55.95 59.45 1tql s SER 360 Cb -0.33 -2.51 -0.00 0.00 0.21 0.00 0.00 66.02 63.39 1tql s SER 360 CO 0.73 -1.75 1.60 0.00 0.41 0.00 0.00 173.24 174.23 1tql h ALA 361 N -0.89 0.59 -2.84 1.44 0.00 -1.92 -3.42 119.26 112.21 1tql h ALA 361 Ca -0.44 -0.24 -0.23 0.00 0.00 0.00 0.00 54.91 54.00 1tql h ALA 361 Cb 1.22 -0.16 -0.10 0.00 0.00 0.00 0.00 17.79 18.75 1tql h ALA 361 CO 0.54 0.34 -0.27 0.95 0.00 0.00 0.00 179.25 180.80 1tql s THR 362 N -5.11 0.00 -0.63 0.00 -4.23 -1.26 -4.93 115.64 99.48 1tql s THR 362 Ca -0.13 -1.65 -0.27 0.00 -1.18 0.00 0.00 61.69 58.46 1tql s THR 362 Cb 0.11 -2.49 -0.01 0.00 1.34 0.00 0.00 72.50 71.44 1tql s THR 362 CO 0.80 0.00 1.71 -0.36 -0.54 0.00 0.00 174.62 176.23 1tql s PHE 363 N -3.53 1.83 0.28 3.99 0.08 -1.26 -4.83 117.98 114.54 1tql s PHE 363 Ca 0.31 0.59 0.08 0.00 0.12 0.00 0.00 56.93 58.02 1tql s PHE 363 Cb 0.01 -4.22 -0.04 0.00 -0.57 0.00 0.00 43.02 38.20 1tql s PHE 363 CO 0.16 -2.26 0.16 -1.21 -0.10 0.00 0.00 175.22 171.97 1tql s GLU 364 N 6.64 2.69 0.30 0.44 0.41 -1.26 -4.96 118.70 122.96 1tql s GLU 364 Ca 0.60 -1.23 -0.30 0.00 -0.41 0.00 0.00 54.97 53.64 1tql s GLU 364 Cb -0.12 -2.41 -0.12 0.00 -1.78 0.00 0.00 34.13 29.69 1tql s GLU 364 CO 0.20 0.32 1.40 2.41 -0.49 0.00 0.00 175.26 179.10 1tql n THR 365 N -1.13 1.45 -3.56 3.63 -1.04 -1.26 -4.96 114.28 107.40 1tql n THR 365 Ca -0.06 -0.36 -0.37 0.00 -2.04 0.00 0.00 64.05 61.22 1tql n THR 365 Cb 0.59 -1.63 -0.09 0.00 -1.82 0.00 0.00 70.33 67.38 1tql n THR 365 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1tql s VAL 366 N -0.53 5.30 0.29 12.58 1.01 -1.26 -5.01 120.40 132.78 1tql s VAL 366 Ca 0.61 0.39 0.05 0.00 0.00 0.00 0.00 61.98 63.03 1tql s VAL 366 Cb -0.58 -3.59 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1tql s VAL 366 CO 0.55 0.32 -0.00 0.42 0.00 0.00 0.00 175.10 176.39 1tql s THR 367 N 1.08 1.37 0.45 3.92 -4.23 -1.26 -4.40 115.64 112.57 1tql s THR 367 Ca 0.12 -2.05 0.40 0.00 -1.18 0.00 0.00 61.69 58.98 1tql s THR 367 Cb -0.14 -2.58 0.42 0.00 1.34 0.00 0.00 72.50 71.54 1tql s THR 367 CO 0.05 -0.18 2.22 -0.50 -0.54 0.00 0.00 174.62 175.67 1tql h TRP 368 N 2.24 0.00 -0.04 3.99 4.06 -1.95 0.23 115.95 124.48 1tql h TRP 368 Ca -0.40 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 60.32 1tql h TRP 368 Cb 1.24 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 29.41 1tql h TRP 368 CO 0.62 0.00 -0.86 1.49 -3.56 0.00 0.00 178.44 176.13 1tql h GLU 369 N 0.00 0.65 -0.00 0.49 4.22 -1.95 -3.38 114.58 114.60 1tql h GLU 369 Ca 0.00 -0.65 0.00 0.00 0.08 0.00 0.00 59.36 58.79 1tql h GLU 369 Cb 0.12 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1tql h GLU 369 CO 0.00 1.25 -0.48 0.27 -2.18 0.00 0.00 179.01 177.87 1tql n ASN 370 N -3.98 0.69 -4.77 1.04 2.04 -0.69 -4.86 115.26 104.72 1tql n ASN 370 Ca -0.10 -0.84 -0.36 0.00 -0.44 0.00 0.00 54.58 52.84 1tql n ASN 370 Cb 0.79 0.90 -0.00 0.00 -2.53 0.00 0.00 39.78 38.94 1tql n ASN 370 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1tql s VAL 371 N -1.96 3.15 0.05 3.53 0.11 0.72 -4.91 120.40 121.09 1tql s VAL 371 Ca 0.05 0.76 0.01 0.00 -2.93 0.00 0.00 61.98 59.87 1tql s VAL 371 Cb 0.09 -3.33 -0.03 0.00 -1.53 0.00 0.00 36.38 31.57 1tql s VAL 371 CO 0.43 -0.11 -0.05 0.42 -3.33 0.00 0.00 175.10 172.46 1tql s THR 372 N -1.70 0.42 -0.13 5.04 -4.23 -1.26 -4.17 115.64 109.61 1tql s THR 372 Ca 0.70 -1.40 -0.05 0.00 -1.18 0.00 0.00 61.69 59.76 1tql s THR 372 Cb -0.25 -0.98 0.06 0.00 1.34 0.00 0.00 72.50 72.67 1tql s THR 372 CO 0.29 -0.66 0.27 0.12 -0.54 0.00 0.00 174.62 174.10 1tql s PHE 373 N -2.47 -0.41 -1.40 3.99 5.36 -0.47 -4.80 117.98 117.78 1tql s PHE 373 Ca -0.03 0.94 -0.05 0.00 -0.96 0.00 0.00 56.93 56.84 1tql s PHE 373 Cb -0.03 0.01 0.01 0.00 -0.34 0.00 0.00 43.02 42.67 1tql s PHE 373 CO -0.03 -0.32 0.63 1.28 -1.46 0.00 0.00 175.22 175.31 1tql n LEU 374 N 4.99 -2.69 0.00 6.12 4.77 -1.26 -1.61 117.00 127.32 1tql n LEU 374 Ca -0.12 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1tql n LEU 374 Cb 0.51 -2.77 0.00 0.00 -2.33 0.00 0.00 43.42 38.83 1tql n LEU 374 CO 0.06 0.27 0.00 0.29 -1.33 0.00 0.00 177.39 176.68 1tql n LYS 375 N -3.86 0.00 -3.62 3.23 5.02 -1.26 -4.97 118.16 112.70 1tql n LYS 375 Ca -0.09 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.83 1tql n LYS 375 Cb 0.60 -3.52 -0.06 0.00 -0.02 0.00 0.00 35.03 32.03 1tql n LYS 375 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1tql s ARG 376 N -0.47 3.83 0.85 1.97 0.52 -0.63 -4.34 118.95 120.67 1tql s ARG 376 Ca 0.00 0.19 -0.09 0.00 -0.52 0.00 0.00 55.73 55.32 1tql s ARG 376 Cb 0.00 -3.25 0.17 0.00 0.52 0.00 0.00 34.95 32.39 1tql s ARG 376 CO 0.00 0.64 1.17 -0.06 0.02 0.00 0.00 175.30 177.07 1tql s PHE 377 N -0.79 1.53 -0.16 -0.53 0.40 0.06 -1.37 117.98 117.11 1tql s PHE 377 Ca 0.20 0.01 0.01 0.00 -0.60 0.00 0.00 56.93 56.54 1tql s PHE 377 Cb -0.15 -3.58 0.02 0.00 0.51 0.00 0.00 43.02 39.83 1tql s PHE 377 CO 0.09 -2.22 -0.18 -0.06 0.70 0.00 0.00 175.22 173.54 1tql s PHE 378 N -3.54 2.53 -0.05 0.36 0.40 -1.26 -1.74 117.98 114.69 1tql s PHE 378 Ca 0.71 -1.43 -0.01 0.00 -0.60 0.00 0.00 56.93 55.60 1tql s PHE 378 Cb -0.04 -1.78 0.03 0.00 0.51 0.00 0.00 43.02 41.74 1tql s PHE 378 CO 0.49 -0.71 0.02 1.03 0.70 0.00 0.00 175.22 176.74 1tql s ARG 379 N 1.25 0.34 0.37 0.44 1.81 -0.97 -4.77 118.95 117.41 1tql s ARG 379 Ca 0.02 0.18 -0.27 0.00 -1.72 0.00 0.00 55.73 53.94 1tql s ARG 379 Cb -0.13 -0.72 -0.09 0.00 -0.45 0.00 0.00 34.95 33.55 1tql s ARG 379 CO -0.10 -0.27 1.29 0.00 -0.68 0.00 0.00 175.30 175.54 1tql s ALA 380 N 1.79 3.35 0.18 2.13 0.00 -1.26 0.70 121.76 128.66 1tql s ALA 380 Ca 0.01 1.21 -0.31 0.00 0.00 0.00 0.00 51.96 52.87 1tql s ALA 380 Cb -0.13 -3.47 -0.10 0.00 0.00 0.00 0.00 23.12 19.42 1tql s ALA 380 CO -0.04 -0.71 1.56 0.34 0.00 0.00 0.00 175.76 176.92 1tql s ASP 381 N -0.67 6.57 0.60 0.00 2.15 0.11 -4.82 116.67 120.61 1tql s ASP 381 Ca 0.53 2.65 0.37 0.00 0.43 0.00 0.00 52.55 56.53 1tql s ASP 381 Cb -0.38 -2.60 1.99 0.00 -0.30 0.00 0.00 42.92 41.63 1tql s ASP 381 CO 0.49 -0.82 2.12 -0.33 -0.17 0.00 0.00 175.17 176.46 1tql h GLU 382 N 6.47 0.00 0.00 4.34 5.08 -1.92 -2.29 114.58 126.27 1tql h GLU 382 Ca -0.43 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 57.67 1tql h GLU 382 Cb 1.21 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.41 1tql h GLU 382 CO 0.89 0.00 -1.99 1.63 -1.00 0.00 0.00 179.01 178.54 1tql n LYS 383 N -2.86 0.61 -3.64 2.33 5.02 -1.26 -4.78 118.16 113.59 1tql n LYS 383 Ca -0.02 0.09 -0.27 0.00 -2.02 0.00 0.00 58.31 56.08 1tql n LYS 383 Cb 0.14 -1.35 -0.10 0.00 -0.02 0.00 0.00 35.03 33.70 1tql n LYS 383 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1tql n TYR 384 N -2.95 2.01 -0.52 2.13 4.02 -1.14 -4.98 117.16 115.72 1tql n TYR 384 Ca -0.30 -3.98 0.44 0.00 -0.01 0.00 0.00 57.90 54.05 1tql n TYR 384 Cb 0.85 -0.37 0.73 0.00 -0.02 0.00 0.00 39.34 40.52 1tql n TYR 384 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1tql h PRO 385 N 5.12 0.00 0.00 -0.72 0.11 -1.72 0.20 132.00 134.99 1tql h PRO 385 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1tql h PRO 385 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1tql h PRO 385 CO 0.63 0.00 0.00 1.97 -0.21 0.00 0.00 178.00 180.39 1tql n PHE 386 N -3.82 0.00 -3.79 0.65 1.16 -1.26 -4.30 117.46 106.09 1tql n PHE 386 Ca 0.36 0.00 -0.36 0.00 -1.87 0.00 0.00 57.45 55.58 1tql n PHE 386 Cb 1.75 -0.38 -0.10 0.00 -1.61 0.00 0.00 39.48 39.15 1tql n PHE 386 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1tql s LEU 387 N -2.75 3.92 -0.16 5.98 1.43 0.72 -4.91 118.68 122.90 1tql s LEU 387 Ca 0.15 0.06 -0.05 0.00 -1.03 0.00 0.00 54.13 53.25 1tql s LEU 387 Cb 0.13 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.29 1tql s LEU 387 CO 0.32 0.09 -0.01 -0.63 0.23 0.00 0.00 176.35 176.35 1tql s ILE 388 N 0.90 4.16 -0.13 -0.59 -1.09 -1.26 0.08 121.20 123.27 1tql s ILE 388 Ca 0.06 -0.26 -0.23 0.00 -2.23 0.00 0.00 60.65 57.99 1tql s ILE 388 Cb -0.13 -2.84 -0.03 0.00 -1.58 0.00 0.00 42.46 37.88 1tql s ILE 388 CO 0.03 0.48 0.69 -1.00 -1.23 0.00 0.00 174.94 173.91 1tql s HIS 389 N 0.38 3.49 -0.35 3.97 3.76 0.22 -4.28 115.29 122.48 1tql s HIS 389 Ca -0.02 1.14 -0.26 0.00 -0.15 0.00 0.00 55.06 55.77 1tql s HIS 389 Cb -0.14 -2.83 0.01 0.00 1.11 0.00 0.00 32.58 30.74 1tql s HIS 389 CO 0.02 -0.04 0.93 -1.25 -0.85 0.00 0.00 174.74 173.55 1tql s PRO 390 N 1.35 3.91 -0.46 8.40 0.04 -1.26 -2.28 135.00 144.70 1tql s PRO 390 Ca 0.35 0.68 -0.08 0.00 0.04 0.00 0.00 61.00 61.98 1tql s PRO 390 Cb -0.17 -3.77 0.12 0.00 0.04 0.00 0.00 34.50 30.71 1tql s PRO 390 CO 0.14 -0.88 0.32 0.08 0.04 0.00 0.00 177.00 176.70 1tql s VAL 391 N 3.40 4.10 0.03 -0.36 1.01 -0.71 -4.80 120.40 123.08 1tql s VAL 391 Ca 0.38 -1.79 -0.30 0.00 0.00 0.00 0.00 61.98 60.27 1tql s VAL 391 Cb -0.12 -3.70 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1tql s VAL 391 CO 0.17 -0.75 1.01 -0.32 0.00 0.00 0.00 175.10 175.22 1tql s MET 392 N 1.34 4.56 0.41 2.72 0.00 -1.26 -0.76 119.30 126.31 1tql s MET 392 Ca 0.06 1.49 -0.26 0.00 0.00 0.00 0.00 55.69 56.97 1tql s MET 392 Cb -0.26 -3.42 -0.09 0.00 0.00 0.00 0.00 34.83 31.06 1tql s MET 392 CO -0.01 -0.03 1.37 -2.14 0.00 0.00 0.00 175.02 174.21 1tql s PRO 393 N 0.80 3.94 0.35 4.11 0.02 -1.26 -4.84 135.00 138.12 1tql s PRO 393 Ca 0.52 2.32 0.05 0.00 0.02 0.00 0.00 61.00 63.90 1tql s PRO 393 Cb -0.23 -2.79 0.69 0.00 0.02 0.00 0.00 34.50 32.19 1tql s PRO 393 CO 0.29 -0.57 1.94 0.52 -0.33 0.00 0.00 177.00 178.85 1tql h MET 394 N 2.69 0.80 -0.87 5.54 2.86 -1.96 -2.54 114.93 121.47 1tql h MET 394 Ca -0.50 -0.05 0.18 0.00 -2.06 0.00 0.00 59.70 57.27 1tql h MET 394 Cb 1.25 -0.18 -0.11 0.00 0.06 0.00 0.00 31.60 32.62 1tql h MET 394 CO 0.63 0.53 0.41 -0.22 1.06 0.00 0.00 176.91 179.32 1tql h LYS 395 N 0.82 0.50 -0.39 1.72 3.64 -1.98 0.59 116.57 121.47 1tql h LYS 395 Ca 0.34 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.66 1tql h LYS 395 Cb 0.26 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1tql h LYS 395 CO -0.12 0.33 0.15 0.93 -2.27 0.00 0.00 179.45 178.47 1tql h GLU 396 N 0.52 0.60 -0.67 1.90 4.39 -1.83 -0.61 114.58 118.87 1tql h GLU 396 Ca 0.51 -0.11 -0.06 0.00 0.34 0.00 0.00 59.36 60.03 1tql h GLU 396 Cb 0.84 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.37 1tql h GLU 396 CO -0.44 0.58 0.17 0.82 -1.16 0.00 0.00 179.01 178.97 1tql h ILE 397 N 0.49 1.26 0.03 3.13 2.04 -0.98 -1.47 117.51 122.01 1tql h ILE 397 Ca 0.13 -0.95 -0.00 0.00 1.00 0.00 0.00 64.86 65.04 1tql h ILE 397 Cb 0.21 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1tql h ILE 397 CO -0.01 0.36 -0.01 0.45 0.00 0.00 0.00 178.15 178.94 1tql h HIS 398 N 1.00 -0.04 -0.42 1.37 3.86 0.29 -1.21 115.15 120.01 1tql h HIS 398 Ca 0.21 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.50 1tql h HIS 398 Cb 0.36 0.01 -0.07 0.00 1.06 0.00 0.00 27.41 28.78 1tql h HIS 398 CO 0.03 0.13 0.00 0.93 0.86 0.00 0.00 177.93 179.88 1tql h GLU 399 N -0.20 0.11 -0.36 2.45 4.39 -0.98 -2.65 114.58 117.33 1tql h GLU 399 Ca -0.00 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.59 1tql h GLU 399 Cb 0.19 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1tql h GLU 399 CO 0.01 0.07 -0.19 1.03 -1.16 0.00 0.00 179.01 178.77 1tql h SER 400 N 0.11 0.67 0.96 1.42 0.87 -1.09 -3.15 113.55 113.35 1tql h SER 400 Ca 0.21 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1tql h SER 400 Cb 0.30 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1tql h SER 400 CO -0.34 0.86 0.00 -0.29 -0.53 0.00 0.00 176.83 176.53 1tql h ILE 401 N 0.60 0.00 0.00 2.23 2.10 -0.86 -3.20 117.51 118.38 1tql h ILE 401 Ca 0.09 -0.34 0.00 0.00 1.08 0.00 0.00 64.86 65.69 1tql h ILE 401 Cb 0.65 1.17 0.00 0.00 -1.09 0.00 0.00 36.82 37.55 1tql h ILE 401 CO 0.05 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.66 1tql n ARG 402 N -2.36 0.66 -4.34 2.19 1.74 -1.15 -4.51 116.66 108.88 1tql n ARG 402 Ca 0.03 0.02 -0.19 0.00 -0.77 0.00 0.00 57.85 56.93 1tql n ARG 402 Cb 0.29 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.14 1tql n ARG 402 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1tql s TRP 403 N -2.14 1.61 -0.02 -1.55 0.52 -1.21 -1.99 118.94 114.16 1tql s TRP 403 Ca 0.33 -1.35 -0.25 0.00 0.02 0.00 0.00 56.10 54.85 1tql s TRP 403 Cb 0.17 -0.88 0.06 0.00 -1.15 0.00 0.00 33.47 31.66 1tql s TRP 403 CO 0.30 -0.49 0.56 -0.08 0.02 0.00 0.00 176.95 177.27 1tql s THR 404 N -3.59 0.02 -0.46 2.01 -1.32 -0.67 -4.61 115.64 107.01 1tql s THR 404 Ca 0.35 -0.15 0.07 0.00 -1.21 0.00 0.00 61.69 60.75 1tql s THR 404 Cb 0.05 -0.91 -0.05 0.00 -1.51 0.00 0.00 72.50 70.08 1tql s THR 404 CO 0.17 -0.09 0.39 0.29 -2.21 0.00 0.00 174.62 173.17 1tql n LYS 405 N 0.85 3.80 -3.16 7.08 5.02 -1.26 -2.65 118.16 127.84 1tql n LYS 405 Ca -0.19 -0.18 0.05 0.00 -2.02 0.00 0.00 58.31 55.97 1tql n LYS 405 Cb 0.58 -0.89 -0.02 0.00 -0.02 0.00 0.00 35.03 34.67 1tql n LYS 405 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1tql s ASP 406 N -1.48 -0.22 0.58 4.39 2.15 -1.26 -4.92 116.67 115.91 1tql s ASP 406 Ca 0.04 0.15 0.32 0.00 0.43 0.00 0.00 52.55 53.49 1tql s ASP 406 Cb 0.06 1.19 1.38 0.00 -0.30 0.00 0.00 42.92 45.25 1tql s ASP 406 CO 0.26 -0.04 1.71 -0.65 -0.17 0.00 0.00 175.17 176.28 1tql h PRO 407 N 7.89 0.00 0.00 4.34 0.11 -1.99 0.18 132.00 142.52 1tql h PRO 407 Ca -0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1tql h PRO 407 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1tql h PRO 407 CO -0.15 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.64 1tql h ARG 408 N 0.00 0.00 -0.44 1.05 3.08 -2.04 -2.95 114.38 113.08 1tql h ARG 408 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1tql h ARG 408 Cb 2.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.08 1tql h ARG 408 CO -0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 1tql n ASN 409 N -2.88 4.07 -0.16 7.04 3.02 0.63 -4.56 115.26 122.42 1tql n ASN 409 Ca 0.02 -2.53 -0.08 0.00 -0.03 0.00 0.00 54.58 51.95 1tql n ASN 409 Cb 0.34 -0.48 0.01 0.00 -0.61 0.00 0.00 39.78 39.03 1tql n ASN 409 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1tql h THR 410 N 2.83 1.21 -0.77 3.41 2.02 -1.56 0.13 112.91 120.17 1tql h THR 410 Ca 0.00 -0.66 0.06 0.00 0.77 0.00 0.00 66.41 66.59 1tql h THR 410 Cb 1.29 0.75 -0.06 0.00 -1.74 0.00 0.00 68.15 68.40 1tql h THR 410 CO 0.18 0.24 0.45 -0.61 0.37 0.00 0.00 175.52 176.16 1tql h GLN 411 N 0.62 0.79 -0.04 6.66 5.75 -1.82 -0.43 115.11 126.65 1tql h GLN 411 Ca 0.16 -0.05 -0.07 0.00 -0.15 0.00 0.00 58.65 58.54 1tql h GLN 411 Cb 0.20 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.58 1tql h GLN 411 CO -0.01 0.53 -0.24 -0.44 -2.65 0.00 0.00 178.83 176.01 1tql h ASP 412 N 0.82 0.29 -0.26 -0.69 3.32 -1.79 -1.75 116.42 116.35 1tql h ASP 412 Ca 0.34 -0.67 0.04 0.00 0.02 0.00 0.00 57.03 56.76 1tql h ASP 412 Cb 0.20 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 1tql h ASP 412 CO -0.19 0.91 0.01 -0.74 -1.72 0.00 0.00 179.24 177.51 1tql h HIS 413 N -0.32 -0.00 -0.29 4.55 2.76 -0.55 0.49 115.15 121.78 1tql h HIS 413 Ca -0.02 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.02 1tql h HIS 413 Cb 0.92 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.91 1tql h HIS 413 CO 0.14 -0.03 -0.42 0.28 -1.30 0.00 0.00 177.93 176.60 1tql h VAL 414 N 0.09 1.29 -0.25 5.26 2.07 -1.15 -1.74 116.25 121.82 1tql h VAL 414 Ca 0.12 -1.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.04 1tql h VAL 414 Cb 0.16 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1tql h VAL 414 CO -0.20 0.51 0.15 -0.09 0.02 0.00 0.00 177.57 177.96 1tql h ARG 415 N 0.57 0.34 -0.73 1.57 9.65 -1.03 -1.58 114.38 123.16 1tql h ARG 415 Ca 0.04 -0.03 0.05 0.00 -1.10 0.00 0.00 59.98 58.94 1tql h ARG 415 Cb 0.96 -0.07 -0.05 0.00 -1.39 0.00 0.00 29.97 29.42 1tql h ARG 415 CO 0.09 0.28 0.45 0.77 2.80 0.00 0.00 179.97 184.36 1tql h SER 416 N 0.31 0.71 -0.19 -3.80 0.02 -0.72 -0.38 113.55 109.49 1tql h SER 416 Ca 0.09 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1tql h SER 416 Cb 0.03 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1tql h SER 416 CO -0.02 0.47 0.00 -0.07 -1.14 0.00 0.00 176.83 176.08 1tql h LEU 417 N 0.84 0.42 -1.09 5.07 3.38 -1.01 -2.10 115.31 120.81 1tql h LEU 417 Ca 0.31 -0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.15 1tql h LEU 417 Cb 0.10 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1tql h LEU 417 CO -0.14 0.48 0.01 0.00 0.09 0.00 0.00 178.44 178.88 1tql h LEU 419 N 0.62 0.00 0.03 0.00 3.38 -0.73 -2.77 115.31 115.84 1tql h LEU 419 Ca 0.13 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.73 1tql h LEU 419 Cb 0.37 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 1tql h LEU 419 CO 0.01 0.00 -2.13 0.18 0.09 0.00 0.00 178.44 176.59 1tql n LEU 420 N -2.40 2.35 -0.14 1.67 4.77 -0.31 -4.67 117.00 118.27 1tql n LEU 420 Ca 0.01 0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 56.11 1tql n LEU 420 Cb 0.22 -0.94 -0.01 0.00 -2.33 0.00 0.00 43.42 40.37 1tql n LEU 420 CO 0.20 0.67 0.93 0.00 -1.33 0.00 0.00 177.39 177.85 1tql h ALA 421 N -0.39 0.53 -0.23 -1.18 0.00 -0.66 -3.26 119.26 114.07 1tql h ALA 421 Ca -0.54 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.30 1tql h ALA 421 Cb 1.71 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.33 1tql h ALA 421 CO -0.18 0.13 0.39 0.11 0.00 0.00 0.00 179.25 179.70 1tql h TRP 422 N 0.51 0.00 0.00 0.00 5.08 -1.76 0.18 115.95 119.96 1tql h TRP 422 Ca 0.14 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.11 1tql h TRP 422 Cb 0.19 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.35 1tql h TRP 422 CO -0.00 0.00 0.00 0.72 -1.28 0.00 0.00 178.44 177.88 1tql n HIS 423 N -3.36 0.06 1.29 0.12 8.25 -1.23 -2.00 115.22 118.35 1tql n HIS 423 Ca 0.03 0.02 0.14 0.00 -0.26 0.00 0.00 57.72 57.66 1tql n HIS 423 Cb 0.51 -0.54 0.64 0.00 1.12 0.00 0.00 29.99 31.73 1tql n HIS 423 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1tql n ASN 424 N -1.55 0.18 0.00 0.41 3.02 0.64 -4.83 115.26 113.12 1tql n ASN 424 Ca 0.02 -0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1tql n ASN 424 Cb 0.13 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 1tql n ASN 424 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tql n GLY 425 N 1.35 3.43 0.30 7.41 0.00 -0.84 -4.67 105.19 112.16 1tql n GLY 425 Ca 0.12 -1.75 -0.07 0.00 0.00 0.00 0.00 46.02 44.32 1tql n GLY 425 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1tql h GLU 426 N 0.00 1.04 0.73 1.61 4.81 -1.95 0.19 114.58 121.00 1tql h GLU 426 Ca 0.00 -0.22 -0.03 0.00 -0.13 0.00 0.00 59.36 58.98 1tql h GLU 426 Cb 0.00 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 1tql h GLU 426 CO 0.00 0.90 -0.46 1.49 -0.73 0.00 0.00 179.01 180.20 1tql h GLU 427 N 0.98 -1.08 -0.95 1.92 4.81 -1.97 -0.48 114.58 117.81 1tql h GLU 427 Ca 0.22 0.07 0.12 0.00 -0.13 0.00 0.00 59.36 59.64 1tql h GLU 427 Cb 0.28 0.25 -0.08 0.00 0.63 0.00 0.00 28.75 29.82 1tql h GLU 427 CO -0.01 -0.72 0.58 0.93 -0.73 0.00 0.00 179.01 179.06 1tql h GLU 428 N -1.12 0.88 -0.36 1.92 4.39 -1.81 -1.79 114.58 116.69 1tql h GLU 428 Ca -0.10 -0.05 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1tql h GLU 428 Cb 0.90 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.34 1tql h GLU 428 CO 0.09 0.58 0.14 -0.92 -1.16 0.00 0.00 179.01 177.74 1tql h TYR 429 N 0.91 0.56 -0.31 4.33 3.20 -0.32 -1.85 116.97 123.48 1tql h TYR 429 Ca 0.48 -0.05 -0.08 0.00 3.14 0.00 0.00 58.73 62.23 1tql h TYR 429 Cb 0.50 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1tql h TYR 429 CO -0.02 0.52 -0.13 -0.91 -1.64 0.00 0.00 178.16 175.98 1tql h ASN 430 N 0.44 0.52 -0.52 -2.11 2.35 -0.48 -0.10 115.58 115.67 1tql h ASN 430 Ca 0.12 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 1tql h ASN 430 Cb 0.20 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 1tql h ASN 430 CO -0.01 0.68 0.18 0.11 -1.65 0.00 0.00 177.43 176.74 1tql h LYS 431 N 0.49 0.85 -0.14 0.81 1.57 -1.15 0.18 116.57 119.19 1tql h LYS 431 Ca 0.09 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1tql h LYS 431 Cb 0.51 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 1tql h LYS 431 CO 0.03 0.74 -0.03 0.35 -0.57 0.00 0.00 179.45 179.97 1tql h PHE 432 N 0.83 0.30 -0.77 -1.35 3.57 -0.47 -1.96 116.94 117.08 1tql h PHE 432 Ca 0.19 -0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 1tql h PHE 432 Cb 0.24 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 1tql h PHE 432 CO 0.02 0.54 0.30 -0.07 -2.23 0.00 0.00 178.31 176.87 1tql h LEU 433 N -0.03 1.07 -0.07 0.59 3.38 -0.74 -2.35 115.31 117.17 1tql h LEU 433 Ca 0.04 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.87 1tql h LEU 433 Cb 0.44 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1tql h LEU 433 CO 0.01 0.95 -0.09 0.00 0.09 0.00 0.00 178.44 179.40 1tql h ALA 434 N 1.20 -0.04 -0.16 1.53 0.00 -0.51 -0.10 119.26 121.17 1tql h ALA 434 Ca 0.26 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.12 1tql h ALA 434 Cb 0.22 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1tql h ALA 434 CO -0.02 -0.56 -0.23 0.87 0.00 0.00 0.00 179.25 179.30 1tql h LYS 435 N -0.13 0.29 -0.64 0.00 1.57 -1.25 -2.21 116.57 114.20 1tql h LYS 435 Ca 0.06 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1tql h LYS 435 Cb 0.21 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1tql h LYS 435 CO -0.14 0.52 0.12 0.82 -0.57 0.00 0.00 179.45 180.19 1tql h ILE 436 N 0.27 1.26 -0.05 1.86 2.04 -0.92 -2.53 117.51 119.43 1tql h ILE 436 Ca 0.04 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1tql h ILE 436 Cb 0.56 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 1tql h ILE 436 CO 0.04 0.37 0.00 0.54 0.00 0.00 0.00 178.15 179.10 1tql n ARG 437 N -4.27 1.14 -0.16 2.37 1.74 -0.09 -3.52 116.66 113.87 1tql n ARG 437 Ca 0.04 -0.22 0.07 0.00 -0.77 0.00 0.00 57.85 56.97 1tql n ARG 437 Cb 0.28 -1.12 0.22 0.00 -1.02 0.00 0.00 32.46 30.82 1tql n ARG 437 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1tql n SER 438 N -0.39 1.92 -4.04 0.55 3.41 -0.91 -4.53 113.62 109.63 1tql n SER 438 Ca 0.05 -1.92 -0.11 0.00 -0.26 0.00 0.00 58.87 56.64 1tql n SER 438 Cb 0.07 -0.21 -0.11 0.00 -0.26 0.00 0.00 64.21 63.70 1tql n SER 438 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1tql s VAL 439 N -1.58 0.35 0.21 -3.33 -7.23 -1.23 -5.07 120.40 102.52 1tql s VAL 439 Ca 0.27 -1.16 -0.13 0.00 -1.81 0.00 0.00 61.98 59.15 1tql s VAL 439 Cb 0.14 -0.66 0.21 0.00 0.56 0.00 0.00 36.38 36.64 1tql s VAL 439 CO 0.20 -0.53 1.64 -0.65 -0.31 0.00 0.00 175.10 175.44 1tql h PRO 440 N 4.29 0.02 -0.20 4.82 0.11 -1.89 -2.56 132.00 136.59 1tql h PRO 440 Ca -0.34 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.82 1tql h PRO 440 Cb 1.20 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.25 1tql h PRO 440 CO 0.45 0.01 -0.13 0.82 -0.21 0.00 0.00 178.00 178.95 1tql h ILE 441 N 0.02 0.61 -0.05 4.15 1.08 -1.94 -2.82 117.51 118.55 1tql h ILE 441 Ca 0.30 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.80 1tql h ILE 441 Cb 0.46 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 34.79 1tql h ILE 441 CO -0.60 0.00 -0.17 1.23 -0.69 0.00 0.00 178.15 177.92 1tql h GLY 442 N -0.13 -0.18 1.54 5.37 0.00 -1.54 -2.03 103.07 106.10 1tql h GLY 442 Ca 0.12 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1tql h GLY 442 CO -0.28 -0.16 0.22 3.21 0.00 0.00 0.00 176.54 179.53 1tql h ARG 443 N -0.25 0.00 -0.02 4.80 3.08 -1.24 0.12 114.38 120.87 1tql h ARG 443 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1tql h ARG 443 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1tql h ARG 443 CO -0.20 0.00 -0.02 0.00 -1.07 0.00 0.00 179.97 178.68 1tql n ALA 444 N -1.89 2.57 -2.21 0.04 0.00 -0.77 -4.92 120.51 113.33 1tql n ALA 444 Ca -0.02 -0.57 -0.32 0.00 0.00 0.00 0.00 53.44 52.53 1tql n ALA 444 Cb 0.27 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 18.69 1tql n ALA 444 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1tql s LEU 445 N -2.03 4.03 -0.52 0.00 1.43 0.42 -5.03 118.68 116.98 1tql s LEU 445 Ca 0.32 1.17 -0.16 0.00 -1.03 0.00 0.00 54.13 54.43 1tql s LEU 445 Cb 0.20 -3.98 0.12 0.00 0.03 0.00 0.00 46.19 42.56 1tql s LEU 445 CO 0.33 -0.22 0.48 -0.62 0.23 0.00 0.00 176.35 176.55 1tql s ASP 446 N -2.49 6.18 0.06 2.29 2.15 -1.26 -5.05 116.67 118.55 1tql s ASP 446 Ca 0.52 -1.67 0.07 0.00 0.43 0.00 0.00 52.55 51.90 1tql s ASP 446 Cb -0.10 -2.20 -0.04 0.00 -0.30 0.00 0.00 42.92 40.28 1tql s ASP 446 CO 0.21 -0.81 -0.15 -0.76 -0.17 0.00 0.00 175.17 173.49 1tql s LEU 447 N 1.62 2.79 0.16 -1.34 1.43 -1.26 -4.93 118.68 117.15 1tql s LEU 447 Ca 0.03 -0.40 -0.27 0.00 -1.03 0.00 0.00 54.13 52.47 1tql s LEU 447 Cb -0.29 -1.63 -0.08 0.00 0.03 0.00 0.00 46.19 44.23 1tql s LEU 447 CO 0.04 0.23 0.83 -2.16 0.23 0.00 0.00 176.35 175.52 1tql s PRO 448 N -1.70 4.64 0.74 1.29 0.04 -1.26 -5.06 135.00 133.68 1tql s PRO 448 Ca 0.17 1.26 -0.12 0.00 0.04 0.00 0.00 61.00 62.35 1tql s PRO 448 Cb -0.11 -3.29 0.03 0.00 0.04 0.00 0.00 34.50 31.18 1tql s PRO 448 CO 0.08 0.49 1.12 -1.21 0.04 0.00 0.00 177.00 177.52 1tql s GLU 449 N -0.91 2.60 0.09 4.56 0.41 -1.26 -4.91 118.70 119.29 1tql s GLU 449 Ca 0.38 0.39 -0.32 0.00 -0.41 0.00 0.00 54.97 55.02 1tql s GLU 449 Cb -0.24 -2.00 -0.14 0.00 -1.78 0.00 0.00 34.13 29.98 1tql s GLU 449 CO 0.28 -1.20 1.61 -0.92 -0.49 0.00 0.00 175.26 174.53 1tql h TYR 450 N -0.78 -1.00 -0.56 1.61 3.20 -1.97 -2.42 116.97 115.05 1tql h TYR 450 Ca -0.45 0.01 0.14 0.00 3.14 0.00 0.00 58.73 61.56 1tql h TYR 450 Cb 1.27 0.39 -0.03 0.00 1.54 0.00 0.00 36.73 39.90 1tql h TYR 450 CO 0.46 -0.52 0.39 0.66 -1.64 0.00 0.00 178.16 177.51 1tql h SER 451 N -0.77 0.13 -0.42 -2.11 4.64 -1.99 -0.08 113.55 112.96 1tql h SER 451 Ca -0.03 0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.16 1tql h SER 451 Cb 0.69 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.75 1tql h SER 451 CO -0.06 0.07 -0.28 0.74 -0.87 0.00 0.00 176.83 176.42 1tql h THR 452 N 0.14 1.27 -0.06 2.95 2.02 -1.83 -2.25 112.91 115.15 1tql h THR 452 Ca 0.27 -1.45 -0.22 0.00 0.77 0.00 0.00 66.41 65.78 1tql h THR 452 Cb 0.88 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 1tql h THR 452 CO -0.04 0.49 -0.85 -0.07 0.37 0.00 0.00 175.52 175.42 1tql h LEU 453 N 0.77 0.68 -0.81 2.58 3.38 -0.76 -2.50 115.31 118.65 1tql h LEU 453 Ca 0.08 -0.49 -0.10 0.00 0.09 0.00 0.00 57.88 57.47 1tql h LEU 453 Cb 0.87 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1tql h LEU 453 CO 0.08 1.27 -0.20 0.22 0.09 0.00 0.00 178.44 179.90 1tql h TYR 454 N 0.35 0.75 0.04 1.13 3.20 -1.07 -1.08 116.97 120.28 1tql h TYR 454 Ca -0.07 -0.16 -0.24 0.00 3.14 0.00 0.00 58.73 61.41 1tql h TYR 454 Cb 1.47 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 39.56 1tql h TYR 454 CO 0.07 0.82 -1.02 -0.44 -1.64 0.00 0.00 178.16 175.95 1tql h ASP 455 N 0.60 0.53 -0.46 -2.11 3.32 -1.45 -2.19 116.42 114.66 1tql h ASP 455 Ca 0.09 -0.46 -0.05 0.00 0.02 0.00 0.00 57.03 56.64 1tql h ASP 455 Cb 0.67 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 1tql h ASP 455 CO 0.05 1.28 0.11 -0.09 -1.72 0.00 0.00 179.24 178.87 1tql h ARG 456 N 0.20 0.74 0.09 3.56 2.43 -1.33 -2.40 114.38 117.67 1tql h ARG 456 Ca -0.10 -0.18 0.01 0.00 -0.81 0.00 0.00 59.98 58.90 1tql h ARG 456 Cb 1.68 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 31.12 1tql h ARG 456 CO 0.18 0.73 -0.11 2.35 -1.51 0.00 0.00 179.97 181.61 1tql h TRP 457 N 0.61 -0.28 -0.54 2.20 7.01 -1.16 -1.38 115.95 122.41 1tql h TRP 457 Ca 0.14 0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.19 1tql h TRP 457 Cb 0.33 0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.47 1tql h TRP 457 CO 0.02 -0.17 0.36 -0.07 -2.79 0.00 0.00 178.44 175.79 1tql h LEU 458 N -0.23 0.47 0.00 0.65 3.38 -1.29 -2.17 115.31 116.12 1tql h LEU 458 Ca 0.01 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 1tql h LEU 458 Cb 0.23 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1tql h LEU 458 CO -0.04 0.32 -0.57 0.44 0.09 0.00 0.00 178.44 178.68 1tql h ASP 459 N 0.54 0.00 0.24 -0.43 3.32 -1.09 -3.31 116.42 115.69 1tql h ASP 459 Ca 0.22 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.27 1tql h ASP 459 Cb 0.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 1tql h ASP 459 CO -0.06 0.56 -0.02 0.77 -1.72 0.00 0.00 179.24 178.77 1tql h SER 460 N 0.00 0.00 0.00 6.45 4.64 -0.57 -3.51 113.55 120.56 1tql h SER 460 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1tql h SER 460 Cb 1.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 1tql h SER 460 CO 0.07 0.02 0.00 0.49 -0.87 0.00 0.00 176.83 176.55