#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rti s ILE 2 N 0.00 -0.23 0.59 0.52 2.07 -1.26 -4.12 121.20 118.78 1rti s ILE 2 Ca 0.00 0.16 -0.17 0.00 -1.41 0.00 0.00 60.65 59.24 1rti s ILE 2 Cb 0.00 -0.42 -0.03 0.00 0.13 0.00 0.00 42.46 42.14 1rti s ILE 2 CO 0.00 -0.00 1.09 -0.94 -1.91 0.00 0.00 174.94 173.18 1rti s SER 3 N 2.26 5.57 -0.55 4.50 1.04 0.47 -4.69 113.70 122.31 1rti s SER 3 Ca 0.04 1.98 -0.02 0.00 0.48 0.00 0.00 55.95 58.44 1rti s SER 3 Cb -0.14 -2.55 0.34 0.00 0.10 0.00 0.00 66.02 63.77 1rti s SER 3 CO -0.07 -1.31 2.07 -0.81 0.98 0.00 0.00 173.24 174.09 1rti n PRO 4 N -1.89 2.37 -3.61 4.02 -0.04 -1.26 -4.57 135.00 130.02 1rti n PRO 4 Ca 0.10 -2.66 -0.33 0.00 -0.04 0.00 0.00 63.50 60.57 1rti n PRO 4 Cb 0.52 -2.05 -0.05 0.00 -0.04 0.00 0.00 33.50 31.88 1rti n PRO 4 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rti s ILE 5 N -3.84 5.11 0.23 0.52 1.10 -1.26 -5.05 121.20 118.02 1rti s ILE 5 Ca 0.52 0.25 -0.31 0.00 -0.51 0.00 0.00 60.65 60.60 1rti s ILE 5 Cb 0.41 -3.63 -0.11 0.00 0.15 0.00 0.00 42.46 39.28 1rti s ILE 5 CO -0.05 0.13 1.59 -1.61 -2.11 0.00 0.00 174.94 172.89 1rti s GLU 6 N -2.37 4.17 0.75 3.50 2.02 -1.26 -4.73 118.70 120.78 1rti s GLU 6 Ca 0.38 2.48 -0.11 0.00 0.02 0.00 0.00 54.97 57.75 1rti s GLU 6 Cb -0.13 -3.08 0.04 0.00 0.10 0.00 0.00 34.13 31.06 1rti s GLU 6 CO 0.21 -0.62 1.08 0.95 0.02 0.00 0.00 175.26 176.91 1rti s THR 7 N 0.56 3.50 -0.17 3.63 -4.23 -1.26 -5.00 115.64 112.67 1rti s THR 7 Ca 0.67 0.50 -0.11 0.00 -1.18 0.00 0.00 61.69 61.57 1rti s THR 7 Cb -0.46 -3.05 -0.05 0.00 1.34 0.00 0.00 72.50 70.28 1rti s THR 7 CO 0.39 -0.62 0.20 -0.69 -0.54 0.00 0.00 174.62 173.36 1rti s VAL 8 N -2.90 5.37 -0.35 2.29 1.01 -1.26 -4.94 120.40 119.63 1rti s VAL 8 Ca 0.61 0.35 -0.28 0.00 0.00 0.00 0.00 61.98 62.66 1rti s VAL 8 Cb -0.17 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1rti s VAL 8 CO 0.55 0.45 2.02 -2.16 0.00 0.00 0.00 175.10 175.95 1rti s PRO 9 N 0.18 3.03 -0.07 2.72 0.04 -1.26 -4.20 135.00 135.44 1rti s PRO 9 Ca 0.12 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.72 1rti s PRO 9 Cb -0.12 -4.32 -0.02 0.00 0.04 0.00 0.00 34.50 30.07 1rti s PRO 9 CO 0.01 -2.22 -0.16 0.08 0.04 0.00 0.00 177.00 174.75 1rti s VAL 10 N 8.27 2.86 0.06 -0.36 1.01 -1.26 -5.12 120.40 125.86 1rti s VAL 10 Ca 0.87 -0.78 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1rti s VAL 10 Cb -0.24 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 1rti s VAL 10 CO 0.32 0.57 -0.04 -1.59 0.00 0.00 0.00 175.10 174.36 1rti s LYS 11 N -0.38 0.63 0.82 2.72 -2.85 -1.26 -4.64 119.74 114.78 1rti s LYS 11 Ca 0.04 -1.16 -0.12 0.00 -1.00 0.00 0.00 55.97 53.73 1rti s LYS 11 Cb -0.12 0.08 0.08 0.00 -2.06 0.00 0.00 37.83 35.81 1rti s LYS 11 CO 0.02 -0.07 1.11 -0.51 0.10 0.00 0.00 175.35 175.99 1rti s LEU 12 N -2.73 2.46 0.73 2.77 1.43 -1.26 -2.47 118.68 119.61 1rti s LEU 12 Ca 0.05 1.21 -0.15 0.00 -1.03 0.00 0.00 54.13 54.21 1rti s LEU 12 Cb 0.05 -3.76 0.04 0.00 0.03 0.00 0.00 46.19 42.55 1rti s LEU 12 CO -0.07 -2.09 1.21 -0.54 0.23 0.00 0.00 176.35 175.08 1rti s LYS 13 N -5.20 2.13 -0.33 1.70 1.02 0.98 -4.64 119.74 115.40 1rti s LYS 13 Ca 0.61 1.77 -0.39 0.00 0.02 0.00 0.00 55.97 57.99 1rti s LYS 13 Cb -0.14 -1.83 -0.14 0.00 -0.52 0.00 0.00 37.83 35.19 1rti s LYS 13 CO 0.54 -1.85 1.98 -0.35 -0.92 0.00 0.00 175.35 174.75 1rti n PRO 14 N -2.72 0.99 -0.99 -1.68 -0.04 -1.26 -1.75 135.00 127.54 1rti n PRO 14 Ca 0.13 0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 1rti n PRO 14 Cb 0.50 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 1rti n PRO 14 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rti n GLY 15 N 5.59 0.81 3.94 0.55 0.00 -1.26 -5.04 105.19 109.77 1rti n GLY 15 Ca 0.36 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.14 1rti n GLY 15 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1rti s MET 16 N -0.02 3.50 0.29 1.61 -1.94 -0.72 -5.12 119.30 116.90 1rti s MET 16 Ca 0.00 -0.35 0.11 0.00 -1.71 0.00 0.00 55.69 53.74 1rti s MET 16 Cb 0.00 -2.71 -0.05 0.00 2.01 0.00 0.00 34.83 34.08 1rti s MET 16 CO 0.00 0.22 -0.18 0.34 -0.01 0.00 0.00 175.02 175.39 1rti s ASP 17 N -3.83 3.53 0.95 3.03 2.15 -1.26 -4.80 116.67 116.45 1rti s ASP 17 Ca 0.39 -1.06 -0.10 0.00 0.43 0.00 0.00 52.55 52.21 1rti s ASP 17 Cb -0.10 -0.30 0.17 0.00 -0.30 0.00 0.00 42.92 42.39 1rti s ASP 17 CO 0.34 -0.02 1.13 -0.83 -0.17 0.00 0.00 175.17 175.62 1rti s GLY 18 N -3.51 1.67 0.36 2.66 0.00 -1.26 -4.97 107.32 102.27 1rti s GLY 18 Ca 0.30 0.52 -0.28 0.00 0.00 0.00 0.00 44.72 45.26 1rti s GLY 18 CO 0.15 0.98 1.46 -1.05 0.00 0.00 0.00 173.10 174.63 1rti n PRO 19 N -4.35 2.54 -0.46 2.90 -0.02 -1.26 -4.92 135.00 129.44 1rti n PRO 19 Ca 0.11 0.89 0.01 0.00 -2.02 0.00 0.00 63.50 62.49 1rti n PRO 19 Cb 0.52 -2.60 0.02 0.00 -0.02 0.00 0.00 33.50 31.42 1rti n PRO 19 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1rti n LYS 20 N 0.72 0.14 -2.00 -0.52 5.02 -1.23 -0.47 118.16 119.82 1rti n LYS 20 Ca 0.03 -1.18 -0.41 0.00 -2.02 0.00 0.00 58.31 54.73 1rti n LYS 20 Cb 0.38 -0.61 -0.01 0.00 -0.02 0.00 0.00 35.03 34.76 1rti n LYS 20 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1rti s VAL 21 N -0.32 2.47 0.81 -0.18 0.11 -1.17 -4.73 120.40 117.39 1rti s VAL 21 Ca 0.04 0.47 -0.11 0.00 -2.93 0.00 0.00 61.98 59.45 1rti s VAL 21 Cb 0.03 -3.30 0.08 0.00 -1.53 0.00 0.00 36.38 31.66 1rti s VAL 21 CO 0.00 0.11 1.09 -0.75 -3.33 0.00 0.00 175.10 172.22 1rti s LYS 22 N -1.89 2.00 0.13 1.54 2.20 -1.26 -4.16 119.74 118.30 1rti s LYS 22 Ca 0.50 0.88 -0.07 0.00 -0.36 0.00 0.00 55.97 56.92 1rti s LYS 22 Cb -0.42 -1.89 -0.06 0.00 -1.51 0.00 0.00 37.83 33.95 1rti s LYS 22 CO 0.57 -1.74 0.41 -1.14 -0.36 0.00 0.00 175.35 173.08 1rti s GLN 23 N -5.01 3.69 0.46 4.03 2.00 -1.26 -4.56 119.66 119.01 1rti s GLN 23 Ca 0.61 0.05 -0.16 0.00 -2.00 0.00 0.00 55.36 53.87 1rti s GLN 23 Cb -0.16 -2.88 -0.08 0.00 0.80 0.00 0.00 33.01 30.69 1rti s GLN 23 CO 0.56 0.48 0.90 -1.58 -0.50 0.00 0.00 175.29 175.15 1rti s TRP 24 N -1.58 3.43 0.32 1.67 0.52 -1.26 -5.05 118.94 116.98 1rti s TRP 24 Ca 0.39 1.36 -0.28 0.00 0.02 0.00 0.00 56.10 57.59 1rti s TRP 24 Cb -0.13 -2.69 -0.09 0.00 -1.15 0.00 0.00 33.47 29.41 1rti s TRP 24 CO 0.22 -0.22 1.06 -1.25 0.02 0.00 0.00 176.95 176.78 1rti s PRO 25 N -3.77 4.51 0.14 4.98 0.04 -1.26 -4.94 135.00 134.70 1rti s PRO 25 Ca 0.57 1.66 0.07 0.00 0.04 0.00 0.00 61.00 63.34 1rti s PRO 25 Cb -0.10 -2.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.43 1rti s PRO 25 CO 0.27 0.13 -0.15 -0.51 0.04 0.00 0.00 177.00 176.78 1rti s LEU 26 N -1.83 2.43 0.50 -3.56 1.43 -1.26 -5.14 118.68 111.25 1rti s LEU 26 Ca 0.49 -0.84 -0.20 0.00 -1.03 0.00 0.00 54.13 52.54 1rti s LEU 26 Cb -0.28 -0.64 -0.08 0.00 0.03 0.00 0.00 46.19 45.23 1rti s LEU 26 CO 0.35 -0.12 1.05 -0.89 0.23 0.00 0.00 176.35 176.98 1rti s THR 27 N -2.19 3.70 0.32 5.49 2.01 -1.26 -4.85 115.64 118.86 1rti s THR 27 Ca 0.12 1.05 0.08 0.00 0.31 0.00 0.00 61.69 63.25 1rti s THR 27 Cb -0.05 -3.42 0.35 0.00 0.01 0.00 0.00 72.50 69.39 1rti s THR 27 CO 0.04 -0.24 1.61 -0.08 -0.69 0.00 0.00 174.62 175.27 1rti h GLU 28 N 1.48 0.11 0.76 4.92 4.81 -2.00 -1.53 114.58 123.13 1rti h GLU 28 Ca -0.50 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 58.69 1rti h GLU 28 Cb 1.23 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 30.59 1rti h GLU 28 CO 0.59 0.08 -0.38 0.93 -0.73 0.00 0.00 179.01 179.49 1rti h GLU 29 N 0.12 -1.01 0.00 1.92 4.39 -2.00 -1.78 114.58 116.22 1rti h GLU 29 Ca 0.66 0.07 -0.00 0.00 0.34 0.00 0.00 59.36 60.43 1rti h GLU 29 Cb 1.48 0.23 -0.00 0.00 -0.10 0.00 0.00 28.75 30.36 1rti h GLU 29 CO -0.75 -0.67 -0.01 1.57 -1.16 0.00 0.00 179.01 177.99 1rti h LYS 30 N -1.05 0.00 -0.02 2.33 2.10 -1.68 -1.99 116.57 116.27 1rti h LYS 30 Ca -0.10 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.54 1rti h LYS 30 Cb 0.81 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.14 1rti h LYS 30 CO 0.16 0.01 -0.02 0.82 -2.00 0.00 0.00 179.45 178.42 1rti h ILE 31 N 0.00 1.39 -0.30 0.07 2.04 -1.13 -1.77 117.51 117.82 1rti h ILE 31 Ca -0.00 -1.18 0.07 0.00 1.00 0.00 0.00 64.86 64.74 1rti h ILE 31 Cb 0.01 2.16 -0.08 0.00 -0.74 0.00 0.00 36.82 38.17 1rti h ILE 31 CO 0.00 0.31 -0.29 0.11 0.00 0.00 0.00 178.15 178.29 1rti h LYS 32 N -0.44 -0.26 0.17 2.37 1.57 -0.60 -0.85 116.57 118.52 1rti h LYS 32 Ca 0.00 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1rti h LYS 32 Cb 0.52 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.85 1rti h LYS 32 CO 0.00 -0.17 -0.34 0.00 -0.57 0.00 0.00 179.45 178.37 1rti h ALA 33 N 0.75 -0.62 -0.97 3.86 0.00 -1.45 -0.86 119.26 119.97 1rti h ALA 33 Ca 0.15 -0.07 0.17 0.00 0.00 0.00 0.00 54.91 55.16 1rti h ALA 33 Cb 0.51 0.55 -0.09 0.00 0.00 0.00 0.00 17.79 18.76 1rti h ALA 33 CO -0.45 -0.90 0.61 -0.07 0.00 0.00 0.00 179.25 178.43 1rti h LEU 34 N -0.60 0.72 0.12 0.00 3.38 -0.78 0.91 115.31 119.07 1rti h LEU 34 Ca 0.02 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1rti h LEU 34 Cb 0.61 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1rti h LEU 34 CO -0.17 0.31 -0.06 0.58 0.09 0.00 0.00 178.44 179.19 1rti h VAL 35 N 0.73 1.03 0.24 1.22 2.07 -0.62 0.00 116.25 120.94 1rti h VAL 35 Ca 0.52 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1rti h VAL 35 Cb 0.84 1.46 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 1rti h VAL 35 CO -0.28 0.16 -0.48 -0.33 0.02 0.00 0.00 177.57 176.65 1rti h GLU 36 N -0.48 -0.76 -0.32 1.57 5.08 0.10 -0.07 114.58 119.69 1rti h GLU 36 Ca -0.02 0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.44 1rti h GLU 36 Cb 0.39 0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 1rti h GLU 36 CO 0.03 -0.51 0.09 0.82 -1.00 0.00 0.00 179.01 178.45 1rti h ILE 37 N -0.79 0.88 -0.50 3.13 2.04 -0.93 -0.58 117.51 120.77 1rti h ILE 37 Ca -0.03 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1rti h ILE 37 Cb 0.74 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1rti h ILE 37 CO -0.19 0.04 0.19 0.00 0.00 0.00 0.00 178.15 178.19 1rti h THR 39 N 0.71 1.35 0.79 0.00 2.02 -0.58 -1.64 112.91 115.57 1rti h THR 39 Ca 0.17 -1.83 -0.04 0.00 0.77 0.00 0.00 66.41 65.48 1rti h THR 39 Cb 0.15 1.86 0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1rti h THR 39 CO -0.02 0.55 -0.38 -0.08 0.37 0.00 0.00 175.52 175.96 1rti h GLU 40 N 0.26 -1.03 0.00 6.66 4.57 0.02 -1.86 114.58 123.20 1rti h GLU 40 Ca 0.00 0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1rti h GLU 40 Cb 1.04 0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1rti h GLU 40 CO 0.09 -0.68 0.00 0.00 -1.18 0.00 0.00 179.01 177.24 1rti h MET 41 N -1.07 0.00 -0.08 1.92 -0.00 -1.29 -2.06 114.93 112.35 1rti h MET 41 Ca -0.11 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.56 1rti h MET 41 Cb 0.82 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.42 1rti h MET 41 CO 0.18 0.00 -0.08 1.49 -0.00 0.00 0.00 176.91 178.50 1rti h GLU 42 N 0.00 0.20 -0.35 -0.10 4.81 -0.93 -1.02 114.58 117.19 1rti h GLU 42 Ca 0.00 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1rti h GLU 42 Cb 0.24 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1rti h GLU 42 CO 0.00 0.63 0.15 1.57 -0.73 0.00 0.00 179.01 180.63 1rti h LYS 43 N -0.22 0.48 0.00 1.92 2.10 -0.63 -0.70 116.57 119.52 1rti h LYS 43 Ca 0.01 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1rti h LYS 43 Cb 0.59 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.83 1rti h LYS 43 CO 0.02 0.40 0.00 0.39 -2.00 0.00 0.00 179.45 178.26 1rti n GLU 44 N -4.41 0.52 -1.00 0.07 1.02 -1.06 -4.86 120.64 110.93 1rti n GLU 44 Ca 0.02 0.04 -0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1rti n GLU 44 Cb 0.13 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1rti n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rti n GLY 45 N 0.51 0.48 0.16 0.62 0.00 -0.27 -4.70 105.19 101.99 1rti n GLY 45 Ca 0.14 -0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.99 1rti n GLY 45 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rti h LYS 46 N 0.97 0.48 -5.33 1.61 1.57 -1.36 -3.44 116.57 111.07 1rti h LYS 46 Ca -0.00 -0.47 -0.43 0.00 -1.87 0.00 0.00 60.65 57.88 1rti h LYS 46 Cb 0.03 0.12 -0.14 0.00 0.08 0.00 0.00 32.23 32.33 1rti h LYS 46 CO 0.00 1.12 -0.69 0.96 -0.57 0.00 0.00 179.45 180.27 1rti s ILE 47 N -3.36 1.41 -0.02 1.86 -4.36 -1.14 -0.45 121.20 115.15 1rti s ILE 47 Ca -0.13 -2.11 -0.04 0.00 -0.26 0.00 0.00 60.65 58.12 1rti s ILE 47 Cb 0.05 -2.25 0.00 0.00 1.25 0.00 0.00 42.46 41.51 1rti s ILE 47 CO 0.84 -0.43 0.09 -0.44 0.24 0.00 0.00 174.94 175.24 1rti s SER 48 N -3.34 -0.01 0.55 4.36 0.01 0.37 -4.38 113.70 111.26 1rti s SER 48 Ca 0.26 -0.03 -0.19 0.00 1.31 0.00 0.00 55.95 57.29 1rti s SER 48 Cb 0.03 0.20 -0.05 0.00 0.21 0.00 0.00 66.02 66.40 1rti s SER 48 CO 0.08 -0.18 1.16 -0.54 0.41 0.00 0.00 173.24 174.17 1rti s LYS 49 N -0.64 3.26 0.14 12.44 1.02 -1.26 -0.29 119.74 134.42 1rti s LYS 49 Ca -0.07 1.69 0.05 0.00 0.02 0.00 0.00 55.97 57.66 1rti s LYS 49 Cb -0.04 -2.00 -0.04 0.00 -0.52 0.00 0.00 37.83 35.22 1rti s LYS 49 CO 0.00 -0.94 -0.12 0.96 -0.92 0.00 0.00 175.35 174.34 1rti s ILE 50 N -1.70 1.25 0.75 2.17 -4.36 -1.07 -4.85 121.20 113.38 1rti s ILE 50 Ca 0.74 -1.88 -0.07 0.00 -0.26 0.00 0.00 60.65 59.17 1rti s ILE 50 Cb -0.26 -1.67 0.10 0.00 1.25 0.00 0.00 42.46 41.87 1rti s ILE 50 CO 0.29 -0.58 1.06 -0.83 0.24 0.00 0.00 174.94 175.12 1rti s GLY 51 N -2.81 1.72 0.00 6.27 0.00 -1.26 -4.70 107.32 106.55 1rti s GLY 51 Ca 0.13 -1.15 0.04 0.00 0.00 0.00 0.00 44.72 43.74 1rti s GLY 51 CO 0.02 -0.64 1.01 -1.55 0.00 0.00 0.00 173.10 171.93 1rti n PRO 52 N -3.05 0.04 0.00 2.90 -0.04 -1.26 -2.89 135.00 130.70 1rti n PRO 52 Ca 0.11 0.30 0.07 0.00 -0.04 0.00 0.00 63.50 63.94 1rti n PRO 52 Cb 0.60 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.97 1rti n PRO 52 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1rti n GLU 53 N -1.35 0.61 -3.87 0.54 0.00 -1.26 -4.49 120.64 110.82 1rti n GLU 53 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.82 1rti n GLU 53 Cb 0.04 -1.36 -0.13 0.00 0.00 0.00 0.00 31.44 29.99 1rti n GLU 53 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1rti s ASN 54 N -1.82 4.99 0.00 -1.84 3.84 -1.14 -4.97 114.94 114.00 1rti s ASN 54 Ca 0.21 -1.32 0.29 0.00 0.21 0.00 0.00 52.86 52.25 1rti s ASN 54 Cb 0.10 -1.75 1.24 0.00 -0.55 0.00 0.00 41.25 40.29 1rti s ASN 54 CO 0.16 -0.30 1.92 -0.81 -2.79 0.00 0.00 177.10 175.28 1rti n PRO 55 N 4.65 0.09 -2.43 0.43 -0.04 -1.26 -4.90 135.00 131.54 1rti n PRO 55 Ca -0.12 -0.01 -0.33 0.00 -0.04 0.00 0.00 63.50 63.01 1rti n PRO 55 Cb 0.43 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.36 1rti n PRO 55 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1rti s TYR 56 N -2.92 3.21 -0.14 0.54 2.02 -1.26 -4.70 117.35 114.11 1rti s TYR 56 Ca 0.17 1.53 -0.29 0.00 -0.37 0.00 0.00 57.07 58.11 1rti s TYR 56 Cb 0.19 -2.92 0.09 0.00 -0.40 0.00 0.00 41.96 38.92 1rti s TYR 56 CO 0.53 -0.60 0.78 1.21 -1.57 0.00 0.00 175.55 175.90 1rti s ASN 57 N -2.59 -0.61 -0.01 2.29 2.47 0.38 -4.64 114.94 112.25 1rti s ASN 57 Ca 0.62 0.82 0.00 0.00 0.42 0.00 0.00 52.86 54.73 1rti s ASN 57 Cb -0.13 0.72 0.00 0.00 -1.45 0.00 0.00 41.25 40.40 1rti s ASN 57 CO 0.26 -0.44 -0.01 -0.89 -3.72 0.00 0.00 177.10 172.30 1rti s THR 58 N -0.72 0.10 -0.14 -5.21 2.01 0.54 -3.04 115.64 109.18 1rti s THR 58 Ca -0.06 -0.02 -0.29 0.00 0.31 0.00 0.00 61.69 61.63 1rti s THR 58 Cb -0.02 -0.11 -0.02 0.00 0.01 0.00 0.00 72.50 72.36 1rti s THR 58 CO 0.05 0.05 1.35 -2.16 -0.69 0.00 0.00 174.62 173.21 1rti s PRO 59 N 0.16 4.22 0.09 4.92 0.04 -1.26 -4.13 135.00 139.05 1rti s PRO 59 Ca -0.01 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1rti s PRO 59 Cb -0.03 -3.81 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 1rti s PRO 59 CO -0.00 -0.73 0.25 0.08 0.04 0.00 0.00 177.00 176.63 1rti s VAL 60 N 3.59 5.35 0.17 -0.36 1.01 -1.26 -0.77 120.40 128.13 1rti s VAL 60 Ca 0.59 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1rti s VAL 60 Cb -0.24 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1rti s VAL 60 CO 0.18 0.06 0.05 -0.36 0.00 0.00 0.00 175.10 175.04 1rti s PHE 61 N -1.59 1.12 0.06 5.22 0.08 0.14 -4.83 117.98 118.17 1rti s PHE 61 Ca 0.35 -1.18 0.05 0.00 0.12 0.00 0.00 56.93 56.27 1rti s PHE 61 Cb -0.12 -0.62 -0.03 0.00 -0.57 0.00 0.00 43.02 41.68 1rti s PHE 61 CO 0.28 -0.41 -0.13 0.00 -0.10 0.00 0.00 175.22 174.86 1rti s ALA 62 N -3.89 1.10 -0.28 5.36 0.00 -1.26 -0.88 121.76 121.90 1rti s ALA 62 Ca 0.28 -0.93 -0.23 0.00 0.00 0.00 0.00 51.96 51.09 1rti s ALA 62 Cb 0.07 -0.10 0.11 0.00 0.00 0.00 0.00 23.12 23.20 1rti s ALA 62 CO 0.06 0.16 0.93 -1.50 0.00 0.00 0.00 175.76 175.40 1rti s ILE 63 N -1.18 0.00 0.42 0.00 1.10 -1.10 -4.98 121.20 115.46 1rti s ILE 63 Ca -0.02 0.00 -0.26 0.00 -0.51 0.00 0.00 60.65 59.86 1rti s ILE 63 Cb -0.09 -1.00 -0.08 0.00 0.15 0.00 0.00 42.46 41.43 1rti s ILE 63 CO 0.02 0.00 1.31 -0.54 -2.11 0.00 0.00 174.94 173.62 1rti s LYS 64 N 0.55 3.88 1.27 3.50 1.02 -1.26 -0.98 119.74 127.72 1rti s LYS 64 Ca -0.00 2.17 -0.21 0.00 0.02 0.00 0.00 55.97 57.95 1rti s LYS 64 Cb -0.05 -2.70 0.32 0.00 -0.52 0.00 0.00 37.83 34.88 1rti s LYS 64 CO -0.07 -0.58 1.08 0.21 -0.92 0.00 0.00 175.35 175.07 1rti s LYS 65 N -2.33 -1.79 -0.83 1.68 2.20 -0.30 -4.85 119.74 113.53 1rti s LYS 65 Ca 0.58 -0.13 -0.25 0.00 -0.36 0.00 0.00 55.97 55.82 1rti s LYS 65 Cb -0.38 -1.53 0.00 0.00 -1.51 0.00 0.00 37.83 34.41 1rti s LYS 65 CO 0.49 -4.07 1.63 0.21 -0.36 0.00 0.00 175.35 173.24 1rti s LYS 66 N -5.43 3.01 -0.97 4.03 2.20 -1.26 -3.90 119.74 117.43 1rti s LYS 66 Ca 0.71 -0.30 -0.08 0.00 -0.36 0.00 0.00 55.97 55.95 1rti s LYS 66 Cb -0.09 -4.77 -0.03 0.00 -1.51 0.00 0.00 37.83 31.43 1rti s LYS 66 CO 0.56 -2.61 0.81 -0.25 -0.36 0.00 0.00 175.35 173.50 1rti n ASP 67 N 11.18 -6.54 0.00 1.43 8.00 -1.26 -4.91 116.55 124.44 1rti n ASP 67 Ca 0.25 -0.63 0.00 0.00 0.71 0.00 0.00 54.79 55.12 1rti n ASP 67 Cb 0.50 -4.58 0.00 0.00 -0.02 0.00 0.00 41.12 37.02 1rti n ASP 67 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1rti n SER 68 N -2.66 0.00 -0.54 -2.24 3.41 -1.25 -5.01 113.62 105.33 1rti n SER 68 Ca -0.07 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.47 1rti n SER 68 Cb 0.58 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1rti n SER 68 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1rti n THR 69 N -0.65 0.00 -4.43 6.66 -1.04 -1.26 -4.96 114.28 108.61 1rti n THR 69 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.69 1rti n THR 69 Cb 0.00 -1.09 -0.10 0.00 -1.82 0.00 0.00 70.33 67.32 1rti n THR 69 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1rti s LYS 70 N -2.26 2.48 0.13 -2.82 2.20 -1.26 -4.93 119.74 113.27 1rti s LYS 70 Ca 0.00 -0.78 -0.30 0.00 -0.36 0.00 0.00 55.97 54.53 1rti s LYS 70 Cb 0.00 -2.46 -0.06 0.00 -1.51 0.00 0.00 37.83 33.79 1rti s LYS 70 CO 0.00 0.58 1.00 -1.58 -0.36 0.00 0.00 175.35 174.99 1rti s TRP 71 N -1.03 3.76 0.53 4.03 0.52 -1.26 -1.15 118.94 124.34 1rti s TRP 71 Ca 0.18 1.74 0.04 0.00 0.02 0.00 0.00 56.10 58.08 1rti s TRP 71 Cb -0.11 -3.11 0.04 0.00 -1.15 0.00 0.00 33.47 29.14 1rti s TRP 71 CO 0.09 -0.01 0.32 2.89 0.02 0.00 0.00 176.95 180.26 1rti n ARG 72 N 2.71 0.71 -4.22 4.98 1.85 -0.15 -4.90 116.66 117.64 1rti n ARG 72 Ca 0.03 -3.43 -0.13 0.00 -1.00 0.00 0.00 57.85 53.32 1rti n ARG 72 Cb 0.48 0.49 -0.10 0.00 -1.05 0.00 0.00 32.46 32.28 1rti n ARG 72 CO 0.00 0.00 0.00 -1.59 -0.01 0.00 0.00 177.63 176.03 1rti s LYS 73 N -4.13 1.00 -0.25 2.89 -2.85 -1.26 -2.72 119.74 112.42 1rti s LYS 73 Ca 0.24 -1.44 -0.15 0.00 -1.00 0.00 0.00 55.97 53.61 1rti s LYS 73 Cb -0.02 -0.35 0.07 0.00 -2.06 0.00 0.00 37.83 35.48 1rti s LYS 73 CO 0.15 -0.04 0.63 -1.17 0.10 0.00 0.00 175.35 175.03 1rti s LEU 74 N -3.13 -0.72 -0.14 2.77 2.96 -0.06 -4.97 118.68 115.39 1rti s LEU 74 Ca 0.18 1.37 -0.05 0.00 -0.22 0.00 0.00 54.13 55.40 1rti s LEU 74 Cb 0.05 2.16 -0.04 0.00 0.50 0.00 0.00 46.19 48.86 1rti s LEU 74 CO -0.00 -0.23 0.04 -0.69 -1.32 0.00 0.00 176.35 174.15 1rti s VAL 75 N 1.43 4.65 -1.09 1.68 1.01 -1.26 0.24 120.40 127.05 1rti s VAL 75 Ca -0.09 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 1rti s VAL 75 Cb -0.06 -3.04 0.14 0.00 0.00 0.00 0.00 36.38 33.43 1rti s VAL 75 CO -0.16 0.53 1.33 -0.62 0.00 0.00 0.00 175.10 176.18 1rti s ASP 76 N -0.20 6.85 0.00 3.32 2.15 0.05 -4.87 116.67 123.97 1rti s ASP 76 Ca 0.07 -2.51 0.00 0.00 0.43 0.00 0.00 52.55 50.54 1rti s ASP 76 Cb -0.12 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1rti s ASP 76 CO 0.02 -0.94 0.67 0.49 -0.17 0.00 0.00 175.17 175.24 1rti n PHE 77 N 6.33 0.00 -0.14 -5.34 3.72 -1.26 -4.38 117.46 116.39 1rti n PHE 77 Ca 0.32 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.60 1rti n PHE 77 Cb 0.46 -0.02 -0.09 0.00 -0.94 0.00 0.00 39.48 38.89 1rti n PHE 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rti h ARG 78 N 0.06 -0.31 -0.56 -1.08 3.08 -1.92 0.27 114.38 113.92 1rti h ARG 78 Ca 0.00 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.15 1rti h ARG 78 Cb 0.12 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.17 1rti h ARG 78 CO 0.00 -0.20 0.23 1.49 -1.07 0.00 0.00 179.97 180.41 1rti h GLU 79 N -0.32 0.41 -0.35 0.04 4.57 -2.00 -0.58 114.58 116.35 1rti h GLU 79 Ca 0.07 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 1rti h GLU 79 Cb 0.50 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 1rti h GLU 79 CO -0.54 0.27 0.15 1.25 -1.18 0.00 0.00 179.01 178.97 1rti h LEU 80 N 0.42 0.47 -2.33 1.64 5.85 -1.68 -2.11 115.31 117.57 1rti h LEU 80 Ca 0.27 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1rti h LEU 80 Cb 0.29 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.20 1rti h LEU 80 CO -0.26 0.49 -0.03 0.78 -0.34 0.00 0.00 178.44 179.08 1rti h ASN 81 N 0.42 0.00 0.60 1.25 2.35 0.24 0.88 115.58 121.32 1rti h ASN 81 Ca 0.12 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.70 1rti h ASN 81 Cb 0.16 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1rti h ASN 81 CO -0.01 0.03 -0.76 0.11 -1.65 0.00 0.00 177.43 175.14 1rti h LYS 82 N 0.00 0.12 0.00 0.81 1.57 -0.45 -3.30 116.57 115.33 1rti h LYS 82 Ca -0.00 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.57 1rti h LYS 82 Cb 0.08 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1rti h LYS 82 CO 0.00 0.82 -1.38 0.54 -0.57 0.00 0.00 179.45 178.86 1rti n ARG 83 N -3.70 0.62 -1.98 3.15 1.74 -0.21 -4.95 116.66 111.33 1rti n ARG 83 Ca -0.02 0.12 -0.38 0.00 -0.77 0.00 0.00 57.85 56.80 1rti n ARG 83 Cb 0.73 -1.76 0.01 0.00 -1.02 0.00 0.00 32.46 30.42 1rti n ARG 83 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1rti s THR 84 N -3.14 2.50 0.93 0.55 2.01 0.13 -0.01 115.64 118.61 1rti s THR 84 Ca -0.03 0.39 -0.10 0.00 0.31 0.00 0.00 61.69 62.26 1rti s THR 84 Cb 0.10 -3.21 0.16 0.00 0.01 0.00 0.00 72.50 69.55 1rti s THR 84 CO 0.82 0.02 1.13 0.00 -0.69 0.00 0.00 174.62 175.89 1rti s GLN 85 N -2.66 0.87 0.02 4.92 -2.07 -1.03 -4.55 119.66 115.16 1rti s GLN 85 Ca 0.65 1.43 -0.22 0.00 -1.82 0.00 0.00 55.36 55.40 1rti s GLN 85 Cb -0.37 -1.72 -0.06 0.00 -1.09 0.00 0.00 33.01 29.78 1rti s GLN 85 CO 0.45 -2.69 0.66 -0.51 -1.32 0.00 0.00 175.29 171.88 1rti s ASP 86 N -2.72 7.08 0.27 12.60 1.01 -1.26 -4.92 116.67 128.74 1rti s ASP 86 Ca 0.66 1.29 0.06 0.00 0.71 0.00 0.00 52.55 55.27 1rti s ASP 86 Cb -0.23 -2.41 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 1rti s ASP 86 CO 0.59 0.08 0.33 -0.36 0.21 0.00 0.00 175.17 176.03 1rti s PHE 87 N -0.23 3.23 0.00 4.23 0.40 -1.26 -5.08 117.98 119.28 1rti s PHE 87 Ca 0.34 -0.12 0.00 0.00 -0.60 0.00 0.00 56.93 56.55 1rti s PHE 87 Cb -0.19 -1.64 0.00 0.00 0.51 0.00 0.00 43.02 41.69 1rti s PHE 87 CO 0.20 0.34 0.41 1.87 0.70 0.00 0.00 175.22 178.73 1rti n TRP 88 N -1.40 0.00 -3.73 0.36 -0.00 -1.26 -4.92 117.44 106.49 1rti n TRP 88 Ca -0.06 0.00 -0.12 0.00 -0.00 0.00 0.00 57.50 57.32 1rti n TRP 88 Cb 0.58 0.00 -0.07 0.00 -0.00 0.00 0.00 31.31 31.81 1rti n TRP 88 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 1rti s GLU 89 N -0.82 0.79 -0.64 5.87 2.02 -1.26 -5.02 118.70 119.65 1rti s GLU 89 Ca 0.00 -0.37 0.02 0.00 0.02 0.00 0.00 54.97 54.64 1rti s GLU 89 Cb 0.00 0.35 0.38 0.00 0.10 0.00 0.00 34.13 34.96 1rti s GLU 89 CO 0.00 -0.25 1.51 0.28 0.02 0.00 0.00 175.26 176.82 1rti n VAL 90 N 0.78 3.06 -3.71 2.63 0.31 -1.26 -4.92 118.33 115.21 1rti n VAL 90 Ca -0.19 -4.74 -0.24 0.00 -0.01 0.00 0.00 64.34 59.15 1rti n VAL 90 Cb 0.58 -1.27 0.01 0.00 -0.91 0.00 0.00 33.84 32.25 1rti n VAL 90 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1rti n GLN 91 N -0.48 -1.33 -2.60 5.55 7.27 -1.26 -4.83 117.38 119.70 1rti n GLN 91 Ca 0.45 0.77 -0.42 0.00 0.07 0.00 0.00 57.00 57.86 1rti n GLN 91 Cb 0.45 -2.97 -0.01 0.00 2.41 0.00 0.00 30.24 30.12 1rti n GLN 91 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1rti s LEU 92 N -5.23 3.80 0.00 1.69 1.02 -1.26 -4.58 118.68 114.12 1rti s LEU 92 Ca 0.09 -2.05 0.00 0.00 0.02 0.00 0.00 54.13 52.19 1rti s LEU 92 Cb -0.04 -2.56 0.00 0.00 0.02 0.00 0.00 46.19 43.60 1rti s LEU 92 CO 0.88 -1.29 0.00 0.61 0.02 0.00 0.00 176.35 176.58 1rti n GLY 93 N 5.96 1.08 3.90 -3.19 0.00 -1.26 -5.18 105.19 106.50 1rti n GLY 93 Ca 0.41 0.51 -0.30 0.00 0.00 0.00 0.00 46.02 46.64 1rti n GLY 93 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rti s ILE 94 N 0.00 5.15 -0.08 -0.61 -4.36 -1.26 -5.04 121.20 115.00 1rti s ILE 94 Ca 0.00 -0.05 -0.29 0.00 -0.26 0.00 0.00 60.65 60.05 1rti s ILE 94 Cb 0.00 -3.66 -0.06 0.00 1.25 0.00 0.00 42.46 39.99 1rti s ILE 94 CO 0.00 -0.06 1.87 -2.84 0.24 0.00 0.00 174.94 174.15 1rti s PRO 95 N -2.94 3.89 0.19 0.37 0.02 -1.26 -4.96 135.00 130.31 1rti s PRO 95 Ca 0.41 2.21 -0.30 0.00 0.02 0.00 0.00 61.00 63.34 1rti s PRO 95 Cb -0.12 -4.14 -0.08 0.00 0.02 0.00 0.00 34.50 30.19 1rti s PRO 95 CO 0.26 -1.21 1.13 -1.58 -0.33 0.00 0.00 177.00 175.27 1rti s HIS 96 N 5.22 3.55 0.26 6.54 2.46 -1.26 -4.93 115.29 127.13 1rti s HIS 96 Ca 0.84 1.57 -0.07 0.00 0.47 0.00 0.00 55.06 57.86 1rti s HIS 96 Cb -0.35 -3.32 0.45 0.00 -0.13 0.00 0.00 32.58 29.23 1rti s HIS 96 CO 0.35 -0.76 1.60 -1.35 -2.47 0.00 0.00 174.74 172.11 1rti h PRO 97 N 4.98 0.03 -0.05 2.88 0.11 -1.96 0.23 132.00 138.21 1rti h PRO 97 Ca -0.45 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.68 1rti h PRO 97 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1rti h PRO 97 CO 0.72 0.02 0.25 0.00 -0.21 0.00 0.00 178.00 178.78 1rti h ALA 98 N 1.84 1.36 -0.01 -0.75 0.00 -1.79 -0.77 119.26 119.15 1rti h ALA 98 Ca 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1rti h ALA 98 Cb 0.75 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1rti h ALA 98 CO -0.84 -0.28 -0.29 0.41 0.00 0.00 0.00 179.25 178.26 1rti n GLY 99 N -1.23 -0.71 3.80 0.00 0.00 0.80 -3.45 105.19 104.39 1rti n GLY 99 Ca -0.01 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.26 1rti n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rti s LEU 100 N -2.57 4.08 0.02 0.99 1.43 -0.30 -4.78 118.68 117.55 1rti s LEU 100 Ca 0.22 1.86 -0.12 0.00 -1.03 0.00 0.00 54.13 55.07 1rti s LEU 100 Cb 0.19 -4.31 -0.06 0.00 0.03 0.00 0.00 46.19 42.05 1rti s LEU 100 CO 0.54 -0.39 0.37 -0.54 0.23 0.00 0.00 176.35 176.57 1rti s LYS 101 N -2.71 3.80 -0.03 1.70 1.02 -1.26 -0.50 119.74 121.76 1rti s LYS 101 Ca 0.59 0.25 -0.30 0.00 0.02 0.00 0.00 55.97 56.53 1rti s LYS 101 Cb -0.16 -3.13 -0.05 0.00 -0.52 0.00 0.00 37.83 33.97 1rti s LYS 101 CO 0.21 0.65 1.51 -1.59 -0.92 0.00 0.00 175.35 175.20 1rti s LYS 102 N -1.41 4.23 0.03 1.68 -2.85 -1.23 -4.91 119.74 115.28 1rti s LYS 102 Ca 0.26 2.06 0.07 0.00 -1.00 0.00 0.00 55.97 57.36 1rti s LYS 102 Cb -0.15 -3.74 -0.03 0.00 -2.06 0.00 0.00 37.83 31.85 1rti s LYS 102 CO 0.14 -0.70 -0.19 0.15 0.10 0.00 0.00 175.35 174.85 1rti s LYS 103 N 3.10 2.09 0.55 1.78 -0.14 -1.26 -5.00 119.74 120.86 1rti s LYS 103 Ca 0.67 -0.96 0.28 0.00 -1.36 0.00 0.00 55.97 54.60 1rti s LYS 103 Cb -0.32 -2.18 1.58 0.00 -1.68 0.00 0.00 37.83 35.23 1rti s LYS 103 CO 0.27 0.55 2.14 -0.22 -0.76 0.00 0.00 175.35 177.32 1rti h LYS 104 N 4.70 0.00 -1.97 1.68 3.64 -0.97 -3.44 116.57 120.21 1rti h LYS 104 Ca -0.47 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 58.88 1rti h LYS 104 Cb 1.15 0.00 -0.21 0.00 -0.41 0.00 0.00 32.23 32.76 1rti h LYS 104 CO 0.47 0.08 0.15 -1.54 -2.27 0.00 0.00 179.45 176.34 1rti s SER 105 N -6.18 -0.74 0.16 4.20 1.04 -0.79 -5.00 113.70 106.39 1rti s SER 105 Ca -0.04 1.41 0.09 0.00 0.48 0.00 0.00 55.95 57.90 1rti s SER 105 Cb 0.14 1.43 -0.04 0.00 0.10 0.00 0.00 66.02 67.65 1rti s SER 105 CO 0.57 -0.24 -0.19 -0.69 0.98 0.00 0.00 173.24 173.67 1rti s VAL 106 N 0.44 1.87 -0.01 5.02 1.01 -1.26 -1.51 120.40 125.96 1rti s VAL 106 Ca -0.00 -1.87 -0.02 0.00 0.00 0.00 0.00 61.98 60.09 1rti s VAL 106 Cb -0.05 -1.83 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 1rti s VAL 106 CO -0.01 -0.25 0.03 -0.89 0.00 0.00 0.00 175.10 173.99 1rti s THR 107 N -1.86 0.03 -0.30 3.92 2.01 0.18 -4.94 115.64 114.68 1rti s THR 107 Ca 0.15 -0.25 -0.04 0.00 0.31 0.00 0.00 61.69 61.87 1rti s THR 107 Cb -0.07 -0.13 0.04 0.00 0.01 0.00 0.00 72.50 72.35 1rti s THR 107 CO 0.07 -0.13 0.03 0.54 -0.69 0.00 0.00 174.62 174.43 1rti s VAL 108 N -0.40 3.32 -0.42 3.82 0.11 -1.26 -0.46 120.40 125.11 1rti s VAL 108 Ca -0.04 -1.16 -0.23 0.00 -2.93 0.00 0.00 61.98 57.61 1rti s VAL 108 Cb -0.03 -2.84 0.02 0.00 -1.53 0.00 0.00 36.38 32.00 1rti s VAL 108 CO -0.00 -0.05 0.80 -0.76 -3.33 0.00 0.00 175.10 171.76 1rti s LEU 109 N 1.34 4.19 -1.07 2.54 2.01 0.21 -4.71 118.68 123.19 1rti s LEU 109 Ca -0.02 0.06 -0.19 0.00 0.01 0.00 0.00 54.13 53.99 1rti s LEU 109 Cb -0.19 -3.00 0.11 0.00 0.01 0.00 0.00 46.19 43.12 1rti s LEU 109 CO -0.00 -0.87 1.37 -0.62 1.01 0.00 0.00 176.35 177.24 1rti s ASP 110 N 2.05 6.72 -0.42 2.29 2.15 -1.26 -0.33 116.67 127.87 1rti s ASP 110 Ca 0.31 -2.15 -0.04 0.00 0.43 0.00 0.00 52.55 51.10 1rti s ASP 110 Cb -0.12 -2.47 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1rti s ASP 110 CO 0.21 -1.13 2.92 0.52 -0.17 0.00 0.00 175.17 177.51 1rti n VAL 111 N 5.82 3.35 0.17 1.11 0.31 0.23 -4.57 118.33 124.76 1rti n VAL 111 Ca 0.33 -2.78 -0.07 0.00 -0.01 0.00 0.00 64.34 61.81 1rti n VAL 111 Cb 0.48 -1.69 -0.03 0.00 -0.91 0.00 0.00 33.84 31.68 1rti n VAL 111 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1rti h GLY 112 N 4.22 -0.48 0.87 2.92 0.00 -1.86 -3.24 103.07 105.50 1rti h GLY 112 Ca 0.37 0.18 0.06 0.00 0.00 0.00 0.00 47.33 47.94 1rti h GLY 112 CO 0.79 -0.18 0.51 -1.80 0.00 0.00 0.00 176.54 175.86 1rti h ASP 113 N -0.61 0.00 -1.47 0.19 3.58 -1.86 -3.00 116.42 113.25 1rti h ASP 113 Ca -0.05 0.00 0.43 0.00 0.42 0.00 0.00 57.03 57.83 1rti h ASP 113 Cb 0.35 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.35 1rti h ASP 113 CO 0.08 0.00 1.07 0.00 -2.88 0.00 0.00 179.24 177.51 1rti h ALA 114 N 1.19 3.40 -1.00 -0.78 0.00 -1.83 0.12 119.26 120.36 1rti h ALA 114 Ca 0.10 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.08 1rti h ALA 114 Cb 1.11 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 18.93 1rti h ALA 114 CO -0.00 -1.83 0.63 1.88 0.00 0.00 0.00 179.25 179.93 1rti h TYR 115 N 0.00 1.13 -0.56 0.00 -1.99 -1.77 0.34 116.97 114.12 1rti h TYR 115 Ca 0.70 0.03 -0.38 0.00 2.00 0.00 0.00 58.73 61.08 1rti h TYR 115 Cb 2.83 -0.36 -0.16 0.00 2.00 0.00 0.00 36.73 41.04 1rti h TYR 115 CO 0.00 0.45 0.49 1.19 -0.00 0.00 0.00 178.16 180.29 1rti n PHE 116 N -4.62 1.82 0.00 4.88 3.01 0.43 -3.53 117.46 119.44 1rti n PHE 116 Ca 0.19 -2.14 0.00 0.00 1.01 0.00 0.00 57.45 56.51 1rti n PHE 116 Cb 0.35 -1.03 0.00 0.00 -0.01 0.00 0.00 39.48 38.79 1rti n PHE 116 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1rti n SER 117 N 0.14 2.24 -4.63 4.37 7.64 0.10 -4.65 113.62 118.82 1rti n SER 117 Ca 0.35 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.83 1rti n SER 117 Cb 0.59 0.28 -0.06 0.00 -1.01 0.00 0.00 64.21 64.01 1rti n SER 117 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1rti s VAL 118 N -1.32 4.97 0.42 0.44 1.01 -1.18 -0.39 120.40 124.35 1rti s VAL 118 Ca 0.00 1.19 -0.25 0.00 0.00 0.00 0.00 61.98 62.91 1rti s VAL 118 Cb 0.00 -3.95 -0.08 0.00 0.00 0.00 0.00 36.38 32.34 1rti s VAL 118 CO 0.00 0.03 1.29 -2.16 0.00 0.00 0.00 175.10 174.26 1rti s PRO 119 N 2.45 3.89 0.30 2.72 0.04 -1.26 -1.37 135.00 141.77 1rti s PRO 119 Ca 0.27 2.12 -0.06 0.00 0.04 0.00 0.00 61.00 63.37 1rti s PRO 119 Cb -0.16 -2.69 -0.05 0.00 0.04 0.00 0.00 34.50 31.65 1rti s PRO 119 CO 0.09 -0.55 0.58 -1.17 0.04 0.00 0.00 177.00 175.99 1rti s LEU 120 N -2.57 4.04 -0.11 -3.56 2.96 -0.29 -4.60 118.68 114.55 1rti s LEU 120 Ca 0.59 0.79 -0.35 0.00 -0.22 0.00 0.00 54.13 54.93 1rti s LEU 120 Cb -0.37 -3.61 -0.12 0.00 0.50 0.00 0.00 46.19 42.59 1rti s LEU 120 CO 0.47 -0.21 1.86 -0.67 -1.32 0.00 0.00 176.35 176.48 1rti n ASP 121 N -0.92 3.31 -0.13 3.68 -0.08 -1.26 -4.85 116.55 116.30 1rti n ASP 121 Ca -0.01 0.99 -0.05 0.00 -1.51 0.00 0.00 54.79 54.21 1rti n ASP 121 Cb 0.54 -1.34 0.01 0.00 2.34 0.00 0.00 41.12 42.67 1rti n ASP 121 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1rti h GLU 122 N 8.92 -0.12 -0.97 -0.67 4.22 -1.94 -0.81 114.58 123.21 1rti h GLU 122 Ca -0.48 0.01 0.15 0.00 0.08 0.00 0.00 59.36 59.12 1rti h GLU 122 Cb 1.28 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 30.47 1rti h GLU 122 CO 0.95 -0.08 0.61 -0.44 -2.18 0.00 0.00 179.01 177.87 1rti h ASP 123 N -0.12 0.79 0.69 1.04 5.19 -1.95 -1.44 116.42 120.63 1rti h ASP 123 Ca 0.21 0.06 -0.17 0.00 -0.62 0.00 0.00 57.03 56.51 1rti h ASP 123 Cb 0.45 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 1rti h ASP 123 CO -0.51 0.37 -0.79 0.15 -3.12 0.00 0.00 179.24 175.34 1rti h PHE 124 N 0.82 0.10 -0.99 4.55 3.04 -1.46 -3.34 116.94 119.65 1rti h PHE 124 Ca 0.50 -0.05 0.36 0.00 3.98 0.00 0.00 57.97 62.77 1rti h PHE 124 Cb 0.70 -0.01 -0.18 0.00 2.56 0.00 0.00 35.95 39.02 1rti h PHE 124 CO -0.00 0.83 0.40 0.00 -2.02 0.00 0.00 178.31 177.51 1rti h ARG 125 N 0.04 0.04 -0.83 1.11 3.08 -0.07 0.26 114.38 118.01 1rti h ARG 125 Ca -0.02 -0.00 0.21 0.00 0.07 0.00 0.00 59.98 60.24 1rti h ARG 125 Cb 1.38 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.38 1rti h ARG 125 CO 0.11 0.03 0.57 1.57 -1.07 0.00 0.00 179.97 181.18 1rti h LYS 126 N 0.04 0.20 0.00 0.04 2.10 -1.72 -1.45 116.57 115.79 1rti h LYS 126 Ca 0.76 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.40 1rti h LYS 126 Cb 1.88 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 33.16 1rti h LYS 126 CO -0.79 0.13 0.00 1.88 -2.00 0.00 0.00 179.45 178.67 1rti h TYR 127 N 0.21 0.00 -0.24 0.07 0.05 -1.22 -2.96 116.97 112.87 1rti h TYR 127 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.19 1rti h TYR 127 Cb 1.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.03 1rti h TYR 127 CO -0.00 0.00 0.00 0.25 -1.05 0.00 0.00 178.16 177.36 1rti n THR 128 N -2.50 0.75 -1.69 -2.88 -2.24 -0.55 -4.65 114.28 100.51 1rti n THR 128 Ca 0.02 -0.46 -0.44 0.00 -2.27 0.00 0.00 64.05 60.90 1rti n THR 128 Cb 0.25 -0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 1rti n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rti n ALA 129 N 0.27 2.07 -2.63 6.98 0.00 -1.12 -4.35 120.51 121.73 1rti n ALA 129 Ca 0.10 0.42 -0.09 0.00 0.00 0.00 0.00 53.44 53.87 1rti n ALA 129 Cb 0.44 -2.43 -0.10 0.00 0.00 0.00 0.00 19.45 17.36 1rti n ALA 129 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1rti s PHE 130 N 0.94 0.29 -0.05 0.00 -0.12 -0.95 -0.34 117.98 117.76 1rti s PHE 130 Ca 0.76 -0.65 0.05 0.00 -0.05 0.00 0.00 56.93 57.04 1rti s PHE 130 Cb -0.59 -0.22 -0.01 0.00 -0.63 0.00 0.00 43.02 41.57 1rti s PHE 130 CO 0.36 -0.33 -0.21 0.99 -0.05 0.00 0.00 175.22 175.99 1rti s THR 131 N -2.65 1.74 -0.46 -4.49 2.01 -1.26 -1.86 115.64 108.68 1rti s THR 131 Ca -0.05 -0.90 -0.17 0.00 0.31 0.00 0.00 61.69 60.89 1rti s THR 131 Cb -0.01 -1.48 0.05 0.00 0.01 0.00 0.00 72.50 71.07 1rti s THR 131 CO -0.05 0.49 0.44 -0.63 -0.69 0.00 0.00 174.62 174.18 1rti s ILE 132 N -0.12 5.13 0.84 1.82 -1.09 0.13 -4.74 121.20 123.17 1rti s ILE 132 Ca -0.02 -0.77 -0.14 0.00 -2.23 0.00 0.00 60.65 57.49 1rti s ILE 132 Cb -0.12 -4.13 0.21 0.00 -1.58 0.00 0.00 42.46 36.84 1rti s ILE 132 CO 0.02 -0.57 0.73 -0.81 -1.23 0.00 0.00 174.94 173.08 1rti n PRO 133 N 5.48 -2.57 -4.15 2.79 -0.04 -1.26 -0.45 135.00 134.79 1rti n PRO 133 Ca -0.10 -1.17 -0.17 0.00 -0.04 0.00 0.00 63.50 62.02 1rti n PRO 133 Cb 0.45 -1.12 -0.12 0.00 -0.04 0.00 0.00 33.50 32.67 1rti n PRO 133 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1rti s SER 134 N -3.44 1.53 0.07 3.54 0.15 -1.26 -4.75 113.70 109.53 1rti s SER 134 Ca 0.48 -0.61 -0.36 0.00 0.70 0.00 0.00 55.95 56.16 1rti s SER 134 Cb -0.05 -0.03 -0.19 0.00 -1.71 0.00 0.00 66.02 64.04 1rti s SER 134 CO 0.37 -0.10 1.58 0.40 1.20 0.00 0.00 173.24 176.68 1rti h ILE 135 N 4.31 0.06 0.00 6.45 2.04 -1.99 -3.03 117.51 125.36 1rti h ILE 135 Ca -0.40 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1rti h ILE 135 Cb 1.19 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1rti h ILE 135 CO 0.41 0.00 0.00 -0.46 0.00 0.00 0.00 178.15 178.10 1rti n ASN 136 N -5.60 0.00 -4.20 1.72 2.04 -1.26 -4.59 115.26 103.37 1rti n ASN 136 Ca -0.14 0.00 -0.33 0.00 -0.44 0.00 0.00 54.58 53.66 1rti n ASN 136 Cb 0.48 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.69 1rti n ASN 136 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1rti n ASN 137 N -0.57 -1.79 0.00 0.53 5.15 -1.14 -4.89 115.26 112.54 1rti n ASN 137 Ca 0.00 -1.07 0.00 0.00 -0.60 0.00 0.00 54.58 52.91 1rti n ASN 137 Cb 0.00 -2.57 0.00 0.00 -0.53 0.00 0.00 39.78 36.68 1rti n ASN 137 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1rti n GLU 138 N -4.38 1.13 0.00 1.20 0.00 -1.26 -5.04 120.64 112.28 1rti n GLU 138 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.08 1rti n GLU 138 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.01 1rti n GLU 138 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1rti n THR 139 N 0.00 0.00 -3.04 6.31 -1.04 -1.26 -5.12 114.28 110.13 1rti n THR 139 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1rti n THR 139 Cb 0.00 -0.19 0.00 0.00 -1.82 0.00 0.00 70.33 68.32 1rti n THR 139 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1rti n PRO 140 N -0.51 2.76 -2.22 -2.82 -0.04 -1.26 -5.11 135.00 125.79 1rti n PRO 140 Ca 0.00 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.44 1rti n PRO 140 Cb 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.45 1rti n PRO 140 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1rti n GLY 141 N 5.00 3.96 3.47 0.55 0.00 -1.26 -4.71 105.19 112.20 1rti n GLY 141 Ca 0.00 -1.78 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 1rti n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rti s ILE 142 N -1.96 4.36 0.14 -0.61 -1.09 0.40 -4.88 121.20 117.56 1rti s ILE 142 Ca 0.03 -0.75 -0.19 0.00 -2.23 0.00 0.00 60.65 57.51 1rti s ILE 142 Cb 0.00 -4.78 -0.07 0.00 -1.58 0.00 0.00 42.46 36.03 1rti s ILE 142 CO 0.02 -1.56 0.64 -0.13 -1.23 0.00 0.00 174.94 172.68 1rti s ARG 143 N 3.85 4.24 0.29 2.79 0.52 -1.26 -0.69 118.95 128.69 1rti s ARG 143 Ca 0.29 0.80 0.00 0.00 -0.52 0.00 0.00 55.73 56.31 1rti s ARG 143 Cb -0.10 -3.09 -0.02 0.00 0.52 0.00 0.00 34.95 32.26 1rti s ARG 143 CO 0.02 0.53 0.32 0.71 0.02 0.00 0.00 175.30 176.90 1rti s TYR 144 N -1.30 1.27 -0.06 -0.53 2.02 -0.77 -2.60 117.35 115.37 1rti s TYR 144 Ca 0.36 -1.39 -0.29 0.00 -0.37 0.00 0.00 57.07 55.37 1rti s TYR 144 Cb -0.18 -0.40 0.07 0.00 -0.40 0.00 0.00 41.96 41.04 1rti s TYR 144 CO 0.21 -0.90 0.65 1.14 -1.57 0.00 0.00 175.55 175.08 1rti s GLN 145 N -3.56 1.01 0.23 -0.62 -2.07 0.61 -2.24 119.66 113.01 1rti s GLN 145 Ca 0.36 0.28 -0.28 0.00 -1.82 0.00 0.00 55.36 53.89 1rti s GLN 145 Cb 0.02 0.48 -0.09 0.00 -1.09 0.00 0.00 33.01 32.33 1rti s GLN 145 CO 0.20 -0.30 0.90 0.71 -1.32 0.00 0.00 175.29 175.48 1rti s TYR 146 N -1.07 3.95 -0.04 9.60 1.51 -1.26 -0.48 117.35 129.55 1rti s TYR 146 Ca -0.10 1.84 0.14 0.00 -1.01 0.00 0.00 57.07 57.94 1rti s TYR 146 Cb -0.01 -2.92 -0.22 0.00 -0.11 0.00 0.00 41.96 38.70 1rti s TYR 146 CO 0.09 0.46 0.32 0.09 -1.11 0.00 0.00 175.55 175.40 1rti n ASN 147 N 1.44 1.71 -4.67 2.29 3.02 0.41 -4.73 115.26 114.73 1rti n ASN 147 Ca -0.03 -0.03 -0.25 0.00 -0.03 0.00 0.00 54.58 54.24 1rti n ASN 147 Cb 0.48 1.62 -0.09 0.00 -0.61 0.00 0.00 39.78 41.19 1rti n ASN 147 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1rti s VAL 148 N -2.96 2.41 -0.09 2.41 0.11 -1.19 -1.14 120.40 119.95 1rti s VAL 148 Ca -0.05 -1.87 -0.32 0.00 -2.93 0.00 0.00 61.98 56.81 1rti s VAL 148 Cb 0.09 -2.91 -0.10 0.00 -1.53 0.00 0.00 36.38 31.94 1rti s VAL 148 CO 0.59 -0.09 1.99 0.18 -3.33 0.00 0.00 175.10 174.44 1rti n LEU 149 N -1.06 3.55 -4.75 2.54 4.77 -0.47 -4.60 117.00 116.98 1rti n LEU 149 Ca -0.03 0.79 -0.41 0.00 -0.03 0.00 0.00 56.01 56.33 1rti n LEU 149 Cb 0.64 -1.44 -0.03 0.00 -2.33 0.00 0.00 43.42 40.26 1rti n LEU 149 CO 0.45 -0.12 0.90 -2.84 -1.33 0.00 0.00 177.39 174.45 1rti s PRO 150 N 4.74 4.48 -0.08 3.23 0.02 -1.26 -4.37 135.00 141.76 1rti s PRO 150 Ca 0.94 1.99 -0.30 0.00 0.02 0.00 0.00 61.00 63.65 1rti s PRO 150 Cb -0.57 -3.16 -0.04 0.00 0.02 0.00 0.00 34.50 30.75 1rti s PRO 150 CO 0.46 -0.05 1.49 -1.14 -0.33 0.00 0.00 177.00 177.43 1rti s GLN 151 N -1.07 4.21 0.00 5.54 2.00 -1.26 -2.32 119.66 126.75 1rti s GLN 151 Ca 0.50 1.99 0.00 0.00 -2.00 0.00 0.00 55.36 55.84 1rti s GLN 151 Cb -0.35 -3.85 0.00 0.00 0.80 0.00 0.00 33.01 29.60 1rti s GLN 151 CO 0.43 -0.76 0.00 0.41 -0.50 0.00 0.00 175.29 174.87 1rti n GLY 152 N 3.89 0.16 3.74 2.59 0.00 -1.26 -4.82 105.19 109.50 1rti n GLY 152 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1rti n GLY 152 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1rti s TRP 153 N -2.05 3.59 0.24 1.61 -0.00 -0.98 -4.84 118.94 116.51 1rti s TRP 153 Ca 0.00 1.63 -0.14 0.00 -0.00 0.00 0.00 56.10 57.59 1rti s TRP 153 Cb 0.00 -3.28 0.31 0.00 -0.00 0.00 0.00 33.47 30.50 1rti s TRP 153 CO 0.00 -0.60 1.53 1.17 -0.00 0.00 0.00 176.95 179.05 1rti n LYS 154 N 2.00 -0.18 0.15 5.86 4.81 -1.26 -1.69 118.16 127.85 1rti n LYS 154 Ca 0.02 1.52 0.03 0.00 -0.87 0.00 0.00 58.31 59.00 1rti n LYS 154 Cb 0.46 -2.26 0.16 0.00 0.02 0.00 0.00 35.03 33.41 1rti n LYS 154 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 1rti h GLY 155 N 0.00 0.00 -0.54 3.14 0.00 -1.92 -3.38 103.07 100.38 1rti h GLY 155 Ca 0.38 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.80 1rti h GLY 155 CO -0.99 0.00 -0.47 1.76 0.00 0.00 0.00 176.54 176.84 1rti h SER 156 N 0.00 -1.64 -0.67 0.19 0.02 -1.62 -0.55 113.55 109.28 1rti h SER 156 Ca -0.00 0.26 0.12 0.00 -0.84 0.00 0.00 61.79 61.32 1rti h SER 156 Cb 1.18 0.73 -0.09 0.00 0.14 0.00 0.00 62.40 64.37 1rti h SER 156 CO 0.06 -0.34 0.23 -0.65 -1.14 0.00 0.00 176.83 175.00 1rti h PRO 157 N -0.24 0.38 0.26 3.45 0.11 -1.74 0.12 132.00 134.34 1rti h PRO 157 Ca 0.16 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1rti h PRO 157 Cb 0.56 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.59 1rti h PRO 157 CO -0.70 0.25 -0.12 0.00 -0.21 0.00 0.00 178.00 177.21 1rti h ALA 158 N 1.49 -0.35 -0.02 -0.75 0.00 -1.58 -2.67 119.26 115.39 1rti h ALA 158 Ca 0.36 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1rti h ALA 158 Cb 0.51 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1rti h ALA 158 CO -0.37 -0.54 -0.19 0.82 0.00 0.00 0.00 179.25 178.97 1rti h ILE 159 N -0.66 0.54 -0.99 0.00 2.04 -0.80 -1.68 117.51 115.96 1rti h ILE 159 Ca -0.04 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.05 1rti h ILE 159 Cb 0.46 0.54 -0.12 0.00 -0.74 0.00 0.00 36.82 36.97 1rti h ILE 159 CO 0.06 0.00 0.57 0.15 0.00 0.00 0.00 178.15 178.93 1rti h PHE 160 N -0.30 0.98 0.28 1.37 3.57 -0.81 0.21 116.94 122.24 1rti h PHE 160 Ca 0.06 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1rti h PHE 160 Cb 0.38 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1rti h PHE 160 CO -0.25 0.10 -0.13 0.37 -2.23 0.00 0.00 178.31 176.17 1rti h GLN 161 N 0.61 -0.36 -0.66 1.11 5.75 -0.95 -1.24 115.11 119.37 1rti h GLN 161 Ca 0.61 0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 59.12 1rti h GLN 161 Cb 1.10 0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.70 1rti h GLN 161 CO -0.45 -0.13 0.36 0.66 -2.65 0.00 0.00 178.83 176.62 1rti h SER 162 N -0.53 0.83 -0.41 -0.69 4.64 -0.84 0.16 113.55 116.71 1rti h SER 162 Ca -0.04 -0.10 0.06 0.00 -0.47 0.00 0.00 61.79 61.24 1rti h SER 162 Cb 0.39 -0.21 -0.05 0.00 -0.31 0.00 0.00 62.40 62.22 1rti h SER 162 CO 0.06 0.69 0.12 0.28 -0.87 0.00 0.00 176.83 177.11 1rti h SER 163 N 0.90 0.10 -0.52 4.97 0.02 -0.95 0.47 113.55 118.54 1rti h SER 163 Ca 0.23 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 1rti h SER 163 Cb 0.04 0.05 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 1rti h SER 163 CO -0.04 0.09 0.31 -0.03 -1.14 0.00 0.00 176.83 176.03 1rti h MET 164 N 0.27 0.70 -0.46 3.45 -1.53 -0.63 -1.54 114.93 115.20 1rti h MET 164 Ca 0.19 -0.06 0.08 0.00 -3.44 0.00 0.00 59.70 56.47 1rti h MET 164 Cb 0.20 -0.15 -0.07 0.00 -0.55 0.00 0.00 31.60 31.04 1rti h MET 164 CO -0.22 0.51 0.06 1.15 0.14 0.00 0.00 176.91 178.56 1rti h THR 165 N 0.69 0.72 -0.14 -0.77 2.02 0.63 -0.64 112.91 115.43 1rti h THR 165 Ca 0.19 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.30 1rti h THR 165 Cb -0.01 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 1rti h THR 165 CO -0.04 0.03 0.07 0.11 0.37 0.00 0.00 175.52 176.07 1rti h LYS 166 N 0.19 0.19 -0.79 6.66 1.57 -0.52 -1.27 116.57 122.60 1rti h LYS 166 Ca 0.23 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1rti h LYS 166 Cb 0.31 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1rti h LYS 166 CO -0.32 0.21 0.49 0.82 -0.57 0.00 0.00 179.45 180.07 1rti h ILE 167 N 0.12 1.21 0.00 1.86 2.04 -0.72 -2.55 117.51 119.48 1rti h ILE 167 Ca 0.05 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1rti h ILE 167 Cb 0.07 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.24 1rti h ILE 167 CO -0.01 0.22 -0.28 0.18 0.00 0.00 0.00 178.15 178.26 1rti n LEU 168 N -4.39 0.79 -0.06 1.44 4.77 -0.30 -4.24 117.00 115.00 1rti n LEU 168 Ca 0.09 0.43 -0.09 0.00 -0.03 0.00 0.00 56.01 56.41 1rti n LEU 168 Cb 0.05 -0.25 -0.02 0.00 -2.33 0.00 0.00 43.42 40.87 1rti n LEU 168 CO 0.37 -0.13 0.66 -0.08 -1.33 0.00 0.00 177.39 176.88 1rti h GLU 169 N 0.00 -0.28 -0.17 3.23 4.57 -0.79 -1.93 114.58 119.22 1rti h GLU 169 Ca 0.00 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1rti h GLU 169 Cb 0.75 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.40 1rti h GLU 169 CO 0.00 -0.19 0.10 -1.00 -1.18 0.00 0.00 179.01 176.74 1rti h PRO 170 N -0.29 0.22 -0.61 0.92 0.13 -1.74 -2.66 132.00 127.97 1rti h PRO 170 Ca 0.14 -0.02 0.08 0.00 -0.87 0.00 0.00 66.00 65.33 1rti h PRO 170 Cb 0.52 -0.05 -0.07 0.00 0.13 0.00 0.00 31.00 31.53 1rti h PRO 170 CO -0.44 0.19 0.27 0.35 -0.23 0.00 0.00 178.00 178.14 1rti h PHE 171 N 0.19 0.48 -0.11 1.56 3.04 -1.74 -1.25 116.94 119.11 1rti h PHE 171 Ca 0.06 0.03 0.02 0.00 3.98 0.00 0.00 57.97 62.06 1rti h PHE 171 Cb 0.03 -0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.39 1rti h PHE 171 CO -0.05 0.16 -0.03 0.00 -2.02 0.00 0.00 178.31 176.37 1rti h ARG 172 N 0.48 -0.01 -0.40 1.11 3.08 -1.23 -0.41 114.38 117.00 1rti h ARG 172 Ca 0.30 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.40 1rti h ARG 172 Cb 0.32 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.32 1rti h ARG 172 CO -0.26 -0.00 0.15 0.87 -1.07 0.00 0.00 179.97 179.65 1rti h LYS 173 N -0.01 0.30 0.00 0.04 1.57 -1.01 -0.86 116.57 116.60 1rti h LYS 173 Ca 0.05 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1rti h LYS 173 Cb 0.09 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1rti h LYS 173 CO -0.11 0.20 0.00 0.00 -0.57 0.00 0.00 179.45 178.96 1rti n GLN 174 N -5.01 0.52 -3.07 3.15 10.64 -0.54 -3.78 117.38 119.30 1rti n GLN 174 Ca 0.02 0.03 -0.16 0.00 -1.83 0.00 0.00 57.00 55.07 1rti n GLN 174 Cb 0.14 -1.50 -0.01 0.00 -0.86 0.00 0.00 30.24 28.02 1rti n GLN 174 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1rti n ASN 175 N -1.19 0.43 0.00 2.61 3.02 -0.19 -4.97 115.26 114.97 1rti n ASN 175 Ca 0.15 -3.06 0.00 0.00 -0.03 0.00 0.00 54.58 51.64 1rti n ASN 175 Cb 0.17 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1rti n ASN 175 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1rti n PRO 176 N 0.24 0.00 0.00 3.52 -0.04 -0.66 -1.06 135.00 137.01 1rti n PRO 176 Ca 0.20 0.25 0.12 0.00 -0.04 0.00 0.00 63.50 64.04 1rti n PRO 176 Cb 0.68 -1.50 0.27 0.00 -0.04 0.00 0.00 33.50 32.91 1rti n PRO 176 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1rti n ASP 177 N -1.24 1.25 -4.53 3.54 5.68 -1.26 -4.87 116.55 115.12 1rti n ASP 177 Ca 0.00 -1.03 -0.34 0.00 -0.50 0.00 0.00 54.79 52.93 1rti n ASP 177 Cb 0.00 0.24 -0.12 0.00 -1.14 0.00 0.00 41.12 40.11 1rti n ASP 177 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 1rti s ILE 178 N -2.52 3.96 -0.13 2.12 1.01 -0.22 -4.65 121.20 120.77 1rti s ILE 178 Ca 0.22 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 1rti s ILE 178 Cb 0.19 -2.72 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 1rti s ILE 178 CO 0.54 0.51 -0.00 0.54 0.00 0.00 0.00 174.94 176.53 1rti s VAL 179 N 0.17 4.26 -0.01 2.92 0.11 -0.86 -4.99 120.40 122.00 1rti s VAL 179 Ca -0.01 -0.24 0.05 0.00 -2.93 0.00 0.00 61.98 58.84 1rti s VAL 179 Cb -0.14 -2.84 -0.01 0.00 -1.53 0.00 0.00 36.38 31.86 1rti s VAL 179 CO 0.03 0.54 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.55 1rti s ILE 180 N -0.24 1.24 -0.05 7.04 1.01 -1.26 -1.45 121.20 127.49 1rti s ILE 180 Ca 0.06 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 60.06 1rti s ILE 180 Cb -0.12 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.30 1rti s ILE 180 CO 0.02 0.33 -0.23 -0.31 0.00 0.00 0.00 174.94 174.74 1rti s TYR 181 N -0.41 2.24 -0.15 3.97 1.51 0.37 -4.98 117.35 119.90 1rti s TYR 181 Ca 0.06 -0.63 -0.03 0.00 -1.01 0.00 0.00 57.07 55.46 1rti s TYR 181 Cb -0.06 -1.47 -0.03 0.00 -0.11 0.00 0.00 41.96 40.29 1rti s TYR 181 CO -0.00 -0.18 -0.05 -0.65 -1.11 0.00 0.00 175.55 173.56 1rti s GLN 182 N -0.18 3.65 -0.36 -0.62 -0.21 -1.26 -0.74 119.66 119.94 1rti s GLN 182 Ca -0.02 -0.53 0.02 0.00 0.02 0.00 0.00 55.36 54.85 1rti s GLN 182 Cb -0.13 -2.89 0.15 0.00 1.00 0.00 0.00 33.01 31.15 1rti s GLN 182 CO 0.03 0.24 0.32 -0.47 -2.12 0.00 0.00 175.29 173.29 1rti s TYR 183 N 0.35 -0.07 0.00 0.91 5.04 0.13 -5.03 117.35 118.68 1rti s TYR 183 Ca -0.05 -0.94 0.00 0.00 -2.44 0.00 0.00 57.07 53.65 1rti s TYR 183 Cb -0.14 -0.54 0.00 0.00 0.35 0.00 0.00 41.96 41.63 1rti s TYR 183 CO 0.03 -0.93 0.00 -1.33 -1.34 0.00 0.00 175.55 171.98 1rti n MET 184 N 4.34 0.00 0.05 4.97 2.81 -1.26 -0.67 117.12 127.36 1rti n MET 184 Ca 0.09 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.11 1rti n MET 184 Cb 0.43 0.00 0.30 0.00 -0.71 0.00 0.00 33.22 33.24 1rti n MET 184 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1rti n ASP 185 N 9.01 0.59 -4.74 7.83 5.75 -1.26 -4.83 116.55 128.91 1rti n ASP 185 Ca 0.00 0.20 -0.38 0.00 -0.01 0.00 0.00 54.79 54.60 1rti n ASP 185 Cb 0.00 -0.12 -0.06 0.00 -1.03 0.00 0.00 41.12 39.91 1rti n ASP 185 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1rti s ASP 186 N -3.90 6.77 -0.26 -1.12 1.01 0.15 0.78 116.67 120.11 1rti s ASP 186 Ca 0.09 0.92 0.02 0.00 0.71 0.00 0.00 52.55 54.29 1rti s ASP 186 Cb 0.15 -2.31 0.06 0.00 1.01 0.00 0.00 42.92 41.83 1rti s ASP 186 CO 0.66 0.03 -0.07 -0.22 0.21 0.00 0.00 175.17 175.78 1rti s LEU 187 N 0.40 3.20 -0.24 1.23 2.96 0.55 -0.69 118.68 126.09 1rti s LEU 187 Ca 0.28 -1.38 -0.14 0.00 -0.22 0.00 0.00 54.13 52.67 1rti s LEU 187 Cb -0.16 -1.40 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 1rti s LEU 187 CO 0.12 -0.23 0.31 -0.31 -1.32 0.00 0.00 176.35 174.93 1rti s TYR 188 N 1.20 3.30 -0.13 5.38 1.51 0.08 0.66 117.35 129.35 1rti s TYR 188 Ca -0.06 0.40 0.02 0.00 -1.01 0.00 0.00 57.07 56.42 1rti s TYR 188 Cb -0.19 -2.47 0.00 0.00 -0.11 0.00 0.00 41.96 39.19 1rti s TYR 188 CO -0.06 -0.09 -0.20 0.08 -1.11 0.00 0.00 175.55 174.18 1rti s VAL 189 N 1.57 2.33 0.04 0.71 1.01 0.39 -0.48 120.40 125.98 1rti s VAL 189 Ca 0.14 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1rti s VAL 189 Cb -0.15 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 1rti s VAL 189 CO 0.08 0.54 -0.04 -0.83 0.00 0.00 0.00 175.10 174.85 1rti s GLY 190 N 0.67 0.43 0.00 4.51 0.00 -0.53 0.52 107.32 112.92 1rti s GLY 190 Ca -0.10 -0.96 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1rti s GLY 190 CO 0.02 -1.05 0.00 -1.14 0.00 0.00 0.00 173.10 170.93 1rti n SER 191 N 0.77 0.00 -2.38 1.64 3.41 -0.57 -2.03 113.62 114.46 1rti n SER 191 Ca -0.18 -0.91 -0.16 0.00 -0.26 0.00 0.00 58.87 57.36 1rti n SER 191 Cb 0.58 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.56 1rti n SER 191 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1rti n ASP 192 N -0.61 3.63 -4.87 4.04 8.00 -1.26 -0.25 116.55 125.23 1rti n ASP 192 Ca 0.00 -3.17 -0.37 0.00 0.71 0.00 0.00 54.79 51.96 1rti n ASP 192 Cb 0.00 -0.42 -0.06 0.00 -0.02 0.00 0.00 41.12 40.62 1rti n ASP 192 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1rti s LEU 193 N -3.60 4.41 0.19 0.64 1.43 -1.26 -4.91 118.68 115.58 1rti s LEU 193 Ca 0.42 0.58 -0.32 0.00 -1.03 0.00 0.00 54.13 53.77 1rti s LEU 193 Cb 0.39 -2.22 -0.15 0.00 0.03 0.00 0.00 46.19 44.24 1rti s LEU 193 CO -0.02 0.38 1.15 1.21 0.23 0.00 0.00 176.35 179.30 1rti n GLU 194 N 1.89 1.22 -0.07 1.70 0.00 -1.26 -4.23 120.64 119.89 1rti n GLU 194 Ca -0.18 0.44 0.00 0.00 0.00 0.00 0.00 57.16 57.42 1rti n GLU 194 Cb 0.54 -1.92 0.01 0.00 0.00 0.00 0.00 31.44 30.07 1rti n GLU 194 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 1rti n ILE 195 N 1.36 -0.09 -0.00 6.31 2.08 -1.26 0.29 119.36 128.05 1rti n ILE 195 Ca 0.14 0.44 -0.12 0.00 0.56 0.00 0.00 62.75 63.78 1rti n ILE 195 Cb 0.26 -0.59 -0.07 0.00 -0.75 0.00 0.00 39.64 38.48 1rti n ILE 195 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1rti h GLY 196 N 0.00 0.09 0.36 7.39 0.00 -2.00 -1.88 103.07 107.02 1rti h GLY 196 Ca 0.07 -0.05 0.09 0.00 0.00 0.00 0.00 47.33 47.45 1rti h GLY 196 CO -0.19 0.05 0.16 1.46 0.00 0.00 0.00 176.54 178.01 1rti h GLN 197 N -0.08 0.30 0.24 4.80 4.20 -0.46 -1.57 115.11 122.54 1rti h GLN 197 Ca 0.02 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1rti h GLN 197 Cb 0.18 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 1rti h GLN 197 CO -0.00 0.20 -0.26 1.25 -0.67 0.00 0.00 178.83 179.34 1rti h HIS 198 N 0.31 -0.70 -0.88 2.96 2.76 -1.21 -2.48 115.15 115.90 1rti h HIS 198 Ca 0.28 0.01 0.18 0.00 -2.20 0.00 0.00 60.37 58.64 1rti h HIS 198 Cb 0.36 0.28 -0.11 0.00 1.55 0.00 0.00 27.41 29.49 1rti h HIS 198 CO -0.20 -0.38 0.43 -0.09 -1.30 0.00 0.00 177.93 176.39 1rti h ARG 199 N -0.55 0.52 0.25 5.26 2.43 -0.64 -1.94 114.38 119.71 1rti h ARG 199 Ca -0.00 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1rti h ARG 199 Cb 0.51 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1rti h ARG 199 CO -0.07 0.35 -0.12 1.15 -1.51 0.00 0.00 179.97 179.76 1rti h THR 200 N 0.54 0.76 -0.92 0.20 2.02 -0.89 -2.17 112.91 112.45 1rti h THR 200 Ca 0.51 -0.03 0.06 0.00 0.77 0.00 0.00 66.41 67.72 1rti h THR 200 Cb 0.85 0.78 -0.06 0.00 -1.74 0.00 0.00 68.15 67.98 1rti h THR 200 CO -0.43 0.01 0.58 0.11 0.37 0.00 0.00 175.52 176.15 1rti h LYS 201 N -0.35 1.03 -0.57 6.66 1.79 -0.98 -0.54 116.57 123.60 1rti h LYS 201 Ca -0.03 -0.06 0.05 0.00 -2.18 0.00 0.00 60.65 58.43 1rti h LYS 201 Cb 0.27 -0.23 -0.05 0.00 -1.58 0.00 0.00 32.23 30.64 1rti h LYS 201 CO 0.06 0.68 0.29 0.82 -1.08 0.00 0.00 179.45 180.22 1rti h ILE 202 N 1.06 0.94 -0.82 1.86 1.08 -1.18 0.87 117.51 121.32 1rti h ILE 202 Ca 0.40 -0.19 -0.03 0.00 -0.39 0.00 0.00 64.86 64.65 1rti h ILE 202 Cb 0.17 0.34 -0.04 0.00 -3.07 0.00 0.00 36.82 34.22 1rti h ILE 202 CO -0.17 0.10 0.40 -0.08 -0.69 0.00 0.00 178.15 177.71 1rti h GLU 203 N 0.56 1.18 -0.47 2.37 4.57 -0.50 0.96 114.58 123.24 1rti h GLU 203 Ca 0.26 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1rti h GLU 203 Cb 0.18 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1rti h GLU 203 CO -0.18 0.90 0.28 0.93 -1.18 0.00 0.00 179.01 179.76 1rti h GLU 204 N 1.17 0.64 -0.09 1.92 5.08 0.16 -0.15 114.58 123.30 1rti h GLU 204 Ca 0.28 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.60 1rti h GLU 204 Cb 0.11 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1rti h GLU 204 CO -0.04 0.47 -0.00 1.25 -1.00 0.00 0.00 179.01 179.69 1rti h LEU 205 N 0.62 -0.04 -0.18 1.33 6.46 -0.13 0.18 115.31 123.55 1rti h LEU 205 Ca 0.17 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 58.00 1rti h LEU 205 Cb 0.00 0.04 -0.05 0.00 -0.73 0.00 0.00 40.66 39.92 1rti h LEU 205 CO -0.03 -0.01 -0.14 -0.09 -0.62 0.00 0.00 178.44 177.55 1rti h ARG 206 N 0.03 -0.14 -0.91 1.25 2.43 -0.44 0.51 114.38 117.11 1rti h ARG 206 Ca 0.04 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.30 1rti h ARG 206 Cb 0.05 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.56 1rti h ARG 206 CO -0.08 -0.09 0.56 1.96 -1.51 0.00 0.00 179.97 180.81 1rti h GLN 207 N -0.15 0.94 0.64 0.20 1.08 -0.62 0.39 115.11 117.60 1rti h GLN 207 Ca 0.11 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.22 1rti h GLN 207 Cb 0.31 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1rti h GLN 207 CO -0.27 0.62 -0.32 1.25 -0.95 0.00 0.00 178.83 179.17 1rti h HIS 208 N 0.97 -0.83 -1.01 2.96 2.76 0.99 -1.37 115.15 119.62 1rti h HIS 208 Ca 0.42 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.61 1rti h HIS 208 Cb 0.28 0.28 -0.06 0.00 1.55 0.00 0.00 27.41 29.46 1rti h HIS 208 CO -0.03 -0.51 0.66 -0.07 -1.30 0.00 0.00 177.93 176.68 1rti h LEU 209 N -0.87 1.08 -0.35 0.26 3.38 -0.55 -2.49 115.31 115.76 1rti h LEU 209 Ca -0.09 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 57.94 1rti h LEU 209 Cb 0.68 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 41.13 1rti h LEU 209 CO 0.13 0.73 -0.02 -0.07 0.09 0.00 0.00 178.44 179.30 1rti h LEU 210 N 1.25 -0.18 -1.09 1.67 3.38 -0.61 -0.51 115.31 119.21 1rti h LEU 210 Ca 0.41 0.09 0.21 0.00 0.09 0.00 0.00 57.88 58.67 1rti h LEU 210 Cb 0.05 0.16 -0.10 0.00 0.09 0.00 0.00 40.66 40.86 1rti h LEU 210 CO -0.14 -0.05 0.61 0.03 0.09 0.00 0.00 178.44 178.98 1rti h ARG 211 N 0.07 0.65 -1.39 1.13 3.08 -0.79 0.38 114.38 117.52 1rti h ARG 211 Ca 0.17 -0.04 -0.36 0.00 0.07 0.00 0.00 59.98 59.82 1rti h ARG 211 Cb 0.24 -0.15 -0.16 0.00 0.08 0.00 0.00 29.97 29.99 1rti h ARG 211 CO -0.30 0.43 0.46 0.91 -1.07 0.00 0.00 179.97 180.40 1rti n TRP 212 N -4.74 1.74 -1.77 3.04 7.02 -0.34 -4.83 117.44 117.56 1rti n TRP 212 Ca 0.24 -1.98 -0.16 0.00 -1.02 0.00 0.00 57.50 54.58 1rti n TRP 212 Cb 0.64 -0.96 -0.05 0.00 -2.42 0.00 0.00 31.31 28.52 1rti n TRP 212 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rti n GLY 213 N 0.10 0.91 3.33 6.99 0.00 0.12 -4.24 105.19 112.39 1rti n GLY 213 Ca 0.34 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.94 1rti n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rti s LEU 214 N -4.68 5.26 0.09 0.99 1.43 -0.41 -4.13 118.68 117.23 1rti s LEU 214 Ca 0.00 -1.37 -0.30 0.00 -1.03 0.00 0.00 54.13 51.42 1rti s LEU 214 Cb 0.00 -2.06 -0.06 0.00 0.03 0.00 0.00 46.19 44.10 1rti s LEU 214 CO 0.00 -0.56 1.11 0.42 0.23 0.00 0.00 176.35 177.55 1rti s THR 215 N 1.52 4.18 0.01 5.49 -4.23 -1.26 -2.98 115.64 118.37 1rti s THR 215 Ca 0.03 1.67 0.03 0.00 -1.18 0.00 0.00 61.69 62.24 1rti s THR 215 Cb -0.23 -4.07 -0.01 0.00 1.34 0.00 0.00 72.50 69.53 1rti s THR 215 CO 0.04 0.19 -0.08 -0.89 -0.54 0.00 0.00 174.62 173.34 1rti s THR 216 N 0.58 0.63 0.53 3.99 2.01 -1.26 -4.68 115.64 117.44 1rti s THR 216 Ca 0.54 -0.55 -0.22 0.00 0.31 0.00 0.00 61.69 61.76 1rti s THR 216 Cb -0.27 -0.57 -0.05 0.00 0.01 0.00 0.00 72.50 71.62 1rti s THR 216 CO 0.31 0.03 1.33 -2.84 -0.69 0.00 0.00 174.62 172.75 1rti s PRO 217 N -0.58 3.23 0.39 4.92 0.02 -1.26 -5.03 135.00 136.68 1rti s PRO 217 Ca -0.00 2.16 -0.06 0.00 0.02 0.00 0.00 61.00 63.12 1rti s PRO 217 Cb -0.05 -2.27 -0.05 0.00 0.02 0.00 0.00 34.50 32.15 1rti s PRO 217 CO 0.00 -1.10 0.70 0.34 -0.33 0.00 0.00 177.00 176.61 1rti s ASP 218 N -1.02 6.39 0.00 2.53 2.15 -1.26 -4.43 116.67 121.03 1rti s ASP 218 Ca 0.70 0.89 0.00 0.00 0.43 0.00 0.00 52.55 54.57 1rti s ASP 218 Cb -0.38 -2.22 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 1rti s ASP 218 CO 0.46 -0.40 0.00 0.29 -0.17 0.00 0.00 175.17 175.35 1rti n LYS 219 N -1.57 0.00 -3.20 4.34 5.02 -1.26 -4.05 118.16 117.44 1rti n LYS 219 Ca -0.00 0.39 -0.15 0.00 -2.02 0.00 0.00 58.31 56.53 1rti n LYS 219 Cb 0.55 -3.38 0.01 0.00 -0.02 0.00 0.00 35.03 32.19 1rti n LYS 219 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1rti n LYS 220 N -2.87 -1.86 0.00 1.97 4.81 -1.26 -4.95 118.16 114.00 1rti n LYS 220 Ca 0.00 1.59 0.00 0.00 -0.87 0.00 0.00 58.31 59.03 1rti n LYS 220 Cb 0.00 -4.40 0.00 0.00 0.02 0.00 0.00 35.03 30.65 1rti n LYS 220 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1rti n HIS 221 N -1.06 -0.01 0.00 5.64 -0.00 -1.26 -4.93 115.22 113.60 1rti n HIS 221 Ca -0.03 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.15 1rti n HIS 221 Cb 0.56 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.43 1rti n HIS 221 CO 0.00 0.00 0.00 0.94 0.46 0.00 0.00 176.34 177.74 1rti n GLN 222 N 0.00 0.00 -3.56 1.57 -0.06 -1.26 -4.51 117.38 109.56 1rti n GLN 222 Ca 0.00 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.69 1rti n GLN 222 Cb 0.00 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.13 1rti n GLN 222 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 1rti s LYS 223 N 0.00 3.67 0.07 3.69 1.02 -1.26 -5.10 119.74 121.82 1rti s LYS 223 Ca 0.00 0.02 0.02 0.00 0.02 0.00 0.00 55.97 56.03 1rti s LYS 223 Cb 0.00 -2.76 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 1rti s LYS 223 CO 0.00 0.39 -0.07 -1.21 -0.92 0.00 0.00 175.35 173.53 1rti s GLU 224 N -2.85 0.66 0.45 1.68 2.02 -1.26 -4.73 118.70 114.67 1rti s GLU 224 Ca 0.43 -1.00 -0.25 0.00 0.02 0.00 0.00 54.97 54.17 1rti s GLU 224 Cb -0.12 -0.26 -0.08 0.00 0.10 0.00 0.00 34.13 33.77 1rti s GLU 224 CO 0.24 0.02 1.39 -2.14 0.02 0.00 0.00 175.26 174.80 1rti s PRO 225 N -2.52 3.68 0.20 0.39 0.02 -1.26 -4.06 135.00 131.46 1rti s PRO 225 Ca -0.01 2.33 -0.30 0.00 0.02 0.00 0.00 61.00 63.04 1rti s PRO 225 Cb -0.04 -2.63 -0.09 0.00 0.02 0.00 0.00 34.50 31.76 1rti s PRO 225 CO -0.02 -0.79 1.37 -2.14 -0.33 0.00 0.00 177.00 175.10 1rti s PRO 226 N -2.46 4.33 -0.30 5.54 0.02 -1.26 -5.05 135.00 135.82 1rti s PRO 226 Ca 0.61 2.15 -0.23 0.00 0.02 0.00 0.00 61.00 63.56 1rti s PRO 226 Cb -0.42 -3.17 -0.00 0.00 0.02 0.00 0.00 34.50 30.93 1rti s PRO 226 CO 0.53 -0.35 0.75 -0.06 -0.33 0.00 0.00 177.00 177.55 1rti s PHE 227 N 0.25 3.22 -0.92 6.54 0.08 -0.51 -4.82 117.98 121.81 1rti s PHE 227 Ca 0.59 0.80 -0.23 0.00 0.12 0.00 0.00 56.93 58.20 1rti s PHE 227 Cb -0.39 -3.14 0.06 0.00 -0.57 0.00 0.00 43.02 38.98 1rti s PHE 227 CO 0.38 -0.52 1.34 -1.17 -0.10 0.00 0.00 175.22 175.15 1rti s LEU 228 N 2.86 3.69 -0.31 -0.37 1.98 -1.26 -1.26 118.68 124.00 1rti s LEU 228 Ca 0.31 -1.27 -0.03 0.00 -2.89 0.00 0.00 54.13 50.25 1rti s LEU 228 Cb -0.14 -2.53 0.05 0.00 0.66 0.00 0.00 46.19 44.22 1rti s LEU 228 CO 0.12 -1.52 0.03 0.86 -1.89 0.00 0.00 176.35 173.94 1rti s TRP 229 N 4.79 3.26 -0.45 5.38 -0.00 -0.24 -4.87 118.94 126.81 1rti s TRP 229 Ca 0.40 -1.75 -0.26 0.00 -0.00 0.00 0.00 56.10 54.50 1rti s TRP 229 Cb -0.04 -2.16 0.04 0.00 -0.00 0.00 0.00 33.47 31.31 1rti s TRP 229 CO -0.03 -0.78 0.55 -1.33 -0.00 0.00 0.00 176.95 175.36 1rti n MET 230 N 4.68 -1.54 0.00 5.86 2.81 -1.26 -0.78 117.12 126.89 1rti n MET 230 Ca -0.13 1.06 0.00 0.00 -1.81 0.00 0.00 57.70 56.82 1rti n MET 230 Cb 0.44 -1.71 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 1rti n MET 230 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1rti n GLY 231 N -0.46 2.02 3.96 3.03 0.00 -1.26 -4.95 105.19 107.53 1rti n GLY 231 Ca -0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 1rti n GLY 231 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rti s TYR 232 N -0.76 3.47 -0.31 1.61 2.02 0.04 -1.05 117.35 122.37 1rti s TYR 232 Ca 0.00 0.09 0.00 0.00 -0.37 0.00 0.00 57.07 56.79 1rti s TYR 232 Cb 0.00 -1.66 0.10 0.00 -0.40 0.00 0.00 41.96 40.00 1rti s TYR 232 CO 0.00 0.37 0.08 -2.00 -1.57 0.00 0.00 175.55 172.44 1rti s GLU 233 N -3.97 0.87 -0.21 -0.62 2.12 0.35 -1.08 118.70 116.15 1rti s GLU 233 Ca 0.36 -1.21 -0.27 0.00 0.36 0.00 0.00 54.97 54.20 1rti s GLU 233 Cb -0.09 -2.23 0.00 0.00 0.26 0.00 0.00 34.13 32.07 1rti s GLU 233 CO 0.31 -0.96 0.95 -0.51 -0.54 0.00 0.00 175.26 174.50 1rti s LEU 234 N 1.48 4.12 0.31 2.70 2.01 -0.39 -0.80 118.68 128.10 1rti s LEU 234 Ca 0.10 1.27 0.09 0.00 0.01 0.00 0.00 54.13 55.59 1rti s LEU 234 Cb -0.18 -3.40 -0.04 0.00 0.01 0.00 0.00 46.19 42.58 1rti s LEU 234 CO -0.21 -0.57 0.05 -1.00 1.01 0.00 0.00 176.35 175.62 1rti s HIS 235 N 2.85 2.66 0.57 0.29 3.76 -0.44 -1.43 115.29 123.56 1rti s HIS 235 Ca 0.41 -0.32 0.27 0.00 -0.15 0.00 0.00 55.06 55.27 1rti s HIS 235 Cb -0.16 -1.40 1.66 0.00 1.11 0.00 0.00 32.58 33.79 1rti s HIS 235 CO 0.08 0.50 2.19 -1.00 -0.85 0.00 0.00 174.74 175.66 1rti h PRO 236 N 1.76 0.00 0.00 8.40 0.13 -1.96 -3.18 132.00 137.15 1rti h PRO 236 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1rti h PRO 236 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1rti h PRO 236 CO 0.63 0.00 -0.23 -0.40 -0.23 0.00 0.00 178.00 177.76 1rti n ASP 237 N -3.99 0.86 -3.50 1.44 5.68 -1.26 -4.76 116.55 111.01 1rti n ASP 237 Ca -0.01 -0.44 -0.12 0.00 -0.50 0.00 0.00 54.79 53.72 1rti n ASP 237 Cb 0.17 1.01 -0.04 0.00 -1.14 0.00 0.00 41.12 41.12 1rti n ASP 237 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1rti s LYS 238 N -1.29 0.94 0.00 0.11 0.00 -1.20 -4.48 119.74 113.81 1rti s LYS 238 Ca 0.00 -0.13 0.02 0.00 0.00 0.00 0.00 55.97 55.86 1rti s LYS 238 Cb 0.01 0.44 -0.04 0.00 0.00 0.00 0.00 37.83 38.24 1rti s LYS 238 CO 0.05 -0.37 -0.00 1.67 0.00 0.00 0.00 175.35 176.71 1rti s TRP 239 N -2.44 3.06 0.21 1.78 1.48 0.50 -1.33 118.94 122.20 1rti s TRP 239 Ca -0.01 0.07 0.09 0.00 -1.06 0.00 0.00 56.10 55.19 1rti s TRP 239 Cb -0.01 -1.66 -0.05 0.00 -1.16 0.00 0.00 33.47 30.59 1rti s TRP 239 CO -0.04 0.46 -0.17 0.99 -4.06 0.00 0.00 176.95 174.13 1rti s THR 240 N -1.08 1.94 -0.08 0.66 2.01 0.02 0.25 115.64 119.37 1rti s THR 240 Ca 0.19 -2.17 -0.14 0.00 0.31 0.00 0.00 61.69 59.89 1rti s THR 240 Cb -0.11 -2.05 -0.05 0.00 0.01 0.00 0.00 72.50 70.30 1rti s THR 240 CO 0.10 -0.46 0.36 -0.69 -0.69 0.00 0.00 174.62 173.24 1rti s VAL 241 N -2.56 5.18 0.31 3.82 1.01 -0.95 -0.50 120.40 126.72 1rti s VAL 241 Ca 0.22 0.71 -0.30 0.00 0.00 0.00 0.00 61.98 62.62 1rti s VAL 241 Cb -0.03 -3.67 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 1rti s VAL 241 CO 0.09 0.49 1.56 1.67 0.00 0.00 0.00 175.10 178.90 1rti n GLN 242 N 2.64 2.66 -1.54 2.72 7.27 -0.21 -4.76 117.38 126.15 1rti n GLN 242 Ca -0.13 0.94 -0.46 0.00 0.07 0.00 0.00 57.00 57.42 1rti n GLN 242 Cb 0.52 -2.70 -0.05 0.00 2.41 0.00 0.00 30.24 30.42 1rti n GLN 242 CO 0.00 0.00 0.00 -0.35 0.07 0.00 0.00 177.06 176.78 1rti n PRO 243 N 1.67 1.63 -2.63 3.69 -0.04 -1.26 -4.91 135.00 133.16 1rti n PRO 243 Ca 0.07 0.45 -0.43 0.00 -0.04 0.00 0.00 63.50 63.55 1rti n PRO 243 Cb 0.37 -2.92 -0.02 0.00 -0.04 0.00 0.00 33.50 30.89 1rti n PRO 243 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rti s ILE 244 N 7.79 4.25 -0.05 0.52 1.10 -1.26 -5.01 121.20 128.54 1rti s ILE 244 Ca 1.04 1.20 -0.17 0.00 -0.51 0.00 0.00 60.65 62.21 1rti s ILE 244 Cb -0.55 -4.58 -0.05 0.00 0.15 0.00 0.00 42.46 37.43 1rti s ILE 244 CO 0.41 -0.97 0.45 -0.69 -2.11 0.00 0.00 174.94 172.03 1rti s VAL 245 N 4.35 5.08 -0.22 4.00 1.01 -1.26 -5.01 120.40 128.35 1rti s VAL 245 Ca 0.47 0.91 -0.08 0.00 0.00 0.00 0.00 61.98 63.28 1rti s VAL 245 Cb -0.08 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1rti s VAL 245 CO 0.31 0.46 0.08 -0.76 0.00 0.00 0.00 175.10 175.18 1rti s LEU 246 N -0.28 3.64 -0.51 3.92 1.43 -1.26 -5.05 118.68 120.58 1rti s LEU 246 Ca 0.25 -0.07 -0.27 0.00 -1.03 0.00 0.00 54.13 53.01 1rti s LEU 246 Cb -0.16 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.06 1rti s LEU 246 CO 0.12 0.05 2.08 -2.84 0.23 0.00 0.00 176.35 175.99 1rti s PRO 247 N 1.10 2.55 -0.52 1.29 0.02 -1.26 -4.95 135.00 133.23 1rti s PRO 247 Ca 0.05 1.09 -0.27 0.00 0.02 0.00 0.00 61.00 61.88 1rti s PRO 247 Cb -0.14 -4.44 0.03 0.00 0.02 0.00 0.00 34.50 29.97 1rti s PRO 247 CO 0.03 -2.79 1.07 -2.00 -0.33 0.00 0.00 177.00 172.98 1rti s GLU 248 N 7.28 3.54 0.29 5.54 2.56 -1.26 -4.98 118.70 131.68 1rti s GLU 248 Ca 0.82 0.23 0.06 0.00 0.00 0.00 0.00 54.97 56.07 1rti s GLU 248 Cb -0.17 -3.97 -0.02 0.00 2.00 0.00 0.00 34.13 31.97 1rti s GLU 248 CO 0.25 -1.46 0.20 0.36 -0.56 0.00 0.00 175.26 174.06 1rti n LYS 249 N 7.81 0.41 0.00 4.30 2.85 -1.26 -5.08 118.16 127.18 1rti n LYS 249 Ca 0.08 -2.77 0.00 0.00 -1.05 0.00 0.00 58.31 54.57 1rti n LYS 249 Cb 0.49 2.08 0.00 0.00 -0.65 0.00 0.00 35.03 36.94 1rti n LYS 249 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1rti n ASP 250 N -1.84 1.02 -4.08 -5.58 8.00 -1.26 -4.97 116.55 107.84 1rti n ASP 250 Ca 0.04 -1.03 -0.23 0.00 0.71 0.00 0.00 54.79 54.27 1rti n ASP 250 Cb 0.50 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.44 1rti n ASP 250 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1rti s SER 251 N -0.03 1.69 -0.06 -2.24 0.15 -1.26 -4.97 113.70 106.96 1rti s SER 251 Ca 0.00 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.38 1rti s SER 251 Cb 0.00 -0.41 0.02 0.00 -1.71 0.00 0.00 66.02 63.92 1rti s SER 251 CO 0.00 0.12 -0.03 0.26 1.20 0.00 0.00 173.24 174.79 1rti s TRP 252 N 0.04 0.83 0.22 3.44 0.52 -1.26 -5.06 118.94 117.66 1rti s TRP 252 Ca -0.02 -0.27 0.05 0.00 0.02 0.00 0.00 56.10 55.88 1rti s TRP 252 Cb -0.09 -0.79 -0.03 0.00 -1.15 0.00 0.00 33.47 31.40 1rti s TRP 252 CO 0.01 -0.28 0.33 0.95 0.02 0.00 0.00 176.95 177.98 1rti s THR 253 N 1.39 5.23 0.16 2.01 -4.23 -1.26 0.30 115.64 119.24 1rti s THR 253 Ca -0.03 -0.95 -0.24 0.00 -1.18 0.00 0.00 61.69 59.28 1rti s THR 253 Cb -0.13 -3.81 0.04 0.00 1.34 0.00 0.00 72.50 69.94 1rti s THR 253 CO -0.03 -0.28 1.59 0.58 -0.54 0.00 0.00 174.62 175.94 1rti h VAL 254 N 1.29 0.18 -0.10 2.29 2.07 -0.83 0.97 116.25 122.12 1rti h VAL 254 Ca -0.51 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.05 1rti h VAL 254 Cb 1.22 0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 31.11 1rti h VAL 254 CO 0.63 0.00 -0.38 -1.13 0.02 0.00 0.00 177.57 176.71 1rti h ASN 255 N -0.28 -1.18 -0.69 0.57 -0.73 -1.26 0.26 115.58 112.27 1rti h ASN 255 Ca 0.16 0.16 0.14 0.00 1.87 0.00 0.00 56.30 58.63 1rti h ASN 255 Cb 0.56 0.48 -0.04 0.00 0.27 0.00 0.00 38.32 39.59 1rti h ASN 255 CO -0.56 -0.41 0.47 0.44 -0.37 0.00 0.00 177.43 177.00 1rti h ASP 256 N -0.48 0.31 -0.16 1.15 3.32 -1.53 -0.26 116.42 118.78 1rti h ASP 256 Ca 0.08 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1rti h ASP 256 Cb 0.60 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 1rti h ASP 256 CO -0.36 0.16 -0.26 0.40 -1.72 0.00 0.00 179.24 177.47 1rti h ILE 257 N 0.33 1.35 -0.15 0.35 1.08 0.10 -1.40 117.51 119.18 1rti h ILE 257 Ca 0.34 -1.48 -0.00 0.00 -0.39 0.00 0.00 64.86 63.32 1rti h ILE 257 Cb 0.85 1.93 -0.01 0.00 -3.07 0.00 0.00 36.82 36.52 1rti h ILE 257 CO -0.09 0.44 0.09 1.56 -0.69 0.00 0.00 178.15 179.47 1rti h GLN 258 N 0.08 0.20 -0.79 2.37 4.20 0.51 0.39 115.11 122.08 1rti h GLN 258 Ca 0.01 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.76 1rti h GLN 258 Cb 0.83 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.51 1rti h GLN 258 CO 0.06 0.17 0.49 0.87 -0.67 0.00 0.00 178.83 179.75 1rti h LYS 259 N 0.18 0.90 0.95 1.46 1.57 -1.14 -0.05 116.57 120.43 1rti h LYS 259 Ca 0.05 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 1rti h LYS 259 Cb 0.02 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.13 1rti h LYS 259 CO -0.01 0.59 -0.48 1.25 -0.57 0.00 0.00 179.45 180.23 1rti h LEU 260 N 0.92 -1.17 -1.40 2.94 5.85 -0.69 -2.13 115.31 119.63 1rti h LEU 260 Ca 0.34 0.05 0.25 0.00 0.84 0.00 0.00 57.88 59.36 1rti h LEU 260 Cb 0.11 0.31 -0.09 0.00 0.37 0.00 0.00 40.66 41.36 1rti h LEU 260 CO -0.15 -0.80 0.66 0.58 -0.34 0.00 0.00 178.44 178.39 1rti h VAL 261 N -1.31 0.56 0.76 1.05 2.07 -0.57 0.24 116.25 119.04 1rti h VAL 261 Ca -0.13 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1rti h VAL 261 Cb 1.02 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 1rti h VAL 261 CO 0.19 0.07 -0.44 1.23 0.02 0.00 0.00 177.57 178.65 1rti h GLY 262 N 0.40 -1.25 0.33 2.17 0.00 -0.46 0.19 103.07 104.45 1rti h GLY 262 Ca 0.57 0.50 0.11 0.00 0.00 0.00 0.00 47.33 48.51 1rti h GLY 262 CO -0.27 -0.43 0.31 0.50 0.00 0.00 0.00 176.54 176.65 1rti h LYS 263 N -1.12 0.48 -0.48 4.80 6.56 -0.52 0.31 116.57 126.60 1rti h LYS 263 Ca -0.10 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.45 1rti h LYS 263 Cb 0.88 -0.11 -0.02 0.00 -0.57 0.00 0.00 32.23 32.41 1rti h LYS 263 CO 0.12 0.32 0.28 -0.07 -2.06 0.00 0.00 179.45 178.05 1rti h LEU 264 N 0.50 0.57 -0.41 2.94 -0.00 -0.78 -0.77 115.31 117.36 1rti h LEU 264 Ca 0.37 -0.03 -0.18 0.00 -0.00 0.00 0.00 57.88 58.04 1rti h LEU 264 Cb 0.47 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 40.98 1rti h LEU 264 CO -0.33 0.44 -0.76 -1.13 -0.00 0.00 0.00 178.44 176.66 1rti h ASN 265 N 0.66 0.34 -0.27 -0.43 -1.24 0.14 -2.43 115.58 112.35 1rti h ASN 265 Ca 0.17 -0.24 -0.07 0.00 0.71 0.00 0.00 56.30 56.88 1rti h ASN 265 Cb -0.02 -0.10 -0.01 0.00 0.73 0.00 0.00 38.32 38.92 1rti h ASN 265 CO -0.03 0.98 -0.09 -0.25 -1.29 0.00 0.00 177.43 176.74 1rti h TRP 266 N 0.18 0.62 -0.59 0.67 7.01 -0.69 -3.11 115.95 120.04 1rti h TRP 266 Ca -0.03 -0.14 0.07 0.00 2.11 0.00 0.00 58.89 60.90 1rti h TRP 266 Cb 1.34 -0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 28.22 1rti h TRP 266 CO 0.03 0.77 0.40 0.00 -2.79 0.00 0.00 178.44 176.85 1rti h ALA 267 N 0.76 1.87 -0.85 2.65 0.00 -1.08 -2.63 119.26 119.97 1rti h ALA 267 Ca 0.06 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.19 1rti h ALA 267 Cb 0.59 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1rti h ALA 267 CO 0.03 0.03 0.60 0.66 0.00 0.00 0.00 179.25 180.57 1rti h SER 268 N 0.53 0.12 -0.30 0.00 4.64 -1.36 0.24 113.55 117.43 1rti h SER 268 Ca 0.26 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.60 1rti h SER 268 Cb 0.34 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 1rti h SER 268 CO -0.08 0.05 0.19 1.56 -0.87 0.00 0.00 176.83 177.68 1rti h GLN 269 N 0.12 0.37 0.00 4.77 1.08 -1.63 -2.96 115.11 116.87 1rti h GLN 269 Ca 0.42 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 1rti h GLN 269 Cb 1.46 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.81 1rti h GLN 269 CO -0.06 0.25 -0.99 1.51 -0.95 0.00 0.00 178.83 178.59 1rti n ILE 270 N -4.90 0.45 -3.73 2.54 0.13 -0.47 -3.15 119.36 110.23 1rti n ILE 270 Ca -0.01 -0.44 -0.28 0.00 -1.10 0.00 0.00 62.75 60.93 1rti n ILE 270 Cb 0.03 -0.18 -0.11 0.00 -0.84 0.00 0.00 39.64 38.54 1rti n ILE 270 CO 0.00 0.00 0.00 -1.22 2.80 0.00 0.00 176.55 178.13 1rti n TYR 271 N -2.41 2.52 -1.78 9.51 4.01 0.72 -5.02 117.16 124.71 1rti n TYR 271 Ca 0.01 -4.11 -0.19 0.00 -0.16 0.00 0.00 57.90 53.44 1rti n TYR 271 Cb 0.51 -0.46 -0.08 0.00 -0.31 0.00 0.00 39.34 39.00 1rti n TYR 271 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 1rti s PRO 272 N -1.35 1.87 0.00 -0.72 0.02 -1.15 -2.27 135.00 131.40 1rti s PRO 272 Ca 0.28 -0.21 0.00 0.00 0.02 0.00 0.00 61.00 61.09 1rti s PRO 272 Cb 0.00 -4.98 0.00 0.00 0.02 0.00 0.00 34.50 29.55 1rti s PRO 272 CO -0.15 -4.39 0.00 0.41 -0.33 0.00 0.00 177.00 172.53 1rti n GLY 273 N 6.49 0.10 3.70 0.52 0.00 -1.26 -5.13 105.19 109.60 1rti n GLY 273 Ca 0.43 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.03 1rti n GLY 273 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rti n ILE 274 N 0.00 1.71 -4.02 -0.61 2.08 -0.96 -5.01 119.36 112.56 1rti n ILE 274 Ca 0.00 -0.43 -0.14 0.00 0.56 0.00 0.00 62.75 62.74 1rti n ILE 274 Cb 0.00 -1.58 -0.14 0.00 -0.75 0.00 0.00 39.64 37.17 1rti n ILE 274 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 1rti s LYS 275 N -1.48 0.22 0.00 0.38 1.02 -1.26 -4.93 119.74 113.69 1rti s LYS 275 Ca 0.59 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.47 1rti s LYS 275 Cb -0.58 -0.21 0.00 0.00 -0.52 0.00 0.00 37.83 36.52 1rti s LYS 275 CO 0.59 0.06 0.69 1.33 -0.92 0.00 0.00 175.35 177.09 1rti n VAL 276 N 2.98 0.46 -0.38 3.17 0.24 -1.26 -4.87 118.33 118.68 1rti n VAL 276 Ca -0.13 -0.63 -0.11 0.00 -2.04 0.00 0.00 64.34 61.44 1rti n VAL 276 Cb 0.59 0.85 -0.09 0.00 -1.47 0.00 0.00 33.84 33.72 1rti n VAL 276 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1rti h ARG 277 N 0.00 -0.03 -0.36 7.34 1.12 -2.03 0.10 114.38 120.53 1rti h ARG 277 Ca 0.00 0.00 -0.04 0.00 -1.11 0.00 0.00 59.98 58.83 1rti h ARG 277 Cb 0.39 0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.34 1rti h ARG 277 CO 0.00 -0.02 0.05 1.96 -3.11 0.00 0.00 179.97 178.85 1rti h GLN 278 N -0.03 0.60 -1.34 0.20 7.50 -1.94 -3.14 115.11 116.97 1rti h GLN 278 Ca 0.15 -0.16 0.00 0.00 0.50 0.00 0.00 58.65 59.13 1rti h GLN 278 Cb 0.40 -0.07 0.00 0.00 0.05 0.00 0.00 27.48 27.86 1rti h GLN 278 CO -0.87 0.67 0.00 1.28 -1.50 0.00 0.00 178.83 178.42 1rti n LEU 279 N -4.56 0.00 0.00 1.46 4.32 0.02 -3.15 117.00 115.10 1rti n LEU 279 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.98 1rti n LEU 279 Cb 0.23 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.03 1rti n LEU 279 CO 0.39 0.00 0.00 0.29 -1.22 0.00 0.00 177.39 176.85 1rti n LYS 281 N 0.71 0.00 0.00 3.23 5.02 -1.19 -4.21 118.16 121.72 1rti n LYS 281 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 1rti n LYS 281 Cb 0.00 -0.06 0.30 0.00 -0.02 0.00 0.00 35.03 35.25 1rti n LYS 281 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1rti n LEU 282 N 0.00 0.00 -0.38 -0.35 7.99 -1.19 -2.04 117.00 121.03 1rti n LEU 282 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 56.01 56.08 1rti n LEU 282 Cb 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.31 1rti n LEU 282 CO 0.00 0.00 0.28 0.18 -1.51 0.00 0.00 177.39 176.34 1rti n LEU 283 N -0.97 1.65 -4.71 2.23 4.32 -1.26 -4.94 117.00 113.32 1rti n LEU 283 Ca 0.07 -0.78 -0.42 0.00 -0.02 0.00 0.00 56.01 54.86 1rti n LEU 283 Cb 0.03 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.80 1rti n LEU 283 CO 0.06 0.32 1.24 -0.13 -1.22 0.00 0.00 177.39 177.65 1rti s ARG 284 N -1.81 4.21 -1.75 3.23 0.52 -0.87 -3.13 118.95 119.36 1rti s ARG 284 Ca 0.13 2.36 -0.01 0.00 -0.52 0.00 0.00 55.73 57.69 1rti s ARG 284 Cb 0.13 -3.21 0.00 0.00 0.52 0.00 0.00 34.95 32.39 1rti s ARG 284 CO 0.38 -0.62 0.09 0.41 0.02 0.00 0.00 175.30 175.58 1rti n GLY 285 N 3.78 -0.49 3.69 -3.53 0.00 -1.26 -4.94 105.19 102.43 1rti n GLY 285 Ca 0.14 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1rti n GLY 285 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rti s THR 286 N -3.06 3.60 -0.00 2.61 -4.23 -1.18 -4.94 115.64 108.43 1rti s THR 286 Ca 0.05 1.00 -0.04 0.00 -1.18 0.00 0.00 61.69 61.52 1rti s THR 286 Cb -0.02 -3.64 -0.28 0.00 1.34 0.00 0.00 72.50 69.89 1rti s THR 286 CO 0.06 0.00 0.83 0.07 -0.54 0.00 0.00 174.62 175.04 1rti h LYS 287 N 7.84 0.27 -4.03 3.99 2.10 -1.94 -3.47 116.57 121.33 1rti h LYS 287 Ca -0.39 -0.47 -0.21 0.00 -2.00 0.00 0.00 60.65 57.59 1rti h LYS 287 Cb 1.18 0.17 -0.23 0.00 -0.90 0.00 0.00 32.23 32.46 1rti h LYS 287 CO 0.90 1.14 -0.71 0.00 -2.00 0.00 0.00 179.45 178.78 1rti s ALA 288 N -2.61 0.18 0.44 0.07 0.00 -1.26 -5.03 121.76 113.55 1rti s ALA 288 Ca -0.10 -0.46 0.26 0.00 0.00 0.00 0.00 51.96 51.66 1rti s ALA 288 Cb 0.07 0.09 1.45 0.00 0.00 0.00 0.00 23.12 24.72 1rti s ALA 288 CO 0.85 -0.09 2.09 1.25 0.00 0.00 0.00 175.76 179.87 1rti h LEU 289 N 5.04 0.00 -1.41 0.00 5.85 -1.98 -1.67 115.31 121.14 1rti h LEU 289 Ca -0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1rti h LEU 289 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1rti h LEU 289 CO 0.44 0.11 0.00 0.35 -0.34 0.00 0.00 178.44 179.00 1rti n THR 290 N -3.75 0.23 -2.15 1.05 -2.24 -1.26 -0.80 114.28 105.36 1rti n THR 290 Ca -0.02 -0.43 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 1rti n THR 290 Cb 0.22 0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 1rti n THR 290 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1rti s GLU 291 N -1.77 4.33 0.03 -0.78 2.12 -0.63 -4.75 118.70 117.24 1rti s GLU 291 Ca 0.34 2.12 -0.25 0.00 0.36 0.00 0.00 54.97 57.54 1rti s GLU 291 Cb 0.19 -3.21 -0.05 0.00 0.26 0.00 0.00 34.13 31.32 1rti s GLU 291 CO 0.29 -0.39 0.76 0.14 -0.54 0.00 0.00 175.26 175.51 1rti s VAL 292 N 0.69 4.78 -0.20 3.70 -7.23 -1.26 -0.60 120.40 120.27 1rti s VAL 292 Ca 0.62 1.62 -0.03 0.00 -1.81 0.00 0.00 61.98 62.38 1rti s VAL 292 Cb -0.38 -4.11 -0.01 0.00 0.56 0.00 0.00 36.38 32.44 1rti s VAL 292 CO 0.34 0.35 -0.06 -0.63 -0.31 0.00 0.00 175.10 174.78 1rti s ILE 293 N 0.08 3.27 -0.27 -0.62 -1.09 0.15 -4.95 121.20 117.77 1rti s ILE 293 Ca 0.39 -0.54 -0.28 0.00 -2.23 0.00 0.00 60.65 57.99 1rti s ILE 293 Cb -0.20 -2.47 -0.03 0.00 -1.58 0.00 0.00 42.46 38.18 1rti s ILE 293 CO 0.22 0.45 1.89 -2.16 -1.23 0.00 0.00 174.94 174.11 1rti s PRO 294 N 1.24 3.38 -0.11 2.79 0.04 -1.26 -4.33 135.00 136.75 1rti s PRO 294 Ca 0.03 1.67 -0.29 0.00 0.04 0.00 0.00 61.00 62.45 1rti s PRO 294 Cb -0.14 -4.22 -0.06 0.00 0.04 0.00 0.00 34.50 30.12 1rti s PRO 294 CO -0.02 -1.81 1.86 -1.17 0.04 0.00 0.00 177.00 175.90 1rti s LEU 295 N 6.92 4.05 0.68 -3.56 2.96 -1.26 -4.97 118.68 123.50 1rti s LEU 295 Ca 0.85 2.12 -0.15 0.00 -0.22 0.00 0.00 54.13 56.72 1rti s LEU 295 Cb -0.26 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 42.91 1rti s LEU 295 CO 0.34 -1.28 1.13 0.28 -1.32 0.00 0.00 176.35 175.50 1rti s THR 296 N 5.42 2.98 0.36 3.68 -1.32 -1.26 -4.84 115.64 120.67 1rti s THR 296 Ca 0.83 0.46 0.05 0.00 -1.21 0.00 0.00 61.69 61.81 1rti s THR 296 Cb -0.34 -2.98 0.22 0.00 -1.51 0.00 0.00 72.50 67.90 1rti s THR 296 CO 0.34 -0.28 1.97 1.05 -2.21 0.00 0.00 174.62 175.49 1rti h GLU 297 N -0.12 0.61 -0.82 7.08 4.11 -1.99 -0.69 114.58 122.76 1rti h GLU 297 Ca -0.47 -0.07 0.01 0.00 0.07 0.00 0.00 59.36 58.90 1rti h GLU 297 Cb 1.26 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 1rti h GLU 297 CO 0.53 0.49 0.54 0.93 0.07 0.00 0.00 179.01 181.56 1rti h GLU 298 N 0.61 1.09 -0.10 1.06 3.07 -2.00 -1.10 114.58 117.21 1rti h GLU 298 Ca 0.15 -0.07 -0.18 0.00 -0.50 0.00 0.00 59.36 58.76 1rti h GLU 298 Cb 0.09 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.75 1rti h GLU 298 CO -0.02 0.73 -0.71 0.00 -1.40 0.00 0.00 179.01 177.61 1rti h ALA 299 N 1.48 0.59 -0.09 3.43 0.00 -1.58 -2.40 119.26 120.68 1rti h ALA 299 Ca 0.30 -0.59 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1rti h ALA 299 Cb -0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1rti h ALA 299 CO -0.06 0.74 0.03 0.93 0.00 0.00 0.00 179.25 180.88 1rti h GLU 300 N 0.32 0.07 -0.79 0.00 4.39 -0.22 0.18 114.58 118.53 1rti h GLU 300 Ca -0.03 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.63 1rti h GLU 300 Cb 1.28 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.88 1rti h GLU 300 CO 0.13 0.04 0.33 -0.07 -1.16 0.00 0.00 179.01 178.28 1rti h LEU 301 N 0.07 1.07 0.34 1.33 -0.00 -1.24 0.46 115.31 117.33 1rti h LEU 301 Ca 0.04 -0.16 -0.02 0.00 -0.00 0.00 0.00 57.88 57.74 1rti h LEU 301 Cb 0.02 -0.28 0.00 0.00 -0.00 0.00 0.00 40.66 40.41 1rti h LEU 301 CO -0.04 0.94 -0.16 -0.08 -0.00 0.00 0.00 178.44 179.09 1rti h GLU 302 N 1.13 -0.44 -0.65 1.13 4.81 -1.09 0.25 114.58 119.73 1rti h GLU 302 Ca 0.26 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.58 1rti h GLU 302 Cb 0.19 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.61 1rti h GLU 302 CO -0.03 -0.14 0.35 1.25 -0.73 0.00 0.00 179.01 179.72 1rti h LEU 303 N -0.74 0.51 -0.25 1.64 6.46 -0.60 0.57 115.31 122.90 1rti h LEU 303 Ca -0.05 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.72 1rti h LEU 303 Cb 0.50 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.36 1rti h LEU 303 CO 0.08 0.33 0.07 0.00 -0.62 0.00 0.00 178.44 178.29 1rti h ALA 304 N 1.34 0.33 -0.89 1.25 0.00 -0.86 -2.32 119.26 118.12 1rti h ALA 304 Ca 0.29 -0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.14 1rti h ALA 304 Cb 0.20 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1rti h ALA 304 CO -0.19 -0.02 0.53 1.49 0.00 0.00 0.00 179.25 181.06 1rti h GLU 305 N 0.24 0.87 -0.92 0.00 4.81 0.26 -0.18 114.58 119.66 1rti h GLU 305 Ca 0.08 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1rti h GLU 305 Cb 0.26 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.40 1rti h GLU 305 CO -0.00 0.57 0.55 -0.91 -0.73 0.00 0.00 179.01 178.49 1rti h ASN 306 N 0.89 1.11 -0.87 1.04 2.35 -0.59 -2.31 115.58 117.20 1rti h ASN 306 Ca 0.42 -0.07 0.03 0.00 -0.55 0.00 0.00 56.30 56.13 1rti h ASN 306 Cb 0.36 -0.28 -0.05 0.00 0.05 0.00 0.00 38.32 38.40 1rti h ASN 306 CO -0.24 0.85 0.57 0.03 -1.65 0.00 0.00 177.43 176.99 1rti h ARG 307 N 1.27 1.08 -0.13 0.81 3.08 -0.49 -1.57 114.38 118.42 1rti h ARG 307 Ca 0.33 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.25 1rti h ARG 307 Cb -0.04 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.75 1rti h ARG 307 CO -0.06 0.71 -0.19 0.93 -1.07 0.00 0.00 179.97 180.29 1rti h GLU 308 N 1.11 0.22 -0.12 0.04 4.39 -1.04 -2.45 114.58 116.73 1rti h GLU 308 Ca 0.34 -0.06 -0.11 0.00 0.34 0.00 0.00 59.36 59.87 1rti h GLU 308 Cb -0.02 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1rti h GLU 308 CO -0.11 0.41 -0.36 0.82 -1.16 0.00 0.00 179.01 178.61 1rti h ILE 309 N 0.20 1.38 0.00 3.13 1.08 -1.11 -3.07 117.51 119.12 1rti h ILE 309 Ca 0.04 -1.68 0.00 0.00 -0.39 0.00 0.00 64.86 62.83 1rti h ILE 309 Cb 0.46 2.13 0.00 0.00 -3.07 0.00 0.00 36.82 36.35 1rti h ILE 309 CO 0.03 0.50 0.00 0.18 -0.69 0.00 0.00 178.15 178.17 1rti n LEU 310 N -4.35 0.00 -0.05 1.44 4.77 -0.66 -2.95 117.00 115.19 1rti n LEU 310 Ca -0.07 0.06 -0.12 0.00 -0.03 0.00 0.00 56.01 55.84 1rti n LEU 310 Cb 0.52 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1rti n LEU 310 CO 0.43 -0.02 0.47 0.50 -1.33 0.00 0.00 177.39 177.44 1rti h LYS 311 N 0.00 0.76 -6.12 3.23 1.63 -1.34 -3.42 116.57 111.31 1rti h LYS 311 Ca 0.00 -0.47 -0.58 0.00 -0.85 0.00 0.00 60.65 58.75 1rti h LYS 311 Cb 0.03 0.05 -0.08 0.00 -0.60 0.00 0.00 32.23 31.63 1rti h LYS 311 CO 0.00 1.09 0.68 -2.00 -3.45 0.00 0.00 179.45 175.77 1rti s GLU 312 N -4.12 4.00 -0.14 1.90 -6.30 -1.15 -5.01 118.70 107.88 1rti s GLU 312 Ca -0.09 0.85 -0.29 0.00 -2.50 0.00 0.00 54.97 52.94 1rti s GLU 312 Cb 0.11 -3.75 -0.02 0.00 0.00 0.00 0.00 34.13 30.47 1rti s GLU 312 CO 0.87 -0.85 1.28 -1.25 0.02 0.00 0.00 175.26 175.33 1rti s PRO 313 N 3.43 4.25 0.21 4.30 0.04 -1.26 -5.02 135.00 140.95 1rti s PRO 313 Ca 0.41 1.70 -0.18 0.00 0.04 0.00 0.00 61.00 62.97 1rti s PRO 313 Cb -0.13 -3.75 -0.08 0.00 0.04 0.00 0.00 34.50 30.59 1rti s PRO 313 CO 0.15 -0.68 0.68 0.08 0.04 0.00 0.00 177.00 177.27 1rti s VAL 314 N 3.33 4.65 -0.02 -0.36 1.01 -1.26 -5.00 120.40 122.75 1rti s VAL 314 Ca 0.56 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.68 1rti s VAL 314 Cb -0.23 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 32.37 1rti s VAL 314 CO 0.17 0.18 0.01 -1.38 0.00 0.00 0.00 175.10 174.08 1rti s HIS 315 N -1.55 0.17 0.45 5.22 -3.43 -1.26 -2.24 115.29 112.64 1rti s HIS 315 Ca 0.43 0.06 0.08 0.00 -0.80 0.00 0.00 55.06 54.82 1rti s HIS 315 Cb -0.16 -0.30 0.01 0.00 -1.43 0.00 0.00 32.58 30.71 1rti s HIS 315 CO 0.20 -0.10 0.51 0.20 -2.00 0.00 0.00 174.74 173.56 1rti s GLY 316 N 0.93 2.03 0.52 -1.38 0.00 0.14 -4.83 107.32 104.73 1rti s GLY 316 Ca -0.09 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 42.88 1rti s GLY 316 CO -0.02 -1.64 0.26 0.54 0.00 0.00 0.00 173.10 172.24 1rti s VAL 317 N -2.48 1.58 0.47 1.40 0.11 0.12 -0.37 120.40 121.23 1rti s VAL 317 Ca 0.52 -1.66 0.04 0.00 -2.93 0.00 0.00 61.98 57.95 1rti s VAL 317 Cb -0.06 -2.25 0.02 0.00 -1.53 0.00 0.00 36.38 32.56 1rti s VAL 317 CO 0.31 0.00 0.65 -0.31 -3.33 0.00 0.00 175.10 172.42 1rti s TYR 318 N -2.78 2.90 0.01 1.54 2.02 -1.26 -4.50 117.35 115.28 1rti s TYR 318 Ca 0.26 -0.16 -0.25 0.00 -0.37 0.00 0.00 57.07 56.55 1rti s TYR 318 Cb -0.00 -2.49 -0.05 0.00 -0.40 0.00 0.00 41.96 39.02 1rti s TYR 318 CO 0.16 -0.56 0.78 -0.47 -1.57 0.00 0.00 175.55 173.90 1rti s TYR 319 N -2.52 3.68 -0.40 2.71 5.04 0.34 -4.89 117.35 121.32 1rti s TYR 319 Ca 0.54 1.45 0.03 0.00 -2.44 0.00 0.00 57.07 56.66 1rti s TYR 319 Cb -0.10 -2.87 0.11 0.00 0.35 0.00 0.00 41.96 39.45 1rti s TYR 319 CO 0.35 0.17 0.13 0.34 -1.34 0.00 0.00 175.55 175.21 1rti s ASP 320 N 0.36 4.49 0.57 4.32 2.15 -1.26 -3.47 116.67 123.83 1rti s ASP 320 Ca 0.41 -2.39 0.39 0.00 0.43 0.00 0.00 52.55 51.39 1rti s ASP 320 Cb -0.20 -1.52 1.50 0.00 -0.30 0.00 0.00 42.92 42.41 1rti s ASP 320 CO 0.22 -0.33 1.63 -0.65 -0.17 0.00 0.00 175.17 175.88 1rti h PRO 321 N 7.28 0.00 -0.03 4.34 0.11 -1.98 -1.38 132.00 140.34 1rti h PRO 321 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1rti h PRO 321 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1rti h PRO 321 CO 0.56 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.22 1rti n SER 322 N -3.87 0.03 -4.17 -2.05 3.41 -1.26 -4.79 113.62 100.91 1rti n SER 322 Ca 0.31 -1.57 -0.14 0.00 -0.26 0.00 0.00 58.87 57.21 1rti n SER 322 Cb 1.54 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 65.37 1rti n SER 322 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1rti s LYS 323 N -1.96 0.84 0.94 4.33 1.02 -0.52 -5.15 119.74 119.24 1rti s LYS 323 Ca 0.00 -1.19 -0.12 0.00 0.02 0.00 0.00 55.97 54.69 1rti s LYS 323 Cb 0.00 -0.48 0.15 0.00 -0.52 0.00 0.00 37.83 36.99 1rti s LYS 323 CO 0.00 0.06 1.09 -0.51 -0.92 0.00 0.00 175.35 175.07 1rti s ASP 324 N -2.54 3.04 -0.25 2.83 1.01 -1.26 -4.95 116.67 114.54 1rti s ASP 324 Ca 0.06 1.56 -0.01 0.00 0.71 0.00 0.00 52.55 54.88 1rti s ASP 324 Cb -0.02 -2.23 0.03 0.00 1.01 0.00 0.00 42.92 41.72 1rti s ASP 324 CO -0.01 -2.92 -0.07 -0.76 0.21 0.00 0.00 175.17 171.62 1rti s LEU 325 N -6.41 3.23 -0.09 1.23 1.43 -1.26 -4.40 118.68 112.41 1rti s LEU 325 Ca 0.65 -0.96 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1rti s LEU 325 Cb -0.19 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 1rti s LEU 325 CO 0.58 -0.14 -0.10 -0.63 0.23 0.00 0.00 176.35 176.29 1rti s ILE 326 N 1.29 3.38 -0.17 -0.59 -1.09 0.25 -0.02 121.20 124.26 1rti s ILE 326 Ca -0.01 -0.58 0.00 0.00 -2.23 0.00 0.00 60.65 57.83 1rti s ILE 326 Cb -0.17 -2.39 0.04 0.00 -1.58 0.00 0.00 42.46 38.35 1rti s ILE 326 CO -0.05 0.56 -0.08 0.00 -1.23 0.00 0.00 174.94 174.14 1rti s ALA 327 N -0.32 1.67 -0.07 9.38 0.00 -0.37 -0.63 121.76 131.42 1rti s ALA 327 Ca 0.04 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 51.07 1rti s ALA 327 Cb -0.13 -1.13 -0.04 0.00 0.00 0.00 0.00 23.12 21.83 1rti s ALA 327 CO 0.02 -0.68 0.04 -2.00 0.00 0.00 0.00 175.76 173.14 1rti s GLU 328 N 1.55 3.06 0.01 0.00 2.12 -0.99 -1.17 118.70 123.28 1rti s GLU 328 Ca 0.01 -0.40 0.06 0.00 0.36 0.00 0.00 54.97 55.00 1rti s GLU 328 Cb -0.15 -2.86 -0.02 0.00 0.26 0.00 0.00 34.13 31.36 1rti s GLU 328 CO -0.08 0.70 -0.17 0.42 -0.54 0.00 0.00 175.26 175.58 1rti s ILE 329 N -1.00 1.35 0.14 -3.70 1.01 -1.01 -1.94 121.20 116.05 1rti s ILE 329 Ca 0.16 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 59.98 1rti s ILE 329 Cb -0.12 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 1rti s ILE 329 CO 0.06 0.26 -0.11 -1.10 0.00 0.00 0.00 174.94 174.05 1rti s GLN 330 N -0.72 1.03 -0.30 2.79 1.11 0.11 -4.18 119.66 119.51 1rti s GLN 330 Ca 0.06 -1.40 -0.04 0.00 0.01 0.00 0.00 55.36 53.99 1rti s GLN 330 Cb -0.07 -0.65 0.03 0.00 -1.01 0.00 0.00 33.01 31.32 1rti s GLN 330 CO 0.00 0.09 0.03 0.21 0.01 0.00 0.00 175.29 175.63 1rti s LYS 331 N -3.53 2.69 0.00 2.91 2.20 -1.26 -0.58 119.74 122.16 1rti s LYS 331 Ca 0.15 -1.10 0.27 0.00 -0.36 0.00 0.00 55.97 54.92 1rti s LYS 331 Cb 0.01 -3.26 0.78 0.00 -1.51 0.00 0.00 37.83 33.86 1rti s LYS 331 CO 0.01 -0.55 1.61 1.04 -0.36 0.00 0.00 175.35 177.09 1rti n GLN 332 N 4.73 0.07 -3.63 4.03 1.13 0.41 -4.65 117.38 119.47 1rti n GLN 332 Ca -0.14 -0.03 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 1rti n GLN 332 Cb 0.45 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.30 1rti n GLN 332 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rti n GLY 333 N 1.48 -2.18 3.63 1.08 0.00 -1.15 -4.97 105.19 103.09 1rti n GLY 333 Ca 0.07 -1.20 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 1rti n GLY 333 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1rti s GLN 334 N -1.93 3.65 0.00 1.61 0.74 -1.26 -1.93 119.66 120.54 1rti s GLN 334 Ca 0.00 2.03 0.00 0.00 0.05 0.00 0.00 55.36 57.44 1rti s GLN 334 Cb 0.00 -4.19 0.00 0.00 1.10 0.00 0.00 33.01 29.92 1rti s GLN 334 CO 0.00 -1.49 0.00 0.41 -0.55 0.00 0.00 175.29 173.66 1rti n GLY 335 N 5.02 1.18 3.12 2.59 0.00 -1.26 -4.94 105.19 110.90 1rti n GLY 335 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 1rti n GLY 335 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rti s GLN 336 N -0.29 2.86 0.06 1.61 -0.21 -0.81 -1.55 119.66 121.32 1rti s GLN 336 Ca 0.00 -0.92 0.07 0.00 0.02 0.00 0.00 55.36 54.53 1rti s GLN 336 Cb 0.00 -2.65 -0.03 0.00 1.00 0.00 0.00 33.01 31.34 1rti s GLN 336 CO 0.00 -0.28 -0.19 -1.58 -2.12 0.00 0.00 175.29 171.12 1rti s TRP 337 N 1.26 1.64 0.09 0.91 0.52 -1.13 -0.44 118.94 121.78 1rti s TRP 337 Ca 0.02 -0.39 0.10 0.00 0.02 0.00 0.00 56.10 55.86 1rti s TRP 337 Cb -0.14 -0.95 -0.04 0.00 -1.15 0.00 0.00 33.47 31.19 1rti s TRP 337 CO -0.11 0.11 -0.26 0.95 0.02 0.00 0.00 176.95 177.66 1rti s THR 338 N -0.93 2.28 -0.00 2.01 -4.23 0.25 -1.96 115.64 113.05 1rti s THR 338 Ca 0.05 -1.57 -0.09 0.00 -1.18 0.00 0.00 61.69 58.90 1rti s THR 338 Cb -0.09 -1.96 0.01 0.00 1.34 0.00 0.00 72.50 71.80 1rti s THR 338 CO 0.02 0.21 0.18 -0.72 -0.54 0.00 0.00 174.62 173.78 1rti s TYR 339 N -0.96 -0.02 -0.05 3.99 1.13 -0.65 0.09 117.35 120.88 1rti s TYR 339 Ca 0.13 -0.01 -0.02 0.00 -1.41 0.00 0.00 57.07 55.76 1rti s TYR 339 Cb -0.10 -0.01 0.03 0.00 -1.10 0.00 0.00 41.96 40.79 1rti s TYR 339 CO 0.05 -0.30 0.08 1.14 -2.51 0.00 0.00 175.55 174.01 1rti s GLN 340 N -1.31 -0.05 -0.19 -3.49 0.00 -0.82 -1.79 119.66 112.01 1rti s GLN 340 Ca -0.14 0.41 -0.14 0.00 -0.00 0.00 0.00 55.36 55.49 1rti s GLN 340 Cb -0.07 -0.43 -0.04 0.00 0.00 0.00 0.00 33.01 32.47 1rti s GLN 340 CO 0.02 -0.31 0.33 0.42 0.00 0.00 0.00 175.29 175.75 1rti s ILE 341 N 2.11 5.26 0.27 3.63 1.01 0.11 -2.35 121.20 131.24 1rti s ILE 341 Ca 0.03 0.59 -0.09 0.00 0.00 0.00 0.00 60.65 61.18 1rti s ILE 341 Cb -0.12 -3.67 -0.00 0.00 0.01 0.00 0.00 42.46 38.68 1rti s ILE 341 CO -0.04 0.31 0.45 -0.72 0.00 0.00 0.00 174.94 174.94 1rti s TYR 342 N 0.99 0.60 -0.02 3.97 -0.85 0.20 -0.25 117.35 122.00 1rti s TYR 342 Ca 0.17 -0.93 -0.04 0.00 -0.52 0.00 0.00 57.07 55.75 1rti s TYR 342 Cb -0.14 0.07 -0.02 0.00 0.38 0.00 0.00 41.96 42.24 1rti s TYR 342 CO 0.06 -1.01 -0.09 1.04 -1.52 0.00 0.00 175.55 174.04 1rti n GLN 343 N -0.42 0.14 -3.89 -3.49 6.02 -1.25 -0.58 117.38 113.91 1rti n GLN 343 Ca -0.01 0.06 -0.36 0.00 -0.01 0.00 0.00 57.00 56.68 1rti n GLN 343 Cb 0.62 -0.74 -0.08 0.00 1.02 0.00 0.00 30.24 31.06 1rti n GLN 343 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1rti s GLU 344 N -2.18 3.73 0.14 -1.09 2.02 -1.26 -4.83 118.70 115.23 1rti s GLU 344 Ca -0.09 -0.22 -0.33 0.00 0.02 0.00 0.00 54.97 54.35 1rti s GLU 344 Cb 0.02 -3.23 -0.17 0.00 0.10 0.00 0.00 34.13 30.85 1rti s GLU 344 CO 0.12 0.53 0.98 -2.30 0.02 0.00 0.00 175.26 174.61 1rti n PRO 345 N 2.75 0.61 0.00 0.39 -0.02 -1.26 -1.11 135.00 136.36 1rti n PRO 345 Ca -0.18 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1rti n PRO 345 Cb 0.53 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 1rti n PRO 345 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1rti n PHE 346 N 1.10 0.00 -2.86 6.00 3.72 -1.26 -4.86 117.46 119.29 1rti n PHE 346 Ca 0.17 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 57.13 1rti n PHE 346 Cb 0.21 -0.23 -0.01 0.00 -0.94 0.00 0.00 39.48 38.52 1rti n PHE 346 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1rti s LYS 347 N 0.00 3.98 0.19 -1.08 3.01 -0.27 -4.99 119.74 120.59 1rti s LYS 347 Ca 0.00 -2.30 -0.30 0.00 -1.01 0.00 0.00 55.97 52.36 1rti s LYS 347 Cb 0.00 -5.14 -0.08 0.00 -1.01 0.00 0.00 37.83 31.60 1rti s LYS 347 CO 0.00 -1.87 1.17 -0.80 0.51 0.00 0.00 175.35 174.36 1rti s ASN 348 N 3.28 7.13 -0.17 2.83 0.01 -1.26 -3.97 114.94 122.78 1rti s ASN 348 Ca 0.43 2.22 -0.16 0.00 -0.71 0.00 0.00 52.86 54.64 1rti s ASN 348 Cb -0.02 -2.61 -0.12 0.00 0.41 0.00 0.00 41.25 38.91 1rti s ASN 348 CO -0.00 -0.33 0.07 -0.07 -1.51 0.00 0.00 177.10 175.26 1rti h LEU 349 N 5.07 0.00 -7.54 0.60 3.38 -0.87 0.36 115.31 116.31 1rti h LEU 349 Ca -0.45 -0.30 -0.12 0.00 0.09 0.00 0.00 57.88 57.10 1rti h LEU 349 Cb 1.21 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.76 1rti h LEU 349 CO 0.73 1.11 -0.31 -0.75 0.09 0.00 0.00 178.44 179.31 1rti s LYS 350 N -2.26 0.62 0.21 1.13 2.20 -1.00 -4.45 119.74 116.19 1rti s LYS 350 Ca -0.21 -0.18 0.00 0.00 -0.36 0.00 0.00 55.97 55.22 1rti s LYS 350 Cb 0.04 0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 36.58 1rti s LYS 350 CO 0.41 -0.16 0.10 0.95 -0.36 0.00 0.00 175.35 176.29 1rti s THR 351 N -1.22 0.28 -1.20 3.43 -4.23 -1.26 0.05 115.64 111.49 1rti s THR 351 Ca -0.13 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.40 1rti s THR 351 Cb -0.05 -2.45 0.00 0.00 1.34 0.00 0.00 72.50 71.33 1rti s THR 351 CO 0.04 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 1rti n GLY 352 N -0.31 -1.41 3.33 3.99 0.00 -0.74 -4.72 105.19 105.33 1rti n GLY 352 Ca -0.00 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 1rti n GLY 352 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rti s LYS 353 N -1.29 0.98 -0.09 1.61 -2.85 -1.26 -1.63 119.74 115.21 1rti s LYS 353 Ca 0.00 -0.45 0.02 0.00 -1.00 0.00 0.00 55.97 54.54 1rti s LYS 353 Cb 0.00 0.44 0.01 0.00 -2.06 0.00 0.00 37.83 36.22 1rti s LYS 353 CO 0.00 -0.35 -0.14 0.71 0.10 0.00 0.00 175.35 175.67 1rti s TYR 354 N -2.88 1.74 -0.21 1.78 2.02 -0.83 -4.94 117.35 114.03 1rti s TYR 354 Ca -0.03 -0.74 -0.07 0.00 -0.37 0.00 0.00 57.07 55.86 1rti s TYR 354 Cb 0.00 -1.27 -0.04 0.00 -0.40 0.00 0.00 41.96 40.26 1rti s TYR 354 CO -0.05 -0.38 0.07 0.00 -1.57 0.00 0.00 175.55 173.62 1rti s ALA 355 N 0.83 3.30 0.43 3.71 0.00 -1.26 -2.83 121.76 125.94 1rti s ALA 355 Ca -0.11 -0.92 0.08 0.00 0.00 0.00 0.00 51.96 51.01 1rti s ALA 355 Cb -0.15 -2.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.96 1rti s ALA 355 CO 0.01 -0.12 0.42 1.03 0.00 0.00 0.00 175.76 177.11 1rti s ARG 356 N 0.93 2.54 -0.22 0.00 1.81 -0.60 -5.04 118.95 118.38 1rti s ARG 356 Ca 0.04 -1.54 0.01 0.00 -1.72 0.00 0.00 55.73 52.52 1rti s ARG 356 Cb -0.14 -2.42 0.05 0.00 -0.45 0.00 0.00 34.95 32.00 1rti s ARG 356 CO 0.03 -0.26 -0.08 1.41 -0.68 0.00 0.00 175.30 175.72 1rti s MET 357 N -4.19 1.85 0.33 3.54 -2.45 -1.26 -4.95 119.30 112.17 1rti s MET 357 Ca 0.49 -0.93 0.25 0.00 -1.25 0.00 0.00 55.69 54.25 1rti s MET 357 Cb -0.04 -2.50 1.10 0.00 1.25 0.00 0.00 34.83 34.63 1rti s MET 357 CO 0.29 -0.51 1.12 2.89 1.05 0.00 0.00 175.02 179.86 1rti n ARG 358 N 4.67 -0.02 0.00 4.11 1.85 -1.26 -4.88 116.66 121.13 1rti n ARG 358 Ca -0.13 0.89 0.00 0.00 -1.00 0.00 0.00 57.85 57.60 1rti n ARG 358 Cb 0.45 -1.78 0.00 0.00 -1.05 0.00 0.00 32.46 30.08 1rti n ARG 358 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1rti n GLY 359 N -1.41 -0.29 0.27 2.89 0.00 -1.26 -3.76 105.19 101.62 1rti n GLY 359 Ca 0.29 -0.96 0.03 0.00 0.00 0.00 0.00 46.02 45.39 1rti n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rti h ALA 360 N -0.93 0.98 0.00 4.61 0.00 -1.93 -1.28 119.26 120.70 1rti h ALA 360 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1rti h ALA 360 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1rti h ALA 360 CO 0.00 -0.15 0.00 -2.39 0.00 0.00 0.00 179.25 176.71 1rti n HIS 361 N -4.96 0.00 -4.33 0.00 1.44 -1.25 -4.28 115.22 101.85 1rti n HIS 361 Ca 0.12 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.64 1rti n HIS 361 Cb 0.34 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.37 1rti n HIS 361 CO 0.00 0.00 0.00 0.99 -2.81 0.00 0.00 176.34 174.52 1rti s THR 362 N 0.00 0.18 0.04 0.61 2.01 -0.94 -4.91 115.64 112.62 1rti s THR 362 Ca 0.00 -2.00 -0.05 0.00 0.31 0.00 0.00 61.69 59.95 1rti s THR 362 Cb 0.00 -2.47 -0.01 0.00 0.01 0.00 0.00 72.50 70.02 1rti s THR 362 CO 0.00 0.00 0.08 0.54 -0.69 0.00 0.00 174.62 174.55 1rti s ASN 363 N -3.39 0.21 0.15 3.53 2.20 -1.26 -1.55 114.94 114.84 1rti s ASN 363 Ca 0.36 -0.59 -0.23 0.00 -0.94 0.00 0.00 52.86 51.46 1rti s ASN 363 Cb 0.04 0.23 0.03 0.00 -2.00 0.00 0.00 41.25 39.55 1rti s ASN 363 CO 0.21 -0.53 1.62 0.44 -2.94 0.00 0.00 177.10 175.91 1rti h ASP 364 N 3.57 -0.84 -0.55 3.54 3.32 -1.93 -0.83 116.42 122.69 1rti h ASP 364 Ca -0.33 0.15 0.10 0.00 0.02 0.00 0.00 57.03 56.97 1rti h ASP 364 Cb 1.18 0.39 -0.08 0.00 0.22 0.00 0.00 39.33 41.04 1rti h ASP 364 CO 0.52 -0.29 0.09 0.58 -1.72 0.00 0.00 179.24 178.42 1rti h VAL 365 N -0.26 0.65 -0.43 -1.35 2.07 -1.95 0.41 116.25 115.40 1rti h VAL 365 Ca 0.14 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.64 1rti h VAL 365 Cb 0.48 0.42 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1rti h VAL 365 CO -0.41 0.04 0.15 0.50 0.02 0.00 0.00 177.57 177.86 1rti h LYS 366 N 0.22 0.30 -0.79 1.57 1.63 -1.82 -0.63 116.57 117.04 1rti h LYS 366 Ca 0.28 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 60.03 1rti h LYS 366 Cb 0.41 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.94 1rti h LYS 366 CO -0.39 0.20 0.36 1.96 -3.45 0.00 0.00 179.45 178.13 1rti h GLN 367 N 0.31 1.16 -0.08 1.90 4.20 0.50 -0.05 115.11 123.04 1rti h GLN 367 Ca 0.20 -0.18 0.02 0.00 0.06 0.00 0.00 58.65 58.75 1rti h GLN 367 Cb 0.19 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.75 1rti h GLN 367 CO -0.21 0.91 -0.06 1.25 -0.67 0.00 0.00 178.83 180.05 1rti h LEU 368 N 1.14 -0.18 -0.44 1.46 6.46 0.76 0.53 115.31 125.04 1rti h LEU 368 Ca 0.27 0.04 0.08 0.00 -0.12 0.00 0.00 57.88 58.15 1rti h LEU 368 Cb 0.15 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.11 1rti h LEU 368 CO -0.03 -0.08 0.04 0.74 -0.62 0.00 0.00 178.44 178.49 1rti h THR 369 N -0.06 0.71 0.00 1.05 2.02 -0.49 0.83 112.91 116.97 1rti h THR 369 Ca 0.05 -0.06 -0.00 0.00 0.77 0.00 0.00 66.41 67.17 1rti h THR 369 Cb 0.14 0.54 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1rti h THR 369 CO -0.12 0.03 -0.02 -0.33 0.37 0.00 0.00 175.52 175.44 1rti h GLU 370 N 0.16 0.00 0.22 6.66 5.08 -0.08 -1.41 114.58 125.21 1rti h GLU 370 Ca 0.22 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1rti h GLU 370 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1rti h GLU 370 CO -0.32 0.02 -0.10 0.00 -1.00 0.00 0.00 179.01 177.61 1rti h ALA 371 N 1.98 -0.29 -0.88 3.43 0.00 0.13 -2.59 119.26 121.04 1rti h ALA 371 Ca -0.00 -0.18 0.23 0.00 0.00 0.00 0.00 54.91 54.96 1rti h ALA 371 Cb 0.04 0.11 -0.15 0.00 0.00 0.00 0.00 17.79 17.79 1rti h ALA 371 CO 0.00 -0.33 0.16 0.28 0.00 0.00 0.00 179.25 179.37 1rti h VAL 372 N -0.96 0.26 0.55 0.00 2.07 -0.61 0.11 116.25 117.67 1rti h VAL 372 Ca -0.03 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 1rti h VAL 372 Cb 0.46 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1rti h VAL 372 CO 0.05 0.03 -0.34 -0.61 0.02 0.00 0.00 177.57 176.72 1rti h GLN 373 N 0.15 -0.81 -0.24 1.57 5.75 -1.31 0.78 115.11 120.99 1rti h GLN 373 Ca 0.54 0.06 0.05 0.00 -0.15 0.00 0.00 58.65 59.15 1rti h GLN 373 Cb 1.10 0.18 -0.05 0.00 1.07 0.00 0.00 27.48 29.78 1rti h GLN 373 CO -0.71 -0.54 -0.09 0.87 -2.65 0.00 0.00 178.83 175.71 1rti h LYS 374 N -0.84 -0.04 -0.46 1.69 1.57 -0.46 -1.16 116.57 116.85 1rti h LYS 374 Ca -0.07 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.79 1rti h LYS 374 Cb 0.68 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.94 1rti h LYS 374 CO 0.07 -0.03 0.08 0.82 -0.57 0.00 0.00 179.45 179.83 1rti h ILE 375 N -0.04 0.74 -0.00 1.86 2.04 -0.80 -1.01 117.51 120.28 1rti h ILE 375 Ca 0.12 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.94 1rti h ILE 375 Cb 0.23 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 1rti h ILE 375 CO -0.28 0.04 -0.26 0.74 0.00 0.00 0.00 178.15 178.39 1rti h THR 376 N 0.22 0.41 -0.46 -0.27 2.02 0.04 -0.21 112.91 114.65 1rti h THR 376 Ca 0.23 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.48 1rti h THR 376 Cb 0.30 0.41 -0.06 0.00 -1.74 0.00 0.00 68.15 67.06 1rti h THR 376 CO -0.31 0.00 0.10 0.74 0.37 0.00 0.00 175.52 176.42 1rti h THR 377 N -0.40 0.76 -0.52 3.16 2.02 -0.67 -0.79 112.91 116.47 1rti h THR 377 Ca 0.06 -0.08 0.07 0.00 0.77 0.00 0.00 66.41 67.23 1rti h THR 377 Cb 0.49 0.51 -0.06 0.00 -1.74 0.00 0.00 68.15 67.35 1rti h THR 377 CO -0.23 0.04 0.21 -0.08 0.37 0.00 0.00 175.52 175.83 1rti h GLU 378 N 0.24 0.39 0.01 6.66 4.81 -0.51 -1.78 114.58 124.39 1rti h GLU 378 Ca 0.22 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1rti h GLU 378 Cb 0.28 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1rti h GLU 378 CO -0.29 0.26 -0.00 0.77 -0.73 0.00 0.00 179.01 179.02 1rti h SER 379 N 0.40 -0.01 -0.94 1.04 0.02 0.03 -1.32 113.55 112.76 1rti h SER 379 Ca 0.25 -0.00 0.10 0.00 -0.84 0.00 0.00 61.79 61.29 1rti h SER 379 Cb 0.25 0.00 -0.08 0.00 0.14 0.00 0.00 62.40 62.72 1rti h SER 379 CO -0.24 -0.00 0.58 0.40 -1.14 0.00 0.00 176.83 176.43 1rti h ILE 380 N -0.02 0.96 -0.15 3.27 2.04 -0.70 0.65 117.51 123.57 1rti h ILE 380 Ca -0.00 -0.33 -0.15 0.00 1.00 0.00 0.00 64.86 65.38 1rti h ILE 380 Cb 0.02 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 35.99 1rti h ILE 380 CO 0.00 0.18 -0.53 0.58 0.00 0.00 0.00 178.15 178.38 1rti h VAL 381 N 0.98 1.34 0.00 1.67 2.07 -1.04 -1.45 116.25 119.81 1rti h VAL 381 Ca 0.45 -1.79 0.00 0.00 0.82 0.00 0.00 66.70 66.18 1rti h VAL 381 Cb 0.36 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1rti h VAL 381 CO -0.23 0.55 -0.05 0.40 0.02 0.00 0.00 177.57 178.25 1rti h ILE 382 N 0.33 0.00 -0.49 4.57 2.04 -0.04 -3.40 117.51 120.52 1rti h ILE 382 Ca 0.01 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1rti h ILE 382 Cb 1.04 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1rti h ILE 382 CO 0.09 0.00 0.00 0.79 0.00 0.00 0.00 178.15 179.03 1rti n TRP 383 N -2.69 0.69 -1.22 1.37 8.01 0.22 -4.86 117.44 118.95 1rti n TRP 383 Ca -0.01 -0.33 -0.10 0.00 -1.31 0.00 0.00 57.50 55.75 1rti n TRP 383 Cb 0.03 -0.02 -0.04 0.00 -2.01 0.00 0.00 31.31 29.27 1rti n TRP 383 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1rti n GLY 384 N 1.25 0.98 3.26 6.99 0.00 -0.54 -4.91 105.19 112.21 1rti n GLY 384 Ca 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 1rti n GLY 384 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rti s LYS 385 N -2.72 0.96 -0.13 1.61 -2.85 -1.26 -4.89 119.74 110.46 1rti s LYS 385 Ca 0.00 -0.98 -0.14 0.00 -1.00 0.00 0.00 55.97 53.85 1rti s LYS 385 Cb 0.00 0.37 -0.05 0.00 -2.06 0.00 0.00 37.83 36.09 1rti s LYS 385 CO 0.00 -0.33 0.32 0.95 0.10 0.00 0.00 175.35 176.39 1rti s THR 386 N -3.88 5.27 0.71 3.79 -4.23 -1.26 -3.12 115.64 112.91 1rti s THR 386 Ca 0.08 0.61 -0.11 0.00 -1.18 0.00 0.00 61.69 61.09 1rti s THR 386 Cb 0.04 -3.65 0.02 0.00 1.34 0.00 0.00 72.50 70.25 1rti s THR 386 CO -0.08 0.43 1.07 -2.16 -0.54 0.00 0.00 174.62 173.33 1rti s PRO 387 N 0.14 2.84 0.08 3.99 0.04 -1.26 -4.91 135.00 135.91 1rti s PRO 387 Ca 0.19 0.75 -0.22 0.00 0.04 0.00 0.00 61.00 61.75 1rti s PRO 387 Cb -0.14 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1rti s PRO 387 CO 0.06 -1.12 0.66 0.15 0.04 0.00 0.00 177.00 176.80 1rti s LYS 388 N -5.16 4.37 -0.06 4.56 1.02 0.97 -4.88 119.74 120.57 1rti s LYS 388 Ca 0.58 0.91 -0.05 0.00 0.02 0.00 0.00 55.97 57.43 1rti s LYS 388 Cb -0.13 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.85 1rti s LYS 388 CO 0.54 0.50 0.15 -0.06 -0.92 0.00 0.00 175.35 175.56 1rti s PHE 389 N -0.74 3.55 -0.31 3.18 0.08 -1.11 -1.23 117.98 121.39 1rti s PHE 389 Ca 0.33 0.42 0.03 0.00 0.12 0.00 0.00 56.93 57.83 1rti s PHE 389 Cb -0.20 -1.87 0.08 0.00 -0.57 0.00 0.00 43.02 40.45 1rti s PHE 389 CO 0.21 0.68 -0.01 0.15 -0.10 0.00 0.00 175.22 176.16 1rti s LYS 390 N -1.47 1.85 0.01 0.44 -0.14 -0.32 0.40 119.74 120.51 1rti s LYS 390 Ca 0.21 -1.64 0.07 0.00 -1.36 0.00 0.00 55.97 53.25 1rti s LYS 390 Cb -0.12 -3.11 -0.03 0.00 -1.68 0.00 0.00 37.83 32.90 1rti s LYS 390 CO 0.11 -0.79 -0.22 -0.51 -0.76 0.00 0.00 175.35 173.18 1rti s LEU 391 N 1.01 2.35 -1.53 3.17 1.43 -0.35 -2.41 118.68 122.35 1rti s LEU 391 Ca 0.02 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 1rti s LEU 391 Cb -0.20 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.60 1rti s LEU 391 CO -0.06 0.29 2.60 -0.81 0.23 0.00 0.00 176.35 178.60 1rti n PRO 392 N 2.00 3.47 -3.68 1.29 -0.04 -1.26 -1.98 135.00 134.80 1rti n PRO 392 Ca -0.16 -2.52 -0.14 0.00 -0.04 0.00 0.00 63.50 60.64 1rti n PRO 392 Cb 0.52 -2.97 -0.08 0.00 -0.04 0.00 0.00 33.50 30.93 1rti n PRO 392 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1rti s ILE 393 N 2.17 0.01 0.28 0.52 2.07 -1.26 -1.71 121.20 123.28 1rti s ILE 393 Ca 0.59 -0.06 -0.29 0.00 -1.41 0.00 0.00 60.65 59.47 1rti s ILE 393 Cb 0.16 -0.76 -0.09 0.00 0.13 0.00 0.00 42.46 41.90 1rti s ILE 393 CO -0.07 -0.04 1.13 -1.10 -1.91 0.00 0.00 174.94 172.96 1rti s GLN 394 N -0.13 4.59 0.41 3.50 -1.52 -1.26 -4.73 119.66 120.53 1rti s GLN 394 Ca -0.03 1.86 0.08 0.00 -1.95 0.00 0.00 55.36 55.31 1rti s GLN 394 Cb -0.03 -3.18 0.88 0.00 -0.22 0.00 0.00 33.01 30.45 1rti s GLN 394 CO 0.02 0.13 2.06 1.57 -0.25 0.00 0.00 175.29 178.83 1rti h LYS 395 N 3.91 0.50 -0.20 2.91 2.10 -1.99 -1.12 116.57 122.69 1rti h LYS 395 Ca -0.47 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.13 1rti h LYS 395 Cb 1.21 -0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 32.42 1rti h LYS 395 CO 0.67 0.34 0.04 0.93 -2.00 0.00 0.00 179.45 179.44 1rti h GLU 396 N 0.51 0.32 -0.25 0.07 3.07 -1.99 -0.19 114.58 116.12 1rti h GLU 396 Ca 0.14 -0.08 0.06 0.00 -0.50 0.00 0.00 59.36 58.98 1rti h GLU 396 Cb -0.04 -0.04 -0.06 0.00 -0.84 0.00 0.00 28.75 27.77 1rti h GLU 396 CO -0.03 0.46 -0.14 1.15 -1.40 0.00 0.00 179.01 179.05 1rti h THR 397 N 0.13 0.57 0.40 1.13 2.02 -1.65 -0.48 112.91 115.02 1rti h THR 397 Ca 0.06 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.24 1rti h THR 397 Cb 0.29 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1rti h THR 397 CO 0.00 0.00 -0.39 -0.25 0.37 0.00 0.00 175.52 175.25 1rti h TRP 398 N -0.12 -1.06 -0.38 3.16 2.91 -1.02 -2.01 115.95 117.44 1rti h TRP 398 Ca 0.14 0.01 0.04 0.00 1.13 0.00 0.00 58.89 60.21 1rti h TRP 398 Cb 0.33 0.41 -0.07 0.00 -0.51 0.00 0.00 29.16 29.32 1rti h TRP 398 CO -0.32 -0.54 -0.48 0.93 -1.03 0.00 0.00 178.44 176.99 1rti h GLU 399 N -0.81 -0.31 -1.00 2.65 4.39 -0.61 -0.39 114.58 118.48 1rti h GLU 399 Ca -0.03 0.02 0.22 0.00 0.34 0.00 0.00 59.36 59.91 1rti h GLU 399 Cb 0.72 0.07 -0.12 0.00 -0.10 0.00 0.00 28.75 29.33 1rti h GLU 399 CO -0.06 -0.21 0.60 1.15 -1.16 0.00 0.00 179.01 179.34 1rti h THR 400 N -0.33 0.62 0.06 1.13 2.02 -0.99 -1.59 112.91 113.84 1rti h THR 400 Ca 0.07 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 1rti h THR 400 Cb 0.50 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1rti h THR 400 CO -0.53 0.12 -0.03 -0.25 0.37 0.00 0.00 175.52 175.20 1rti h TRP 401 N 0.67 -0.08 -0.57 3.16 7.01 -0.36 -3.33 115.95 122.44 1rti h TRP 401 Ca 0.61 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.68 1rti h TRP 401 Cb 1.07 0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 28.12 1rti h TRP 401 CO -0.01 -0.05 0.38 0.11 -2.79 0.00 0.00 178.44 176.09 1rti h TRP 402 N -0.18 0.52 0.00 2.65 5.08 -1.12 -0.97 115.95 121.93 1rti h TRP 402 Ca -0.01 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1rti h TRP 402 Cb 0.07 -0.17 0.00 0.00 -3.00 0.00 0.00 29.16 26.06 1rti h TRP 402 CO 0.08 0.27 0.00 1.79 -1.28 0.00 0.00 178.44 179.30 1rti h THR 403 N 0.51 0.00 -0.00 0.12 1.35 -1.45 -2.95 112.91 110.49 1rti h THR 403 Ca 0.25 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 1rti h THR 403 Cb 0.34 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 67.60 1rti h THR 403 CO -0.07 0.00 -0.05 -0.62 -0.25 0.00 0.00 175.52 174.53 1rti n GLU 404 N -2.55 4.31 -2.20 4.72 1.02 -0.46 -5.05 120.64 120.43 1rti n GLU 404 Ca -0.01 -0.18 -0.40 0.00 -0.02 0.00 0.00 57.16 56.55 1rti n GLU 404 Cb 0.12 -0.71 -0.02 0.00 -0.02 0.00 0.00 31.44 30.81 1rti n GLU 404 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1rti s TYR 405 N -0.84 3.14 0.40 -0.32 5.04 -0.69 -4.93 117.35 119.15 1rti s TYR 405 Ca 0.01 1.49 0.21 0.00 -2.44 0.00 0.00 57.07 56.34 1rti s TYR 405 Cb 0.01 -3.57 1.15 0.00 0.35 0.00 0.00 41.96 39.91 1rti s TYR 405 CO 0.05 -1.55 1.99 0.11 -1.34 0.00 0.00 175.55 174.81 1rti h TRP 406 N 3.34 0.00 -3.03 4.97 5.08 -1.91 -3.43 115.95 120.96 1rti h TRP 406 Ca -0.48 0.00 -0.65 0.00 1.08 0.00 0.00 58.89 58.84 1rti h TRP 406 Cb 1.23 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 27.30 1rti h TRP 406 CO 0.56 0.19 -0.55 -1.14 -1.28 0.00 0.00 178.44 176.22 1rti s GLN 407 N -4.29 3.16 0.20 0.12 0.74 -1.26 -5.08 119.66 113.24 1rti s GLN 407 Ca -0.03 -0.46 -0.30 0.00 0.05 0.00 0.00 55.36 54.62 1rti s GLN 407 Cb 0.14 -2.91 -0.08 0.00 1.10 0.00 0.00 33.01 31.25 1rti s GLN 407 CO 0.65 0.65 1.22 0.00 -0.55 0.00 0.00 175.29 177.26 1rti s ALA 408 N -1.25 3.46 0.13 1.58 0.00 -1.26 -5.02 121.76 119.39 1rti s ALA 408 Ca 0.25 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 53.08 1rti s ALA 408 Cb -0.12 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.58 1rti s ALA 408 CO 0.16 -0.41 0.32 -0.08 0.00 0.00 0.00 175.76 175.75 1rti s THR 409 N -0.09 0.09 -0.23 0.00 -1.32 -1.26 -5.18 115.64 107.65 1rti s THR 409 Ca 0.53 -0.98 -0.27 0.00 -1.21 0.00 0.00 61.69 59.77 1rti s THR 409 Cb -0.34 -1.43 0.09 0.00 -1.51 0.00 0.00 72.50 69.32 1rti s THR 409 CO 0.38 -0.39 0.85 0.86 -2.21 0.00 0.00 174.62 174.11 1rti s TRP 410 N -3.87 -0.61 -0.14 9.09 -0.00 -1.26 -5.10 118.94 117.04 1rti s TRP 410 Ca 0.08 1.39 0.01 0.00 -0.00 0.00 0.00 56.10 57.58 1rti s TRP 410 Cb 0.03 0.34 0.02 0.00 -0.00 0.00 0.00 33.47 33.86 1rti s TRP 410 CO -0.08 -0.36 -0.15 0.42 -0.00 0.00 0.00 176.95 176.79 1rti s ILE 411 N -0.09 1.58 1.07 5.86 1.01 -1.26 -4.94 121.20 124.43 1rti s ILE 411 Ca -0.01 -0.65 -0.18 0.00 0.00 0.00 0.00 60.65 59.81 1rti s ILE 411 Cb -0.04 -1.47 0.06 0.00 0.01 0.00 0.00 42.46 41.02 1rti s ILE 411 CO 0.00 0.46 -0.08 -2.65 0.00 0.00 0.00 174.94 172.67 1rti n PRO 412 N 4.67 -1.13 -1.63 2.79 -0.02 -1.26 -4.73 135.00 133.69 1rti n PRO 412 Ca -0.17 -0.31 -0.59 0.00 -2.02 0.00 0.00 63.50 60.41 1rti n PRO 412 Cb 0.50 -1.65 -0.08 0.00 -0.02 0.00 0.00 33.50 32.25 1rti n PRO 412 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1rti n GLU 413 N -1.43 0.81 -4.42 -0.52 0.00 -1.26 -4.84 120.64 108.97 1rti n GLU 413 Ca 0.02 0.28 -0.22 0.00 0.00 0.00 0.00 57.16 57.24 1rti n GLU 413 Cb 0.61 -1.98 -0.09 0.00 0.00 0.00 0.00 31.44 29.98 1rti n GLU 413 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.13 178.80 1rti s TRP 414 N 4.31 1.75 -0.01 4.31 1.48 -1.26 -2.74 118.94 126.77 1rti s TRP 414 Ca 1.04 -1.21 -0.01 0.00 -1.06 0.00 0.00 56.10 54.86 1rti s TRP 414 Cb -1.17 -1.07 0.00 0.00 -1.16 0.00 0.00 33.47 30.07 1rti s TRP 414 CO 0.66 -0.29 0.03 -2.00 -4.06 0.00 0.00 176.95 171.29 1rti s GLU 415 N -3.83 0.03 0.16 3.25 2.12 0.16 -4.92 118.70 115.68 1rti s GLU 415 Ca 0.32 0.04 -0.30 0.00 0.36 0.00 0.00 54.97 55.39 1rti s GLU 415 Cb 0.05 0.01 -0.08 0.00 0.26 0.00 0.00 34.13 34.38 1rti s GLU 415 CO 0.15 -0.01 1.20 0.12 -0.54 0.00 0.00 175.26 176.18 1rti s PHE 416 N 0.03 3.44 -0.23 5.30 5.36 -1.26 -1.21 117.98 129.40 1rti s PHE 416 Ca -0.00 1.40 0.01 0.00 -0.96 0.00 0.00 56.93 57.38 1rti s PHE 416 Cb -0.00 -3.42 0.06 0.00 -0.34 0.00 0.00 43.02 39.31 1rti s PHE 416 CO -0.00 -1.21 -0.07 0.54 -1.46 0.00 0.00 175.22 173.02 1rti s VAL 417 N 0.17 1.65 -1.04 3.12 0.11 -0.84 -4.86 120.40 118.71 1rti s VAL 417 Ca 0.54 -1.25 -0.23 0.00 -2.93 0.00 0.00 61.98 58.11 1rti s VAL 417 Cb -0.32 -1.86 -0.12 0.00 -1.53 0.00 0.00 36.38 32.55 1rti s VAL 417 CO 0.35 -0.05 1.92 -3.20 -3.33 0.00 0.00 175.10 170.80 1rti n ASN 418 N 4.63 2.87 -3.85 3.54 5.15 -1.26 -4.21 115.26 122.14 1rti n ASN 418 Ca -0.13 -2.69 -0.30 0.00 -0.60 0.00 0.00 54.58 50.86 1rti n ASN 418 Cb 0.44 -1.53 -0.15 0.00 -0.53 0.00 0.00 39.78 38.01 1rti n ASN 418 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1rti s THR 419 N 9.19 1.32 0.71 -0.44 -1.32 -1.26 -5.13 115.64 118.71 1rti s THR 419 Ca 0.65 -1.49 -0.16 0.00 -1.21 0.00 0.00 61.69 59.48 1rti s THR 419 Cb 0.04 -1.87 0.03 0.00 -1.51 0.00 0.00 72.50 69.19 1rti s THR 419 CO 0.14 -0.47 1.23 -2.16 -2.21 0.00 0.00 174.62 171.14 1rti s PRO 420 N 1.42 2.23 0.01 7.08 0.04 -1.26 -4.22 135.00 140.30 1rti s PRO 420 Ca 0.05 1.84 -0.28 0.00 0.04 0.00 0.00 61.00 62.65 1rti s PRO 420 Cb -0.18 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.49 1rti s PRO 420 CO -0.15 -1.79 0.88 -1.25 0.04 0.00 0.00 177.00 174.73 1rti s PRO 421 N -3.77 4.54 0.27 0.56 0.04 -1.26 -4.98 135.00 130.40 1rti s PRO 421 Ca 0.76 1.25 -0.29 0.00 0.04 0.00 0.00 61.00 62.76 1rti s PRO 421 Cb -0.31 -3.43 -0.09 0.00 0.04 0.00 0.00 34.50 30.71 1rti s PRO 421 CO 0.44 0.07 0.94 -0.51 0.04 0.00 0.00 177.00 177.98 1rti s LEU 422 N 0.64 4.55 -0.06 -3.56 1.43 -1.26 -4.66 118.68 115.76 1rti s LEU 422 Ca 0.46 1.92 -0.29 0.00 -1.03 0.00 0.00 54.13 55.19 1rti s LEU 422 Cb -0.21 -3.74 -0.02 0.00 0.03 0.00 0.00 46.19 42.25 1rti s LEU 422 CO 0.25 0.08 0.94 0.68 0.23 0.00 0.00 176.35 178.54 1rti s VAL 423 N -1.32 4.86 0.05 -1.59 -7.23 -0.69 -5.02 120.40 109.46 1rti s VAL 423 Ca 0.44 1.95 -0.01 0.00 -1.81 0.00 0.00 61.98 62.55 1rti s VAL 423 Cb -0.24 -4.27 -0.04 0.00 0.56 0.00 0.00 36.38 32.39 1rti s VAL 423 CO 0.30 0.10 -0.03 -1.59 -0.31 0.00 0.00 175.10 173.56 1rti s LYS 424 N 1.46 0.61 -0.31 4.82 0.00 -1.26 -4.56 119.74 120.50 1rti s LYS 424 Ca 0.48 -1.19 -0.29 0.00 0.00 0.00 0.00 55.97 54.97 1rti s LYS 424 Cb -0.19 0.17 -0.01 0.00 0.00 0.00 0.00 37.83 37.80 1rti s LYS 424 CO 0.22 -0.10 1.59 -0.51 0.00 0.00 0.00 175.35 176.55 1rti s LEU 425 N -2.83 3.70 0.51 2.77 1.43 -1.26 -4.87 118.68 118.13 1rti s LEU 425 Ca 0.06 1.29 0.16 0.00 -1.03 0.00 0.00 54.13 54.61 1rti s LEU 425 Cb 0.07 -3.53 1.24 0.00 0.03 0.00 0.00 46.19 43.99 1rti s LEU 425 CO -0.09 -1.41 2.13 -0.50 0.23 0.00 0.00 176.35 176.71 1rti h TRP 426 N 11.20 0.00 -2.99 0.29 4.06 -1.99 -3.44 115.95 123.08 1rti h TRP 426 Ca -0.31 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.61 1rti h TRP 426 Cb 1.14 0.00 -0.12 0.00 -1.00 0.00 0.00 29.16 29.18 1rti h TRP 426 CO 0.94 0.02 0.18 1.52 -3.56 0.00 0.00 178.44 177.54 1rti s TYR 427 N -5.02 -0.52 -0.04 0.49 1.13 -1.26 -4.75 117.35 107.38 1rti s TYR 427 Ca -0.05 0.33 -0.02 0.00 -1.41 0.00 0.00 57.07 55.92 1rti s TYR 427 Cb 0.17 0.53 0.03 0.00 -1.10 0.00 0.00 41.96 41.59 1rti s TYR 427 CO 0.67 -0.83 0.06 -0.65 -2.51 0.00 0.00 175.55 172.30 1rti s GLN 428 N -3.64 -0.07 0.43 -3.49 -0.21 -1.26 -5.10 119.66 106.32 1rti s GLN 428 Ca 0.01 0.37 -0.24 0.00 0.02 0.00 0.00 55.36 55.52 1rti s GLN 428 Cb -0.01 -0.47 -0.08 0.00 1.00 0.00 0.00 33.01 33.45 1rti s GLN 428 CO -0.12 -0.31 1.20 -0.51 -2.12 0.00 0.00 175.29 173.43 1rti s LEU 429 N 2.08 4.12 0.42 2.90 1.43 -1.26 -4.68 118.68 123.69 1rti s LEU 429 Ca 0.04 2.41 -0.24 0.00 -1.03 0.00 0.00 54.13 55.31 1rti s LEU 429 Cb -0.12 -4.09 -0.08 0.00 0.03 0.00 0.00 46.19 41.93 1rti s LEU 429 CO -0.03 -0.84 1.10 -1.61 0.23 0.00 0.00 176.35 175.21 1rti s GLU 430 N -2.46 4.00 0.00 1.70 0.41 0.05 -4.94 118.70 117.46 1rti s GLU 430 Ca 0.60 1.64 0.29 0.00 -0.41 0.00 0.00 54.97 57.08 1rti s GLU 430 Cb -0.32 -2.50 1.19 0.00 -1.78 0.00 0.00 34.13 30.73 1rti s GLU 430 CO 0.39 -0.31 1.86 1.63 -0.49 0.00 0.00 175.26 178.34 1rti n LYS 431 N -0.22 0.35 -3.52 1.61 5.02 -1.26 -4.67 118.16 115.47 1rti n LYS 431 Ca 0.06 -0.09 -0.12 0.00 -2.02 0.00 0.00 58.31 56.14 1rti n LYS 431 Cb 0.49 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.96 1rti n LYS 431 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1rti s GLU 432 N -2.71 1.16 0.34 1.97 -1.05 -1.26 -5.15 118.70 112.00 1rti s GLU 432 Ca 0.22 -0.49 -0.28 0.00 -0.15 0.00 0.00 54.97 54.28 1rti s GLU 432 Cb 0.19 0.53 -0.12 0.00 -0.44 0.00 0.00 34.13 34.29 1rti s GLU 432 CO 0.52 -0.47 1.23 -2.30 0.95 0.00 0.00 175.26 175.18 1rti n PRO 433 N -0.15 1.94 -2.82 -4.83 -0.02 -1.26 -4.85 135.00 123.01 1rti n PRO 433 Ca -0.17 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 61.58 1rti n PRO 433 Cb 0.64 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.84 1rti n PRO 433 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1rti s ILE 434 N -1.11 4.88 0.22 4.25 1.01 -1.26 -5.02 121.20 124.18 1rti s ILE 434 Ca 0.57 1.81 -0.30 0.00 0.00 0.00 0.00 60.65 62.73 1rti s ILE 434 Cb -0.59 -4.21 -0.09 0.00 0.01 0.00 0.00 42.46 37.59 1rti s ILE 434 CO 0.61 0.09 1.16 -0.69 0.00 0.00 0.00 174.94 176.11 1rti s VAL 435 N 1.64 3.53 -0.97 2.92 1.01 -1.26 -3.44 120.40 123.83 1rti s VAL 435 Ca 0.44 1.39 -0.02 0.00 0.00 0.00 0.00 61.98 63.78 1rti s VAL 435 Cb -0.18 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1rti s VAL 435 CO 0.18 0.27 0.32 0.61 0.00 0.00 0.00 175.10 176.48 1rti n GLY 436 N 1.75 -0.07 3.26 4.51 0.00 -1.26 -5.03 105.19 108.35 1rti n GLY 436 Ca 0.02 -0.24 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 1rti n GLY 436 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rti s ALA 437 N -2.89 1.62 0.49 4.61 0.00 -1.22 -5.10 121.76 119.27 1rti s ALA 437 Ca 0.16 -1.24 -0.23 0.00 0.00 0.00 0.00 51.96 50.65 1rti s ALA 437 Cb -0.07 -0.16 -0.07 0.00 0.00 0.00 0.00 23.12 22.82 1rti s ALA 437 CO 0.20 0.23 1.25 -2.00 0.00 0.00 0.00 175.76 175.44 1rti s GLU 438 N -2.19 3.55 -0.23 0.00 2.12 -1.26 -4.84 118.70 115.86 1rti s GLU 438 Ca 0.06 1.98 0.01 0.00 0.36 0.00 0.00 54.97 57.39 1rti s GLU 438 Cb -0.08 -2.38 0.04 0.00 0.26 0.00 0.00 34.13 31.96 1rti s GLU 438 CO 0.04 -0.79 -0.13 0.99 -0.54 0.00 0.00 175.26 174.83 1rti s THR 439 N -1.43 2.29 -0.40 -1.70 2.01 -1.26 -1.81 115.64 113.33 1rti s THR 439 Ca 0.66 -1.22 -0.16 0.00 0.31 0.00 0.00 61.69 61.28 1rti s THR 439 Cb -0.34 -2.15 0.02 0.00 0.01 0.00 0.00 72.50 70.03 1rti s THR 439 CO 0.41 0.25 0.35 -0.36 -0.69 0.00 0.00 174.62 174.58 1rti s PHE 440 N 1.23 3.21 -0.80 4.92 0.40 0.41 -2.56 117.98 124.78 1rti s PHE 440 Ca -0.01 -0.45 -0.22 0.00 -0.60 0.00 0.00 56.93 55.65 1rti s PHE 440 Cb -0.16 -2.69 0.09 0.00 0.51 0.00 0.00 43.02 40.76 1rti s PHE 440 CO -0.08 -0.60 1.10 0.71 0.70 0.00 0.00 175.22 177.05 1rti s TYR 441 N 1.87 2.78 0.25 0.36 1.51 -0.13 -1.62 117.35 122.37 1rti s TYR 441 Ca 0.08 -0.84 -0.06 0.00 -1.01 0.00 0.00 57.07 55.23 1rti s TYR 441 Cb -0.18 -4.36 -0.06 0.00 -0.11 0.00 0.00 41.96 37.25 1rti s TYR 441 CO 0.11 -1.66 0.53 0.14 -1.11 0.00 0.00 175.55 173.56 1rti s VAL 442 N 3.81 5.01 -0.12 0.71 -7.23 -0.46 -3.00 120.40 119.13 1rti s VAL 442 Ca 0.30 0.19 -0.30 0.00 -1.81 0.00 0.00 61.98 60.35 1rti s VAL 442 Cb -0.10 -3.68 0.11 0.00 0.56 0.00 0.00 36.38 33.27 1rti s VAL 442 CO 0.01 -0.19 0.90 -0.62 -0.31 0.00 0.00 175.10 174.90 1rti s ASP 443 N -2.80 -0.45 -0.05 4.85 2.15 -1.19 -4.44 116.67 114.75 1rti s ASP 443 Ca 0.45 0.47 -0.24 0.00 0.43 0.00 0.00 52.55 53.66 1rti s ASP 443 Cb -0.11 0.37 0.05 0.00 -0.30 0.00 0.00 42.92 42.93 1rti s ASP 443 CO 0.26 -0.43 0.53 -0.83 -0.17 0.00 0.00 175.17 174.53 1rti s GLY 444 N -1.20 -0.41 -0.03 2.66 0.00 -1.26 -2.38 107.32 104.70 1rti s GLY 444 Ca -0.04 0.98 -0.20 0.00 0.00 0.00 0.00 44.72 45.46 1rti s GLY 444 CO 0.03 0.69 0.42 0.00 0.00 0.00 0.00 173.10 174.24 1rti s ALA 445 N -1.09 -1.08 -0.06 3.20 0.00 -0.50 -4.49 121.76 117.74 1rti s ALA 445 Ca -0.11 0.63 -0.09 0.00 0.00 0.00 0.00 51.96 52.39 1rti s ALA 445 Cb -0.02 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.16 1rti s ALA 445 CO 0.07 -0.29 0.22 0.00 0.00 0.00 0.00 175.76 175.75 1rti s ALA 446 N -1.28 -0.54 -0.18 0.00 0.00 -1.26 -0.65 121.76 117.86 1rti s ALA 446 Ca -0.13 0.42 -0.29 0.00 0.00 0.00 0.00 51.96 51.96 1rti s ALA 446 Cb -0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1rti s ALA 446 CO 0.06 -0.15 1.53 1.21 0.00 0.00 0.00 175.76 178.41 1rti s ASN 447 N -0.41 6.57 0.32 0.00 3.84 0.23 -4.55 114.94 120.94 1rti s ASN 447 Ca -0.05 1.73 0.04 0.00 0.21 0.00 0.00 52.86 54.79 1rti s ASN 447 Cb -0.03 -2.53 0.67 0.00 -0.55 0.00 0.00 41.25 38.80 1rti s ASN 447 CO 0.01 -1.08 1.88 0.03 -2.79 0.00 0.00 177.10 175.15 1rti h ARG 448 N 9.88 0.84 0.51 0.43 2.47 -1.93 0.40 114.38 126.99 1rti h ARG 448 Ca -0.33 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.32 1rti h ARG 448 Cb 1.14 -0.19 0.00 0.00 -1.65 0.00 0.00 29.97 29.28 1rti h ARG 448 CO 0.99 0.56 -0.24 0.93 0.56 0.00 0.00 179.97 182.76 1rti h GLU 449 N 0.87 -0.65 0.00 0.04 4.39 -1.97 -3.34 114.58 113.91 1rti h GLU 449 Ca 0.43 0.04 0.00 0.00 0.34 0.00 0.00 59.36 60.18 1rti h GLU 449 Cb 0.47 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1rti h GLU 449 CO -0.19 -0.43 -0.14 0.25 -1.16 0.00 0.00 179.01 177.34 1rti n THR 450 N -5.23 0.02 -3.82 1.13 -2.24 -1.18 -4.94 114.28 98.02 1rti n THR 450 Ca -0.09 -0.01 -0.28 0.00 -2.27 0.00 0.00 64.05 61.40 1rti n THR 450 Cb 0.27 -0.30 0.04 0.00 -2.10 0.00 0.00 70.33 68.25 1rti n THR 450 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1rti n LYS 451 N -1.52 -6.20 -4.94 -0.78 5.02 0.14 -4.68 118.16 105.19 1rti n LYS 451 Ca 0.07 0.66 -0.32 0.00 -2.02 0.00 0.00 58.31 56.70 1rti n LYS 451 Cb 0.34 -5.59 -0.17 0.00 -0.02 0.00 0.00 35.03 29.59 1rti n LYS 451 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1rti s LEU 452 N -7.27 2.13 0.00 -0.35 1.98 -1.23 -0.61 118.68 113.33 1rti s LEU 452 Ca 0.62 -0.57 0.06 0.00 -2.89 0.00 0.00 54.13 51.35 1rti s LEU 452 Cb -0.30 -1.44 -0.02 0.00 0.66 0.00 0.00 46.19 45.09 1rti s LEU 452 CO 0.80 0.12 0.23 0.61 -1.89 0.00 0.00 176.35 176.22 1rti n GLY 453 N 3.79 3.11 2.89 7.98 0.00 -0.03 -0.60 105.19 122.32 1rti n GLY 453 Ca -0.19 -1.86 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 1rti n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rti s LYS 454 N -3.12 0.04 -0.00 1.61 1.02 0.18 -0.09 119.74 119.38 1rti s LYS 454 Ca 0.33 0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.43 1rti s LYS 454 Cb 0.02 -0.04 -0.00 0.00 -0.52 0.00 0.00 37.83 37.28 1rti s LYS 454 CO 0.23 -0.05 -0.00 0.00 -0.92 0.00 0.00 175.35 174.61 1rti s ALA 455 N 0.32 0.03 0.00 5.17 0.00 -0.62 -1.41 121.76 125.25 1rti s ALA 455 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1rti s ALA 455 Cb -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.08 1rti s ALA 455 CO -0.01 0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.17 1rti n GLY 456 N 3.08 2.12 3.81 0.00 0.00 -1.00 0.19 105.19 113.38 1rti n GLY 456 Ca -0.12 -0.69 -0.04 0.00 0.00 0.00 0.00 46.02 45.17 1rti n GLY 456 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1rti s TYR 457 N -2.59 -0.02 -0.18 1.61 -0.85 -0.48 -3.14 117.35 111.69 1rti s TYR 457 Ca 0.00 -0.37 -0.18 0.00 -0.52 0.00 0.00 57.07 56.00 1rti s TYR 457 Cb 0.00 0.69 0.05 0.00 0.38 0.00 0.00 41.96 43.08 1rti s TYR 457 CO 0.00 -0.96 0.51 0.54 -1.52 0.00 0.00 175.55 174.12 1rti s VAL 458 N -2.75 0.00 0.29 -3.49 0.11 -1.16 -1.98 120.40 111.42 1rti s VAL 458 Ca 0.16 -0.03 0.10 0.00 -2.93 0.00 0.00 61.98 59.29 1rti s VAL 458 Cb -0.02 -0.73 -0.05 0.00 -1.53 0.00 0.00 36.38 34.05 1rti s VAL 458 CO 0.05 -0.02 -0.09 0.42 -3.33 0.00 0.00 175.10 172.13 1rti s THR 459 N 0.10 2.77 -0.51 5.04 -4.23 0.37 -0.95 115.64 118.23 1rti s THR 459 Ca -0.01 -2.16 0.21 0.00 -1.18 0.00 0.00 61.69 58.55 1rti s THR 459 Cb -0.03 -2.59 0.22 0.00 1.34 0.00 0.00 72.50 71.43 1rti s THR 459 CO 0.01 -0.33 1.65 -0.46 -0.54 0.00 0.00 174.62 174.95 1rti n ASN 460 N -0.78 0.55 -0.70 3.99 6.94 -1.06 -1.41 115.26 122.78 1rti n ASN 460 Ca -0.05 0.66 0.09 0.00 -0.02 0.00 0.00 54.58 55.26 1rti n ASN 460 Cb 0.60 -0.77 0.28 0.00 -2.36 0.00 0.00 39.78 37.54 1rti n ASN 460 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1rti n ARG 461 N -2.13 1.91 0.00 -3.83 1.74 -1.26 -4.94 116.66 108.14 1rti n ARG 461 Ca 0.02 -1.38 0.00 0.00 -0.77 0.00 0.00 57.85 55.71 1rti n ARG 461 Cb 0.18 -1.38 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1rti n ARG 461 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rti n GLY 462 N 1.18 2.90 3.68 -0.13 0.00 -0.50 -5.04 105.19 107.28 1rti n GLY 462 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1rti n GLY 462 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1rti n ARG 463 N -0.08 1.17 -3.63 1.61 0.63 -1.26 -4.68 116.66 110.42 1rti n ARG 463 Ca 0.00 0.45 -0.10 0.00 -0.92 0.00 0.00 57.85 57.27 1rti n ARG 463 Cb 0.00 -2.37 -0.03 0.00 0.45 0.00 0.00 32.46 30.51 1rti n ARG 463 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 1rti s GLN 464 N -2.94 1.34 0.06 -0.14 -2.07 -1.26 -0.48 119.66 114.17 1rti s GLN 464 Ca 0.76 -0.73 -0.28 0.00 -1.82 0.00 0.00 55.36 53.30 1rti s GLN 464 Cb -0.41 0.54 0.09 0.00 -1.09 0.00 0.00 33.01 32.14 1rti s GLN 464 CO 0.46 -0.57 1.03 0.21 -1.32 0.00 0.00 175.29 175.09 1rti s LYS 465 N -3.83 0.88 -0.19 9.60 2.20 -0.84 -4.97 119.74 122.59 1rti s LYS 465 Ca 0.06 -0.45 -0.28 0.00 -0.36 0.00 0.00 55.97 54.94 1rti s LYS 465 Cb -0.01 0.33 0.11 0.00 -1.51 0.00 0.00 37.83 36.75 1rti s LYS 465 CO -0.07 -0.40 0.95 0.54 -0.36 0.00 0.00 175.35 176.02 1rti s VAL 466 N -3.01 0.00 -0.02 4.02 0.11 -1.26 -1.39 120.40 118.85 1rti s VAL 466 Ca 0.11 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.16 1rti s VAL 466 Cb -0.00 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 1rti s VAL 466 CO -0.02 0.00 0.00 -0.69 -3.33 0.00 0.00 175.10 171.06 1rti s VAL 467 N -0.61 0.11 -0.13 2.04 1.01 0.13 -4.95 120.40 118.00 1rti s VAL 467 Ca -0.01 0.09 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 1rti s VAL 467 Cb -0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.13 1rti s VAL 467 CO 0.00 0.11 0.62 -0.89 0.00 0.00 0.00 175.10 174.94 1rti s THR 468 N 0.85 5.07 -0.12 3.92 2.01 -1.26 -1.59 115.64 124.53 1rti s THR 468 Ca -0.08 1.22 0.00 0.00 0.31 0.00 0.00 61.69 63.14 1rti s THR 468 Cb -0.11 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.43 1rti s THR 468 CO -0.02 0.21 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.24 1rti s LEU 469 N 1.22 2.78 0.35 4.42 1.43 0.87 -4.98 118.68 124.77 1rti s LEU 469 Ca 0.31 -0.28 -0.06 0.00 -1.03 0.00 0.00 54.13 53.07 1rti s LEU 469 Cb -0.16 -1.62 -0.05 0.00 0.03 0.00 0.00 46.19 44.38 1rti s LEU 469 CO 0.13 0.20 0.65 -0.89 0.23 0.00 0.00 176.35 176.67 1rti s THR 470 N 0.15 4.94 -0.41 5.49 2.01 -1.26 -0.85 115.64 125.70 1rti s THR 470 Ca -0.06 0.23 -0.19 0.00 0.31 0.00 0.00 61.69 61.98 1rti s THR 470 Cb -0.15 -3.75 0.03 0.00 0.01 0.00 0.00 72.50 68.64 1rti s THR 470 CO 0.05 -0.45 0.46 -0.67 -0.69 0.00 0.00 174.62 173.31 1rti n ASP 471 N -1.24 -3.72 -3.44 3.53 2.03 -0.34 -4.92 116.55 108.46 1rti n ASP 471 Ca -0.00 -0.32 -0.11 0.00 0.52 0.00 0.00 54.79 54.87 1rti n ASP 471 Cb 0.54 -1.13 -0.03 0.00 -0.72 0.00 0.00 41.12 39.78 1rti n ASP 471 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1rti s THR 472 N -1.61 0.00 0.19 5.18 -1.32 0.22 -5.02 115.64 113.27 1rti s THR 472 Ca 0.18 -1.40 0.09 0.00 -1.21 0.00 0.00 61.69 59.35 1rti s THR 472 Cb -0.02 -2.54 -0.04 0.00 -1.51 0.00 0.00 72.50 68.39 1rti s THR 472 CO 0.63 0.00 -0.18 0.42 -2.21 0.00 0.00 174.62 173.28 1rti s THR 473 N -3.23 1.88 0.31 5.08 -4.23 -1.26 -4.31 115.64 109.88 1rti s THR 473 Ca 0.24 -2.04 0.07 0.00 -1.18 0.00 0.00 61.69 58.79 1rti s THR 473 Cb -0.02 -1.95 0.30 0.00 1.34 0.00 0.00 72.50 72.18 1rti s THR 473 CO 0.14 -0.38 1.72 -1.13 -0.54 0.00 0.00 174.62 174.43 1rti h ASN 474 N 2.99 0.57 0.05 3.99 -1.24 -1.92 0.11 115.58 120.13 1rti h ASN 474 Ca -0.41 0.14 0.02 0.00 0.71 0.00 0.00 56.30 56.76 1rti h ASN 474 Cb 1.21 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 40.30 1rti h ASN 474 CO 0.54 0.08 -0.18 0.06 -1.29 0.00 0.00 177.43 176.64 1rti h GLN 475 N 0.53 -0.31 -0.71 6.67 3.07 -1.96 -0.09 115.11 122.31 1rti h GLN 475 Ca 0.61 0.02 0.01 0.00 0.09 0.00 0.00 58.65 59.39 1rti h GLN 475 Cb 1.15 0.07 -0.04 0.00 0.08 0.00 0.00 27.48 28.74 1rti h GLN 475 CO -0.49 -0.21 0.46 0.87 0.09 0.00 0.00 178.83 179.56 1rti h LYS 476 N -0.32 0.91 0.08 0.06 1.57 -1.45 -1.37 116.57 116.04 1rti h LYS 476 Ca 0.04 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1rti h LYS 476 Cb 0.37 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 1rti h LYS 476 CO -0.13 0.60 -0.22 1.15 -0.57 0.00 0.00 179.45 180.28 1rti h THR 477 N 0.94 0.51 -0.05 -0.16 2.02 -0.54 0.48 112.91 116.10 1rti h THR 477 Ca 0.26 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.46 1rti h THR 477 Cb -0.08 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 1rti h THR 477 CO -0.07 0.00 -0.03 -0.33 0.37 0.00 0.00 175.52 175.46 1rti h GLU 478 N -0.39 -0.04 -0.73 6.66 5.08 -0.76 0.25 114.58 124.66 1rti h GLU 478 Ca 0.04 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.45 1rti h GLU 478 Cb 0.43 0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.63 1rti h GLU 478 CO -0.14 -0.02 0.43 -0.07 -1.00 0.00 0.00 179.01 178.20 1rti h LEU 479 N -0.04 0.66 -1.12 1.33 3.38 -0.95 -0.83 115.31 117.74 1rti h LEU 479 Ca 0.03 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1rti h LEU 479 Cb 0.08 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 1rti h LEU 479 CO -0.07 0.43 0.60 -0.61 0.09 0.00 0.00 178.44 178.88 1rti h GLN 480 N 0.80 1.10 -0.09 1.13 -0.00 0.64 0.13 115.11 118.82 1rti h GLN 480 Ca 0.32 -0.07 0.01 0.00 -0.00 0.00 0.00 58.65 58.92 1rti h GLN 480 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 27.48 27.38 1rti h GLN 480 CO -0.17 0.73 -0.00 0.00 0.00 0.00 0.00 178.83 179.39 1rti h ALA 481 N 1.47 0.07 -0.82 3.38 0.00 0.47 -0.17 119.26 123.66 1rti h ALA 481 Ca 0.36 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 1rti h ALA 481 Cb 0.03 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1rti h ALA 481 CO -0.11 -0.47 0.36 0.82 0.00 0.00 0.00 179.25 179.85 1rti h ILE 482 N 0.02 1.26 0.48 0.00 2.04 -0.69 -1.86 117.51 118.77 1rti h ILE 482 Ca 0.04 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.11 1rti h ILE 482 Cb 0.05 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.37 1rti h ILE 482 CO -0.07 0.32 -0.33 0.22 0.00 0.00 0.00 178.15 178.29 1rti h TYR 483 N 1.18 -0.88 -0.93 1.37 3.20 -0.18 -1.96 116.97 118.76 1rti h TYR 483 Ca 0.28 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.23 1rti h TYR 483 Cb 0.17 0.32 -0.07 0.00 1.54 0.00 0.00 36.73 38.69 1rti h TYR 483 CO 0.02 -0.50 0.57 -0.07 -1.64 0.00 0.00 178.16 176.54 1rti h LEU 484 N -0.79 0.86 -0.62 2.82 3.38 -0.91 -0.62 115.31 119.44 1rti h LEU 484 Ca -0.05 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.04 1rti h LEU 484 Cb 0.66 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1rti h LEU 484 CO 0.03 0.50 0.26 0.00 0.09 0.00 0.00 178.44 179.32 1rti h ALA 485 N 1.47 0.81 -0.23 1.53 0.00 -0.98 -0.95 119.26 120.91 1rti h ALA 485 Ca 0.43 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 55.30 1rti h ALA 485 Cb 0.33 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1rti h ALA 485 CO -0.23 -0.15 -0.32 -0.07 0.00 0.00 0.00 179.25 178.49 1rti h LEU 486 N 0.46 0.49 0.15 0.00 3.38 -0.40 -2.05 115.31 117.34 1rti h LEU 486 Ca 0.30 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1rti h LEU 486 Cb 0.34 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1rti h LEU 486 CO -0.28 0.79 -0.07 1.56 0.09 0.00 0.00 178.44 180.53 1rti h GLN 487 N 0.41 -0.20 -0.02 1.13 4.20 0.10 -3.22 115.11 117.51 1rti h GLN 487 Ca 0.05 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1rti h GLN 487 Cb 0.77 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.59 1rti h GLN 487 CO 0.06 -0.06 -0.06 -0.25 -0.67 0.00 0.00 178.83 177.85 1rti n ASP 488 N -5.14 1.86 0.00 1.46 8.00 -0.89 -4.73 116.55 117.12 1rti n ASP 488 Ca -0.09 -1.56 0.00 0.00 0.71 0.00 0.00 54.79 53.86 1rti n ASP 488 Cb 0.14 0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 1rti n ASP 488 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1rti n SER 489 N 0.37 0.00 0.00 -2.24 3.41 -0.77 -5.09 113.62 109.30 1rti n SER 489 Ca 0.16 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1rti n SER 489 Cb 0.42 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 1rti n SER 489 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rti n GLY 490 N 0.14 0.25 0.33 5.00 0.00 -1.26 -4.93 105.19 104.73 1rti n GLY 490 Ca 0.00 -1.82 0.12 0.00 0.00 0.00 0.00 46.02 44.32 1rti n GLY 490 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rti h LEU 491 N 0.00 0.20 -7.94 0.99 4.07 -1.96 -3.39 115.31 107.28 1rti h LEU 491 Ca 0.00 0.00 -0.57 0.00 0.08 0.00 0.00 57.88 57.39 1rti h LEU 491 Cb 0.00 -0.04 -0.35 0.00 1.08 0.00 0.00 40.66 41.35 1rti h LEU 491 CO 0.00 0.13 -0.83 -1.61 -1.08 0.00 0.00 178.44 175.05 1rti s GLU 492 N -5.23 2.09 0.02 1.13 2.02 -1.26 -1.80 118.70 115.68 1rti s GLU 492 Ca -0.06 -0.50 -0.00 0.00 0.02 0.00 0.00 54.97 54.42 1rti s GLU 492 Cb 0.19 -1.85 -0.02 0.00 0.10 0.00 0.00 34.13 32.55 1rti s GLU 492 CO 0.72 -0.12 -0.03 0.08 0.02 0.00 0.00 175.26 175.93 1rti s VAL 493 N 1.17 0.13 -0.13 2.63 1.01 -0.10 -4.20 120.40 120.90 1rti s VAL 493 Ca -0.03 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 60.97 1rti s VAL 493 Cb -0.14 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 35.87 1rti s VAL 493 CO -0.04 -0.55 -0.20 0.20 0.00 0.00 0.00 175.10 174.52 1rti s ASN 494 N -1.60 2.91 -0.10 3.32 0.01 -0.75 -1.24 114.94 117.49 1rti s ASN 494 Ca -0.14 -0.55 0.00 0.00 -0.71 0.00 0.00 52.86 51.46 1rti s ASN 494 Cb -0.08 -1.34 0.02 0.00 0.41 0.00 0.00 41.25 40.26 1rti s ASN 494 CO -0.02 0.06 -0.09 -0.63 -1.51 0.00 0.00 177.10 174.91 1rti s ILE 495 N 0.87 1.08 -0.13 0.60 1.01 -0.18 -0.45 121.20 124.00 1rti s ILE 495 Ca -0.07 -0.35 -0.03 0.00 0.00 0.00 0.00 60.65 60.20 1rti s ILE 495 Cb -0.15 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.22 1rti s ILE 495 CO -0.02 0.37 -0.03 0.54 0.00 0.00 0.00 174.94 175.80 1rti s VAL 496 N 1.44 4.02 0.07 2.92 0.11 -0.64 -0.61 120.40 127.71 1rti s VAL 496 Ca 0.00 -0.33 -0.13 0.00 -2.93 0.00 0.00 61.98 58.60 1rti s VAL 496 Cb -0.13 -2.73 0.02 0.00 -1.53 0.00 0.00 36.38 32.00 1rti s VAL 496 CO -0.06 0.53 0.29 0.28 -3.33 0.00 0.00 175.10 172.82 1rti s THR 497 N -0.04 0.10 -1.97 5.04 -1.32 -0.22 -1.35 115.64 115.87 1rti s THR 497 Ca 0.02 -0.79 0.21 0.00 -1.21 0.00 0.00 61.69 59.92 1rti s THR 497 Cb -0.13 -1.09 0.53 0.00 -1.51 0.00 0.00 72.50 70.30 1rti s THR 497 CO 0.02 -0.43 1.45 -0.90 -2.21 0.00 0.00 174.62 172.55 1rti n ASP 498 N 0.25 3.64 -4.72 8.08 5.75 -1.26 -2.03 116.55 126.27 1rti n ASP 498 Ca -0.17 -1.98 -0.42 0.00 -0.01 0.00 0.00 54.79 52.21 1rti n ASP 498 Cb 0.61 -0.38 -0.03 0.00 -1.03 0.00 0.00 41.12 40.29 1rti n ASP 498 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1rti s SER 499 N -1.14 6.94 0.15 -1.12 0.15 -1.26 -4.61 113.70 112.81 1rti s SER 499 Ca 0.42 2.20 -0.12 0.00 0.70 0.00 0.00 55.95 59.16 1rti s SER 499 Cb 0.23 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 1rti s SER 499 CO 0.30 -0.56 1.56 1.56 1.20 0.00 0.00 173.24 177.31 1rti h GLN 500 N 6.62 0.91 -0.68 5.44 1.08 -1.98 -2.84 115.11 123.66 1rti h GLN 500 Ca -0.42 -0.34 0.01 0.00 -1.45 0.00 0.00 58.65 56.45 1rti h GLN 500 Cb 1.21 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.55 1rti h GLN 500 CO 0.83 0.99 0.45 -0.92 -0.95 0.00 0.00 178.83 179.23 1rti h TYR 501 N 0.76 0.85 -0.95 2.96 5.03 -1.99 -1.20 116.97 122.42 1rti h TYR 501 Ca 0.12 0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.54 1rti h TYR 501 Cb 0.65 -0.28 -0.07 0.00 1.55 0.00 0.00 36.73 38.57 1rti h TYR 501 CO 0.05 0.53 0.61 0.00 -1.32 0.00 0.00 178.16 178.02 1rti h ALA 502 N 1.25 1.53 -0.92 1.82 0.00 -1.93 0.21 119.26 121.22 1rti h ALA 502 Ca 0.25 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.23 1rti h ALA 502 Cb -0.09 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.40 1rti h ALA 502 CO -0.06 0.29 0.60 1.25 0.00 0.00 0.00 179.25 181.33 1rti h LEU 503 N 1.01 0.92 -0.53 0.00 5.85 -1.00 0.40 115.31 121.97 1rti h LEU 503 Ca 0.43 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 59.11 1rti h LEU 503 Cb 0.33 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1rti h LEU 503 CO -0.19 0.58 0.13 1.23 -0.34 0.00 0.00 178.44 179.84 1rti h GLY 504 N 1.04 0.91 1.78 3.75 0.00 -0.24 -0.88 103.07 109.43 1rti h GLY 504 Ca 0.40 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 1rti h GLY 504 CO -0.16 0.53 0.05 -2.22 0.00 0.00 0.00 176.54 174.74 1rti h ILE 505 N 0.74 1.11 -0.02 2.60 2.04 -0.17 -0.68 117.51 123.13 1rti h ILE 505 Ca 0.16 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1rti h ILE 505 Cb 0.34 0.90 -0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1rti h ILE 505 CO 0.00 0.13 -0.01 0.40 0.00 0.00 0.00 178.15 178.67 1rti h ILE 506 N 0.29 1.35 0.00 -0.67 2.04 -0.18 0.47 117.51 120.81 1rti h ILE 506 Ca 0.07 -1.04 -0.07 0.00 1.00 0.00 0.00 64.86 64.82 1rti h ILE 506 Cb 0.12 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 1rti h ILE 506 CO -0.00 0.27 -0.33 -0.61 0.00 0.00 0.00 178.15 177.49 1rti h GLN 507 N -0.39 0.00 0.00 2.37 4.15 -0.73 -3.35 115.11 117.16 1rti h GLN 507 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 1rti h GLN 507 Cb 0.45 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 1rti h GLN 507 CO 0.00 0.33 -1.16 0.00 -1.93 0.00 0.00 178.83 176.07 1rti n ALA 508 N -2.34 1.94 -3.80 3.38 0.00 -0.30 -4.46 120.51 114.92 1rti n ALA 508 Ca -0.01 -0.15 -0.28 0.00 0.00 0.00 0.00 53.44 53.00 1rti n ALA 508 Cb 0.43 0.24 0.01 0.00 0.00 0.00 0.00 19.45 20.12 1rti n ALA 508 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rti n GLN 509 N -2.17 -1.21 -2.18 0.00 10.64 0.17 -4.93 117.38 117.70 1rti n GLN 509 Ca -0.04 0.63 -0.33 0.00 -1.83 0.00 0.00 57.00 55.43 1rti n GLN 509 Cb 0.57 -2.67 0.00 0.00 -0.86 0.00 0.00 30.24 27.28 1rti n GLN 509 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1rti s PRO 510 N -5.45 3.39 -0.25 2.61 0.04 -1.26 -4.93 135.00 129.14 1rti s PRO 510 Ca 0.14 1.34 0.12 0.00 0.04 0.00 0.00 61.00 62.63 1rti s PRO 510 Cb -0.07 -2.03 0.50 0.00 0.04 0.00 0.00 34.50 32.94 1rti s PRO 510 CO 0.90 -0.77 1.44 -0.40 0.04 0.00 0.00 177.00 178.21 1rti n ASP 511 N -1.68 2.87 -3.64 6.66 5.68 -0.59 -4.95 116.55 120.90 1rti n ASP 511 Ca 0.10 -3.53 -0.03 0.00 -0.50 0.00 0.00 54.79 50.83 1rti n ASP 511 Cb 0.52 -0.60 -0.05 0.00 -1.14 0.00 0.00 41.12 39.85 1rti n ASP 511 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1rti s GLN 512 N -3.11 0.10 0.10 0.11 -2.07 -1.14 -4.93 119.66 108.72 1rti s GLN 512 Ca 0.43 0.06 -0.26 0.00 -1.82 0.00 0.00 55.36 53.78 1rti s GLN 512 Cb 0.38 0.05 0.08 0.00 -1.09 0.00 0.00 33.01 32.43 1rti s GLN 512 CO 0.03 -0.02 0.82 0.45 -1.32 0.00 0.00 175.29 175.24 1rti s SER 513 N -0.58 -0.36 0.10 12.60 0.15 -1.26 -2.22 113.70 122.14 1rti s SER 513 Ca 0.08 -0.17 -0.12 0.00 0.70 0.00 0.00 55.95 56.44 1rti s SER 513 Cb -0.03 0.50 -0.15 0.00 -1.71 0.00 0.00 66.02 64.63 1rti s SER 513 CO -0.10 -0.85 1.29 1.05 1.20 0.00 0.00 173.24 175.83 1rti h GLU 514 N 2.00 0.75 -6.28 5.44 -0.00 -1.41 -3.44 114.58 111.64 1rti h GLU 514 Ca -0.25 -0.64 -0.57 0.00 -0.00 0.00 0.00 59.36 57.89 1rti h GLU 514 Cb 1.26 0.15 -0.03 0.00 -0.00 0.00 0.00 28.75 30.13 1rti h GLU 514 CO 0.30 1.25 1.23 0.45 -0.00 0.00 0.00 179.01 182.24 1rti s SER 515 N -7.14 6.08 0.35 3.06 0.15 -1.26 -4.85 113.70 110.09 1rti s SER 515 Ca -0.10 1.47 0.12 0.00 0.70 0.00 0.00 55.95 58.14 1rti s SER 515 Cb 0.08 -2.53 0.90 0.00 -1.71 0.00 0.00 66.02 62.77 1rti s SER 515 CO 0.90 -1.53 1.80 -0.08 1.20 0.00 0.00 173.24 175.53 1rti h GLU 516 N 12.07 0.58 -0.38 5.44 4.57 -1.99 0.61 114.58 135.48 1rti h GLU 516 Ca -0.34 -0.03 0.04 0.00 -1.18 0.00 0.00 59.36 57.84 1rti h GLU 516 Cb 1.17 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 29.59 1rti h GLU 516 CO 1.02 0.38 0.17 1.25 -1.18 0.00 0.00 179.01 180.65 1rti h LEU 517 N 0.60 0.22 -0.64 1.64 6.46 -1.97 0.10 115.31 121.72 1rti h LEU 517 Ca 0.55 0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 58.30 1rti h LEU 517 Cb 1.08 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.97 1rti h LEU 517 CO -0.30 0.17 0.27 0.58 -0.62 0.00 0.00 178.44 178.53 1rti h VAL 518 N 0.35 1.23 -0.98 1.05 2.07 -1.31 -1.28 116.25 117.37 1rti h VAL 518 Ca 0.17 -0.70 0.06 0.00 0.82 0.00 0.00 66.70 67.05 1rti h VAL 518 Cb 0.11 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 30.31 1rti h VAL 518 CO -0.14 0.28 0.63 0.78 0.02 0.00 0.00 177.57 179.14 1rti h ASN 519 N 0.90 1.02 0.22 0.57 2.35 -0.20 0.31 115.58 120.74 1rti h ASN 519 Ca 0.22 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.96 1rti h ASN 519 Cb 0.18 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.35 1rti h ASN 519 CO -0.02 0.65 -0.11 1.56 -1.65 0.00 0.00 177.43 177.86 1rti h GLN 520 N 1.15 -0.29 -0.88 0.81 1.08 -0.11 -0.74 115.11 116.14 1rti h GLN 520 Ca 0.42 0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.74 1rti h GLN 520 Cb 0.16 0.07 -0.07 0.00 -0.05 0.00 0.00 27.48 27.58 1rti h GLN 520 CO -0.17 -0.18 0.53 0.82 -0.95 0.00 0.00 178.83 178.88 1rti h ILE 521 N -0.32 0.94 0.24 2.54 2.04 -0.09 -0.29 117.51 122.57 1rti h ILE 521 Ca -0.03 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.51 1rti h ILE 521 Cb 0.24 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1rti h ILE 521 CO 0.05 0.16 -0.11 0.40 0.00 0.00 0.00 178.15 178.65 1rti h ILE 522 N 0.89 0.80 -0.85 -0.67 2.04 -0.03 0.26 117.51 119.95 1rti h ILE 522 Ca 0.42 -0.21 0.09 0.00 1.00 0.00 0.00 64.86 66.16 1rti h ILE 522 Cb 0.35 0.93 -0.06 0.00 -0.74 0.00 0.00 36.82 37.30 1rti h ILE 522 CO -0.24 0.05 0.55 -0.33 0.00 0.00 0.00 178.15 178.18 1rti h GLU 523 N -0.42 0.83 -0.34 2.37 4.39 -0.62 0.40 114.58 121.20 1rti h GLU 523 Ca -0.03 -0.05 -0.08 0.00 0.34 0.00 0.00 59.36 59.54 1rti h GLU 523 Cb 0.32 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1rti h GLU 523 CO 0.05 0.55 -0.08 0.37 -1.16 0.00 0.00 179.01 178.74 1rti h GLN 524 N 0.86 0.65 -0.58 2.33 5.75 -0.62 -2.87 115.11 120.63 1rti h GLN 524 Ca 0.38 -0.25 -0.03 0.00 -0.15 0.00 0.00 58.65 58.61 1rti h GLN 524 Cb 0.36 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.85 1rti h GLN 524 CO -0.15 0.82 0.25 -0.07 -2.65 0.00 0.00 178.83 177.03 1rti h LEU 525 N 0.43 0.74 -1.43 -2.39 3.38 0.11 -2.22 115.31 113.94 1rti h LEU 525 Ca 0.08 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1rti h LEU 525 Cb 0.58 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1rti h LEU 525 CO 0.03 0.65 -0.27 0.40 0.09 0.00 0.00 178.44 179.34 1rti h ILE 526 N 0.82 0.97 -0.22 1.22 2.04 -0.86 -3.01 117.51 118.47 1rti h ILE 526 Ca 0.20 -1.03 -0.18 0.00 1.00 0.00 0.00 64.86 64.85 1rti h ILE 526 Cb 0.13 1.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1rti h ILE 526 CO -0.02 0.27 -0.60 0.11 0.00 0.00 0.00 178.15 177.91 1rti h LYS 527 N 0.00 0.72 -7.02 2.37 1.57 -1.18 -3.46 116.57 109.57 1rti h LYS 527 Ca -0.00 -0.48 -0.50 0.00 -1.87 0.00 0.00 60.65 57.79 1rti h LYS 527 Cb 0.57 0.07 0.06 0.00 0.08 0.00 0.00 32.23 33.01 1rti h LYS 527 CO 0.04 1.10 0.47 0.15 -0.57 0.00 0.00 179.45 180.64 1rti s LYS 528 N -3.99 3.68 0.11 3.15 -0.14 -1.14 -4.97 119.74 116.45 1rti s LYS 528 Ca -0.09 1.72 0.22 0.00 -1.36 0.00 0.00 55.97 56.47 1rti s LYS 528 Cb 0.10 -2.32 -0.09 0.00 -1.68 0.00 0.00 37.83 33.85 1rti s LYS 528 CO 0.87 -0.60 0.88 -0.85 -0.76 0.00 0.00 175.35 174.89 1rti n GLU 529 N -0.66 0.57 -3.52 1.68 0.28 -0.74 -4.84 120.64 113.40 1rti n GLU 529 Ca 0.08 0.01 -0.09 0.00 -0.16 0.00 0.00 57.16 57.00 1rti n GLU 529 Cb 0.49 -1.71 -0.09 0.00 1.43 0.00 0.00 31.44 31.56 1rti n GLU 529 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1rti s LYS 530 N -3.38 0.32 -0.05 3.44 1.02 -0.93 -5.03 119.74 115.13 1rti s LYS 530 Ca -0.02 0.80 -0.00 0.00 0.02 0.00 0.00 55.97 56.77 1rti s LYS 530 Cb 0.12 -0.03 0.03 0.00 -0.52 0.00 0.00 37.83 37.42 1rti s LYS 530 CO 0.83 -0.42 -0.01 0.08 -0.92 0.00 0.00 175.35 174.90 1rti s VAL 531 N 2.57 0.36 -0.24 3.17 1.01 -1.26 -0.92 120.40 125.09 1rti s VAL 531 Ca 0.05 0.04 -0.00 0.00 0.00 0.00 0.00 61.98 62.06 1rti s VAL 531 Cb -0.13 -0.46 0.03 0.00 0.00 0.00 0.00 36.38 35.82 1rti s VAL 531 CO -0.14 0.21 -0.10 -0.47 0.00 0.00 0.00 175.10 174.61 1rti s TYR 532 N 1.34 3.06 -0.22 5.22 5.04 -0.37 -0.77 117.35 130.65 1rti s TYR 532 Ca -0.05 -1.76 -0.09 0.00 -2.44 0.00 0.00 57.07 52.73 1rti s TYR 532 Cb -0.13 -2.00 -0.05 0.00 0.35 0.00 0.00 41.96 40.13 1rti s TYR 532 CO -0.02 -0.78 0.12 -1.17 -1.34 0.00 0.00 175.55 172.36 1rti s LEU 533 N 1.26 3.98 0.05 6.97 2.96 -1.26 -1.02 118.68 131.63 1rti s LEU 533 Ca -0.01 0.09 0.06 0.00 -0.22 0.00 0.00 54.13 54.05 1rti s LEU 533 Cb -0.17 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.45 1rti s LEU 533 CO -0.06 0.10 -0.18 0.00 -1.32 0.00 0.00 176.35 174.89 1rti s ALA 534 N 0.83 1.50 0.11 5.97 0.00 0.22 -4.98 121.76 125.41 1rti s ALA 534 Ca 0.06 -0.97 0.10 0.00 0.00 0.00 0.00 51.96 51.15 1rti s ALA 534 Cb -0.13 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.69 1rti s ALA 534 CO 0.02 0.31 -0.22 -0.46 0.00 0.00 0.00 175.76 175.41 1rti s TRP 535 N -0.85 2.43 0.03 0.00 -0.00 -1.26 -1.06 118.94 118.23 1rti s TRP 535 Ca 0.05 -0.32 -0.01 0.00 -0.00 0.00 0.00 56.10 55.82 1rti s TRP 535 Cb -0.08 -1.32 -0.02 0.00 -0.00 0.00 0.00 33.47 32.04 1rti s TRP 535 CO 0.02 0.33 -0.02 0.14 -0.00 0.00 0.00 176.95 177.42 1rti s VAL 536 N -1.06 0.13 -0.01 5.86 -7.23 -0.86 -4.92 120.40 112.32 1rti s VAL 536 Ca 0.16 -1.09 -0.36 0.00 -1.81 0.00 0.00 61.98 58.87 1rti s VAL 536 Cb -0.10 -0.54 -0.14 0.00 0.56 0.00 0.00 36.38 36.15 1rti s VAL 536 CO 0.07 -0.60 1.62 -2.65 -0.31 0.00 0.00 175.10 173.24 1rti n PRO 537 N 1.26 1.69 -2.06 4.82 -0.02 -1.26 -4.19 135.00 135.25 1rti n PRO 537 Ca -0.22 0.62 -0.34 0.00 -2.02 0.00 0.00 63.50 61.53 1rti n PRO 537 Cb 0.56 -2.35 0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1rti n PRO 537 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rti s ALA 538 N 2.11 2.60 -0.03 3.55 0.00 -1.26 -3.26 121.76 125.46 1rti s ALA 538 Ca 0.88 0.76 0.00 0.00 0.00 0.00 0.00 51.96 53.59 1rti s ALA 538 Cb -0.83 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1rti s ALA 538 CO 0.49 -0.99 0.00 0.72 0.00 0.00 0.00 175.76 175.98 1rti n HIS 539 N -1.71 0.00 -1.72 0.00 8.25 -1.26 -4.98 115.22 113.80 1rti n HIS 539 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 1rti n HIS 539 Cb 0.51 -1.47 0.00 0.00 1.12 0.00 0.00 29.99 30.15 1rti n HIS 539 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1rti n LYS 540 N -0.16 2.34 0.00 -0.41 4.01 -1.20 -5.03 118.16 117.71 1rti n LYS 540 Ca -0.00 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.92 1rti n LYS 540 Cb 0.36 0.00 0.28 0.00 -0.51 0.00 0.00 35.03 35.16 1rti n LYS 540 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1rti n GLY 541 N 5.00 -0.77 3.62 0.72 0.00 -1.26 -4.91 105.19 107.59 1rti n GLY 541 Ca 0.00 -0.42 -0.43 0.00 0.00 0.00 0.00 46.02 45.17 1rti n GLY 541 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rti s ILE 542 N -2.68 3.15 0.00 -0.61 1.09 -1.26 -5.23 121.20 115.66 1rti s ILE 542 Ca 0.19 0.17 0.00 0.00 -1.10 0.00 0.00 60.65 59.90 1rti s ILE 542 Cb 0.18 -3.18 0.00 0.00 -1.06 0.00 0.00 42.46 38.41 1rti s ILE 542 CO 0.60 -0.09 0.00 0.61 -0.10 0.00 0.00 174.94 175.96