#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fxo s ARG 3 N 0.00 3.62 0.04 1.64 3.52 -1.26 -2.33 118.95 124.19 1fxo s ARG 3 Ca 0.00 -0.54 -0.01 0.00 -0.13 0.00 0.00 55.73 55.05 1fxo s ARG 3 Cb 0.00 -2.91 -0.04 0.00 -1.56 0.00 0.00 34.95 30.44 1fxo s ARG 3 CO 0.00 0.19 0.19 0.15 -0.81 0.00 0.00 175.30 175.02 1fxo s LYS 4 N 0.48 3.40 0.18 5.12 1.02 -0.50 -4.66 119.74 124.78 1fxo s LYS 4 Ca -0.04 -0.42 0.07 0.00 0.02 0.00 0.00 55.97 55.60 1fxo s LYS 4 Cb -0.14 -3.03 -0.04 0.00 -0.52 0.00 0.00 37.83 34.09 1fxo s LYS 4 CO 0.03 0.63 0.05 0.20 -0.92 0.00 0.00 175.35 175.34 1fxo s GLY 5 N -2.31 1.71 -0.03 -3.33 0.00 -0.32 -0.96 107.32 102.08 1fxo s GLY 5 Ca 0.32 -1.34 0.01 0.00 0.00 0.00 0.00 44.72 43.71 1fxo s GLY 5 CO 0.24 -1.35 -0.03 -0.42 0.00 0.00 0.00 173.10 171.54 1fxo s ILE 6 N -1.78 0.38 -0.29 0.90 1.01 0.76 -0.50 121.20 121.68 1fxo s ILE 6 Ca 0.29 -0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.84 1fxo s ILE 6 Cb -0.09 -0.42 0.02 0.00 0.01 0.00 0.00 42.46 41.97 1fxo s ILE 6 CO 0.20 0.18 0.04 -0.63 0.00 0.00 0.00 174.94 174.74 1fxo s ILE 7 N 0.85 3.66 -0.51 2.92 1.01 0.29 -0.83 121.20 128.59 1fxo s ILE 7 Ca -0.10 -0.82 -0.20 0.00 0.00 0.00 0.00 60.65 59.53 1fxo s ILE 7 Cb -0.13 -2.90 0.05 0.00 0.01 0.00 0.00 42.46 39.49 1fxo s ILE 7 CO -0.01 0.09 0.69 -0.22 0.00 0.00 0.00 174.94 175.50 1fxo s LEU 8 N 1.44 4.73 -0.36 2.97 2.96 -0.41 -0.95 118.68 129.07 1fxo s LEU 8 Ca 0.02 -0.72 0.09 0.00 -0.22 0.00 0.00 54.13 53.30 1fxo s LEU 8 Cb -0.17 -2.56 0.45 0.00 0.50 0.00 0.00 46.19 44.41 1fxo s LEU 8 CO 0.01 -0.94 1.11 0.00 -1.32 0.00 0.00 176.35 175.20 1fxo n ALA 9 N 6.44 4.54 -2.46 5.97 0.00 0.29 -0.51 120.51 134.78 1fxo n ALA 9 Ca -0.04 -3.83 0.00 0.00 0.00 0.00 0.00 53.44 49.57 1fxo n ALA 9 Cb 0.46 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.33 1fxo n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fxo n GLY 10 N -0.49 2.04 0.00 0.00 0.00 -1.24 -4.45 105.19 101.05 1fxo n GLY 10 Ca 0.32 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1fxo n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fxo n GLY 11 N 5.00 2.83 0.26 -0.02 0.00 -1.26 -4.90 105.19 107.10 1fxo n GLY 11 Ca 0.00 -1.73 -0.05 0.00 0.00 0.00 0.00 46.02 44.23 1fxo n GLY 11 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1fxo n SER 12 N 0.00 -0.60 0.00 1.61 2.88 -1.26 -4.92 113.62 111.32 1fxo n SER 12 Ca 0.00 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 1fxo n SER 12 Cb 0.00 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 1fxo n SER 12 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1fxo n GLY 13 N -1.19 2.92 0.37 0.46 0.00 -1.26 -4.94 105.19 101.54 1fxo n GLY 13 Ca 0.03 -0.76 0.25 0.00 0.00 0.00 0.00 46.02 45.53 1fxo n GLY 13 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1fxo h THR 14 N 0.00 0.34 -0.94 2.61 2.02 -1.95 -2.62 112.91 112.37 1fxo h THR 14 Ca 0.00 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.07 1fxo h THR 14 Cb 0.00 -0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 66.34 1fxo h THR 14 CO 0.00 0.06 0.61 -0.09 0.37 0.00 0.00 175.52 176.47 1fxo h ARG 15 N 0.33 1.24 -0.62 6.66 2.43 -1.97 -2.77 114.38 119.68 1fxo h ARG 15 Ca 0.71 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.80 1fxo h ARG 15 Cb 1.73 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 31.01 1fxo h ARG 15 CO -0.51 0.83 0.00 1.28 -1.51 0.00 0.00 179.97 180.06 1fxo n LEU 16 N -4.38 5.23 -4.81 3.80 4.77 -0.99 -4.93 117.00 115.68 1fxo n LEU 16 Ca 0.11 -2.65 -0.33 0.00 -0.03 0.00 0.00 56.01 53.11 1fxo n LEU 16 Cb 0.03 -0.64 -0.03 0.00 -2.33 0.00 0.00 43.42 40.44 1fxo n LEU 16 CO 0.37 0.69 0.69 -1.00 -1.33 0.00 0.00 177.39 176.81 1fxo s HIS 17 N -2.35 3.17 -2.19 -1.77 3.76 -1.05 -0.79 115.29 114.08 1fxo s HIS 17 Ca 0.52 1.55 0.29 0.00 -0.15 0.00 0.00 55.06 57.27 1fxo s HIS 17 Cb 0.37 -2.94 1.51 0.00 1.11 0.00 0.00 32.58 32.63 1fxo s HIS 17 CO 0.19 -0.62 2.00 -0.35 -0.85 0.00 0.00 174.74 175.11 1fxo n PRO 18 N -1.26 1.26 -0.13 8.40 -0.04 -1.26 -4.82 135.00 137.15 1fxo n PRO 18 Ca 0.08 -0.38 -0.06 0.00 -0.04 0.00 0.00 63.50 63.09 1fxo n PRO 18 Cb 0.53 -1.48 0.02 0.00 -0.04 0.00 0.00 33.50 32.54 1fxo n PRO 18 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fxo h ALA 19 N 4.10 0.52 -0.24 0.55 0.00 -1.54 -1.96 119.26 120.70 1fxo h ALA 19 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fxo h ALA 19 Cb 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1fxo h ALA 19 CO 0.00 -0.11 0.00 0.25 0.00 0.00 0.00 179.25 179.39 1fxo n THR 20 N -4.88 0.32 0.10 0.00 -2.24 0.03 -3.13 114.28 104.48 1fxo n THR 20 Ca 0.02 -0.32 -0.04 0.00 -2.27 0.00 0.00 64.05 61.44 1fxo n THR 20 Cb 0.08 0.16 0.05 0.00 -2.10 0.00 0.00 70.33 68.52 1fxo n THR 20 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1fxo h LEU 21 N 1.38 0.00 0.01 3.22 3.38 -1.61 -3.32 115.31 118.36 1fxo h LEU 21 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 1fxo h LEU 21 Cb 0.32 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 1fxo h LEU 21 CO 0.00 0.78 -2.24 0.00 0.09 0.00 0.00 178.44 177.07 1fxo n ALA 22 N -2.39 1.46 -3.69 1.53 0.00 -1.18 -4.91 120.51 111.32 1fxo n ALA 22 Ca -0.01 -1.15 -0.21 0.00 0.00 0.00 0.00 53.44 52.08 1fxo n ALA 22 Cb 0.75 -0.34 -0.18 0.00 0.00 0.00 0.00 19.45 19.69 1fxo n ALA 22 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1fxo s ILE 23 N -2.52 0.00 0.64 0.00 1.01 -1.24 -5.14 121.20 113.95 1fxo s ILE 23 Ca -0.13 0.35 -0.18 0.00 0.00 0.00 0.00 60.65 60.70 1fxo s ILE 23 Cb 0.07 -0.24 -0.02 0.00 0.01 0.00 0.00 42.46 42.28 1fxo s ILE 23 CO 0.80 0.20 1.15 -1.54 0.00 0.00 0.00 174.94 175.54 1fxo n SER 24 N 5.23 1.46 -0.29 3.58 3.41 -1.26 -4.16 113.62 121.60 1fxo n SER 24 Ca -0.05 0.81 -0.08 0.00 -0.26 0.00 0.00 58.87 59.29 1fxo n SER 24 Cb 0.50 -1.48 -0.07 0.00 -0.26 0.00 0.00 64.21 62.90 1fxo n SER 24 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1fxo n LYS 25 N -1.58 -0.30 0.19 4.33 4.81 -1.26 -1.28 118.16 123.07 1fxo n LYS 25 Ca 0.15 1.26 0.14 0.00 -0.87 0.00 0.00 58.31 58.99 1fxo n LYS 25 Cb 0.48 -1.87 0.67 0.00 0.02 0.00 0.00 35.03 34.33 1fxo n LYS 25 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 1fxo h GLN 26 N 0.00 0.00 -0.01 1.64 7.50 -1.89 4.17 115.11 126.53 1fxo h GLN 26 Ca 0.11 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.26 1fxo h GLN 26 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.81 1fxo h GLN 26 CO -0.64 0.00 -0.28 1.28 -1.50 0.00 0.00 178.83 177.69 1fxo n LEU 27 N -2.45 1.01 -4.66 1.46 4.77 -0.40 -2.98 117.00 113.75 1fxo n LEU 27 Ca -0.01 -0.26 -0.43 0.00 -0.03 0.00 0.00 56.01 55.29 1fxo n LEU 27 Cb 0.11 -0.13 -0.02 0.00 -2.33 0.00 0.00 43.42 41.06 1fxo n LEU 27 CO 0.15 0.19 0.95 -0.76 -1.33 0.00 0.00 177.39 176.60 1fxo s LEU 28 N -2.53 4.14 0.57 2.23 1.43 1.37 -4.61 118.68 121.28 1fxo s LEU 28 Ca 0.23 1.49 -0.19 0.00 -1.03 0.00 0.00 54.13 54.63 1fxo s LEU 28 Cb 0.19 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 1fxo s LEU 28 CO 0.53 -0.67 1.17 -2.16 0.23 0.00 0.00 176.35 175.45 1fxo s PRO 29 N 3.14 3.17 -0.37 1.29 0.04 -1.26 -3.20 135.00 137.81 1fxo s PRO 29 Ca 0.48 1.71 -0.05 0.00 0.04 0.00 0.00 61.00 63.17 1fxo s PRO 29 Cb -0.17 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.47 1fxo s PRO 29 CO 0.10 -1.02 0.16 0.08 0.04 0.00 0.00 177.00 176.35 1fxo s VAL 30 N -1.70 3.63 0.00 -0.36 1.01 -0.69 -4.79 120.40 117.50 1fxo s VAL 30 Ca 0.75 -1.50 0.00 0.00 0.00 0.00 0.00 61.98 61.23 1fxo s VAL 30 Cb -0.27 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1fxo s VAL 30 CO 0.30 -0.40 0.00 0.00 0.00 0.00 0.00 175.10 175.00 1fxo n TYR 31 N 4.75 0.00 -0.28 5.22 9.36 -1.26 -3.39 117.16 131.55 1fxo n TYR 31 Ca -0.09 0.00 0.04 0.00 3.32 0.00 0.00 57.90 61.17 1fxo n TYR 31 Cb 0.43 0.00 0.11 0.00 -0.63 0.00 0.00 39.34 39.25 1fxo n TYR 31 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1fxo n ASP 32 N 5.31 2.66 -3.45 2.98 5.75 -1.26 -5.01 116.55 123.53 1fxo n ASP 32 Ca 0.00 -2.21 -0.12 0.00 -0.01 0.00 0.00 54.79 52.45 1fxo n ASP 32 Cb 0.00 -0.20 -0.03 0.00 -1.03 0.00 0.00 41.12 39.86 1fxo n ASP 32 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1fxo s LYS 33 N -1.37 1.24 0.42 0.11 -2.85 -1.22 -5.07 119.74 111.00 1fxo s LYS 33 Ca 0.18 -0.45 -0.26 0.00 -1.00 0.00 0.00 55.97 54.44 1fxo s LYS 33 Cb 0.12 0.57 -0.10 0.00 -2.06 0.00 0.00 37.83 36.36 1fxo s LYS 33 CO 0.08 -0.53 1.37 -2.30 0.10 0.00 0.00 175.35 174.08 1fxo n PRO 34 N -0.28 2.20 -0.29 1.78 -0.02 -1.26 -1.70 135.00 135.42 1fxo n PRO 34 Ca -0.17 0.78 0.01 0.00 -2.02 0.00 0.00 63.50 62.09 1fxo n PRO 34 Cb 0.64 -2.53 0.07 0.00 -0.02 0.00 0.00 33.50 31.67 1fxo n PRO 34 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1fxo h MET 35 N 2.34 -0.03 -0.13 -0.52 1.85 -1.64 -0.91 114.93 115.88 1fxo h MET 35 Ca -0.49 0.00 0.04 0.00 -0.61 0.00 0.00 59.70 58.64 1fxo h MET 35 Cb 1.27 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 33.31 1fxo h MET 35 CO 0.61 -0.02 0.20 0.97 -0.40 0.00 0.00 176.91 178.27 1fxo h ILE 36 N -0.04 0.32 -0.28 1.77 2.10 -1.74 -1.70 117.51 117.95 1fxo h ILE 36 Ca 0.36 0.00 -0.00 0.00 1.08 0.00 0.00 64.86 66.29 1fxo h ILE 36 Cb 0.60 0.83 -0.01 0.00 -1.09 0.00 0.00 36.82 37.14 1fxo h ILE 36 CO -0.85 0.00 0.16 1.88 -1.08 0.00 0.00 178.15 178.26 1fxo h TYR 37 N 0.00 0.35 0.61 2.19 -1.99 -1.50 -1.35 116.97 115.28 1fxo h TYR 37 Ca 0.06 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.77 1fxo h TYR 37 Cb 0.47 -0.12 0.01 0.00 2.00 0.00 0.00 36.73 39.08 1fxo h TYR 37 CO 0.00 0.24 -0.29 1.88 -0.00 0.00 0.00 178.16 179.99 1fxo h TYR 38 N 0.38 -0.76 -0.02 4.88 -1.99 -1.45 0.74 116.97 118.76 1fxo h TYR 38 Ca 0.10 -0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.79 1fxo h TYR 38 Cb -0.01 0.25 -0.00 0.00 2.00 0.00 0.00 36.73 38.97 1fxo h TYR 38 CO 0.00 -0.47 -0.11 -1.00 -0.00 0.00 0.00 178.16 176.58 1fxo h PRO 39 N -1.13 0.02 -0.37 4.88 0.13 -1.63 -1.73 132.00 132.18 1fxo h PRO 39 Ca -0.08 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.04 1fxo h PRO 39 Cb 0.62 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.73 1fxo h PRO 39 CO 0.14 0.14 0.20 1.25 -0.23 0.00 0.00 178.00 179.50 1fxo h LEU 40 N 0.02 0.46 -1.43 1.56 5.85 -1.19 -1.76 115.31 118.82 1fxo h LEU 40 Ca 0.00 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1fxo h LEU 40 Cb 0.22 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1fxo h LEU 40 CO 0.02 0.41 0.44 0.28 -0.34 0.00 0.00 178.44 179.25 1fxo h SER 41 N 0.47 0.62 -0.27 1.25 0.02 -0.34 -1.15 113.55 114.15 1fxo h SER 41 Ca 0.13 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1fxo h SER 41 Cb 0.06 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1fxo h SER 41 CO -0.02 0.41 0.13 0.74 -1.14 0.00 0.00 176.83 176.96 1fxo h THR 42 N 0.72 1.15 -0.86 -2.27 2.02 -0.48 0.10 112.91 113.29 1fxo h THR 42 Ca 0.28 -0.41 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1fxo h THR 42 Cb 0.20 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.49 1fxo h THR 42 CO -0.09 0.15 0.51 -0.07 0.37 0.00 0.00 175.52 176.39 1fxo h LEU 43 N 0.31 1.04 -0.62 2.58 3.38 -0.81 -2.14 115.31 119.05 1fxo h LEU 43 Ca 0.09 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1fxo h LEU 43 Cb 0.11 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1fxo h LEU 43 CO -0.01 0.81 0.27 0.24 0.09 0.00 0.00 178.44 179.84 1fxo h MET 44 N 1.19 0.91 0.00 1.13 2.86 -0.84 -1.30 114.93 118.88 1fxo h MET 44 Ca 0.31 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 1fxo h MET 44 Cb -0.03 -0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.47 1fxo h MET 44 CO -0.06 0.76 -0.11 -0.07 1.06 0.00 0.00 176.91 178.50 1fxo h LEU 45 N 0.86 0.00 -0.31 1.22 3.38 -0.50 0.11 115.31 120.07 1fxo h LEU 45 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1fxo h LEU 45 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1fxo h LEU 45 CO -0.02 0.11 -0.02 0.00 0.09 0.00 0.00 178.44 178.60 1fxo n ALA 46 N -2.22 2.66 -0.56 1.53 0.00 -0.67 -4.86 120.51 116.40 1fxo n ALA 46 Ca -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.15 1fxo n ALA 46 Cb 0.26 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1fxo n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fxo n GLY 47 N 1.10 0.69 3.68 0.00 0.00 0.39 -4.90 105.19 106.15 1fxo n GLY 47 Ca 0.21 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 1fxo n GLY 47 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fxo s ILE 48 N -2.00 5.19 -0.01 -0.61 1.01 -0.58 -4.95 121.20 119.25 1fxo s ILE 48 Ca 0.00 0.74 0.08 0.00 0.00 0.00 0.00 60.65 61.47 1fxo s ILE 48 Cb 0.00 -3.74 -0.12 0.00 0.01 0.00 0.00 42.46 38.61 1fxo s ILE 48 CO 0.00 0.26 0.16 0.54 0.00 0.00 0.00 174.94 175.90 1fxo n ARG 49 N 4.39 0.24 -3.72 2.79 1.74 -1.26 -3.98 116.66 116.86 1fxo n ARG 49 Ca -0.08 -0.07 -0.38 0.00 -0.77 0.00 0.00 57.85 56.55 1fxo n ARG 49 Cb 0.51 -1.18 -0.12 0.00 -1.02 0.00 0.00 32.46 30.65 1fxo n ARG 49 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1fxo s GLU 50 N -2.52 3.03 -0.04 5.56 2.12 -1.26 -0.62 118.70 124.98 1fxo s GLU 50 Ca -0.03 -0.91 0.01 0.00 0.36 0.00 0.00 54.97 54.41 1fxo s GLU 50 Cb 0.05 -3.47 0.02 0.00 0.26 0.00 0.00 34.13 30.98 1fxo s GLU 50 CO 0.31 -0.51 -0.05 0.42 -0.54 0.00 0.00 175.26 174.90 1fxo s ILE 51 N 1.52 0.52 -0.23 -3.70 1.01 -0.30 -1.17 121.20 118.85 1fxo s ILE 51 Ca 0.02 -0.14 -0.12 0.00 0.00 0.00 0.00 60.65 60.42 1fxo s ILE 51 Cb -0.18 -0.53 -0.05 0.00 0.01 0.00 0.00 42.46 41.71 1fxo s ILE 51 CO 0.04 0.21 0.23 -0.22 0.00 0.00 0.00 174.94 175.20 1fxo s LEU 52 N 0.77 4.13 -0.29 2.97 2.96 0.34 -1.14 118.68 128.42 1fxo s LEU 52 Ca -0.10 0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 53.95 1fxo s LEU 52 Cb -0.13 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.32 1fxo s LEU 52 CO 0.00 0.03 0.12 -0.63 -1.32 0.00 0.00 176.35 174.55 1fxo s ILE 53 N 1.12 4.53 -0.20 6.68 1.01 0.31 -0.55 121.20 134.10 1fxo s ILE 53 Ca 0.11 -0.29 -0.06 0.00 0.00 0.00 0.00 60.65 60.41 1fxo s ILE 53 Cb -0.14 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.07 1fxo s ILE 53 CO 0.05 0.18 0.03 -0.63 0.00 0.00 0.00 174.94 174.57 1fxo s ILE 54 N 1.62 4.27 0.00 2.92 1.01 -0.13 -1.51 121.20 129.39 1fxo s ILE 54 Ca 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 60.65 60.50 1fxo s ILE 54 Cb -0.16 -2.93 0.00 0.00 0.01 0.00 0.00 42.46 39.37 1fxo s ILE 54 CO 0.06 0.43 0.00 -0.24 0.00 0.00 0.00 174.94 175.18 1fxo n SER 55 N 4.05 0.00 -4.73 3.58 2.88 -0.62 -0.55 113.62 118.23 1fxo n SER 55 Ca -0.17 -0.95 -0.30 0.00 -1.33 0.00 0.00 58.87 56.13 1fxo n SER 55 Cb 0.52 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 64.11 1fxo n SER 55 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1fxo s THR 56 N -2.03 2.70 0.30 2.46 -4.23 -1.26 -0.29 115.64 113.29 1fxo s THR 56 Ca 0.00 0.23 0.01 0.00 -1.18 0.00 0.00 61.69 60.75 1fxo s THR 56 Cb 0.00 -2.75 0.28 0.00 1.34 0.00 0.00 72.50 71.37 1fxo s THR 56 CO 0.00 -0.30 1.90 -0.65 -0.54 0.00 0.00 174.62 175.03 1fxo h PRO 57 N -1.49 1.00 -0.08 3.99 0.11 -1.88 -1.59 132.00 132.06 1fxo h PRO 57 Ca -0.49 -0.06 -0.19 0.00 0.11 0.00 0.00 66.00 65.37 1fxo h PRO 57 Cb 1.28 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1fxo h PRO 57 CO 0.55 0.66 -0.74 1.96 -0.21 0.00 0.00 178.00 180.23 1fxo h GLN 58 N 1.03 0.43 0.00 1.05 7.50 -1.96 -3.31 115.11 119.85 1fxo h GLN 58 Ca 0.41 -0.35 0.00 0.00 0.50 0.00 0.00 58.65 59.20 1fxo h GLN 58 Cb 0.24 0.07 0.00 0.00 0.05 0.00 0.00 27.48 27.85 1fxo h GLN 58 CO -0.16 0.99 -0.55 -0.44 -1.50 0.00 0.00 178.83 177.17 1fxo h ASP 59 N 0.29 0.00 -0.43 1.46 3.32 -1.85 -3.38 116.42 115.83 1fxo h ASP 59 Ca -0.03 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.00 1fxo h ASP 59 Cb 1.32 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.84 1fxo h ASP 59 CO 0.13 0.01 0.27 0.74 -1.72 0.00 0.00 179.24 178.67 1fxo h THR 60 N 0.00 1.08 0.00 0.35 2.02 -1.38 0.10 112.91 115.08 1fxo h THR 60 Ca 0.00 -0.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 1fxo h THR 60 Cb 0.96 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1fxo h THR 60 CO 0.00 0.10 -0.11 -0.65 0.37 0.00 0.00 175.52 175.23 1fxo h PRO 61 N 0.55 0.00 -0.28 6.66 0.10 -1.78 -1.37 132.00 135.89 1fxo h PRO 61 Ca 0.17 0.00 -0.07 0.00 0.10 0.00 0.00 66.00 66.20 1fxo h PRO 61 Cb -0.03 0.00 -0.01 0.00 0.10 0.00 0.00 31.00 31.07 1fxo h PRO 61 CO -0.06 0.11 -0.10 0.00 0.10 0.00 0.00 178.00 178.06 1fxo h ARG 62 N 0.00 0.56 -0.76 1.05 3.08 -1.06 -1.54 114.38 115.71 1fxo h ARG 62 Ca -0.00 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.81 1fxo h ARG 62 Cb 0.26 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.25 1fxo h ARG 62 CO 0.01 0.78 0.41 0.74 -1.07 0.00 0.00 179.97 180.85 1fxo h PHE 63 N 0.31 1.04 -0.82 3.04 -1.00 -0.76 -0.84 116.94 117.91 1fxo h PHE 63 Ca 0.07 -0.03 0.07 0.00 2.81 0.00 0.00 57.97 60.89 1fxo h PHE 63 Cb 0.59 -0.33 -0.06 0.00 3.61 0.00 0.00 35.95 39.76 1fxo h PHE 63 CO 0.06 0.73 0.50 1.96 -1.61 0.00 0.00 178.31 179.95 1fxo h GLN 64 N 1.05 0.87 -0.45 1.51 4.20 -1.04 0.23 115.11 121.48 1fxo h GLN 64 Ca 0.27 -0.05 -0.11 0.00 0.06 0.00 0.00 58.65 58.82 1fxo h GLN 64 Cb 0.04 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.60 1fxo h GLN 64 CO -0.04 0.58 -0.14 0.37 -0.67 0.00 0.00 178.83 178.92 1fxo h GLN 65 N 0.90 0.85 -0.06 1.46 4.15 -0.88 0.16 115.11 121.68 1fxo h GLN 65 Ca 0.37 -0.31 -0.02 0.00 0.77 0.00 0.00 58.65 59.46 1fxo h GLN 65 Cb 0.20 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 27.83 1fxo h GLN 65 CO -0.19 0.94 -0.03 1.25 -1.93 0.00 0.00 178.83 178.88 1fxo h LEU 66 N 0.76 0.13 0.00 -2.39 5.85 -0.64 -3.38 115.31 115.63 1fxo h LEU 66 Ca 0.12 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.42 1fxo h LEU 66 Cb 0.66 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 1fxo h LEU 66 CO 0.05 0.51 -1.58 0.18 -0.34 0.00 0.00 178.44 177.26 1fxo n LEU 67 N -4.79 0.00 0.00 2.25 4.77 0.02 -5.10 117.00 114.15 1fxo n LEU 67 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 1fxo n LEU 67 Cb 0.25 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 1fxo n LEU 67 CO 0.35 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1fxo n GLY 68 N 1.80 1.02 0.17 -0.72 0.00 0.54 -3.19 105.19 104.82 1fxo n GLY 68 Ca -0.03 -0.63 0.15 0.00 0.00 0.00 0.00 46.02 45.51 1fxo n GLY 68 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fxo n ASP 69 N -2.99 0.55 0.00 1.61 5.68 -1.26 -4.76 116.55 115.38 1fxo n ASP 69 Ca 0.00 -0.98 0.00 0.00 -0.50 0.00 0.00 54.79 53.31 1fxo n ASP 69 Cb 0.00 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 1fxo n ASP 69 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fxo n GLY 70 N 1.14 2.28 0.26 6.12 0.00 -1.19 -1.28 105.19 112.51 1fxo n GLY 70 Ca 0.19 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.30 1fxo n GLY 70 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fxo h SER 71 N 0.00 0.00 0.04 1.61 4.64 -1.81 0.65 113.55 118.67 1fxo h SER 71 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1fxo h SER 71 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1fxo h SER 71 CO 0.00 0.05 -0.03 0.78 -0.87 0.00 0.00 176.83 176.76 1fxo h ASN 72 N 0.00 0.00 -0.31 4.97 2.35 -1.90 -2.30 115.58 118.40 1fxo h ASN 72 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1fxo h ASN 72 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1fxo h ASN 72 CO 0.01 0.03 0.00 0.79 -1.65 0.00 0.00 177.43 176.60 1fxo n TRP 73 N -4.31 0.77 -1.46 1.19 8.01 0.06 -4.95 117.44 116.74 1fxo n TRP 73 Ca -0.03 -0.71 -0.12 0.00 -1.31 0.00 0.00 57.50 55.33 1fxo n TRP 73 Cb 0.11 -0.19 -0.04 0.00 -2.01 0.00 0.00 31.31 29.17 1fxo n TRP 73 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1fxo n GLY 74 N -0.02 1.10 3.78 6.99 0.00 -0.86 -4.68 105.19 111.49 1fxo n GLY 74 Ca 0.17 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 1fxo n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fxo s LEU 75 N -2.78 3.46 -0.38 0.99 1.43 -0.26 -4.96 118.68 116.18 1fxo s LEU 75 Ca 0.00 -0.58 0.03 0.00 -1.03 0.00 0.00 54.13 52.55 1fxo s LEU 75 Cb 0.00 -1.99 0.11 0.00 0.03 0.00 0.00 46.19 44.33 1fxo s LEU 75 CO 0.00 -0.24 0.11 -0.62 0.23 0.00 0.00 176.35 175.84 1fxo s ASP 76 N -3.87 4.48 -0.14 2.29 2.15 0.21 -2.50 116.67 119.30 1fxo s ASP 76 Ca 0.37 -2.29 -0.06 0.00 0.43 0.00 0.00 52.55 51.00 1fxo s ASP 76 Cb -0.05 -1.48 -0.04 0.00 -0.30 0.00 0.00 42.92 41.06 1fxo s ASP 76 CO 0.24 -0.35 0.08 -0.76 -0.17 0.00 0.00 175.17 174.21 1fxo s LEU 77 N 0.72 3.97 0.21 -1.34 1.43 -0.40 -1.15 118.68 122.12 1fxo s LEU 77 Ca 0.13 0.24 0.05 0.00 -1.03 0.00 0.00 54.13 53.51 1fxo s LEU 77 Cb -0.21 -1.97 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 1fxo s LEU 77 CO -0.08 0.31 -0.05 -1.10 0.23 0.00 0.00 176.35 175.66 1fxo s GLN 78 N -0.45 1.29 -0.01 1.70 -0.21 -0.29 -4.66 119.66 117.02 1fxo s GLN 78 Ca 0.10 -1.62 0.02 0.00 0.02 0.00 0.00 55.36 53.88 1fxo s GLN 78 Cb -0.12 -0.74 -0.00 0.00 1.00 0.00 0.00 33.01 33.14 1fxo s GLN 78 CO 0.02 -0.00 -0.06 0.71 -2.12 0.00 0.00 175.29 173.84 1fxo s TYR 79 N -3.29 0.55 0.10 0.91 1.51 -1.26 -0.53 117.35 115.34 1fxo s TYR 79 Ca 0.25 -0.11 -0.03 0.00 -1.01 0.00 0.00 57.07 56.17 1fxo s TYR 79 Cb 0.04 -0.37 -0.03 0.00 -0.11 0.00 0.00 41.96 41.49 1fxo s TYR 79 CO 0.07 -0.02 0.07 0.00 -1.11 0.00 0.00 175.55 174.55 1fxo s ALA 80 N -0.06 0.51 -0.06 3.71 0.00 -0.57 -4.92 121.76 120.37 1fxo s ALA 80 Ca 0.01 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 50.77 1fxo s ALA 80 Cb -0.03 0.61 -0.03 0.00 0.00 0.00 0.00 23.12 23.67 1fxo s ALA 80 CO -0.00 -0.47 -0.07 0.08 0.00 0.00 0.00 175.76 175.30 1fxo s VAL 81 N -3.97 3.68 -0.37 0.00 1.01 -1.26 -1.59 120.40 117.90 1fxo s VAL 81 Ca 0.15 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.55 1fxo s VAL 81 Cb 0.07 -2.51 0.06 0.00 0.00 0.00 0.00 36.38 34.00 1fxo s VAL 81 CO -0.04 0.58 0.16 -1.58 0.00 0.00 0.00 175.10 174.22 1fxo s GLN 82 N -0.86 2.52 0.34 2.72 0.74 0.60 -4.88 119.66 120.83 1fxo s GLN 82 Ca 0.13 -1.36 0.05 0.00 0.05 0.00 0.00 55.36 54.23 1fxo s GLN 82 Cb -0.11 -3.56 0.71 0.00 1.10 0.00 0.00 33.01 31.15 1fxo s GLN 82 CO 0.02 -0.81 1.91 -1.35 -0.55 0.00 0.00 175.29 174.51 1fxo h PRO 83 N 8.24 0.79 -3.10 1.67 0.11 -1.96 -3.38 132.00 134.36 1fxo h PRO 83 Ca -0.22 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.70 1fxo h PRO 83 Cb 1.08 -0.18 -0.24 0.00 0.11 0.00 0.00 31.00 31.77 1fxo h PRO 83 CO 0.66 0.52 -0.37 0.45 -0.21 0.00 0.00 178.00 179.04 1fxo s SER 84 N -5.99 -0.24 -1.19 -2.05 0.15 -1.26 -4.82 113.70 98.30 1fxo s SER 84 Ca -0.10 0.37 -0.17 0.00 0.70 0.00 0.00 55.95 56.75 1fxo s SER 84 Cb 0.20 0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 64.95 1fxo s SER 84 CO 0.79 -0.21 2.11 -0.81 1.20 0.00 0.00 173.24 176.32 1fxo n PRO 85 N 2.40 2.33 -0.54 5.44 -0.04 -1.26 -4.67 135.00 138.66 1fxo n PRO 85 Ca -0.16 -2.31 0.07 0.00 -0.04 0.00 0.00 63.50 61.06 1fxo n PRO 85 Cb 0.57 -3.15 0.30 0.00 -0.04 0.00 0.00 33.50 31.18 1fxo n PRO 85 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1fxo n ASP 86 N 6.67 4.08 0.00 3.54 8.00 -1.26 -4.90 116.55 132.69 1fxo n ASP 86 Ca 0.51 -2.43 0.00 0.00 0.71 0.00 0.00 54.79 53.58 1fxo n ASP 86 Cb 0.40 -0.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1fxo n ASP 86 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1fxo n GLY 87 N 0.88 4.71 0.32 0.44 0.00 -1.26 -0.88 105.19 109.40 1fxo n GLY 87 Ca 0.21 -1.13 -0.00 0.00 0.00 0.00 0.00 46.02 45.10 1fxo n GLY 87 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fxo h LEU 88 N 0.00 0.74 -2.50 0.99 3.38 -1.87 -2.17 115.31 113.88 1fxo h LEU 88 Ca 0.00 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1fxo h LEU 88 Cb 0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 1fxo h LEU 88 CO 0.00 0.63 -0.02 0.00 0.09 0.00 0.00 178.44 179.14 1fxo h ALA 89 N 1.49 1.22 -0.07 1.53 0.00 -1.53 -2.48 119.26 119.42 1fxo h ALA 89 Ca 0.21 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1fxo h ALA 89 Cb 0.08 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1fxo h ALA 89 CO -0.03 0.03 0.20 1.96 0.00 0.00 0.00 179.25 181.41 1fxo h GLN 90 N 0.00 0.00 -0.85 0.00 4.20 -1.56 -1.98 115.11 114.91 1fxo h GLN 90 Ca -0.00 0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.85 1fxo h GLN 90 Cb 0.11 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.82 1fxo h GLN 90 CO 0.00 0.00 0.55 0.00 -0.67 0.00 0.00 178.83 178.72 1fxo h ALA 91 N 1.67 1.91 0.00 3.87 0.00 -1.63 0.23 119.26 125.30 1fxo h ALA 91 Ca 0.03 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1fxo h ALA 91 Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1fxo h ALA 91 CO -0.00 -0.14 -0.11 0.74 0.00 0.00 0.00 179.25 179.74 1fxo h PHE 92 N 0.61 0.00 0.01 0.00 -1.00 -1.59 0.26 116.94 115.23 1fxo h PHE 92 Ca 0.42 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 61.01 1fxo h PHE 92 Cb 0.75 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.28 1fxo h PHE 92 CO -0.00 0.00 -1.04 -0.07 -1.61 0.00 0.00 178.31 175.59 1fxo h LEU 93 N 0.00 0.03 -1.05 1.54 3.38 -1.23 -2.55 115.31 115.43 1fxo h LEU 93 Ca 0.00 -0.63 0.04 0.00 0.09 0.00 0.00 57.88 57.38 1fxo h LEU 93 Cb 0.78 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 1fxo h LEU 93 CO 0.00 1.41 0.64 0.40 0.09 0.00 0.00 178.44 180.98 1fxo h ILE 94 N -0.94 1.16 -0.47 1.22 2.04 -0.65 -2.65 117.51 117.21 1fxo h ILE 94 Ca -0.28 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.16 1fxo h ILE 94 Cb 1.28 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1fxo h ILE 94 CO -0.15 0.22 0.00 0.61 0.00 0.00 0.00 178.15 178.83 1fxo n GLY 95 N -1.38 1.49 0.26 5.37 0.00 0.91 -4.49 105.19 107.36 1fxo n GLY 95 Ca 0.13 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.53 1fxo n GLY 95 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1fxo h GLU 96 N 2.82 -0.23 -0.75 1.61 4.81 -1.07 0.33 114.58 122.08 1fxo h GLU 96 Ca 0.00 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1fxo h GLU 96 Cb 0.80 0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.20 1fxo h GLU 96 CO 0.06 -0.15 0.29 1.03 -0.73 0.00 0.00 179.01 179.50 1fxo h SER 97 N -0.24 1.04 -0.47 1.04 0.87 -1.83 -2.00 113.55 111.97 1fxo h SER 97 Ca 0.13 -0.17 -0.01 0.00 -1.23 0.00 0.00 61.79 60.51 1fxo h SER 97 Cb 0.44 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.11 1fxo h SER 97 CO -0.36 0.93 0.24 0.15 -0.53 0.00 0.00 176.83 177.26 1fxo h PHE 98 N 1.10 0.66 -0.49 2.24 3.57 -1.72 -3.04 116.94 119.26 1fxo h PHE 98 Ca 0.25 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.67 1fxo h PHE 98 Cb 0.23 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 1fxo h PHE 98 CO 0.02 0.51 0.08 0.82 -2.23 0.00 0.00 178.31 177.51 1fxo h ILE 99 N 0.61 1.25 0.00 1.41 2.04 -0.68 -3.48 117.51 118.66 1fxo h ILE 99 Ca 0.16 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 65.10 1fxo h ILE 99 Cb 0.09 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1fxo h ILE 99 CO -0.02 0.33 0.00 0.61 0.00 0.00 0.00 178.15 179.07 1fxo n GLY 100 N -0.53 3.38 1.93 5.37 0.00 -0.78 -1.84 105.19 112.73 1fxo n GLY 100 Ca 0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 1fxo n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1fxo n ASN 101 N 3.53 4.79 -4.99 1.61 3.02 -1.26 -4.99 115.26 116.97 1fxo n ASN 101 Ca 0.00 -3.22 -0.19 0.00 -0.03 0.00 0.00 54.58 51.14 1fxo n ASN 101 Cb 0.00 -0.73 0.01 0.00 -0.61 0.00 0.00 39.78 38.45 1fxo n ASN 101 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1fxo s ASP 102 N -1.11 5.62 0.90 6.41 1.01 -0.76 -4.91 116.67 123.82 1fxo s ASP 102 Ca 0.54 -0.23 -0.12 0.00 0.71 0.00 0.00 52.55 53.46 1fxo s ASP 102 Cb 0.44 -0.87 0.13 0.00 1.01 0.00 0.00 42.92 43.62 1fxo s ASP 102 CO 0.13 -0.80 1.10 -0.76 0.21 0.00 0.00 175.17 175.05 1fxo s LEU 103 N -4.44 2.13 0.24 1.23 1.43 -0.98 -4.39 118.68 113.89 1fxo s LEU 103 Ca 0.53 1.26 -0.11 0.00 -1.03 0.00 0.00 54.13 54.79 1fxo s LEU 103 Cb -0.10 -3.66 -0.01 0.00 0.03 0.00 0.00 46.19 42.46 1fxo s LEU 103 CO 0.34 -2.58 0.42 -0.94 0.23 0.00 0.00 176.35 173.83 1fxo s SER 104 N -3.67 -0.06 -0.07 2.29 1.04 -0.52 -1.40 113.70 111.31 1fxo s SER 104 Ca 0.63 -0.98 -0.10 0.00 0.48 0.00 0.00 55.95 55.98 1fxo s SER 104 Cb -0.17 0.55 0.02 0.00 0.10 0.00 0.00 66.02 66.53 1fxo s SER 104 CO 0.56 -1.08 0.26 0.00 0.98 0.00 0.00 173.24 173.96 1fxo s ALA 105 N -4.03 -0.66 -0.08 5.32 0.00 -0.13 -0.90 121.76 121.27 1fxo s ALA 105 Ca 0.24 0.57 0.04 0.00 0.00 0.00 0.00 51.96 52.82 1fxo s ALA 105 Cb 0.01 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1fxo s ALA 105 CO 0.09 -0.17 -0.22 -1.17 0.00 0.00 0.00 175.76 174.30 1fxo s LEU 106 N -0.33 2.00 0.02 0.00 2.96 0.37 -0.17 118.68 123.52 1fxo s LEU 106 Ca -0.04 -0.49 0.05 0.00 -0.22 0.00 0.00 54.13 53.43 1fxo s LEU 106 Cb -0.03 -1.27 -0.02 0.00 0.50 0.00 0.00 46.19 45.37 1fxo s LEU 106 CO 0.01 0.15 -0.16 0.54 -1.32 0.00 0.00 176.35 175.57 1fxo s VAL 107 N 0.30 1.28 0.22 1.68 0.11 -0.01 -0.61 120.40 123.37 1fxo s VAL 107 Ca -0.15 -0.92 -0.30 0.00 -2.93 0.00 0.00 61.98 57.68 1fxo s VAL 107 Cb -0.17 -1.11 -0.08 0.00 -1.53 0.00 0.00 36.38 33.49 1fxo s VAL 107 CO 0.07 0.17 0.95 -0.76 -3.33 0.00 0.00 175.10 172.21 1fxo s LEU 108 N -0.87 4.62 0.49 2.54 1.43 -0.46 -1.28 118.68 125.14 1fxo s LEU 108 Ca 0.05 1.94 0.33 0.00 -1.03 0.00 0.00 54.13 55.41 1fxo s LEU 108 Cb -0.07 -3.61 1.61 0.00 0.03 0.00 0.00 46.19 44.15 1fxo s LEU 108 CO 0.01 0.10 2.00 1.23 0.23 0.00 0.00 176.35 179.92 1fxo h GLY 109 N 4.41 0.00 -2.00 -3.19 0.00 -1.14 -2.41 103.07 98.73 1fxo h GLY 109 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1fxo h GLY 109 CO 0.69 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.32 1fxo n ASP 110 N -2.75 4.22 -4.74 0.19 5.75 -1.26 -4.41 116.55 113.55 1fxo n ASP 110 Ca -0.01 -2.93 -0.35 0.00 -0.01 0.00 0.00 54.79 51.49 1fxo n ASP 110 Cb 0.16 -0.56 -0.08 0.00 -1.03 0.00 0.00 41.12 39.61 1fxo n ASP 110 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 1fxo s ASN 111 N -1.64 6.24 -0.24 -1.12 0.02 -0.91 -2.00 114.94 115.29 1fxo s ASN 111 Ca 0.44 0.26 0.02 0.00 -1.02 0.00 0.00 52.86 52.56 1fxo s ASN 111 Cb 0.34 -2.09 0.05 0.00 0.02 0.00 0.00 41.25 39.57 1fxo s ASN 111 CO 0.11 0.19 -0.11 -0.22 0.02 0.00 0.00 177.10 177.09 1fxo s LEU 112 N 0.26 2.98 -0.00 0.60 0.20 0.81 -3.70 118.68 119.83 1fxo s LEU 112 Ca 0.09 -1.20 0.01 0.00 0.69 0.00 0.00 54.13 53.72 1fxo s LEU 112 Cb -0.11 -1.44 -0.04 0.00 -0.43 0.00 0.00 46.19 44.17 1fxo s LEU 112 CO -0.01 -0.17 0.04 -0.31 -0.29 0.00 0.00 176.35 175.61 1fxo s TYR 113 N 1.21 3.17 -0.25 5.38 1.51 -1.26 0.05 117.35 127.15 1fxo s TYR 113 Ca -0.06 0.14 -0.19 0.00 -1.01 0.00 0.00 57.07 55.95 1fxo s TYR 113 Cb -0.18 -1.70 0.07 0.00 -0.11 0.00 0.00 41.96 40.03 1fxo s TYR 113 CO -0.07 0.50 0.65 -0.47 -1.11 0.00 0.00 175.55 175.06 1fxo s TYR 114 N -1.13 -0.85 0.00 2.71 5.04 0.00 -5.00 117.35 118.12 1fxo s TYR 114 Ca 0.21 1.87 0.00 0.00 -2.44 0.00 0.00 57.07 56.71 1fxo s TYR 114 Cb -0.12 0.40 0.00 0.00 0.35 0.00 0.00 41.96 42.59 1fxo s TYR 114 CO 0.12 -0.42 0.00 0.41 -1.34 0.00 0.00 175.55 174.32 1fxo n GLY 115 N 3.45 1.91 3.74 8.97 0.00 -1.26 -0.52 105.19 121.48 1fxo n GLY 115 Ca -0.17 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 1fxo n GLY 115 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fxo s HIS 116 N -2.00 3.00 -1.15 1.61 2.46 -1.26 -2.71 115.29 115.24 1fxo s HIS 116 Ca 0.00 1.00 0.00 0.00 0.47 0.00 0.00 55.06 56.53 1fxo s HIS 116 Cb 0.00 -3.84 0.00 0.00 -0.13 0.00 0.00 32.58 28.61 1fxo s HIS 116 CO 0.00 -2.74 0.00 -0.25 -2.47 0.00 0.00 174.74 169.28 1fxo n ASP 117 N 2.37 -4.24 -0.27 9.88 8.00 -1.26 -4.91 116.55 126.12 1fxo n ASP 117 Ca 0.07 0.23 0.03 0.00 0.71 0.00 0.00 54.79 55.84 1fxo n ASP 117 Cb 0.40 -2.84 0.25 0.00 -0.02 0.00 0.00 41.12 38.91 1fxo n ASP 117 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 1fxo h PHE 118 N 0.00 1.00 -0.93 1.24 3.57 -1.93 -2.15 116.94 117.73 1fxo h PHE 118 Ca -0.24 0.03 0.12 0.00 3.53 0.00 0.00 57.97 61.41 1fxo h PHE 118 Cb 0.80 -0.33 -0.07 0.00 2.79 0.00 0.00 35.95 39.14 1fxo h PHE 118 CO 0.31 0.55 0.59 1.25 -2.23 0.00 0.00 178.31 178.78 1fxo h HIS 119 N 1.00 0.97 -0.25 0.41 2.76 -1.89 -0.08 115.15 118.08 1fxo h HIS 119 Ca 0.36 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.44 1fxo h HIS 119 Cb 0.13 -0.31 -0.00 0.00 1.55 0.00 0.00 27.41 28.78 1fxo h HIS 119 CO -0.00 0.40 -0.29 0.93 -1.30 0.00 0.00 177.93 177.66 1fxo h GLU 120 N 0.86 0.64 -0.39 5.26 5.08 -1.78 0.97 114.58 125.22 1fxo h GLU 120 Ca 0.45 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1fxo h GLU 120 Cb 0.54 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 1fxo h GLU 120 CO -0.22 0.96 0.26 1.25 -1.00 0.00 0.00 179.01 180.26 1fxo h LEU 121 N 0.36 0.45 -0.49 1.33 5.85 -1.21 -0.86 115.31 120.74 1fxo h LEU 121 Ca 0.03 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 1fxo h LEU 121 Cb 0.87 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1fxo h LEU 121 CO 0.07 0.34 0.04 -0.07 -0.34 0.00 0.00 178.44 178.47 1fxo h LEU 122 N 0.53 0.82 -0.92 2.25 3.38 -0.99 -3.15 115.31 117.22 1fxo h LEU 122 Ca 0.14 -0.29 0.05 0.00 0.09 0.00 0.00 57.88 57.87 1fxo h LEU 122 Cb -0.05 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.42 1fxo h LEU 122 CO -0.03 0.90 0.59 1.23 0.09 0.00 0.00 178.44 181.23 1fxo h GLY 123 N 0.71 1.37 1.33 0.83 0.00 -0.41 0.26 103.07 107.16 1fxo h GLY 123 Ca 0.14 -0.45 -0.14 0.00 0.00 0.00 0.00 47.33 46.89 1fxo h GLY 123 CO 0.02 0.36 -0.38 1.76 0.00 0.00 0.00 176.54 178.30 1fxo h SER 124 N 1.13 0.78 -0.30 0.19 0.02 -1.16 -1.70 113.55 112.52 1fxo h SER 124 Ca 0.38 -0.35 -0.14 0.00 -0.84 0.00 0.00 61.79 60.84 1fxo h SER 124 Cb 0.07 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1fxo h SER 124 CO -0.14 1.08 -0.34 0.00 -1.14 0.00 0.00 176.83 176.29 1fxo h ALA 125 N 0.96 0.72 -0.23 3.77 0.00 -1.42 -3.17 119.26 119.89 1fxo h ALA 125 Ca 0.05 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 1fxo h ALA 125 Cb 0.92 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1fxo h ALA 125 CO 0.08 0.66 -0.12 1.03 0.00 0.00 0.00 179.25 180.91 1fxo h SER 126 N 0.69 0.36 1.41 0.00 0.87 -0.64 -2.82 113.55 113.42 1fxo h SER 126 Ca 0.07 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1fxo h SER 126 Cb 0.89 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.76 1fxo h SER 126 CO 0.08 0.51 0.00 1.56 -0.53 0.00 0.00 176.83 178.45 1fxo h GLN 127 N 0.35 0.00 -6.37 2.24 4.20 -1.29 -3.42 115.11 110.82 1fxo h GLN 127 Ca 0.07 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.22 1fxo h GLN 127 Cb 0.42 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.16 1fxo h GLN 127 CO 0.02 0.00 1.18 1.03 -0.67 0.00 0.00 178.83 180.39 1fxo s ARG 128 N -3.34 3.37 0.00 1.46 0.52 -1.07 -4.86 118.95 115.03 1fxo s ARG 128 Ca 0.06 1.02 0.27 0.00 -0.52 0.00 0.00 55.73 56.56 1fxo s ARG 128 Cb 0.08 -4.13 0.88 0.00 0.52 0.00 0.00 34.95 32.30 1fxo s ARG 128 CO 0.58 -1.83 1.64 1.04 0.02 0.00 0.00 175.30 176.75 1fxo n GLN 129 N 8.38 0.80 -4.57 3.54 6.02 -1.26 -4.84 117.38 125.45 1fxo n GLN 129 Ca 0.19 -0.43 -0.22 0.00 -0.01 0.00 0.00 57.00 56.53 1fxo n GLN 129 Cb 0.48 -1.49 -0.14 0.00 1.02 0.00 0.00 30.24 30.10 1fxo n GLN 129 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1fxo s THR 130 N -2.50 1.18 0.00 5.09 2.01 -1.26 -4.78 115.64 115.37 1fxo s THR 130 Ca 0.25 -0.78 0.00 0.00 0.31 0.00 0.00 61.69 61.47 1fxo s THR 130 Cb 0.19 -1.01 0.00 0.00 0.01 0.00 0.00 72.50 71.69 1fxo s THR 130 CO 0.51 0.21 0.00 0.61 -0.69 0.00 0.00 174.62 175.26 1fxo n GLY 131 N 2.40 -1.59 3.23 4.40 0.00 -1.26 -4.91 105.19 107.46 1fxo n GLY 131 Ca -0.16 -1.43 -0.17 0.00 0.00 0.00 0.00 46.02 44.26 1fxo n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fxo s ALA 132 N -1.17 1.45 -0.02 4.61 0.00 -0.47 -1.77 121.76 124.39 1fxo s ALA 132 Ca 0.00 -1.30 0.03 0.00 0.00 0.00 0.00 51.96 50.69 1fxo s ALA 132 Cb 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 1fxo s ALA 132 CO 0.00 0.07 -0.10 -1.12 0.00 0.00 0.00 175.76 174.61 1fxo s SER 133 N -2.52 1.24 0.27 0.00 0.01 0.01 -0.71 113.70 112.01 1fxo s SER 133 Ca 0.09 -0.19 0.02 0.00 1.31 0.00 0.00 55.95 57.18 1fxo s SER 133 Cb -0.04 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.90 1fxo s SER 133 CO 0.03 0.09 0.16 0.68 0.41 0.00 0.00 173.24 174.61 1fxo s VAL 134 N 0.00 0.24 -0.02 3.43 -7.23 -0.31 -1.21 120.40 115.30 1fxo s VAL 134 Ca -0.00 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.22 1fxo s VAL 134 Cb -0.07 -2.53 -0.01 0.00 0.56 0.00 0.00 36.38 34.33 1fxo s VAL 134 CO 0.00 0.00 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.25 1fxo s PHE 135 N -3.75 1.67 -0.16 2.82 0.40 -1.26 -1.13 117.98 116.57 1fxo s PHE 135 Ca 0.37 -0.34 -0.04 0.00 -0.60 0.00 0.00 56.93 56.32 1fxo s PHE 135 Cb 0.06 -1.08 -0.03 0.00 0.51 0.00 0.00 43.02 42.48 1fxo s PHE 135 CO 0.17 -0.05 -0.02 0.00 0.70 0.00 0.00 175.22 176.01 1fxo s ALA 136 N -0.37 3.06 -0.04 5.36 0.00 -0.25 -1.42 121.76 128.11 1fxo s ALA 136 Ca 0.06 -0.81 0.01 0.00 0.00 0.00 0.00 51.96 51.22 1fxo s ALA 136 Cb -0.08 -1.60 0.02 0.00 0.00 0.00 0.00 23.12 21.46 1fxo s ALA 136 CO -0.00 0.23 -0.05 -0.47 0.00 0.00 0.00 175.76 175.46 1fxo s TYR 137 N 0.31 0.77 0.04 0.00 5.04 -0.19 -0.38 117.35 122.95 1fxo s TYR 137 Ca -0.03 -0.21 -0.31 0.00 -2.44 0.00 0.00 57.07 54.09 1fxo s TYR 137 Cb -0.14 -0.65 -0.07 0.00 0.35 0.00 0.00 41.96 41.46 1fxo s TYR 137 CO 0.03 -0.16 1.43 -1.58 -1.34 0.00 0.00 175.55 173.93 1fxo s HIS 138 N 0.71 2.90 0.14 4.97 5.65 -1.26 -1.40 115.29 127.00 1fxo s HIS 138 Ca -0.10 0.78 0.04 0.00 0.25 0.00 0.00 55.06 56.04 1fxo s HIS 138 Cb -0.13 -3.71 -0.04 0.00 -1.18 0.00 0.00 32.58 27.52 1fxo s HIS 138 CO 0.00 -2.64 -0.10 0.14 -0.65 0.00 0.00 174.74 171.49 1fxo s VAL 139 N 2.05 1.15 0.15 0.89 -7.23 0.15 -4.95 120.40 112.61 1fxo s VAL 139 Ca 0.66 -1.98 -0.09 0.00 -1.81 0.00 0.00 61.98 58.75 1fxo s VAL 139 Cb -0.34 -1.76 -0.05 0.00 0.56 0.00 0.00 36.38 34.78 1fxo s VAL 139 CO 0.28 -0.70 1.47 0.25 -0.31 0.00 0.00 175.10 176.10 1fxo h LEU 140 N 2.94 0.91 -6.20 1.32 5.85 -1.95 -3.40 115.31 114.78 1fxo h LEU 140 Ca -0.37 -0.45 -0.60 0.00 0.84 0.00 0.00 57.88 57.31 1fxo h LEU 140 Cb 1.19 -0.26 -0.42 0.00 0.37 0.00 0.00 40.66 41.54 1fxo h LEU 140 CO 0.61 1.22 -0.59 -0.90 -0.34 0.00 0.00 178.44 178.44 1fxo n ASP 141 N -4.03 3.74 0.28 1.25 5.75 -1.26 -4.92 116.55 117.36 1fxo n ASP 141 Ca -0.03 -3.44 0.14 0.00 -0.01 0.00 0.00 54.79 51.45 1fxo n ASP 141 Cb 0.58 -0.67 0.83 0.00 -1.03 0.00 0.00 41.12 40.83 1fxo n ASP 141 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 1fxo h PRO 142 N 4.19 0.00 0.00 0.11 0.13 -1.87 -2.06 132.00 132.50 1fxo h PRO 142 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1fxo h PRO 142 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1fxo h PRO 142 CO 0.83 0.06 0.02 -0.85 -0.23 0.00 0.00 178.00 177.84 1fxo n GLU 143 N -3.73 0.08 0.00 0.86 0.00 -1.26 -0.99 120.64 115.60 1fxo n GLU 143 Ca -0.02 0.58 0.14 0.00 0.00 0.00 0.00 57.16 57.85 1fxo n GLU 143 Cb 0.15 -1.80 0.44 0.00 0.00 0.00 0.00 31.44 30.23 1fxo n GLU 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1fxo n ARG 144 N -1.95 1.51 -4.47 3.44 1.74 -0.77 -4.22 116.66 111.94 1fxo n ARG 144 Ca -0.01 -0.93 -0.24 0.00 -0.77 0.00 0.00 57.85 55.90 1fxo n ARG 144 Cb 0.05 -1.48 -0.08 0.00 -1.02 0.00 0.00 32.46 29.92 1fxo n ARG 144 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1fxo s TYR 145 N -2.13 1.77 0.26 -1.55 1.51 -0.16 -4.86 117.35 112.18 1fxo s TYR 145 Ca 0.33 -1.30 -0.30 0.00 -1.01 0.00 0.00 57.07 54.80 1fxo s TYR 145 Cb 0.20 -1.10 -0.10 0.00 -0.11 0.00 0.00 41.96 40.86 1fxo s TYR 145 CO 0.38 -0.34 1.33 0.20 -1.11 0.00 0.00 175.55 176.01 1fxo s GLY 146 N -3.55 2.61 -0.07 0.71 0.00 -1.26 -0.74 107.32 105.02 1fxo s GLY 146 Ca 0.27 1.20 0.05 0.00 0.00 0.00 0.00 44.72 46.25 1fxo s GLY 146 CO 0.16 2.05 -0.24 0.14 0.00 0.00 0.00 173.10 175.21 1fxo s VAL 147 N -0.35 1.98 -0.13 1.40 1.01 0.32 -0.70 120.40 123.93 1fxo s VAL 147 Ca 0.54 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.50 1fxo s VAL 147 Cb -0.39 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.29 1fxo s VAL 147 CO 0.44 0.55 -0.12 0.54 0.00 0.00 0.00 175.10 176.52 1fxo s VAL 148 N -0.02 3.19 -0.12 2.92 0.11 -0.34 -1.60 120.40 124.55 1fxo s VAL 148 Ca -0.07 -0.61 -0.05 0.00 -2.93 0.00 0.00 61.98 58.31 1fxo s VAL 148 Cb -0.15 -2.35 -0.04 0.00 -1.53 0.00 0.00 36.38 32.32 1fxo s VAL 148 CO 0.05 0.52 0.09 -0.70 -3.33 0.00 0.00 175.10 171.73 1fxo s GLU 149 N 0.33 3.35 0.09 1.54 2.12 -0.43 -4.42 118.70 121.27 1fxo s GLU 149 Ca -0.09 -0.24 0.07 0.00 0.36 0.00 0.00 54.97 55.07 1fxo s GLU 149 Cb -0.16 -3.07 -0.04 0.00 0.26 0.00 0.00 34.13 31.13 1fxo s GLU 149 CO 0.05 0.71 -0.11 -0.06 -0.54 0.00 0.00 175.26 175.31 1fxo s PHE 150 N -0.85 2.73 0.64 5.30 0.40 -1.26 -0.61 117.98 124.33 1fxo s PHE 150 Ca 0.13 -0.16 -0.10 0.00 -0.60 0.00 0.00 56.93 56.20 1fxo s PHE 150 Cb -0.12 -1.45 0.15 0.00 0.51 0.00 0.00 43.02 42.11 1fxo s PHE 150 CO 0.03 0.41 0.87 -0.40 0.70 0.00 0.00 175.22 176.83 1fxo n ASP 151 N 0.85 0.13 0.29 1.36 5.68 0.45 -4.88 116.55 120.42 1fxo n ASP 151 Ca -0.14 -1.35 0.17 0.00 -0.50 0.00 0.00 54.79 52.97 1fxo n ASP 151 Cb 0.52 -0.66 0.85 0.00 -1.14 0.00 0.00 41.12 40.70 1fxo n ASP 151 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1fxo h GLN 152 N 0.00 0.00 -0.02 0.11 1.08 -2.01 -1.43 115.11 112.84 1fxo h GLN 152 Ca -0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 1fxo h GLN 152 Cb 0.79 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.22 1fxo h GLN 152 CO 0.21 0.04 0.00 0.41 -0.95 0.00 0.00 178.83 178.54 1fxo n GLY 153 N -0.52 -0.29 1.51 3.46 0.00 -1.26 -4.93 105.19 103.16 1fxo n GLY 153 Ca -0.01 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1fxo n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fxo n GLY 154 N 1.11 0.66 3.76 -0.02 0.00 -0.54 -5.06 105.19 105.10 1fxo n GLY 154 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1fxo n GLY 154 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fxo s LYS 155 N -0.28 4.47 0.15 1.61 1.02 -1.26 -4.78 119.74 120.67 1fxo s LYS 155 Ca 0.00 1.01 -0.31 0.00 0.02 0.00 0.00 55.97 56.70 1fxo s LYS 155 Cb 0.00 -3.33 -0.09 0.00 -0.52 0.00 0.00 37.83 33.89 1fxo s LYS 155 CO 0.00 0.37 1.41 0.00 -0.92 0.00 0.00 175.35 176.21 1fxo s ALA 156 N -0.33 3.62 0.00 5.17 0.00 -1.26 -0.41 121.76 128.54 1fxo s ALA 156 Ca 0.36 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1fxo s ALA 156 Cb -0.21 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.37 1fxo s ALA 156 CO 0.22 -0.64 0.00 0.44 0.00 0.00 0.00 175.76 175.78 1fxo n ILE 157 N 3.62 0.00 -3.49 0.00 -5.35 0.22 -4.90 119.36 109.46 1fxo n ILE 157 Ca 0.11 -0.18 -0.15 0.00 -0.27 0.00 0.00 62.75 62.26 1fxo n ILE 157 Cb 0.42 0.68 -0.04 0.00 -1.74 0.00 0.00 39.64 38.95 1fxo n ILE 157 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1fxo s SER 158 N -1.01 -0.59 -0.02 7.28 1.04 -1.19 -4.99 113.70 114.21 1fxo s SER 158 Ca 0.00 0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.84 1fxo s SER 158 Cb 0.00 0.56 -0.01 0.00 0.10 0.00 0.00 66.02 66.67 1fxo s SER 158 CO 0.00 -0.76 -0.14 -0.76 0.98 0.00 0.00 173.24 172.56 1fxo s LEU 159 N -1.89 1.95 -0.05 2.42 1.43 -1.26 -1.32 118.68 119.97 1fxo s LEU 159 Ca -0.06 -0.27 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 1fxo s LEU 159 Cb -0.00 -0.76 0.02 0.00 0.03 0.00 0.00 46.19 45.48 1fxo s LEU 159 CO -0.00 0.15 0.13 -1.61 0.23 0.00 0.00 176.35 175.25 1fxo s GLU 160 N -0.14 0.12 -0.26 1.70 0.41 -0.62 -4.98 118.70 114.92 1fxo s GLU 160 Ca 0.02 0.25 -0.21 0.00 -0.41 0.00 0.00 54.97 54.62 1fxo s GLU 160 Cb -0.08 -0.03 -0.02 0.00 -1.78 0.00 0.00 34.13 32.22 1fxo s GLU 160 CO 0.00 -0.08 0.65 -2.00 -0.49 0.00 0.00 175.26 173.34 1fxo s GLU 161 N 0.52 4.08 -1.30 1.61 2.56 -1.26 -0.52 118.70 124.39 1fxo s GLU 161 Ca -0.04 0.54 -0.13 0.00 0.00 0.00 0.00 54.97 55.34 1fxo s GLU 161 Cb -0.05 -3.66 0.00 0.00 2.00 0.00 0.00 34.13 32.42 1fxo s GLU 161 CO -0.02 -0.45 0.55 1.63 -0.56 0.00 0.00 175.26 176.41 1fxo n LYS 162 N 5.77 -1.87 -2.10 4.30 5.02 0.08 -4.86 118.16 124.50 1fxo n LYS 162 Ca -0.00 0.34 -0.41 0.00 -2.02 0.00 0.00 58.31 56.22 1fxo n LYS 162 Cb 0.49 -3.97 -0.02 0.00 -0.02 0.00 0.00 35.03 31.51 1fxo n LYS 162 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1fxo s PRO 163 N -6.58 4.34 0.33 1.97 0.04 -1.26 -4.90 135.00 128.95 1fxo s PRO 163 Ca 0.25 2.23 0.07 0.00 0.04 0.00 0.00 61.00 63.58 1fxo s PRO 163 Cb -0.10 -3.07 0.59 0.00 0.04 0.00 0.00 34.50 31.95 1fxo s PRO 163 CO 0.90 -0.21 1.80 1.25 0.04 0.00 0.00 177.00 180.78 1fxo h LEU 164 N 3.54 0.31 -6.96 -3.56 5.85 -1.90 -3.33 115.31 109.26 1fxo h LEU 164 Ca -0.49 -0.09 -0.62 0.00 0.84 0.00 0.00 57.88 57.53 1fxo h LEU 164 Cb 1.23 -0.08 -0.41 0.00 0.37 0.00 0.00 40.66 41.76 1fxo h LEU 164 CO 0.67 0.55 -0.64 -1.61 -0.34 0.00 0.00 178.44 177.07 1fxo s GLU 165 N -4.52 2.21 0.40 1.25 2.02 -1.26 -5.03 118.70 113.77 1fxo s GLU 165 Ca -0.06 -3.16 -0.27 0.00 0.02 0.00 0.00 54.97 51.51 1fxo s GLU 165 Cb 0.14 -3.09 -0.10 0.00 0.10 0.00 0.00 34.13 31.18 1fxo s GLU 165 CO 0.76 -1.31 1.38 -2.30 0.02 0.00 0.00 175.26 173.81 1fxo n PRO 166 N 2.10 2.27 0.01 0.39 -0.02 -1.25 -4.91 135.00 133.59 1fxo n PRO 166 Ca 0.22 0.80 0.13 0.00 -2.02 0.00 0.00 63.50 62.63 1fxo n PRO 166 Cb 0.37 -2.52 0.42 0.00 -0.02 0.00 0.00 33.50 31.75 1fxo n PRO 166 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1fxo n LYS 167 N 0.19 0.04 -3.90 -0.52 5.02 -1.26 -4.92 118.16 112.82 1fxo n LYS 167 Ca 0.04 0.02 -0.10 0.00 -2.02 0.00 0.00 58.31 56.25 1fxo n LYS 167 Cb 0.39 -1.53 -0.01 0.00 -0.02 0.00 0.00 35.03 33.86 1fxo n LYS 167 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1fxo s SER 168 N -3.20 0.17 -0.14 4.39 1.04 -1.26 -4.92 113.70 109.78 1fxo s SER 168 Ca 0.12 -1.12 0.17 0.00 0.48 0.00 0.00 55.95 55.60 1fxo s SER 168 Cb 0.17 0.76 0.73 0.00 0.10 0.00 0.00 66.02 67.79 1fxo s SER 168 CO 0.62 -1.49 1.65 0.59 0.98 0.00 0.00 173.24 175.58 1fxo n ASN 169 N -1.16 4.93 -4.54 7.02 3.02 -1.26 -4.83 115.26 118.45 1fxo n ASN 169 Ca -0.05 -2.57 -0.42 0.00 -0.03 0.00 0.00 54.58 51.51 1fxo n ASN 169 Cb 0.60 -0.60 -0.08 0.00 -0.61 0.00 0.00 39.78 39.10 1fxo n ASN 169 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1fxo s TYR 170 N -2.08 3.16 0.24 3.10 1.51 -1.26 -0.68 117.35 121.34 1fxo s TYR 170 Ca 0.51 0.01 -0.22 0.00 -1.01 0.00 0.00 57.07 56.36 1fxo s TYR 170 Cb 0.35 -2.96 -0.09 0.00 -0.11 0.00 0.00 41.96 39.15 1fxo s TYR 170 CO 0.22 -0.61 0.78 0.00 -1.11 0.00 0.00 175.55 174.83 1fxo s ALA 171 N 2.37 3.37 -0.19 3.71 0.00 -0.49 -1.20 121.76 129.33 1fxo s ALA 171 Ca 0.17 0.28 -0.25 0.00 0.00 0.00 0.00 51.96 52.16 1fxo s ALA 171 Cb -0.16 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.03 1fxo s ALA 171 CO 0.14 0.29 0.84 0.08 0.00 0.00 0.00 175.76 177.11 1fxo s VAL 172 N -1.48 4.86 0.85 0.00 1.01 0.12 -1.03 120.40 124.73 1fxo s VAL 172 Ca 0.43 1.64 -0.12 0.00 0.00 0.00 0.00 61.98 63.93 1fxo s VAL 172 Cb -0.18 -4.14 0.10 0.00 0.00 0.00 0.00 36.38 32.16 1fxo s VAL 172 CO 0.22 -0.01 1.13 0.42 0.00 0.00 0.00 175.10 176.86 1fxo s THR 173 N 2.41 2.43 -0.39 3.92 -4.23 -0.51 -4.55 115.64 114.73 1fxo s THR 173 Ca 0.38 0.14 -0.05 0.00 -1.18 0.00 0.00 61.69 60.98 1fxo s THR 173 Cb -0.16 -2.93 -0.02 0.00 1.34 0.00 0.00 72.50 70.73 1fxo s THR 173 CO 0.10 -0.18 2.98 0.61 -0.54 0.00 0.00 174.62 177.60 1fxo n GLY 174 N -2.33 4.03 2.78 3.99 0.00 -1.26 -4.75 105.19 107.65 1fxo n GLY 174 Ca 0.07 -1.71 -0.17 0.00 0.00 0.00 0.00 46.02 44.20 1fxo n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1fxo s LEU 175 N -1.58 0.18 -0.02 0.99 2.96 -1.26 -1.36 118.68 118.60 1fxo s LEU 175 Ca 0.61 0.21 0.01 0.00 -0.22 0.00 0.00 54.13 54.74 1fxo s LEU 175 Cb 0.36 0.10 0.02 0.00 0.50 0.00 0.00 46.19 47.17 1fxo s LEU 175 CO -0.16 -0.23 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.33 1fxo s TYR 176 N 2.03 0.25 -0.12 5.38 1.51 0.22 -4.31 117.35 122.31 1fxo s TYR 176 Ca 0.01 -0.01 -0.00 0.00 -1.01 0.00 0.00 57.07 56.07 1fxo s TYR 176 Cb -0.12 -0.29 -0.02 0.00 -0.11 0.00 0.00 41.96 41.42 1fxo s TYR 176 CO -0.05 -0.07 -0.10 -0.06 -1.11 0.00 0.00 175.55 174.16 1fxo s PHE 177 N 0.59 2.87 0.07 2.71 0.40 -0.35 -0.48 117.98 123.79 1fxo s PHE 177 Ca -0.06 -0.41 0.04 0.00 -0.60 0.00 0.00 56.93 55.91 1fxo s PHE 177 Cb -0.09 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.59 1fxo s PHE 177 CO -0.01 -0.04 -0.12 0.71 0.70 0.00 0.00 175.22 176.46 1fxo s TYR 178 N 0.06 1.04 0.00 0.36 1.51 -0.08 -0.81 117.35 119.43 1fxo s TYR 178 Ca -0.03 -0.51 0.00 0.00 -1.01 0.00 0.00 57.07 55.51 1fxo s TYR 178 Cb -0.14 -0.59 0.00 0.00 -0.11 0.00 0.00 41.96 41.12 1fxo s TYR 178 CO 0.04 0.01 0.00 -0.40 -1.11 0.00 0.00 175.55 174.09 1fxo n ASP 179 N 1.16 0.00 0.00 2.29 5.68 -0.73 -1.43 116.55 123.52 1fxo n ASP 179 Ca -0.20 -0.67 0.10 0.00 -0.50 0.00 0.00 54.79 53.52 1fxo n ASP 179 Cb 0.55 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 41.09 1fxo n ASP 179 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fxo n GLN 180 N -0.67 0.45 0.14 0.11 3.00 -1.26 -3.28 117.38 115.88 1fxo n GLN 180 Ca 0.00 0.05 0.13 0.00 -0.01 0.00 0.00 57.00 57.17 1fxo n GLN 180 Cb 0.00 -1.50 0.35 0.00 0.00 0.00 0.00 30.24 29.09 1fxo n GLN 180 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.06 179.02 1fxo h GLN 181 N 0.00 0.00 -0.66 -1.09 4.20 -1.92 -3.39 115.11 112.25 1fxo h GLN 181 Ca 0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 1fxo h GLN 181 Cb 0.11 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 1fxo h GLN 181 CO 0.00 0.00 0.10 -0.24 -0.67 0.00 0.00 178.83 178.02 1fxo h VAL 182 N 0.00 1.26 -0.25 -0.54 3.04 -1.93 -2.11 116.25 115.72 1fxo h VAL 182 Ca 0.00 -1.04 0.05 0.00 -1.01 0.00 0.00 66.70 64.70 1fxo h VAL 182 Cb 0.79 0.66 -0.05 0.00 -2.01 0.00 0.00 31.29 30.68 1fxo h VAL 182 CO 0.00 0.39 -0.07 0.58 -1.01 0.00 0.00 177.57 177.46 1fxo h VAL 183 N 1.01 0.74 -0.04 1.51 2.07 -1.86 0.45 116.25 120.13 1fxo h VAL 183 Ca 0.20 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.62 1fxo h VAL 183 Cb 0.45 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1fxo h VAL 183 CO 0.01 0.00 -0.42 0.44 0.02 0.00 0.00 177.57 177.62 1fxo h ASP 184 N -0.01 0.08 -0.17 0.57 3.32 -1.78 0.15 116.42 118.58 1fxo h ASP 184 Ca 0.12 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1fxo h ASP 184 Cb 0.19 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1fxo h ASP 184 CO -0.26 0.50 0.02 0.40 -1.72 0.00 0.00 179.24 178.18 1fxo h ILE 185 N 0.07 1.23 -0.48 0.35 2.04 -0.96 -2.72 117.51 117.03 1fxo h ILE 185 Ca 0.00 -0.76 -0.03 0.00 1.00 0.00 0.00 64.86 65.08 1fxo h ILE 185 Cb 0.78 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 1fxo h ILE 185 CO 0.06 0.23 0.18 0.00 0.00 0.00 0.00 178.15 178.62 1fxo h ALA 186 N 0.81 1.42 0.00 1.87 0.00 -0.39 -2.41 119.26 120.56 1fxo h ALA 186 Ca 0.05 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1fxo h ALA 186 Cb 0.33 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1fxo h ALA 186 CO 0.00 0.44 -0.14 0.00 0.00 0.00 0.00 179.25 179.55 1fxo h ARG 187 N 0.69 0.00 0.00 0.00 3.08 -0.82 -2.40 114.38 114.92 1fxo h ARG 187 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1fxo h ARG 187 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1fxo h ARG 187 CO -0.01 0.14 -0.54 -0.25 -1.07 0.00 0.00 179.97 178.24 1fxo n ASP 188 N -4.31 0.58 -4.77 7.04 8.00 -0.92 -4.95 116.55 117.22 1fxo n ASP 188 Ca -0.03 0.01 -0.34 0.00 0.71 0.00 0.00 54.79 55.14 1fxo n ASP 188 Cb 0.21 0.15 0.03 0.00 -0.02 0.00 0.00 41.12 41.49 1fxo n ASP 188 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1fxo s LEU 189 N -3.69 3.60 0.21 0.64 1.43 -0.91 -5.06 118.68 114.90 1fxo s LEU 189 Ca 0.08 2.15 0.10 0.00 -1.03 0.00 0.00 54.13 55.44 1fxo s LEU 189 Cb 0.15 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.76 1fxo s LEU 189 CO 0.70 -1.46 -0.13 -0.54 0.23 0.00 0.00 176.35 175.16 1fxo s LYS 190 N -3.59 1.92 0.54 1.70 -0.14 -1.26 -5.07 119.74 113.82 1fxo s LYS 190 Ca 0.71 -1.42 -0.21 0.00 -1.36 0.00 0.00 55.97 53.69 1fxo s LYS 190 Cb -0.24 -2.03 -0.06 0.00 -1.68 0.00 0.00 37.83 33.82 1fxo s LYS 190 CO 0.33 0.40 1.14 -2.30 -0.76 0.00 0.00 175.35 174.16 1fxo n PRO 191 N -0.15 1.34 -1.98 -1.68 -0.02 -1.26 -4.78 135.00 126.46 1fxo n PRO 191 Ca -0.10 0.49 -0.30 0.00 -2.02 0.00 0.00 63.50 61.58 1fxo n PRO 191 Cb 0.57 -2.30 0.20 0.00 -0.02 0.00 0.00 33.50 31.94 1fxo n PRO 191 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1fxo s SER 192 N -0.98 2.92 0.12 2.55 1.04 0.09 -4.86 113.70 114.59 1fxo s SER 192 Ca 0.71 0.13 -0.20 0.00 0.48 0.00 0.00 55.95 57.07 1fxo s SER 192 Cb -0.45 -0.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.53 1fxo s SER 192 CO 0.50 -2.84 1.72 -0.65 0.98 0.00 0.00 173.24 172.95 1fxo h PRO 193 N -1.69 0.04 0.00 4.02 0.11 -1.94 -1.69 132.00 130.85 1fxo h PRO 193 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1fxo h PRO 193 Cb 1.22 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1fxo h PRO 193 CO 0.33 0.03 0.12 0.54 -0.21 0.00 0.00 178.00 178.80 1fxo n ARG 194 N -5.15 0.00 -0.78 1.05 1.74 -1.26 -4.75 116.66 107.52 1fxo n ARG 194 Ca -0.03 0.38 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 1fxo n ARG 194 Cb 0.11 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 29.93 1fxo n ARG 194 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fxo n GLY 195 N -1.37 0.55 3.59 -0.13 0.00 -0.63 -5.07 105.19 102.12 1fxo n GLY 195 Ca 0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1fxo n GLY 195 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1fxo s GLU 196 N -1.04 2.15 -0.58 1.61 0.41 -1.26 -4.68 118.70 115.31 1fxo s GLU 196 Ca 0.00 -1.02 -0.24 0.00 -0.41 0.00 0.00 54.97 53.30 1fxo s GLU 196 Cb 0.00 -2.32 0.05 0.00 -1.78 0.00 0.00 34.13 30.08 1fxo s GLU 196 CO 0.00 0.51 0.97 -0.51 -0.49 0.00 0.00 175.26 175.74 1fxo s LEU 197 N -2.24 4.08 -0.16 1.80 1.43 -0.06 -0.73 118.68 122.81 1fxo s LEU 197 Ca 0.22 -0.47 -0.16 0.00 -1.03 0.00 0.00 54.13 52.69 1fxo s LEU 197 Cb -0.11 -2.75 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 1fxo s LEU 197 CO 0.14 -1.31 0.40 -1.61 0.23 0.00 0.00 176.35 174.20 1fxo s GLU 198 N 4.10 4.27 0.53 1.70 0.41 -1.26 -1.49 118.70 126.95 1fxo s GLU 198 Ca 0.29 0.26 0.19 0.00 -0.41 0.00 0.00 54.97 55.31 1fxo s GLU 198 Cb -0.13 -3.46 1.33 0.00 -1.78 0.00 0.00 34.13 30.09 1fxo s GLU 198 CO 0.17 0.12 2.12 0.97 -0.49 0.00 0.00 175.26 178.15 1fxo h ILE 199 N 4.81 0.91 -0.33 -1.63 6.09 -1.94 -1.90 117.51 123.51 1fxo h ILE 199 Ca -0.39 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.07 1fxo h ILE 199 Cb 1.17 0.93 -0.02 0.00 0.47 0.00 0.00 36.82 39.37 1fxo h ILE 199 CO 0.75 0.00 0.09 0.74 -3.07 0.00 0.00 178.15 176.66 1fxo h THR 200 N 0.00 1.15 -0.31 2.19 2.02 -1.99 -0.38 112.91 115.59 1fxo h THR 200 Ca 0.06 -0.53 -0.14 0.00 0.77 0.00 0.00 66.41 66.58 1fxo h THR 200 Cb 0.25 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1fxo h THR 200 CO -0.00 0.19 -0.37 0.44 0.37 0.00 0.00 175.52 176.15 1fxo h ASP 201 N 0.48 0.76 -0.09 4.18 3.32 -1.76 0.83 116.42 124.15 1fxo h ASP 201 Ca 0.11 -0.33 -0.00 0.00 0.02 0.00 0.00 57.03 56.83 1fxo h ASP 201 Cb 0.17 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 1fxo h ASP 201 CO -0.01 1.05 0.04 0.58 -1.72 0.00 0.00 179.24 179.18 1fxo h VAL 202 N 0.60 1.13 -0.56 -1.35 2.07 -1.13 -1.98 116.25 115.02 1fxo h VAL 202 Ca 0.06 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 1fxo h VAL 202 Cb 0.91 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1fxo h VAL 202 CO 0.08 0.11 0.16 0.78 0.02 0.00 0.00 177.57 178.72 1fxo h ASN 203 N 0.00 0.78 -0.02 0.57 2.35 -0.92 -2.06 115.58 116.29 1fxo h ASN 203 Ca 0.03 -0.13 -0.06 0.00 -0.55 0.00 0.00 56.30 55.59 1fxo h ASN 203 Cb 0.14 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1fxo h ASN 203 CO -0.00 0.75 -0.14 -0.09 -1.65 0.00 0.00 177.43 176.29 1fxo h ARG 204 N 0.82 0.33 -0.55 0.81 2.43 -0.71 -0.54 114.38 116.98 1fxo h ARG 204 Ca 0.18 -0.09 0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1fxo h ARG 204 Cb 0.26 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 1fxo h ARG 204 CO -0.01 0.48 0.35 0.00 -1.51 0.00 0.00 179.97 179.28 1fxo h ALA 205 N 1.55 0.70 -0.36 2.80 0.00 -0.64 0.54 119.26 123.85 1fxo h ALA 205 Ca 0.06 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1fxo h ALA 205 Cb 0.44 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1fxo h ALA 205 CO 0.03 0.09 -0.14 1.88 0.00 0.00 0.00 179.25 181.11 1fxo h TYR 206 N 0.70 0.83 -0.80 0.00 -1.99 -1.17 -3.10 116.97 111.43 1fxo h TYR 206 Ca 0.21 -0.19 0.06 0.00 2.00 0.00 0.00 58.73 60.81 1fxo h TYR 206 Cb -0.03 -0.19 -0.06 0.00 2.00 0.00 0.00 36.73 38.44 1fxo h TYR 206 CO -0.05 0.90 0.48 1.25 -0.00 0.00 0.00 178.16 180.75 1fxo h LEU 207 N 0.51 0.75 0.00 3.88 5.85 -0.48 -0.41 115.31 125.41 1fxo h LEU 207 Ca 0.08 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1fxo h LEU 207 Cb 0.66 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.56 1fxo h LEU 207 CO 0.05 0.47 0.00 -0.62 -0.34 0.00 0.00 178.44 178.00 1fxo n GLU 208 N -4.67 0.09 -0.13 1.25 1.02 0.13 -1.32 120.64 117.00 1fxo n GLU 208 Ca 0.11 0.13 0.09 0.00 -0.02 0.00 0.00 57.16 57.47 1fxo n GLU 208 Cb 0.18 -1.50 0.16 0.00 -0.02 0.00 0.00 31.44 30.26 1fxo n GLU 208 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1fxo n ARG 209 N -1.43 2.11 -1.93 3.49 5.12 -0.71 -4.97 116.66 118.33 1fxo n ARG 209 Ca 0.07 -1.96 -0.08 0.00 -1.93 0.00 0.00 57.85 53.94 1fxo n ARG 209 Cb 0.22 -1.39 -0.01 0.00 -1.16 0.00 0.00 32.46 30.12 1fxo n ARG 209 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1fxo n GLY 210 N 1.09 0.28 0.10 -0.13 0.00 -0.43 -4.92 105.19 101.17 1fxo n GLY 210 Ca 0.14 -0.57 0.06 0.00 0.00 0.00 0.00 46.02 45.65 1fxo n GLY 210 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fxo n GLN 211 N -2.05 2.13 -3.72 1.61 6.02 -0.25 -4.96 117.38 116.16 1fxo n GLN 211 Ca -0.10 -2.12 -0.37 0.00 -0.01 0.00 0.00 57.00 54.40 1fxo n GLN 211 Cb 0.50 -1.30 -0.12 0.00 1.02 0.00 0.00 30.24 30.34 1fxo n GLN 211 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1fxo s LEU 212 N -2.02 3.62 -0.21 1.08 2.96 -1.22 -1.37 118.68 121.52 1fxo s LEU 212 Ca 0.19 -0.24 -0.14 0.00 -0.22 0.00 0.00 54.13 53.71 1fxo s LEU 212 Cb 0.16 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 1fxo s LEU 212 CO 0.02 -0.06 0.32 -0.44 -1.32 0.00 0.00 176.35 174.87 1fxo s SER 213 N 1.63 6.35 -0.29 3.68 0.01 0.11 -4.91 113.70 120.28 1fxo s SER 213 Ca 0.06 0.40 -0.01 0.00 1.31 0.00 0.00 55.95 57.71 1fxo s SER 213 Cb -0.16 -2.19 0.05 0.00 0.21 0.00 0.00 66.02 63.93 1fxo s SER 213 CO 0.05 -0.02 -0.03 -0.69 0.41 0.00 0.00 173.24 172.96 1fxo s VAL 214 N 1.15 2.79 -0.13 3.43 1.01 -1.26 -1.17 120.40 126.23 1fxo s VAL 214 Ca 0.15 -1.41 -0.10 0.00 0.00 0.00 0.00 61.98 60.63 1fxo s VAL 214 Cb -0.14 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.60 1fxo s VAL 214 CO 0.06 -0.06 0.21 -1.61 0.00 0.00 0.00 175.10 173.70 1fxo s GLU 215 N 1.22 3.82 0.17 2.72 0.41 -0.28 -4.93 118.70 121.83 1fxo s GLU 215 Ca -0.06 -0.03 -0.30 0.00 -0.41 0.00 0.00 54.97 54.18 1fxo s GLU 215 Cb -0.20 -3.29 -0.08 0.00 -1.78 0.00 0.00 34.13 28.79 1fxo s GLU 215 CO -0.02 0.57 1.22 0.42 -0.49 0.00 0.00 175.26 176.96 1fxo s ILE 216 N -0.48 3.56 -0.45 -1.63 -1.09 -1.26 -1.09 121.20 118.77 1fxo s ILE 216 Ca 0.15 1.27 -0.11 0.00 -2.23 0.00 0.00 60.65 59.73 1fxo s ILE 216 Cb -0.13 -3.81 0.09 0.00 -1.58 0.00 0.00 42.46 37.03 1fxo s ILE 216 CO 0.04 0.18 0.32 -0.32 -1.23 0.00 0.00 174.94 173.93 1fxo s MET 217 N -0.00 2.70 1.06 2.79 -2.45 0.49 -4.84 119.30 119.05 1fxo s MET 217 Ca 0.55 -1.49 -0.11 0.00 -1.25 0.00 0.00 55.69 53.38 1fxo s MET 217 Cb -0.33 -3.92 0.23 0.00 1.25 0.00 0.00 34.83 32.06 1fxo s MET 217 CO 0.36 -1.03 1.08 0.20 1.05 0.00 0.00 175.02 176.68 1fxo s GLY 218 N 2.40 1.61 0.44 2.11 0.00 -1.26 -4.47 107.32 108.15 1fxo s GLY 218 Ca 0.04 0.23 0.30 0.00 0.00 0.00 0.00 44.72 45.29 1fxo s GLY 218 CO 0.03 0.82 1.92 0.07 0.00 0.00 0.00 173.10 175.94 1fxo h ARG 219 N -2.35 0.00 0.00 2.90 0.11 -1.97 -1.61 114.38 111.47 1fxo h ARG 219 Ca -0.53 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.55 1fxo h ARG 219 Cb 1.30 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.38 1fxo h ARG 219 CO 0.46 0.00 0.00 0.78 0.10 0.00 0.00 179.97 181.31 1fxo h GLY 220 N 0.80 0.00 -2.74 0.08 0.00 -1.98 -3.43 103.07 95.80 1fxo h GLY 220 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 46.84 1fxo h GLY 220 CO 0.00 0.00 0.11 -0.19 0.00 0.00 0.00 176.54 176.46 1fxo s TYR 221 N -3.41 3.40 -0.21 5.60 1.51 -0.61 -4.73 117.35 118.90 1fxo s TYR 221 Ca 0.04 1.17 -0.12 0.00 -1.01 0.00 0.00 57.07 57.16 1fxo s TYR 221 Cb 0.08 -2.51 -0.05 0.00 -0.11 0.00 0.00 41.96 39.38 1fxo s TYR 221 CO 0.55 0.02 0.22 0.00 -1.11 0.00 0.00 175.55 175.24 1fxo s ALA 222 N -2.11 3.61 -0.24 3.71 0.00 0.32 -4.96 121.76 122.09 1fxo s ALA 222 Ca 0.53 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1fxo s ALA 222 Cb -0.10 -2.36 0.06 0.00 0.00 0.00 0.00 23.12 20.72 1fxo s ALA 222 CO 0.22 -0.11 -0.07 -0.46 0.00 0.00 0.00 175.76 175.35 1fxo s TRP 223 N 0.89 2.63 0.23 0.00 -0.00 -1.26 -0.82 118.94 120.61 1fxo s TRP 223 Ca 0.11 -1.91 0.11 0.00 -0.00 0.00 0.00 56.10 54.41 1fxo s TRP 223 Cb -0.13 -1.68 -0.05 0.00 -0.00 0.00 0.00 33.47 31.61 1fxo s TRP 223 CO 0.04 -0.80 -0.21 -0.51 -0.00 0.00 0.00 176.95 175.46 1fxo s LEU 224 N 1.32 2.51 0.01 5.86 1.43 0.11 -4.98 118.68 124.93 1fxo s LEU 224 Ca -0.06 -0.95 0.04 0.00 -1.03 0.00 0.00 54.13 52.12 1fxo s LEU 224 Cb -0.19 -1.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.93 1fxo s LEU 224 CO -0.06 0.06 -0.11 -0.62 0.23 0.00 0.00 176.35 175.84 1fxo s ASP 225 N -3.09 1.34 -0.35 2.29 -1.08 -1.26 -0.13 116.67 114.39 1fxo s ASP 225 Ca 0.25 -0.29 0.01 0.00 -0.52 0.00 0.00 52.55 52.00 1fxo s ASP 225 Cb -0.06 -0.12 0.34 0.00 -1.46 0.00 0.00 42.92 41.62 1fxo s ASP 225 CO 0.12 0.09 1.81 0.35 0.52 0.00 0.00 175.17 178.05 1fxo n THR 226 N 2.49 2.70 0.29 1.71 -2.24 -0.85 -4.58 114.28 113.81 1fxo n THR 226 Ca -0.15 -1.61 0.09 0.00 -2.27 0.00 0.00 64.05 60.10 1fxo n THR 226 Cb 0.56 -0.99 0.40 0.00 -2.10 0.00 0.00 70.33 68.19 1fxo n THR 226 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fxo n GLY 227 N -0.25 -0.98 3.16 3.38 0.00 -1.26 -4.58 105.19 104.66 1fxo n GLY 227 Ca 0.38 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 1fxo n GLY 227 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fxo s THR 228 N -3.26 0.12 0.21 2.61 -4.23 -1.26 -4.89 115.64 104.93 1fxo s THR 228 Ca 0.02 -1.93 -0.10 0.00 -1.18 0.00 0.00 61.69 58.51 1fxo s THR 228 Cb 0.07 -2.13 0.15 0.00 1.34 0.00 0.00 72.50 71.93 1fxo s THR 228 CO 0.25 -0.39 1.83 0.45 -0.54 0.00 0.00 174.62 176.22 1fxo h HIS 229 N 2.81 1.03 -0.77 3.99 3.86 -1.96 -1.80 115.15 122.31 1fxo h HIS 229 Ca -0.35 -0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 58.79 1fxo h HIS 229 Cb 1.21 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 29.31 1fxo h HIS 229 CO 0.43 0.71 0.29 -0.44 0.86 0.00 0.00 177.93 179.78 1fxo h ASP 230 N 1.04 1.08 0.76 2.45 3.32 -1.97 -2.39 116.42 120.71 1fxo h ASP 230 Ca 0.27 -0.18 -0.16 0.00 0.02 0.00 0.00 57.03 56.98 1fxo h ASP 230 Cb 0.01 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 1fxo h ASP 230 CO -0.05 0.97 -0.77 0.77 -1.72 0.00 0.00 179.24 178.45 1fxo h SER 231 N 1.13 0.01 -0.45 6.45 4.64 -1.78 -1.13 113.55 122.43 1fxo h SER 231 Ca 0.26 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.50 1fxo h SER 231 Cb 0.24 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1fxo h SER 231 CO -0.02 0.77 0.01 0.25 -0.87 0.00 0.00 176.83 176.97 1fxo h LEU 232 N 0.00 0.77 -0.09 5.97 5.85 -1.29 -0.99 115.31 125.54 1fxo h LEU 232 Ca -0.01 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.41 1fxo h LEU 232 Cb 1.36 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 1fxo h LEU 232 CO 0.10 0.88 0.05 0.25 -0.34 0.00 0.00 178.44 179.39 1fxo h LEU 233 N 0.63 0.11 -1.21 2.25 5.85 -1.04 -0.89 115.31 121.01 1fxo h LEU 233 Ca 0.13 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1fxo h LEU 233 Cb 0.48 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1fxo h LEU 233 CO 0.02 0.12 0.40 -0.33 -0.34 0.00 0.00 178.44 178.31 1fxo h GLU 234 N 0.08 0.94 -0.51 1.25 5.08 -1.19 -0.95 114.58 119.28 1fxo h GLU 234 Ca 0.03 -0.09 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 1fxo h GLU 234 Cb 0.04 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 1fxo h GLU 234 CO -0.01 0.67 -0.04 0.00 -1.00 0.00 0.00 179.01 178.64 1fxo h ALA 235 N 1.49 0.70 -0.31 3.43 0.00 -0.86 -1.40 119.26 122.30 1fxo h ALA 235 Ca 0.25 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1fxo h ALA 235 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1fxo h ALA 235 CO -0.04 0.55 0.19 0.78 0.00 0.00 0.00 179.25 180.72 1fxo h GLY 236 N 0.80 0.45 1.74 0.00 0.00 -0.57 -1.35 103.07 104.14 1fxo h GLY 236 Ca 0.14 -0.18 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 1fxo h GLY 236 CO 0.03 0.18 -0.18 -1.61 0.00 0.00 0.00 176.54 174.96 1fxo h GLN 237 N 0.41 0.31 -0.05 4.80 5.75 -1.11 -0.95 115.11 124.28 1fxo h GLN 237 Ca 0.11 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.52 1fxo h GLN 237 Cb -0.00 -0.03 -0.00 0.00 1.07 0.00 0.00 27.48 28.51 1fxo h GLN 237 CO -0.02 0.49 0.00 0.35 -2.65 0.00 0.00 178.83 177.00 1fxo h PHE 238 N 0.29 0.10 -0.47 3.99 3.57 -0.70 -1.28 116.94 122.44 1fxo h PHE 238 Ca 0.05 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1fxo h PHE 238 Cb 0.49 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1fxo h PHE 238 CO 0.01 0.34 0.20 0.82 -2.23 0.00 0.00 178.31 177.45 1fxo h ILE 239 N -0.18 1.21 -0.48 1.41 1.08 -1.19 -2.28 117.51 117.07 1fxo h ILE 239 Ca 0.02 -0.63 -0.06 0.00 -0.39 0.00 0.00 64.86 63.80 1fxo h ILE 239 Cb 0.30 0.74 -0.02 0.00 -3.07 0.00 0.00 36.82 34.77 1fxo h ILE 239 CO 0.00 0.24 0.07 0.00 -0.69 0.00 0.00 178.15 177.77 1fxo h ALA 240 N 1.04 1.22 -0.35 1.87 0.00 -1.07 0.50 119.26 122.48 1fxo h ALA 240 Ca 0.16 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1fxo h ALA 240 Cb 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1fxo h ALA 240 CO -0.01 0.53 -0.04 1.15 0.00 0.00 0.00 179.25 180.87 1fxo h THR 241 N 0.72 1.27 -0.14 0.00 2.02 -1.02 -0.85 112.91 114.91 1fxo h THR 241 Ca 0.15 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.26 1fxo h THR 241 Cb 0.34 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1fxo h THR 241 CO 0.01 0.35 0.05 -0.07 0.37 0.00 0.00 175.52 176.23 1fxo h LEU 242 N 0.45 0.20 -0.57 2.58 3.38 -1.09 -1.96 115.31 118.30 1fxo h LEU 242 Ca 0.10 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1fxo h LEU 242 Cb 0.53 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1fxo h LEU 242 CO 0.03 0.32 -0.03 -0.33 0.09 0.00 0.00 178.44 178.52 1fxo h GLU 243 N 0.06 1.03 0.00 1.13 5.08 -0.77 -0.57 114.58 120.54 1fxo h GLU 243 Ca 0.05 -0.34 -0.12 0.00 -1.00 0.00 0.00 59.36 57.94 1fxo h GLU 243 Cb 0.19 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 1fxo h GLU 243 CO -0.00 1.03 -0.59 -0.91 -1.00 0.00 0.00 179.01 177.54 1fxo h ASN 244 N 0.92 0.00 -0.16 1.42 2.35 -1.18 0.28 115.58 119.21 1fxo h ASN 244 Ca 0.16 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.82 1fxo h ASN 244 Cb 0.59 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.96 1fxo h ASN 244 CO 0.04 0.59 -0.23 -0.09 -1.65 0.00 0.00 177.43 176.08 1fxo h ARG 245 N 0.00 0.44 0.00 0.81 9.65 -1.13 -3.37 114.38 120.77 1fxo h ARG 245 Ca -0.01 -0.26 -0.16 0.00 -1.10 0.00 0.00 59.98 58.45 1fxo h ARG 245 Cb 1.26 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 29.83 1fxo h ARG 245 CO 0.08 0.85 -1.10 1.96 2.80 0.00 0.00 179.97 184.56 1fxo h GLN 246 N 0.07 0.00 -1.17 0.20 4.20 -0.99 -3.47 115.11 113.94 1fxo h GLN 246 Ca 0.02 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.42 1fxo h GLN 246 Cb 0.80 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.49 1fxo h GLN 246 CO 0.05 0.44 -0.32 0.41 -0.67 0.00 0.00 178.83 178.75 1fxo n GLY 247 N 1.35 0.99 3.42 3.46 0.00 0.08 -5.02 105.19 109.47 1fxo n GLY 247 Ca -0.05 -0.29 -0.25 0.00 0.00 0.00 0.00 46.02 45.43 1fxo n GLY 247 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fxo s LEU 248 N -3.74 2.49 0.03 0.99 1.43 -1.23 -5.08 118.68 113.57 1fxo s LEU 248 Ca 0.00 -0.93 0.04 0.00 -1.03 0.00 0.00 54.13 52.21 1fxo s LEU 248 Cb 0.00 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 45.11 1fxo s LEU 248 CO 0.00 0.06 -0.04 -0.54 0.23 0.00 0.00 176.35 176.05 1fxo s LYS 249 N -3.02 2.56 -0.05 1.70 1.02 -1.26 -4.30 119.74 116.38 1fxo s LYS 249 Ca 0.23 -0.75 -0.19 0.00 0.02 0.00 0.00 55.97 55.28 1fxo s LYS 249 Cb -0.06 -2.52 -0.05 0.00 -0.52 0.00 0.00 37.83 34.67 1fxo s LYS 249 CO 0.11 0.58 0.51 0.08 -0.92 0.00 0.00 175.35 175.72 1fxo s VAL 250 N -1.10 5.05 -1.23 3.17 1.01 -1.26 -4.50 120.40 121.54 1fxo s VAL 250 Ca 0.20 1.05 -0.06 0.00 0.00 0.00 0.00 61.98 63.18 1fxo s VAL 250 Cb -0.11 -3.85 0.01 0.00 0.00 0.00 0.00 36.38 32.43 1fxo s VAL 250 CO 0.11 0.40 1.06 0.00 0.00 0.00 0.00 175.10 176.67 1fxo n ALA 251 N 3.01 -1.45 -2.62 5.51 0.00 -1.26 -4.96 120.51 118.73 1fxo n ALA 251 Ca -0.08 0.24 -0.43 0.00 0.00 0.00 0.00 53.44 53.17 1fxo n ALA 251 Cb 0.51 -4.26 -0.05 0.00 0.00 0.00 0.00 19.45 15.65 1fxo n ALA 251 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fxo h PRO 253 N 9.12 0.65 -0.42 0.00 0.11 -1.93 -1.90 132.00 137.64 1fxo h PRO 253 Ca -0.26 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.84 1fxo h PRO 253 Cb 1.08 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.01 1fxo h PRO 253 CO 1.01 0.43 0.24 0.93 -0.21 0.00 0.00 178.00 180.41 1fxo h GLU 254 N 0.67 0.47 -0.26 1.05 3.07 -1.96 0.14 114.58 117.76 1fxo h GLU 254 Ca 0.36 -0.03 -0.00 0.00 -0.50 0.00 0.00 59.36 59.19 1fxo h GLU 254 Cb 0.49 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1fxo h GLU 254 CO -0.14 0.31 0.15 1.49 -1.40 0.00 0.00 179.01 179.42 1fxo h GLU 255 N 0.48 0.35 -0.47 2.33 4.81 -1.78 -2.29 114.58 118.01 1fxo h GLU 255 Ca 0.17 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1fxo h GLU 255 Cb 0.03 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 1fxo h GLU 255 CO -0.09 0.29 0.03 0.82 -0.73 0.00 0.00 179.01 179.33 1fxo h ILE 256 N 0.32 1.26 -0.60 2.32 2.04 -1.12 -0.77 117.51 120.96 1fxo h ILE 256 Ca 0.09 -1.00 0.09 0.00 1.00 0.00 0.00 64.86 65.04 1fxo h ILE 256 Cb 0.03 0.98 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 1fxo h ILE 256 CO -0.02 0.35 0.23 0.00 0.00 0.00 0.00 178.15 178.71 1fxo h ALA 257 N 0.94 0.76 -0.13 1.87 0.00 -0.91 -0.66 119.26 121.13 1fxo h ALA 257 Ca 0.14 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1fxo h ALA 257 Cb 0.46 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1fxo h ALA 257 CO 0.02 -0.19 0.00 -0.92 0.00 0.00 0.00 179.25 178.16 1fxo h TYR 258 N 0.41 0.24 -0.08 0.00 3.20 -1.05 0.16 116.97 119.85 1fxo h TYR 258 Ca 0.30 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 1fxo h TYR 258 Cb 0.35 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 1fxo h TYR 258 CO -0.16 0.46 -0.11 0.00 -1.64 0.00 0.00 178.16 176.70 1fxo h ARG 259 N -0.04 0.12 -0.01 1.82 3.08 -0.93 -1.81 114.38 116.61 1fxo h ARG 259 Ca 0.04 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1fxo h ARG 259 Cb 0.36 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.39 1fxo h ARG 259 CO 0.01 0.25 -0.06 1.04 -1.07 0.00 0.00 179.97 180.13 1fxo n GLN 260 N -4.34 1.32 -1.57 0.04 6.02 -0.27 -4.92 117.38 113.65 1fxo n GLN 260 Ca -0.02 -0.68 -0.09 0.00 -0.01 0.00 0.00 57.00 56.20 1fxo n GLN 260 Cb 0.22 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 1fxo n GLN 260 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1fxo n LYS 261 N -0.25 -0.68 0.08 -1.09 5.02 -0.68 -4.91 118.16 115.65 1fxo n LYS 261 Ca 0.18 0.71 -0.02 0.00 -2.02 0.00 0.00 58.31 57.16 1fxo n LYS 261 Cb 0.32 -4.64 -0.06 0.00 -0.02 0.00 0.00 35.03 30.62 1fxo n LYS 261 CO 0.00 0.00 0.00 -1.49 -0.52 0.00 0.00 177.40 175.39 1fxo h TRP 262 N 0.00 0.00 -3.43 2.13 6.55 -0.96 -3.45 115.95 116.79 1fxo h TRP 262 Ca -0.20 0.00 -0.39 0.00 0.95 0.00 0.00 58.89 59.25 1fxo h TRP 262 Cb 0.79 0.00 -0.17 0.00 -0.86 0.00 0.00 29.16 28.93 1fxo h TRP 262 CO 0.26 0.70 -0.74 0.96 -1.05 0.00 0.00 178.44 178.57 1fxo s ILE 263 N -2.85 1.32 0.57 1.49 -4.36 -1.14 -4.32 121.20 111.92 1fxo s ILE 263 Ca 0.01 -1.88 0.10 0.00 -0.26 0.00 0.00 60.65 58.61 1fxo s ILE 263 Cb 0.08 -1.68 0.09 0.00 1.25 0.00 0.00 42.46 42.20 1fxo s ILE 263 CO 0.79 -0.54 0.79 1.51 0.24 0.00 0.00 174.94 177.72 1fxo s ASP 264 N -2.77 5.12 0.21 4.36 1.47 -1.26 -4.42 116.67 119.37 1fxo s ASP 264 Ca 0.13 -0.83 -0.10 0.00 1.18 0.00 0.00 52.55 52.92 1fxo s ASP 264 Cb -0.02 0.27 0.17 0.00 -0.34 0.00 0.00 42.92 43.00 1fxo s ASP 264 CO 0.03 -1.33 1.88 0.00 0.68 0.00 0.00 175.17 176.43 1fxo h ALA 265 N 0.19 0.97 -0.98 2.11 0.00 -1.98 0.92 119.26 120.49 1fxo h ALA 265 Ca -0.30 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1fxo h ALA 265 Cb 1.29 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 1fxo h ALA 265 CO 0.41 0.36 0.61 0.00 0.00 0.00 0.00 179.25 180.64 1fxo h ALA 266 N 1.29 1.25 -0.31 0.00 0.00 -1.99 0.32 119.26 119.81 1fxo h ALA 266 Ca 0.28 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.01 1fxo h ALA 266 Cb -0.10 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.29 1fxo h ALA 266 CO -0.07 0.67 -0.18 1.96 0.00 0.00 0.00 179.25 181.63 1fxo h GLN 267 N 1.34 0.67 -0.52 0.00 4.20 -1.63 -1.59 115.11 117.58 1fxo h GLN 267 Ca 0.35 -0.31 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 1fxo h GLN 267 Cb -0.10 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1fxo h GLN 267 CO -0.07 0.90 0.21 1.25 -0.67 0.00 0.00 178.83 180.45 1fxo h LEU 268 N 0.43 0.71 -0.97 1.46 5.85 -0.36 -1.88 115.31 120.56 1fxo h LEU 268 Ca 0.06 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.66 1fxo h LEU 268 Cb 0.72 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 41.51 1fxo h LEU 268 CO 0.05 0.68 0.63 -0.08 -0.34 0.00 0.00 178.44 179.39 1fxo h GLU 269 N 0.70 1.17 -0.31 1.25 4.81 -0.09 -1.63 114.58 120.49 1fxo h GLU 269 Ca 0.17 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 1fxo h GLU 269 Cb 0.19 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1fxo h GLU 269 CO -0.02 0.78 -0.00 -0.22 -0.73 0.00 0.00 179.01 178.82 1fxo h LYS 270 N 1.21 0.47 -0.08 1.92 3.64 -0.86 -2.75 116.57 120.12 1fxo h LYS 270 Ca 0.39 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.55 1fxo h LYS 270 Cb 0.03 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1fxo h LYS 270 CO -0.13 0.50 -0.52 -0.07 -2.27 0.00 0.00 179.45 176.97 1fxo h LEU 271 N 0.46 0.24 -0.71 5.20 3.38 -0.52 -3.23 115.31 120.13 1fxo h LEU 271 Ca 0.10 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1fxo h LEU 271 Cb 0.30 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1fxo h LEU 271 CO 0.01 0.71 -0.48 0.00 0.09 0.00 0.00 178.44 178.77 1fxo h ALA 272 N 1.29 0.90 0.13 1.53 0.00 -1.09 -3.39 119.26 118.63 1fxo h ALA 272 Ca 0.00 -0.44 0.01 0.00 0.00 0.00 0.00 54.91 54.49 1fxo h ALA 272 Cb 0.97 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1fxo h ALA 272 CO 0.08 0.60 -0.21 0.00 0.00 0.00 0.00 179.25 179.72 1fxo h ALA 273 N 1.52 -0.37 0.00 0.00 0.00 -1.53 -0.96 119.26 117.92 1fxo h ALA 273 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fxo h ALA 273 Cb 1.06 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1fxo h ALA 273 CO 0.06 -0.75 0.00 -0.35 0.00 0.00 0.00 179.25 178.21 1fxo n PRO 274 N -5.34 0.33 -0.12 0.00 -0.04 -1.26 -1.67 135.00 126.90 1fxo n PRO 274 Ca -0.07 0.09 0.07 0.00 -0.04 0.00 0.00 63.50 63.55 1fxo n PRO 274 Cb 0.25 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.34 1fxo n PRO 274 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1fxo n LEU 275 N -1.19 2.69 -0.11 1.53 4.77 -0.46 -4.71 117.00 119.52 1fxo n LEU 275 Ca 0.09 -1.56 0.11 0.00 -0.03 0.00 0.00 56.01 54.63 1fxo n LEU 275 Cb 0.11 -0.16 0.47 0.00 -2.33 0.00 0.00 43.42 41.50 1fxo n LEU 275 CO 0.12 0.61 1.19 0.00 -1.33 0.00 0.00 177.39 177.98 1fxo h ALA 276 N 2.57 1.94 0.00 -1.18 0.00 -0.36 -1.02 119.26 121.21 1fxo h ALA 276 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fxo h ALA 276 Cb 0.69 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1fxo h ALA 276 CO 0.00 -0.08 0.00 0.87 0.00 0.00 0.00 179.25 180.04 1fxo h LYS 277 N 0.49 0.00 -5.62 0.00 6.56 -1.84 -3.38 116.57 112.78 1fxo h LYS 277 Ca 0.29 0.00 -0.62 0.00 -1.06 0.00 0.00 60.65 59.26 1fxo h LYS 277 Cb 0.50 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 32.04 1fxo h LYS 277 CO -0.09 0.00 -0.54 0.54 -2.06 0.00 0.00 179.45 177.31 1fxo s ASN 278 N -5.18 4.12 0.51 0.86 2.20 -0.45 -5.01 114.94 112.00 1fxo s ASN 278 Ca 0.03 -1.36 0.21 0.00 -0.94 0.00 0.00 52.86 50.80 1fxo s ASN 278 Cb 0.09 -0.14 1.30 0.00 -2.00 0.00 0.00 41.25 40.50 1fxo s ASN 278 CO 0.50 -0.61 2.02 1.23 -2.94 0.00 0.00 177.10 177.31 1fxo h GLY 279 N 1.52 0.11 0.76 0.45 0.00 -1.87 -0.89 103.07 103.15 1fxo h GLY 279 Ca -0.43 -0.03 -0.16 0.00 0.00 0.00 0.00 47.33 46.70 1fxo h GLY 279 CO 0.75 0.02 -0.66 -1.82 0.00 0.00 0.00 176.54 174.83 1fxo h TYR 280 N 0.08 0.59 -0.48 5.60 3.20 -1.95 -0.23 116.97 123.77 1fxo h TYR 280 Ca 0.20 -0.35 -0.05 0.00 3.14 0.00 0.00 58.73 61.67 1fxo h TYR 280 Cb 0.72 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.91 1fxo h TYR 280 CO -0.00 1.19 0.10 0.78 -1.64 0.00 0.00 178.16 178.59 1fxo h GLY 281 N -0.17 0.85 1.09 1.82 0.00 -0.99 -1.63 103.07 104.03 1fxo h GLY 281 Ca -0.09 -0.55 0.05 0.00 0.00 0.00 0.00 47.33 46.74 1fxo h GLY 281 CO 0.13 0.51 0.49 1.46 0.00 0.00 0.00 176.54 179.13 1fxo h GLN 282 N 0.66 0.82 -0.18 4.80 4.20 -1.15 -1.92 115.11 122.35 1fxo h GLN 282 Ca 0.15 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 1fxo h GLN 282 Cb 0.36 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1fxo h GLN 282 CO 0.01 0.55 0.01 -0.92 -0.67 0.00 0.00 178.83 177.80 1fxo h TYR 283 N 0.85 0.33 -0.73 2.96 3.20 -0.40 -1.93 116.97 121.25 1fxo h TYR 283 Ca 0.31 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.13 1fxo h TYR 283 Cb 0.14 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.29 1fxo h TYR 283 CO -0.00 0.51 0.47 -0.07 -1.64 0.00 0.00 178.16 177.43 1fxo h LEU 284 N 0.06 0.85 -0.51 2.82 3.38 -0.90 -1.89 115.31 119.12 1fxo h LEU 284 Ca 0.05 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1fxo h LEU 284 Cb 0.37 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1fxo h LEU 284 CO 0.01 0.62 -0.01 0.11 0.09 0.00 0.00 178.44 179.26 1fxo h LYS 285 N 0.99 0.91 -0.59 1.13 1.57 -1.18 -2.58 116.57 116.82 1fxo h LYS 285 Ca 0.27 -0.30 0.08 0.00 -1.87 0.00 0.00 60.65 58.83 1fxo h LYS 285 Cb -0.10 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 1fxo h LYS 285 CO -0.06 0.94 0.39 -0.09 -0.57 0.00 0.00 179.45 180.07 1fxo h ARG 286 N 0.78 0.48 0.00 3.15 2.43 -0.60 -1.71 114.38 118.90 1fxo h ARG 286 Ca 0.14 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1fxo h ARG 286 Cb 0.54 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1fxo h ARG 286 CO 0.03 0.31 0.00 -0.07 -1.51 0.00 0.00 179.97 178.73 1fxo h LEU 287 N 0.49 0.00 -0.59 3.80 3.38 -0.96 -2.19 115.31 119.23 1fxo h LEU 287 Ca 0.26 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 1fxo h LEU 287 Cb 0.39 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1fxo h LEU 287 CO -0.08 0.00 -0.16 -0.07 0.09 0.00 0.00 178.44 178.23 1fxo h LEU 288 N 0.00 0.00 -0.62 1.67 3.38 -1.38 -3.34 115.31 115.02 1fxo h LEU 288 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1fxo h LEU 288 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1fxo h LEU 288 CO 0.00 0.16 0.00 0.35 0.09 0.00 0.00 178.44 179.04 1fxo n THR 289 N -3.20 0.00 -4.82 0.22 -2.24 -0.88 -5.03 114.28 98.33 1fxo n THR 289 Ca 0.02 -0.38 -0.33 0.00 -2.27 0.00 0.00 64.05 61.10 1fxo n THR 289 Cb 0.50 1.21 -0.14 0.00 -2.10 0.00 0.00 70.33 69.79 1fxo n THR 289 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1fxo s GLU 290 N -0.13 3.12 -0.10 -0.78 2.12 -0.88 -5.09 118.70 116.96 1fxo s GLU 290 Ca 0.00 -0.69 -0.27 0.00 0.36 0.00 0.00 54.97 54.37 1fxo s GLU 290 Cb 0.00 -2.55 -0.02 0.00 0.26 0.00 0.00 34.13 31.82 1fxo s GLU 290 CO 0.00 0.33 0.88 0.99 -0.54 0.00 0.00 175.26 176.92 1fxo s THR 291 N 0.04 4.89 -0.15 -1.70 2.01 -1.26 -4.81 115.64 114.65 1fxo s THR 291 Ca -0.05 1.78 0.01 0.00 0.31 0.00 0.00 61.69 63.74 1fxo s THR 291 Cb -0.14 -4.20 0.02 0.00 0.01 0.00 0.00 72.50 68.19 1fxo s THR 291 CO 0.04 0.09 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.21 1fxo s VAL 292 N 1.65 1.74 -2.33 3.82 1.01 -1.26 -5.21 120.40 119.82 1fxo s VAL 292 Ca 0.43 -0.75 0.29 0.00 0.00 0.00 0.00 61.98 61.96 1fxo s VAL 292 Cb -0.18 -1.60 0.67 0.00 0.00 0.00 0.00 36.38 35.27 1fxo s VAL 292 CO 0.18 0.49 1.91 -1.22 0.00 0.00 0.00 175.10 176.45