#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 1.40 0.15 1.64 3.52 -1.26 -4.19 118.95 120.22 1fxo s ARG 3 Ca 0.00 -0.51 -0.06 0.00 -0.13 0.00 0.00 55.73 55.03 1fxo s ARG 3 Cb 0.00 -1.28 -0.06 0.00 -1.56 0.00 0.00 34.95 32.05 1fxo s ARG 3 CO 0.00 0.24 0.40 0.15 -0.81 0.00 0.00 175.30 175.28 1fxo s LYS 4 N -0.06 3.65 0.14 5.12 1.02 -0.29 -4.59 119.74 124.74 1fxo s LYS 4 Ca -0.00 -0.03 0.09 0.00 0.02 0.00 0.00 55.97 56.05 1fxo s LYS 4 Cb -0.09 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.35 1fxo s LYS 4 CO 0.01 0.45 -0.17 0.20 -0.92 0.00 0.00 175.35 174.92 1fxo s GLY 5 N -2.39 1.71 -0.04 -3.33 0.00 -0.46 -0.74 107.32 102.07 1fxo s GLY 5 Ca 0.41 -1.42 0.03 0.00 0.00 0.00 0.00 44.72 43.75 1fxo s GLY 5 CO 0.24 -1.41 -0.13 -0.42 0.00 0.00 0.00 173.10 171.38 1fxo s ILE 6 N -1.35 1.11 -0.26 0.90 1.01 0.87 -0.67 121.20 122.82 1fxo s ILE 6 Ca 0.20 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 1fxo s ILE 6 Cb -0.10 -0.97 0.01 0.00 0.01 0.00 0.00 42.46 41.41 1fxo s ILE 6 CO 0.11 0.33 0.00 -0.63 0.00 0.00 0.00 174.94 174.76 1fxo s ILE 7 N 0.17 3.51 -0.46 2.92 1.01 -0.25 -1.01 121.20 127.09 1fxo s ILE 7 Ca -0.05 -0.68 -0.21 0.00 0.00 0.00 0.00 60.65 59.72 1fxo s ILE 7 Cb -0.11 -2.73 0.03 0.00 0.01 0.00 0.00 42.46 39.67 1fxo s ILE 7 CO 0.02 0.24 0.66 -0.22 0.00 0.00 0.00 174.94 175.63 1fxo s LEU 8 N 1.45 4.57 -0.34 2.97 2.96 -0.66 -1.28 118.68 128.35 1fxo s LEU 8 Ca 0.03 -0.46 0.11 0.00 -0.22 0.00 0.00 54.13 53.59 1fxo s LEU 8 Cb -0.16 -2.67 0.45 0.00 0.50 0.00 0.00 46.19 44.31 1fxo s LEU 8 CO -0.01 -0.84 1.11 0.00 -1.32 0.00 0.00 176.35 175.29 1fxo n ALA 9 N 6.34 4.36 -2.65 5.97 0.00 0.11 -0.85 120.51 133.78 1fxo n ALA 9 Ca -0.02 -3.69 0.00 0.00 0.00 0.00 0.00 53.44 49.72 1fxo n ALA 9 Cb 0.47 -0.59 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 -0.50 2.59 0.00 0.00 0.00 -1.23 -4.51 105.19 101.54 1fxo n GLY 10 Ca 0.30 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 2.36 3.75 -0.02 0.00 -1.26 -4.93 105.19 110.09 1fxo n GLY 11 Ca 0.00 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 1fxo n GLY 11 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1fxo s SER 12 N 0.00 6.67 0.00 1.61 0.15 -1.26 -4.91 113.70 115.96 1fxo s SER 12 Ca 0.00 2.70 0.22 0.00 0.70 0.00 0.00 55.95 59.56 1fxo s SER 12 Cb 0.00 -2.63 -0.07 0.00 -1.71 0.00 0.00 66.02 61.61 1fxo s SER 12 CO 0.00 -0.66 1.02 0.61 1.20 0.00 0.00 173.24 175.41 1fxo n GLY 13 N 1.66 -0.23 0.52 9.45 0.00 -1.26 -4.65 105.19 110.68 1fxo n GLY 13 Ca 0.04 -0.62 0.39 0.00 0.00 0.00 0.00 46.02 45.84 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 1.76 0.14 0.78 2.61 2.02 -1.95 0.21 112.91 118.47 1fxo h THR 14 Ca 0.00 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1fxo h THR 14 Cb 0.68 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 1fxo h THR 14 CO 0.00 0.01 -0.43 -0.09 0.37 0.00 0.00 175.52 175.38 1fxo h ARG 15 N 0.07 -1.08 -0.00 6.66 2.43 -1.98 -3.23 114.38 117.25 1fxo h ARG 15 Ca 0.81 0.07 0.00 0.00 -0.81 0.00 0.00 59.98 60.06 1fxo h ARG 15 Cb 2.74 0.25 0.00 0.00 -0.42 0.00 0.00 29.97 32.53 1fxo h ARG 15 CO -0.30 -0.72 0.00 1.28 -1.51 0.00 0.00 179.97 178.72 1fxo n LEU 16 N -5.58 0.16 -4.77 3.80 4.77 0.70 -4.83 117.00 111.25 1fxo n LEU 16 Ca -0.15 -0.06 -0.41 0.00 -0.03 0.00 0.00 56.01 55.37 1fxo n LEU 16 Cb 0.46 -0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.54 1fxo n LEU 16 CO 0.37 0.03 1.14 -1.00 -1.33 0.00 0.00 177.39 176.59 1fxo s HIS 17 N -2.00 2.66 -1.97 -1.77 3.76 -1.10 -1.22 115.29 113.66 1fxo s HIS 17 Ca 0.44 1.13 0.27 0.00 -0.15 0.00 0.00 55.06 56.75 1fxo s HIS 17 Cb 0.21 -3.99 0.81 0.00 1.11 0.00 0.00 32.58 30.71 1fxo s HIS 17 CO 0.34 -2.97 1.60 -0.35 -0.85 0.00 0.00 174.74 172.52 1fxo n PRO 18 N 0.76 1.08 -0.27 8.40 -0.04 -1.26 -4.86 135.00 138.81 1fxo n PRO 18 Ca 0.02 -0.64 0.04 0.00 -0.04 0.00 0.00 63.50 62.88 1fxo n PRO 18 Cb 0.39 -1.49 0.18 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 3.87 1.11 -0.54 0.55 0.00 -1.57 -1.45 119.26 121.24 1fxo h ALA 19 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1fxo h ALA 19 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1fxo h ALA 19 CO 0.00 -0.08 0.00 0.25 0.00 0.00 0.00 179.25 179.42 1fxo n THR 20 N -4.88 2.48 -0.05 0.00 -2.24 -0.98 -3.90 114.28 104.71 1fxo n THR 20 Ca 0.14 -1.28 -0.08 0.00 -2.27 0.00 0.00 64.05 60.56 1fxo n THR 20 Cb 0.36 -0.26 0.08 0.00 -2.10 0.00 0.00 70.33 68.41 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 3.72 0.73 0.21 3.22 3.38 -1.55 -3.27 115.31 121.75 1fxo h LEU 21 Ca 0.00 -0.30 -0.34 0.00 0.09 0.00 0.00 57.88 57.33 1fxo h LEU 21 Cb 1.83 -0.20 0.02 0.00 0.09 0.00 0.00 40.66 42.40 1fxo h LEU 21 CO 0.44 1.00 -1.59 0.00 0.09 0.00 0.00 178.44 178.38 1fxo h ALA 22 N 1.04 0.03 -3.46 1.53 0.00 -1.71 -3.47 119.26 113.22 1fxo h ALA 22 Ca 0.06 -1.01 -0.32 0.00 0.00 0.00 0.00 54.91 53.65 1fxo h ALA 22 Cb 0.85 0.29 -0.24 0.00 0.00 0.00 0.00 17.79 18.70 1fxo h ALA 22 CO 0.07 0.90 -0.75 0.42 0.00 0.00 0.00 179.25 179.89 1fxo s ILE 23 N -2.60 0.62 0.34 0.00 1.01 -1.23 -5.12 121.20 114.22 1fxo s ILE 23 Ca -0.12 -0.86 -0.29 0.00 0.00 0.00 0.00 60.65 59.39 1fxo s ILE 23 Cb 0.05 -0.63 -0.11 0.00 0.01 0.00 0.00 42.46 41.79 1fxo s ILE 23 CO 0.90 -0.19 1.49 -0.55 0.00 0.00 0.00 174.94 176.59 1fxo s SER 24 N -1.15 6.43 0.38 3.58 0.15 -1.26 -4.39 113.70 117.45 1fxo s SER 24 Ca -0.05 2.94 0.20 0.00 0.70 0.00 0.00 55.95 59.74 1fxo s SER 24 Cb -0.08 -2.65 1.19 0.00 -1.71 0.00 0.00 66.02 62.77 1fxo s SER 24 CO 0.00 -0.83 1.67 0.50 1.20 0.00 0.00 173.24 175.79 1fxo h LYS 25 N 3.73 0.26 -0.02 5.44 3.64 -1.92 -1.27 116.57 126.43 1fxo h LYS 25 Ca -0.49 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1fxo h LYS 25 Cb 1.23 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1fxo h LYS 25 CO 0.70 0.17 0.00 1.04 -2.27 0.00 0.00 179.45 179.09 1fxo n GLN 26 N -4.86 1.13 -0.00 1.90 3.00 -1.26 -2.20 117.38 115.09 1fxo n GLN 26 Ca 0.32 -0.20 0.08 0.00 -0.01 0.00 0.00 57.00 57.19 1fxo n GLN 26 Cb 1.09 -1.37 -0.11 0.00 0.00 0.00 0.00 30.24 29.86 1fxo n GLN 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1fxo n LEU 27 N -0.64 0.60 -4.77 1.08 4.77 -0.48 -1.57 117.00 115.98 1fxo n LEU 27 Ca 0.17 -0.37 -0.41 0.00 -0.03 0.00 0.00 56.01 55.37 1fxo n LEU 27 Cb 0.13 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.20 1fxo n LEU 27 CO 0.13 0.15 0.97 -0.76 -1.33 0.00 0.00 177.39 176.55 1fxo s LEU 28 N -3.16 4.42 0.39 2.23 1.43 -0.93 -4.45 118.68 118.60 1fxo s LEU 28 Ca 0.03 2.68 -0.25 0.00 -1.03 0.00 0.00 54.13 55.56 1fxo s LEU 28 Cb 0.12 -3.67 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 1fxo s LEU 28 CO 0.71 -0.54 1.11 -2.16 0.23 0.00 0.00 176.35 175.69 1fxo s PRO 29 N -1.82 4.14 -0.51 1.29 0.04 -1.26 -1.16 135.00 135.72 1fxo s PRO 29 Ca 0.49 1.68 -0.14 0.00 0.04 0.00 0.00 61.00 63.07 1fxo s PRO 29 Cb -0.39 -2.64 0.12 0.00 0.04 0.00 0.00 34.50 31.62 1fxo s PRO 29 CO 0.52 -0.20 0.44 0.08 0.04 0.00 0.00 177.00 177.88 1fxo s VAL 30 N -1.51 4.92 0.00 -0.36 1.01 -0.24 -4.80 120.40 119.42 1fxo s VAL 30 Ca 0.57 -1.52 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1fxo s VAL 30 Cb -0.27 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 31.97 1fxo s VAL 30 CO 0.33 -0.80 0.00 0.00 0.00 0.00 0.00 175.10 174.63 1fxo n TYR 31 N 5.15 0.00 -0.25 5.22 9.36 -1.26 -3.22 117.16 132.15 1fxo n TYR 31 Ca -0.12 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.10 1fxo n TYR 31 Cb 0.41 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.12 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 2.17 0.67 -3.68 2.98 5.75 -1.26 -5.08 116.55 118.10 1fxo n ASP 32 Ca 0.00 -0.95 -0.11 0.00 -0.01 0.00 0.00 54.79 53.72 1fxo n ASP 32 Cb 0.00 0.05 -0.06 0.00 -1.03 0.00 0.00 41.12 40.09 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 -0.05 0.97 0.42 0.11 -2.85 -1.20 -5.09 119.74 112.05 1fxo s LYS 33 Ca 0.00 -0.64 -0.26 0.00 -1.00 0.00 0.00 55.97 54.07 1fxo s LYS 33 Cb 0.00 0.42 -0.09 0.00 -2.06 0.00 0.00 37.83 36.11 1fxo s LYS 33 CO 0.00 -0.35 1.38 -2.14 0.10 0.00 0.00 175.35 174.33 1fxo s PRO 34 N -3.36 3.86 0.25 1.78 0.02 -1.26 -1.08 135.00 135.20 1fxo s PRO 34 Ca 0.00 2.32 -0.05 0.00 0.02 0.00 0.00 61.00 63.29 1fxo s PRO 34 Cb 0.01 -2.74 0.47 0.00 0.02 0.00 0.00 34.50 32.27 1fxo s PRO 34 CO -0.09 -0.64 1.68 1.98 -0.33 0.00 0.00 177.00 179.60 1fxo h MET 35 N 2.56 0.25 -0.03 5.54 1.85 -1.18 -0.03 114.93 123.89 1fxo h MET 35 Ca -0.50 -0.01 0.01 0.00 -0.61 0.00 0.00 59.70 58.58 1fxo h MET 35 Cb 1.25 -0.06 -0.00 0.00 0.43 0.00 0.00 31.60 33.23 1fxo h MET 35 CO 0.62 0.16 0.10 0.97 -0.40 0.00 0.00 176.91 178.36 1fxo h ILE 36 N 0.26 0.14 -0.18 1.77 2.10 -1.48 -1.66 117.51 118.46 1fxo h ILE 36 Ca 0.42 0.00 -0.00 0.00 1.08 0.00 0.00 64.86 66.36 1fxo h ILE 36 Cb 0.72 0.91 -0.01 0.00 -1.09 0.00 0.00 36.82 37.35 1fxo h ILE 36 CO -0.52 0.00 0.11 1.88 -1.08 0.00 0.00 178.15 178.53 1fxo h TYR 37 N 0.00 0.23 0.52 2.19 -1.99 -1.31 -1.63 116.97 114.98 1fxo h TYR 37 Ca 0.01 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.72 1fxo h TYR 37 Cb 0.21 -0.08 0.01 0.00 2.00 0.00 0.00 36.73 38.86 1fxo h TYR 37 CO 0.00 0.16 -0.25 1.88 -0.00 0.00 0.00 178.16 179.95 1fxo h TYR 38 N 0.25 -0.64 -0.19 4.88 -1.99 -1.46 -0.36 116.97 117.46 1fxo h TYR 38 Ca 0.07 -0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.72 1fxo h TYR 38 Cb -0.00 0.21 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 1fxo h TYR 38 CO 0.00 -0.40 -0.14 -1.00 -0.00 0.00 0.00 178.16 176.62 1fxo h PRO 39 N -1.15 0.31 -0.47 4.88 0.13 -1.65 -1.76 132.00 132.29 1fxo h PRO 39 Ca -0.07 -0.08 0.08 0.00 -0.87 0.00 0.00 66.00 65.06 1fxo h PRO 39 Cb 0.53 -0.04 -0.06 0.00 0.13 0.00 0.00 31.00 31.56 1fxo h PRO 39 CO 0.12 0.45 0.10 1.25 -0.23 0.00 0.00 178.00 179.69 1fxo h LEU 40 N 0.29 0.02 -1.36 1.56 5.85 -1.32 -2.18 115.31 118.16 1fxo h LEU 40 Ca 0.06 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 1fxo h LEU 40 Cb 0.42 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1fxo h LEU 40 CO 0.02 0.04 0.13 0.28 -0.34 0.00 0.00 178.44 178.58 1fxo h SER 41 N 0.24 0.51 -0.32 1.25 0.02 -0.42 -1.08 113.55 113.75 1fxo h SER 41 Ca 0.23 -0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 1fxo h SER 41 Cb 0.30 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1fxo h SER 41 CO -0.30 0.49 0.13 0.74 -1.14 0.00 0.00 176.83 176.75 1fxo h THR 42 N 0.56 1.18 -0.85 -2.27 2.02 -0.79 0.17 112.91 112.93 1fxo h THR 42 Ca 0.14 -0.55 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 1fxo h THR 42 Cb 0.16 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 1fxo h THR 42 CO -0.01 0.19 0.43 -0.07 0.37 0.00 0.00 175.52 176.43 1fxo h LEU 43 N 0.37 1.09 -0.53 2.58 3.38 -0.89 -2.16 115.31 119.14 1fxo h LEU 43 Ca 0.11 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1fxo h LEU 43 Cb 0.18 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 1fxo h LEU 43 CO -0.01 0.90 0.27 0.24 0.09 0.00 0.00 178.44 179.93 1fxo h MET 44 N 1.20 0.76 0.00 1.13 2.86 -0.81 -0.91 114.93 119.16 1fxo h MET 44 Ca 0.29 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 1fxo h MET 44 Cb 0.08 -0.14 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 1fxo h MET 44 CO -0.04 0.62 -0.08 -0.07 1.06 0.00 0.00 176.91 178.40 1fxo h LEU 45 N 0.72 0.00 -0.71 1.22 3.38 -0.38 -0.31 115.31 119.23 1fxo h LEU 45 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1fxo h LEU 45 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1fxo h LEU 45 CO -0.03 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1fxo n ALA 46 N -2.21 2.53 -0.91 1.53 0.00 -0.44 -4.74 120.51 116.26 1fxo n ALA 46 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1fxo n ALA 46 Cb 0.22 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.55 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 0.96 0.48 3.66 0.00 0.00 -0.13 -4.82 105.19 105.34 1fxo n GLY 47 Ca 0.13 -0.60 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 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 5.29 -0.07 -0.61 1.01 -0.66 -4.88 121.20 119.28 1fxo s ILE 48 Ca 0.00 0.39 0.09 0.00 0.00 0.00 0.00 60.65 61.14 1fxo s ILE 48 Cb 0.00 -3.59 -0.13 0.00 0.01 0.00 0.00 42.46 38.74 1fxo s ILE 48 CO 0.00 0.30 0.10 0.54 0.00 0.00 0.00 174.94 175.88 1fxo n ARG 49 N 4.40 1.71 -3.64 2.79 1.74 -1.26 -3.85 116.66 118.54 1fxo n ARG 49 Ca -0.12 -0.04 -0.39 0.00 -0.77 0.00 0.00 57.85 56.53 1fxo n ARG 49 Cb 0.52 -1.25 -0.11 0.00 -1.02 0.00 0.00 32.46 30.59 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 -2.40 3.25 -0.01 5.56 2.12 -1.26 -0.90 118.70 125.06 1fxo s GLU 50 Ca -0.04 -0.78 0.01 0.00 0.36 0.00 0.00 54.97 54.51 1fxo s GLU 50 Cb 0.04 -3.61 0.01 0.00 0.26 0.00 0.00 34.13 30.84 1fxo s GLU 50 CO 0.41 -0.47 -0.01 0.42 -0.54 0.00 0.00 175.26 175.07 1fxo s ILE 51 N 1.61 0.17 -0.20 -3.70 1.01 -0.52 -1.36 121.20 118.21 1fxo s ILE 51 Ca 0.04 -0.01 -0.07 0.00 0.00 0.00 0.00 60.65 60.62 1fxo s ILE 51 Cb -0.17 -0.21 -0.03 0.00 0.01 0.00 0.00 42.46 42.05 1fxo s ILE 51 CO 0.07 0.10 0.04 -0.22 0.00 0.00 0.00 174.94 174.92 1fxo s LEU 52 N 0.47 3.57 -0.25 2.97 2.96 0.16 -1.26 118.68 127.31 1fxo s LEU 52 Ca -0.04 -0.05 -0.08 0.00 -0.22 0.00 0.00 54.13 53.73 1fxo s LEU 52 Cb -0.07 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.68 1fxo s LEU 52 CO -0.01 0.11 0.08 -0.63 -1.32 0.00 0.00 176.35 174.58 1fxo s ILE 53 N 0.75 4.44 -0.20 6.68 1.01 0.30 -1.10 121.20 133.08 1fxo s ILE 53 Ca 0.02 -0.13 -0.06 0.00 0.00 0.00 0.00 60.65 60.49 1fxo s ILE 53 Cb -0.14 -3.08 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 1fxo s ILE 53 CO 0.02 0.34 0.02 -0.63 0.00 0.00 0.00 174.94 174.68 1fxo s ILE 54 N 1.57 4.13 0.03 2.92 1.01 -0.41 -1.62 121.20 128.84 1fxo s ILE 54 Ca 0.06 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1fxo s ILE 54 Cb -0.15 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.45 1fxo s ILE 54 CO 0.04 0.42 0.04 -0.24 0.00 0.00 0.00 174.94 175.21 1fxo n SER 55 N 4.18 -0.10 -4.80 3.58 2.88 -0.92 0.04 113.62 118.47 1fxo n SER 55 Ca -0.17 -1.21 -0.29 0.00 -1.33 0.00 0.00 58.87 55.87 1fxo n SER 55 Cb 0.52 0.21 0.11 0.00 -0.75 0.00 0.00 64.21 64.30 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 -2.29 2.57 0.23 2.46 -4.23 -1.26 -0.22 115.64 112.89 1fxo s THR 56 Ca 0.04 0.18 -0.07 0.00 -1.18 0.00 0.00 61.69 60.66 1fxo s THR 56 Cb 0.00 -2.95 0.18 0.00 1.34 0.00 0.00 72.50 71.07 1fxo s THR 56 CO 0.03 -0.24 1.82 -0.65 -0.54 0.00 0.00 174.62 175.03 1fxo h PRO 57 N -1.25 0.75 -0.27 3.99 0.11 -1.87 -0.85 132.00 132.61 1fxo h PRO 57 Ca -0.48 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 65.40 1fxo h PRO 57 Cb 1.30 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1fxo h PRO 57 CO 0.61 0.50 -0.56 0.37 -0.21 0.00 0.00 178.00 178.71 1fxo h GLN 58 N 0.77 0.85 0.00 1.05 4.15 -1.96 -3.32 115.11 116.65 1fxo h GLN 58 Ca 0.34 -0.56 -0.06 0.00 0.77 0.00 0.00 58.65 59.15 1fxo h GLN 58 Cb 0.24 0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 1fxo h GLN 58 CO -0.20 1.19 -0.70 -0.44 -1.93 0.00 0.00 178.83 176.75 1fxo h ASP 59 N 0.62 0.00 -0.78 -0.69 3.32 -1.84 -3.37 116.42 113.68 1fxo h ASP 59 Ca 0.01 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.12 1fxo h ASP 59 Cb 1.17 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.66 1fxo h ASP 59 CO 0.12 0.22 0.47 0.74 -1.72 0.00 0.00 179.24 179.07 1fxo h THR 60 N 0.00 1.00 0.00 0.35 2.02 -1.26 0.18 112.91 115.20 1fxo h THR 60 Ca -0.03 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.82 1fxo h THR 60 Cb 1.20 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1fxo h THR 60 CO 0.02 0.15 -0.16 -0.65 0.37 0.00 0.00 175.52 175.26 1fxo h PRO 61 N 0.85 0.00 -0.19 6.66 0.11 -1.77 -1.59 132.00 136.06 1fxo h PRO 61 Ca 0.35 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.28 1fxo h PRO 61 Cb 0.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.30 1fxo h PRO 61 CO -0.18 0.16 -0.60 0.00 -0.21 0.00 0.00 178.00 177.17 1fxo h ARG 62 N 0.00 0.63 -0.47 1.05 3.08 -0.90 -0.79 114.38 116.99 1fxo h ARG 62 Ca -0.00 -0.43 -0.08 0.00 0.07 0.00 0.00 59.98 59.55 1fxo h ARG 62 Cb 0.35 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1fxo h ARG 62 CO 0.02 1.04 -0.01 0.74 -1.07 0.00 0.00 179.97 180.70 1fxo h PHE 63 N 0.47 0.91 -0.52 3.04 -1.00 -0.76 -0.93 116.94 118.15 1fxo h PHE 63 Ca -0.00 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.60 1fxo h PHE 63 Cb 1.17 -0.24 -0.03 0.00 3.61 0.00 0.00 35.95 40.47 1fxo h PHE 63 CO 0.06 0.87 0.26 0.37 -1.61 0.00 0.00 178.31 178.26 1fxo h GLN 64 N 0.68 0.73 -0.02 1.51 4.15 -1.13 0.48 115.11 121.51 1fxo h GLN 64 Ca 0.13 -0.08 -0.16 0.00 0.77 0.00 0.00 58.65 59.31 1fxo h GLN 64 Cb 0.52 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1fxo h GLN 64 CO 0.03 0.56 -0.71 1.96 -1.93 0.00 0.00 178.83 178.73 1fxo h GLN 65 N 0.73 0.13 -0.05 1.69 4.20 -0.82 0.35 115.11 121.34 1fxo h GLN 65 Ca 0.18 -0.11 -0.12 0.00 0.06 0.00 0.00 58.65 58.67 1fxo h GLN 65 Cb 0.06 0.02 0.01 0.00 0.30 0.00 0.00 27.48 27.87 1fxo h GLN 65 CO -0.03 0.78 -0.45 1.25 -0.67 0.00 0.00 178.83 179.72 1fxo h LEU 66 N 0.08 0.47 0.00 1.46 5.85 -0.42 -3.40 115.31 119.36 1fxo h LEU 66 Ca -0.02 -0.70 0.00 0.00 0.84 0.00 0.00 57.88 58.01 1fxo h LEU 66 Cb 1.25 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.14 1fxo h LEU 66 CO 0.10 1.10 -1.60 0.18 -0.34 0.00 0.00 178.44 177.89 1fxo n LEU 67 N -4.32 0.09 0.00 2.25 4.77 0.09 -5.09 117.00 114.78 1fxo n LEU 67 Ca -0.09 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 1fxo n LEU 67 Cb 0.58 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 1fxo n LEU 67 CO 0.44 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1fxo n GLY 68 N 1.58 0.98 0.26 -0.72 0.00 0.11 -3.27 105.19 104.14 1fxo n GLY 68 Ca -0.02 -0.69 0.14 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.09 0.80 0.00 1.61 5.68 -1.26 -4.76 116.55 115.53 1fxo n ASP 69 Ca 0.00 -1.32 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 1fxo n ASP 69 Cb 0.00 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 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 1.07 1.70 0.30 6.12 0.00 -1.20 -1.16 105.19 112.02 1fxo n GLY 70 Ca 0.20 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 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 0.53 -0.20 1.61 4.64 -1.85 0.23 113.55 118.51 1fxo h SER 71 Ca 0.00 -0.04 0.06 0.00 -0.47 0.00 0.00 61.79 61.34 1fxo h SER 71 Cb 0.00 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 1fxo h SER 71 CO 0.00 0.45 0.23 0.78 -0.87 0.00 0.00 176.83 177.41 1fxo h ASN 72 N 0.61 0.00 -0.24 4.97 2.35 -1.90 -2.22 115.58 119.15 1fxo h ASN 72 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1fxo h ASN 72 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1fxo h ASN 72 CO -0.02 0.00 0.00 0.79 -1.65 0.00 0.00 177.43 176.55 1fxo n TRP 73 N -3.79 0.63 -1.53 1.19 8.01 -0.09 -4.97 117.44 116.90 1fxo n TRP 73 Ca 0.02 -0.75 -0.09 0.00 -1.31 0.00 0.00 57.50 55.37 1fxo n TRP 73 Cb 0.35 -0.19 -0.03 0.00 -2.01 0.00 0.00 31.31 29.43 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 -0.32 0.74 3.71 6.99 0.00 -0.84 -4.73 105.19 110.74 1fxo n GLY 74 Ca 0.16 -0.61 -0.25 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.13 3.09 -0.41 0.99 1.43 -0.30 -4.97 118.68 116.38 1fxo s LEU 75 Ca 0.00 -1.06 0.03 0.00 -1.03 0.00 0.00 54.13 52.06 1fxo s LEU 75 Cb 0.00 -1.41 0.12 0.00 0.03 0.00 0.00 46.19 44.93 1fxo s LEU 75 CO 0.00 -0.47 0.17 -0.62 0.23 0.00 0.00 176.35 175.66 1fxo s ASP 76 N -3.86 4.24 -0.16 2.29 2.15 -0.07 -2.89 116.67 118.36 1fxo s ASP 76 Ca 0.39 -2.44 -0.12 0.00 0.43 0.00 0.00 52.55 50.82 1fxo s ASP 76 Cb 0.03 -1.36 -0.05 0.00 -0.30 0.00 0.00 42.92 41.25 1fxo s ASP 76 CO 0.22 -0.31 0.22 -0.76 -0.17 0.00 0.00 175.17 174.36 1fxo s LEU 77 N 0.54 4.26 0.26 -1.34 1.43 -0.31 -1.44 118.68 122.08 1fxo s LEU 77 Ca 0.14 0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.73 1fxo s LEU 77 Cb -0.22 -2.24 -0.06 0.00 0.03 0.00 0.00 46.19 43.70 1fxo s LEU 77 CO -0.07 0.18 -0.06 -1.10 0.23 0.00 0.00 176.35 175.53 1fxo s GLN 78 N 0.17 1.49 0.03 1.70 -0.21 -0.39 -4.66 119.66 117.79 1fxo s GLN 78 Ca 0.13 -1.74 0.03 0.00 0.02 0.00 0.00 55.36 53.80 1fxo s GLN 78 Cb -0.12 -1.07 -0.02 0.00 1.00 0.00 0.00 33.01 32.80 1fxo s GLN 78 CO 0.02 0.04 -0.09 0.71 -2.12 0.00 0.00 175.29 173.85 1fxo s TYR 79 N -3.07 0.76 0.01 0.91 1.51 -1.26 -0.54 117.35 115.67 1fxo s TYR 79 Ca 0.28 -0.37 -0.16 0.00 -1.01 0.00 0.00 57.07 55.81 1fxo s TYR 79 Cb 0.03 -0.46 0.03 0.00 -0.11 0.00 0.00 41.96 41.45 1fxo s TYR 79 CO 0.11 -0.03 0.34 0.00 -1.11 0.00 0.00 175.55 174.85 1fxo s ALA 80 N -0.97 -0.84 -0.09 3.71 0.00 -0.64 -4.94 121.76 118.00 1fxo s ALA 80 Ca -0.04 0.28 -0.06 0.00 0.00 0.00 0.00 51.96 52.14 1fxo s ALA 80 Cb -0.08 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.18 1fxo s ALA 80 CO 0.01 -0.34 0.15 0.08 0.00 0.00 0.00 175.76 175.66 1fxo s VAL 81 N -1.82 5.45 -0.38 0.00 1.01 -1.26 -2.17 120.40 121.23 1fxo s VAL 81 Ca -0.10 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 1fxo s VAL 81 Cb -0.03 -3.42 0.07 0.00 0.00 0.00 0.00 36.38 33.00 1fxo s VAL 81 CO 0.02 0.53 0.17 -1.58 0.00 0.00 0.00 175.10 174.24 1fxo s GLN 82 N -1.29 2.46 0.41 2.72 0.74 0.69 -4.90 119.66 120.50 1fxo s GLN 82 Ca 0.18 -1.43 0.14 0.00 0.05 0.00 0.00 55.36 54.30 1fxo s GLN 82 Cb -0.12 -3.57 1.00 0.00 1.10 0.00 0.00 33.01 31.42 1fxo s GLN 82 CO 0.08 -0.85 1.93 -1.35 -0.55 0.00 0.00 175.29 174.54 1fxo h PRO 83 N 8.22 0.46 -2.79 1.67 0.11 -1.96 -3.38 132.00 134.33 1fxo h PRO 83 Ca -0.21 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.76 1fxo h PRO 83 Cb 1.07 -0.10 -0.22 0.00 0.11 0.00 0.00 31.00 31.86 1fxo h PRO 83 CO 0.67 0.30 -0.21 0.45 -0.21 0.00 0.00 178.00 179.00 1fxo s SER 84 N -5.99 -0.35 -1.49 -2.05 0.15 -1.26 -4.81 113.70 97.90 1fxo s SER 84 Ca -0.08 0.51 -0.12 0.00 0.70 0.00 0.00 55.95 56.97 1fxo s SER 84 Cb 0.21 0.60 0.01 0.00 -1.71 0.00 0.00 66.02 65.13 1fxo s SER 84 CO 0.77 -0.31 2.47 -0.81 1.20 0.00 0.00 173.24 176.55 1fxo n PRO 85 N 2.03 3.35 -0.38 5.44 -0.04 -1.26 -4.68 135.00 139.45 1fxo n PRO 85 Ca -0.17 -2.61 0.06 0.00 -0.04 0.00 0.00 63.50 60.74 1fxo n PRO 85 Cb 0.57 -3.03 0.22 0.00 -0.04 0.00 0.00 33.50 31.21 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 4.68 3.11 0.00 3.54 8.00 -1.26 -4.89 116.55 129.73 1fxo n ASP 86 Ca 0.61 -2.27 0.00 0.00 0.71 0.00 0.00 54.79 53.84 1fxo n ASP 86 Cb 0.32 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.97 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 0.80 4.76 0.25 0.44 0.00 -1.26 -0.77 105.19 109.42 1fxo n GLY 87 Ca 0.16 -1.04 0.04 0.00 0.00 0.00 0.00 46.02 45.17 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 0.22 -1.60 0.99 3.38 -1.85 -1.84 115.31 114.62 1fxo h LEU 88 Ca 0.00 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1fxo h LEU 88 Cb 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1fxo h LEU 88 CO 0.00 0.31 0.00 0.00 0.09 0.00 0.00 178.44 178.84 1fxo h ALA 89 N 1.72 1.00 0.00 1.53 0.00 -1.51 -2.40 119.26 119.60 1fxo h ALA 89 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1fxo h ALA 89 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1fxo h ALA 89 CO 0.01 0.00 0.00 1.96 0.00 0.00 0.00 179.25 181.22 1fxo h GLN 90 N 0.00 0.00 -0.82 0.00 4.20 -1.51 -1.89 115.11 115.08 1fxo h GLN 90 Ca 0.00 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 1fxo h GLN 90 Cb 0.31 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.03 1fxo h GLN 90 CO 0.00 0.00 0.54 0.00 -0.67 0.00 0.00 178.83 178.70 1fxo h ALA 91 N 2.00 1.86 0.00 3.87 0.00 -1.61 -0.62 119.26 124.76 1fxo h ALA 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fxo h ALA 91 Cb 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1fxo h ALA 91 CO 0.00 -0.06 0.00 0.74 0.00 0.00 0.00 179.25 179.93 1fxo h PHE 92 N 0.65 0.00 0.03 0.00 -1.00 -1.58 0.23 116.94 115.28 1fxo h PHE 92 Ca 0.40 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.95 1fxo h PHE 92 Cb 0.63 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.16 1fxo h PHE 92 CO -0.00 0.00 -1.23 -0.07 -1.61 0.00 0.00 178.31 175.39 1fxo h LEU 93 N 0.00 0.11 -1.04 1.54 3.38 -1.37 -2.67 115.31 115.26 1fxo h LEU 93 Ca 0.00 -0.66 0.03 0.00 0.09 0.00 0.00 57.88 57.33 1fxo h LEU 93 Cb 0.83 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 1fxo h LEU 93 CO 0.00 1.50 0.65 0.40 0.09 0.00 0.00 178.44 181.08 1fxo h ILE 94 N -0.77 1.19 -0.45 1.22 2.04 -1.23 -2.46 117.51 117.06 1fxo h ILE 94 Ca -0.31 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.11 1fxo h ILE 94 Cb 1.43 -0.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1fxo h ILE 94 CO -0.11 0.23 0.00 0.61 0.00 0.00 0.00 178.15 178.88 1fxo n GLY 95 N -1.38 1.54 0.23 5.37 0.00 0.07 -4.51 105.19 106.51 1fxo n GLY 95 Ca 0.13 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 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 2.73 -0.28 -0.75 1.61 4.81 -1.06 -0.03 114.58 121.61 1fxo h GLU 96 Ca 0.00 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1fxo h GLU 96 Cb 0.84 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.25 1fxo h GLU 96 CO 0.08 -0.19 0.38 1.03 -0.73 0.00 0.00 179.01 179.58 1fxo h SER 97 N -0.29 0.96 -0.65 1.04 0.87 -1.82 -1.80 113.55 111.86 1fxo h SER 97 Ca 0.07 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1fxo h SER 97 Cb 0.39 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 1fxo h SER 97 CO -0.22 0.81 0.36 0.15 -0.53 0.00 0.00 176.83 177.40 1fxo h PHE 98 N 1.04 0.88 -0.40 2.24 3.57 -1.76 -2.93 116.94 119.59 1fxo h PHE 98 Ca 0.26 -0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.59 1fxo h PHE 98 Cb 0.09 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 1fxo h PHE 98 CO 0.01 0.63 -0.34 0.82 -2.23 0.00 0.00 178.31 177.19 1fxo h ILE 99 N 0.88 1.27 0.00 1.41 2.04 -0.77 -3.48 117.51 118.87 1fxo h ILE 99 Ca 0.23 -1.51 0.00 0.00 1.00 0.00 0.00 64.86 64.58 1fxo h ILE 99 Cb 0.03 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1fxo h ILE 99 CO -0.04 0.51 0.00 0.61 0.00 0.00 0.00 178.15 179.23 1fxo n GLY 100 N 0.05 3.36 1.99 5.37 0.00 -0.70 -2.01 105.19 113.26 1fxo n GLY 100 Ca -0.01 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.72 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 4.00 3.88 -4.81 1.61 3.02 -1.26 -4.99 115.26 116.71 1fxo n ASN 101 Ca 0.00 -3.68 -0.22 0.00 -0.03 0.00 0.00 54.58 50.66 1fxo n ASN 101 Cb 0.00 -0.80 -0.04 0.00 -0.61 0.00 0.00 39.78 38.33 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 -1.69 5.36 0.78 6.41 1.01 -0.85 -4.93 116.67 122.75 1fxo s ASP 102 Ca 0.55 -0.36 -0.13 0.00 0.71 0.00 0.00 52.55 53.32 1fxo s ASP 102 Cb 0.47 -1.23 0.07 0.00 1.01 0.00 0.00 42.92 43.23 1fxo s ASP 102 CO 0.07 -0.12 1.19 -0.76 0.21 0.00 0.00 175.17 175.76 1fxo s LEU 103 N -3.86 3.18 0.20 1.23 1.43 -1.26 -4.55 118.68 115.05 1fxo s LEU 103 Ca 0.35 2.28 -0.04 0.00 -1.03 0.00 0.00 54.13 55.69 1fxo s LEU 103 Cb -0.07 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.54 1fxo s LEU 103 CO 0.25 -2.46 0.22 -0.94 0.23 0.00 0.00 176.35 173.64 1fxo s SER 104 N -2.28 0.10 -0.05 2.29 1.04 -0.40 -1.13 113.70 113.27 1fxo s SER 104 Ca 0.72 -1.23 -0.09 0.00 0.48 0.00 0.00 55.95 55.82 1fxo s SER 104 Cb -0.27 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.30 1fxo s SER 104 CO 0.49 -0.91 0.22 0.00 0.98 0.00 0.00 173.24 174.03 1fxo s ALA 105 N -4.10 -0.55 -0.06 5.32 0.00 0.08 -0.89 121.76 121.55 1fxo s ALA 105 Ca 0.32 0.36 0.05 0.00 0.00 0.00 0.00 51.96 52.70 1fxo s ALA 105 Cb 0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 23.02 1fxo s ALA 105 CO 0.10 -0.17 -0.21 -1.17 0.00 0.00 0.00 175.76 174.31 1fxo s LEU 106 N -0.62 1.98 0.00 0.00 2.96 0.20 -0.09 118.68 123.11 1fxo s LEU 106 Ca -0.07 -0.44 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 1fxo s LEU 106 Cb -0.04 -1.18 -0.01 0.00 0.50 0.00 0.00 46.19 45.46 1fxo s LEU 106 CO 0.02 0.18 -0.11 0.54 -1.32 0.00 0.00 176.35 175.65 1fxo s VAL 107 N 0.08 0.86 0.29 1.68 0.11 -0.18 -0.70 120.40 122.54 1fxo s VAL 107 Ca -0.07 -0.59 -0.28 0.00 -2.93 0.00 0.00 61.98 58.11 1fxo s VAL 107 Cb -0.14 -0.75 -0.09 0.00 -1.53 0.00 0.00 36.38 33.87 1fxo s VAL 107 CO 0.04 0.16 0.96 -0.76 -3.33 0.00 0.00 175.10 172.16 1fxo s LEU 108 N -0.49 4.49 0.22 2.54 1.43 -0.57 -1.65 118.68 124.65 1fxo s LEU 108 Ca 0.03 1.93 0.22 0.00 -1.03 0.00 0.00 54.13 55.27 1fxo s LEU 108 Cb -0.05 -3.81 0.93 0.00 0.03 0.00 0.00 46.19 43.29 1fxo s LEU 108 CO -0.00 0.01 1.66 0.61 0.23 0.00 0.00 176.35 178.86 1fxo n GLY 109 N 1.02 -1.18 0.61 -3.19 0.00 -0.03 -2.43 105.19 99.98 1fxo n GLY 109 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 46.02 46.15 1fxo n GLY 109 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fxo n ASP 110 N -2.13 3.02 -4.71 1.61 5.75 -1.26 -4.31 116.55 114.52 1fxo n ASP 110 Ca 0.02 -2.26 -0.37 0.00 -0.01 0.00 0.00 54.79 52.18 1fxo n ASP 110 Cb 0.20 -0.28 -0.07 0.00 -1.03 0.00 0.00 41.12 39.93 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 -1.26 6.41 -0.20 -1.12 0.02 -1.02 -2.24 114.94 115.53 1fxo s ASN 111 Ca 0.25 0.48 0.01 0.00 -1.02 0.00 0.00 52.86 52.58 1fxo s ASN 111 Cb 0.16 -2.18 0.03 0.00 0.02 0.00 0.00 41.25 39.28 1fxo s ASN 111 CO 0.12 0.07 -0.16 -0.22 0.02 0.00 0.00 177.10 176.93 1fxo s LEU 112 N 0.64 2.47 0.08 0.60 0.20 -0.10 -3.78 118.68 118.78 1fxo s LEU 112 Ca 0.16 -0.87 0.06 0.00 0.69 0.00 0.00 54.13 54.17 1fxo s LEU 112 Cb -0.13 -1.44 -0.04 0.00 -0.43 0.00 0.00 46.19 44.15 1fxo s LEU 112 CO 0.04 -0.08 -0.10 -0.31 -0.29 0.00 0.00 176.35 175.62 1fxo s TYR 113 N 1.27 2.76 -0.27 5.38 1.51 -1.26 -0.35 117.35 126.39 1fxo s TYR 113 Ca 0.00 -0.14 -0.23 0.00 -1.01 0.00 0.00 57.07 55.70 1fxo s TYR 113 Cb -0.15 -1.47 0.07 0.00 -0.11 0.00 0.00 41.96 40.29 1fxo s TYR 113 CO -0.10 0.40 0.70 -0.47 -1.11 0.00 0.00 175.55 174.97 1fxo s TYR 114 N -1.15 -0.82 0.00 2.71 5.04 0.24 -5.00 117.35 118.37 1fxo s TYR 114 Ca 0.20 1.93 0.00 0.00 -2.44 0.00 0.00 57.07 56.76 1fxo s TYR 114 Cb -0.11 0.33 0.00 0.00 0.35 0.00 0.00 41.96 42.53 1fxo s TYR 114 CO 0.12 -0.40 0.00 0.41 -1.34 0.00 0.00 175.55 174.34 1fxo n GLY 115 N 3.00 1.94 3.76 8.97 0.00 -1.26 -0.26 105.19 121.32 1fxo n GLY 115 Ca -0.15 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 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 2.92 -0.51 1.61 2.46 -1.26 -2.67 115.29 115.85 1fxo s HIS 116 Ca 0.00 1.12 0.00 0.00 0.47 0.00 0.00 55.06 56.65 1fxo s HIS 116 Cb 0.00 -3.85 0.00 0.00 -0.13 0.00 0.00 32.58 28.60 1fxo s HIS 116 CO 0.00 -2.63 0.00 -0.25 -2.47 0.00 0.00 174.74 169.39 1fxo n ASP 117 N 1.62 -4.27 -0.09 9.88 8.00 -1.26 -4.89 116.55 125.54 1fxo n ASP 117 Ca 0.04 0.12 0.21 0.00 0.71 0.00 0.00 54.79 55.87 1fxo n ASP 117 Cb 0.40 -2.19 0.64 0.00 -0.02 0.00 0.00 41.12 39.95 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 0.15 -0.76 1.24 3.57 -1.93 -0.63 116.94 118.59 1fxo h PHE 118 Ca -0.10 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.44 1fxo h PHE 118 Cb 0.54 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.19 1fxo h PHE 118 CO 0.28 0.05 0.48 1.25 -2.23 0.00 0.00 178.31 178.15 1fxo h HIS 119 N 0.13 0.91 -0.29 0.41 2.76 -1.89 0.16 115.15 117.33 1fxo h HIS 119 Ca 0.33 0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 58.39 1fxo h HIS 119 Cb 1.13 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.79 1fxo h HIS 119 CO -0.00 0.52 -0.36 0.93 -1.30 0.00 0.00 177.93 177.72 1fxo h GLU 120 N 0.95 0.76 -0.23 5.26 5.08 -1.50 0.15 114.58 125.05 1fxo h GLU 120 Ca 0.31 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1fxo h GLU 120 Cb 0.01 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1fxo h GLU 120 CO -0.11 1.05 0.13 1.25 -1.00 0.00 0.00 179.01 180.33 1fxo h LEU 121 N 0.51 0.29 -0.18 1.33 5.85 -1.15 -0.53 115.31 121.42 1fxo h LEU 121 Ca 0.04 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1fxo h LEU 121 Cb 0.95 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1fxo h LEU 121 CO 0.09 0.28 0.07 -0.07 -0.34 0.00 0.00 178.44 178.47 1fxo h LEU 122 N 0.27 0.25 -0.84 2.25 3.38 -0.87 -2.91 115.31 116.85 1fxo h LEU 122 Ca 0.08 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 1fxo h LEU 122 Cb 0.05 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1fxo h LEU 122 CO -0.01 0.35 0.12 1.23 0.09 0.00 0.00 178.44 180.21 1fxo h GLY 123 N 0.14 1.06 0.95 0.83 0.00 -0.50 0.24 103.07 105.80 1fxo h GLY 123 Ca 0.06 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1fxo h GLY 123 CO -0.01 0.62 0.16 1.76 0.00 0.00 0.00 176.54 179.07 1fxo h SER 124 N 0.93 0.40 -0.52 0.19 0.02 -1.06 -0.26 113.55 113.25 1fxo h SER 124 Ca 0.19 -0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 60.91 1fxo h SER 124 Cb 0.38 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.80 1fxo h SER 124 CO 0.01 0.39 -0.15 0.00 -1.14 0.00 0.00 176.83 175.94 1fxo h ALA 125 N 1.02 0.72 0.00 3.77 0.00 -1.27 -3.05 119.26 120.45 1fxo h ALA 125 Ca 0.11 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1fxo h ALA 125 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1fxo h ALA 125 CO -0.02 0.66 -0.57 1.03 0.00 0.00 0.00 179.25 180.35 1fxo h SER 126 N 0.88 0.00 0.41 0.00 0.87 -0.25 -2.71 113.55 112.74 1fxo h SER 126 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1fxo h SER 126 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1fxo h SER 126 CO 0.06 0.57 -0.22 0.00 -0.53 0.00 0.00 176.83 176.70 1fxo n GLN 127 N -3.77 0.54 -2.10 2.24 6.02 -0.13 -4.81 117.38 115.36 1fxo n GLN 127 Ca -0.01 -0.25 -0.35 0.00 -0.01 0.00 0.00 57.00 56.38 1fxo n GLN 127 Cb 0.59 -1.49 0.02 0.00 1.02 0.00 0.00 30.24 30.38 1fxo n GLN 127 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1fxo s ARG 128 N -2.63 3.12 -0.13 -1.09 0.52 -1.03 -4.95 118.95 112.76 1fxo s ARG 128 Ca 0.23 1.72 0.17 0.00 -0.52 0.00 0.00 55.73 57.33 1fxo s ARG 128 Cb 0.19 -1.96 0.28 0.00 0.52 0.00 0.00 34.95 33.98 1fxo s ARG 128 CO 0.54 -1.06 1.14 1.04 0.02 0.00 0.00 175.30 176.98 1fxo n GLN 129 N -1.51 1.20 -3.67 3.54 6.02 -1.26 -5.03 117.38 116.68 1fxo n GLN 129 Ca 0.13 -2.51 -0.14 0.00 -0.01 0.00 0.00 57.00 54.46 1fxo n GLN 129 Cb 0.50 -1.43 -0.07 0.00 1.02 0.00 0.00 30.24 30.26 1fxo n GLN 129 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1fxo s THR 130 N -2.68 0.04 0.00 5.09 -1.32 -1.26 -4.93 115.64 110.58 1fxo s THR 130 Ca 0.30 -0.33 0.00 0.00 -1.21 0.00 0.00 61.69 60.45 1fxo s THR 130 Cb 0.27 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 70.45 1fxo s THR 130 CO 0.02 -0.18 0.00 0.61 -2.21 0.00 0.00 174.62 172.86 1fxo n GLY 131 N 0.96 -0.14 3.29 6.08 0.00 -1.26 -4.80 105.19 109.33 1fxo n GLY 131 Ca -0.20 -1.04 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 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 -1.54 1.88 -0.06 4.61 0.00 -0.27 -1.30 121.76 125.07 1fxo s ALA 132 Ca 0.00 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 50.76 1fxo s ALA 132 Cb 0.00 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.84 1fxo s ALA 132 CO 0.00 0.40 -0.12 -1.12 0.00 0.00 0.00 175.76 174.91 1fxo s SER 133 N -1.71 1.76 0.28 0.00 0.01 0.39 -0.20 113.70 114.23 1fxo s SER 133 Ca 0.08 -0.30 0.02 0.00 1.31 0.00 0.00 55.95 57.06 1fxo s SER 133 Cb -0.10 -0.79 -0.05 0.00 0.21 0.00 0.00 66.02 65.28 1fxo s SER 133 CO 0.04 0.04 0.09 0.68 0.41 0.00 0.00 173.24 174.49 1fxo s VAL 134 N 0.62 0.71 -0.01 3.43 -7.23 -0.56 -1.09 120.40 116.26 1fxo s VAL 134 Ca -0.14 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.09 1fxo s VAL 134 Cb -0.15 -2.68 -0.01 0.00 0.56 0.00 0.00 36.38 34.09 1fxo s VAL 134 CO 0.04 0.00 -0.19 -0.36 -0.31 0.00 0.00 175.10 174.28 1fxo s PHE 135 N -3.64 1.70 -0.15 2.82 0.40 -1.26 -1.23 117.98 116.62 1fxo s PHE 135 Ca 0.38 -0.32 -0.03 0.00 -0.60 0.00 0.00 56.93 56.36 1fxo s PHE 135 Cb 0.08 -1.09 -0.02 0.00 0.51 0.00 0.00 43.02 42.50 1fxo s PHE 135 CO 0.14 -0.03 -0.06 0.00 0.70 0.00 0.00 175.22 175.97 1fxo s ALA 136 N -0.45 2.91 -0.05 5.36 0.00 -0.45 -0.73 121.76 128.36 1fxo s ALA 136 Ca 0.07 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1fxo s ALA 136 Cb -0.07 -1.48 0.02 0.00 0.00 0.00 0.00 23.12 21.59 1fxo s ALA 136 CO -0.01 0.21 -0.04 -0.47 0.00 0.00 0.00 175.76 175.46 1fxo s TYR 137 N 0.38 0.72 -0.02 0.00 5.04 0.01 -0.93 117.35 122.55 1fxo s TYR 137 Ca -0.06 -0.19 -0.30 0.00 -2.44 0.00 0.00 57.07 54.08 1fxo s TYR 137 Cb -0.15 -0.67 -0.06 0.00 0.35 0.00 0.00 41.96 41.44 1fxo s TYR 137 CO 0.04 -0.20 1.59 -1.58 -1.34 0.00 0.00 175.55 174.06 1fxo s HIS 138 N 1.03 2.25 0.16 4.97 5.65 -1.26 -1.04 115.29 127.05 1fxo s HIS 138 Ca -0.09 0.36 0.06 0.00 0.25 0.00 0.00 55.06 55.64 1fxo s HIS 138 Cb -0.14 -3.87 -0.04 0.00 -1.18 0.00 0.00 32.58 27.35 1fxo s HIS 138 CO -0.01 -3.53 -0.13 0.14 -0.65 0.00 0.00 174.74 170.56 1fxo s VAL 139 N 3.45 1.43 0.22 0.89 -7.23 -0.25 -4.95 120.40 113.95 1fxo s VAL 139 Ca 0.71 -2.01 -0.05 0.00 -1.81 0.00 0.00 61.98 58.83 1fxo s VAL 139 Cb -0.34 -1.82 0.04 0.00 0.56 0.00 0.00 36.38 34.83 1fxo s VAL 139 CO 0.29 -0.58 1.64 0.25 -0.31 0.00 0.00 175.10 176.39 1fxo h LEU 140 N 2.94 0.81 -6.08 1.32 5.85 -1.95 -3.39 115.31 114.81 1fxo h LEU 140 Ca -0.38 -0.28 -0.60 0.00 0.84 0.00 0.00 57.88 57.46 1fxo h LEU 140 Cb 1.20 -0.22 -0.42 0.00 0.37 0.00 0.00 40.66 41.59 1fxo h LEU 140 CO 0.59 0.98 -0.58 -0.90 -0.34 0.00 0.00 178.44 178.19 1fxo n ASP 141 N -4.13 3.90 0.28 1.25 5.75 -1.26 -4.92 116.55 117.42 1fxo n ASP 141 Ca 0.01 -3.48 0.16 0.00 -0.01 0.00 0.00 54.79 51.46 1fxo n ASP 141 Cb 0.41 -0.66 0.79 0.00 -1.03 0.00 0.00 41.12 40.64 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 4.03 0.00 0.00 0.11 0.13 -1.88 -2.58 132.00 131.80 1fxo h PRO 142 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1fxo h PRO 142 Cb 0.64 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.77 1fxo h PRO 142 CO 0.84 0.08 0.05 -0.85 -0.23 0.00 0.00 178.00 177.89 1fxo n GLU 143 N -3.38 0.12 0.00 0.86 0.00 -1.26 -1.17 120.64 115.80 1fxo n GLU 143 Ca -0.01 0.61 0.13 0.00 0.00 0.00 0.00 57.16 57.89 1fxo n GLU 143 Cb 0.24 -1.94 0.48 0.00 0.00 0.00 0.00 31.44 30.22 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 -2.15 0.73 -4.45 3.44 1.74 -0.97 -4.25 116.66 110.76 1fxo n ARG 144 Ca -0.01 -0.35 -0.24 0.00 -0.77 0.00 0.00 57.85 56.47 1fxo n ARG 144 Cb 0.08 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 29.95 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 -2.51 1.79 0.16 -1.55 1.51 -0.32 -4.83 117.35 111.59 1fxo s TYR 145 Ca 0.26 -1.48 -0.30 0.00 -1.01 0.00 0.00 57.07 54.54 1fxo s TYR 145 Cb 0.20 -0.99 -0.08 0.00 -0.11 0.00 0.00 41.96 40.97 1fxo s TYR 145 CO 0.51 -0.55 1.24 0.20 -1.11 0.00 0.00 175.55 175.83 1fxo s GLY 146 N -3.55 2.50 -0.12 0.71 0.00 -1.26 -0.37 107.32 105.22 1fxo s GLY 146 Ca 0.28 0.98 0.00 0.00 0.00 0.00 0.00 44.72 45.99 1fxo s GLY 146 CO 0.20 1.99 -0.14 0.14 0.00 0.00 0.00 173.10 175.29 1fxo s VAL 147 N 0.32 2.99 -0.15 1.40 1.01 0.37 -0.08 120.40 126.27 1fxo s VAL 147 Ca 0.56 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.81 1fxo s VAL 147 Cb -0.33 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 1fxo s VAL 147 CO 0.35 0.53 -0.00 0.54 0.00 0.00 0.00 175.10 176.52 1fxo s VAL 148 N 0.27 4.24 -0.14 2.92 0.11 -0.46 -2.01 120.40 125.33 1fxo s VAL 148 Ca -0.10 -0.24 -0.05 0.00 -2.93 0.00 0.00 61.98 58.66 1fxo s VAL 148 Cb -0.16 -2.86 -0.04 0.00 -1.53 0.00 0.00 36.38 31.80 1fxo s VAL 148 CO 0.06 0.51 0.04 -0.70 -3.33 0.00 0.00 175.10 171.67 1fxo s GLU 149 N 0.09 3.56 0.12 1.54 2.12 -0.40 -4.48 118.70 121.26 1fxo s GLU 149 Ca 0.02 -0.37 0.07 0.00 0.36 0.00 0.00 54.97 55.05 1fxo s GLU 149 Cb -0.13 -3.03 -0.04 0.00 0.26 0.00 0.00 34.13 31.19 1fxo s GLU 149 CO 0.02 0.46 -0.07 -0.06 -0.54 0.00 0.00 175.26 175.07 1fxo s PHE 150 N -0.18 2.79 0.92 5.30 0.40 -1.26 -0.06 117.98 125.89 1fxo s PHE 150 Ca 0.06 -0.14 -0.15 0.00 -0.60 0.00 0.00 56.93 56.11 1fxo s PHE 150 Cb -0.12 -1.42 0.21 0.00 0.51 0.00 0.00 43.02 42.19 1fxo s PHE 150 CO 0.02 0.46 1.26 -0.40 0.70 0.00 0.00 175.22 177.25 1fxo n ASP 151 N 0.46 0.19 0.28 1.36 5.68 0.53 -4.87 116.55 120.19 1fxo n ASP 151 Ca -0.12 -1.51 0.12 0.00 -0.50 0.00 0.00 54.79 52.78 1fxo n ASP 151 Cb 0.53 -0.95 0.80 0.00 -1.14 0.00 0.00 41.12 40.36 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 -1.23 115.11 113.04 1fxo h GLN 152 Ca -0.41 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.79 1fxo h GLN 152 Cb 1.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.57 1fxo h GLN 152 CO 0.30 0.01 0.00 0.41 -0.95 0.00 0.00 178.83 178.60 1fxo n GLY 153 N -1.37 -0.17 0.64 3.46 0.00 -1.26 -4.93 105.19 101.56 1fxo n GLY 153 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 1.14 0.80 3.69 -0.02 0.00 -0.46 -5.05 105.19 105.29 1fxo n GLY 154 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1fxo n GLY 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fxo s LYS 155 N -0.72 4.27 0.11 1.61 2.20 -1.26 -4.78 119.74 121.18 1fxo s LYS 155 Ca 0.00 0.55 -0.31 0.00 -0.36 0.00 0.00 55.97 55.85 1fxo s LYS 155 Cb 0.00 -3.51 -0.09 0.00 -1.51 0.00 0.00 37.83 32.72 1fxo s LYS 155 CO 0.00 -0.06 1.59 0.00 -0.36 0.00 0.00 175.35 176.52 1fxo s ALA 156 N 1.31 3.71 0.00 3.13 0.00 -1.26 -0.35 121.76 128.30 1fxo s ALA 156 Ca 0.28 1.25 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1fxo s ALA 156 Cb -0.16 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.31 1fxo s ALA 156 CO 0.11 -0.93 0.00 0.44 0.00 0.00 0.00 175.76 175.38 1fxo n ILE 157 N 4.37 0.00 -3.59 0.00 -5.35 0.91 -4.89 119.36 110.82 1fxo n ILE 157 Ca 0.15 -0.08 -0.14 0.00 -0.27 0.00 0.00 62.75 62.41 1fxo n ILE 157 Cb 0.40 0.57 -0.05 0.00 -1.74 0.00 0.00 39.64 38.82 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 -1.79 -0.41 -0.02 7.28 1.04 -1.17 -5.00 113.70 113.63 1fxo s SER 158 Ca 0.00 0.13 0.02 0.00 0.48 0.00 0.00 55.95 56.58 1fxo s SER 158 Cb 0.00 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.61 1fxo s SER 158 CO 0.00 -0.72 -0.08 -0.76 0.98 0.00 0.00 173.24 172.65 1fxo s LEU 159 N -2.02 1.79 -0.01 2.42 1.43 -1.26 -1.28 118.68 119.75 1fxo s LEU 159 Ca -0.05 -0.17 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 1fxo s LEU 159 Cb -0.01 -0.52 0.00 0.00 0.03 0.00 0.00 46.19 45.70 1fxo s LEU 159 CO -0.02 0.06 -0.04 -1.61 0.23 0.00 0.00 176.35 174.97 1fxo s GLU 160 N 0.19 0.37 -0.25 1.70 2.02 -0.85 -4.97 118.70 116.90 1fxo s GLU 160 Ca -0.03 -0.12 -0.18 0.00 0.02 0.00 0.00 54.97 54.67 1fxo s GLU 160 Cb -0.08 -0.38 -0.03 0.00 0.10 0.00 0.00 34.13 33.74 1fxo s GLU 160 CO 0.00 0.05 0.51 -2.00 0.02 0.00 0.00 175.26 173.84 1fxo s GLU 161 N 0.12 4.10 -1.31 1.61 2.56 -1.26 -0.48 118.70 124.03 1fxo s GLU 161 Ca -0.01 0.33 -0.22 0.00 0.00 0.00 0.00 54.97 55.08 1fxo s GLU 161 Cb -0.04 -3.63 0.03 0.00 2.00 0.00 0.00 34.13 32.49 1fxo s GLU 161 CO -0.00 -0.30 0.49 1.63 -0.56 0.00 0.00 175.26 176.52 1fxo n LYS 162 N 5.34 -0.73 -2.19 4.30 5.02 0.50 -4.89 118.16 125.51 1fxo n LYS 162 Ca -0.04 0.13 -0.41 0.00 -2.02 0.00 0.00 58.31 55.97 1fxo n LYS 162 Cb 0.50 -3.09 -0.03 0.00 -0.02 0.00 0.00 35.03 32.40 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 -7.24 4.41 0.39 1.97 0.04 -1.26 -4.93 135.00 128.38 1fxo s PRO 163 Ca 0.33 2.13 0.17 0.00 0.04 0.00 0.00 61.00 63.67 1fxo s PRO 163 Cb -0.17 -3.10 0.79 0.00 0.04 0.00 0.00 34.50 32.07 1fxo s PRO 163 CO 0.97 -0.12 1.81 -0.07 0.04 0.00 0.00 177.00 179.63 1fxo h LEU 164 N 3.54 0.00 -6.93 -3.56 3.38 -1.90 -3.32 115.31 106.51 1fxo h LEU 164 Ca -0.48 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 56.87 1fxo h LEU 164 Cb 1.22 0.00 -0.42 0.00 0.09 0.00 0.00 40.66 41.56 1fxo h LEU 164 CO 0.66 0.35 -0.62 -0.62 0.09 0.00 0.00 178.44 178.31 1fxo n GLU 165 N -3.79 1.73 -1.64 1.13 1.02 -1.26 -4.99 120.64 112.84 1fxo n GLU 165 Ca -0.01 -4.37 -0.41 0.00 -0.02 0.00 0.00 57.16 52.34 1fxo n GLU 165 Cb 0.43 -2.22 0.01 0.00 -0.02 0.00 0.00 31.44 29.65 1fxo n GLU 165 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1fxo n PRO 166 N 1.94 1.51 0.02 3.49 -0.02 -1.25 -4.89 135.00 135.80 1fxo n PRO 166 Ca 0.22 0.54 0.13 0.00 -2.02 0.00 0.00 63.50 62.37 1fxo n PRO 166 Cb 0.37 -2.16 0.38 0.00 -0.02 0.00 0.00 33.50 32.07 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 0.04 0.06 -3.94 -0.52 5.02 -1.26 -4.90 118.16 112.65 1fxo n LYS 167 Ca 0.09 0.03 -0.11 0.00 -2.02 0.00 0.00 58.31 56.29 1fxo n LYS 167 Cb 0.40 -1.55 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 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 -3.28 0.42 -0.32 4.39 1.04 -1.26 -4.92 113.70 109.77 1fxo s SER 168 Ca 0.11 -1.28 0.10 0.00 0.48 0.00 0.00 55.95 55.36 1fxo s SER 168 Cb 0.17 0.76 0.73 0.00 0.10 0.00 0.00 66.02 67.78 1fxo s SER 168 CO 0.64 -1.49 1.78 0.59 0.98 0.00 0.00 173.24 175.74 1fxo n ASN 169 N -1.36 4.74 -4.39 7.02 3.02 -1.26 -4.84 115.26 118.19 1fxo n ASN 169 Ca -0.04 -3.24 -0.40 0.00 -0.03 0.00 0.00 54.58 50.88 1fxo n ASN 169 Cb 0.61 -0.73 -0.11 0.00 -0.61 0.00 0.00 39.78 38.93 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 -3.00 3.22 0.17 3.10 1.51 -1.26 -1.09 117.35 119.99 1fxo s TYR 170 Ca 0.54 -0.83 -0.15 0.00 -1.01 0.00 0.00 57.07 55.62 1fxo s TYR 170 Cb 0.44 -2.40 -0.07 0.00 -0.11 0.00 0.00 41.96 39.82 1fxo s TYR 170 CO 0.13 -0.58 0.58 0.00 -1.11 0.00 0.00 175.55 174.58 1fxo s ALA 171 N 1.57 3.54 -0.15 3.71 0.00 -0.21 -1.35 121.76 128.87 1fxo s ALA 171 Ca 0.03 -0.09 -0.29 0.00 0.00 0.00 0.00 51.96 51.61 1fxo s ALA 171 Cb -0.18 -2.57 -0.01 0.00 0.00 0.00 0.00 23.12 20.36 1fxo s ALA 171 CO 0.06 0.43 1.09 0.08 0.00 0.00 0.00 175.76 177.42 1fxo s VAL 172 N -1.51 4.59 0.81 0.00 1.01 0.89 -0.81 120.40 125.39 1fxo s VAL 172 Ca 0.40 1.89 -0.12 0.00 0.00 0.00 0.00 61.98 64.15 1fxo s VAL 172 Cb -0.15 -4.22 0.08 0.00 0.00 0.00 0.00 36.38 32.09 1fxo s VAL 172 CO 0.19 -0.09 1.13 0.42 0.00 0.00 0.00 175.10 176.76 1fxo s THR 173 N 2.71 2.53 -0.46 3.92 -4.23 0.10 -4.54 115.64 115.67 1fxo s THR 173 Ca 0.49 0.17 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 1fxo s THR 173 Cb -0.19 -3.05 -0.13 0.00 1.34 0.00 0.00 72.50 70.48 1fxo s THR 173 CO 0.14 -0.22 3.22 0.61 -0.54 0.00 0.00 174.62 177.82 1fxo n GLY 174 N -2.69 3.70 2.95 3.99 0.00 -1.26 -4.74 105.19 107.14 1fxo n GLY 174 Ca 0.07 -1.49 -0.15 0.00 0.00 0.00 0.00 46.02 44.45 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 -0.70 -0.21 -0.02 0.99 2.96 -1.26 -1.52 118.68 118.92 1fxo s LEU 175 Ca 0.64 0.51 0.01 0.00 -0.22 0.00 0.00 54.13 55.07 1fxo s LEU 175 Cb 0.31 0.56 0.01 0.00 0.50 0.00 0.00 46.19 47.56 1fxo s LEU 175 CO -0.07 -0.24 -0.02 -0.31 -1.32 0.00 0.00 176.35 174.39 1fxo s TYR 176 N 2.35 0.29 -0.07 5.38 1.51 0.12 -4.30 117.35 122.63 1fxo s TYR 176 Ca 0.02 -0.03 0.06 0.00 -1.01 0.00 0.00 57.07 56.10 1fxo s TYR 176 Cb -0.12 -0.28 -0.01 0.00 -0.11 0.00 0.00 41.96 41.44 1fxo s TYR 176 CO -0.08 -0.06 -0.24 -0.06 -1.11 0.00 0.00 175.55 174.00 1fxo s PHE 177 N 0.45 2.48 0.03 2.71 0.40 -0.25 -0.63 117.98 123.17 1fxo s PHE 177 Ca -0.04 -0.75 0.03 0.00 -0.60 0.00 0.00 56.93 55.56 1fxo s PHE 177 Cb -0.07 -1.62 -0.02 0.00 0.51 0.00 0.00 43.02 41.81 1fxo s PHE 177 CO -0.01 -0.24 -0.10 0.71 0.70 0.00 0.00 175.22 176.28 1fxo s TYR 178 N -0.09 0.87 0.00 0.36 1.51 -0.07 -0.46 117.35 119.48 1fxo s TYR 178 Ca -0.06 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.64 1fxo s TYR 178 Cb -0.14 -0.52 0.00 0.00 -0.11 0.00 0.00 41.96 41.18 1fxo s TYR 178 CO 0.04 -0.01 0.00 -0.40 -1.11 0.00 0.00 175.55 174.07 1fxo n ASP 179 N 1.90 0.00 0.00 2.29 5.68 -0.42 -1.27 116.55 124.73 1fxo n ASP 179 Ca -0.19 -0.27 0.13 0.00 -0.50 0.00 0.00 54.79 53.95 1fxo n ASP 179 Cb 0.55 0.00 0.74 0.00 -1.14 0.00 0.00 41.12 41.28 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 -0.27 0.81 0.07 0.11 6.02 -1.26 -3.52 117.38 119.33 1fxo n GLN 180 Ca 0.00 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.12 1fxo n GLN 180 Cb 0.00 -1.48 0.44 0.00 1.02 0.00 0.00 30.24 30.22 1fxo n GLN 180 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1fxo n GLN 181 N -0.98 0.18 -0.10 -1.09 6.02 -1.26 -4.35 117.38 115.79 1fxo n GLN 181 Ca 0.19 0.13 -0.12 0.00 -0.01 0.00 0.00 57.00 57.19 1fxo n GLN 181 Cb 0.09 -1.69 0.00 0.00 1.02 0.00 0.00 30.24 29.65 1fxo n GLN 181 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 1fxo h VAL 182 N 0.00 1.28 -0.22 5.09 3.04 -1.94 -2.49 116.25 121.01 1fxo h VAL 182 Ca 0.00 -1.56 -0.02 0.00 -1.01 0.00 0.00 66.70 64.12 1fxo h VAL 182 Cb 0.66 1.40 -0.01 0.00 -2.01 0.00 0.00 31.29 31.33 1fxo h VAL 182 CO 0.00 0.52 0.07 0.58 -1.01 0.00 0.00 177.57 177.73 1fxo h VAL 183 N 0.72 1.18 -0.08 1.51 2.07 -1.87 -0.30 116.25 119.49 1fxo h VAL 183 Ca 0.06 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 1fxo h VAL 183 Cb 0.96 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1fxo h VAL 183 CO 0.09 0.18 -0.20 0.44 0.02 0.00 0.00 177.57 178.10 1fxo h ASP 184 N 0.18 0.12 -0.30 0.57 3.32 -1.82 0.36 116.42 118.84 1fxo h ASP 184 Ca 0.07 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1fxo h ASP 184 Cb 0.21 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1fxo h ASP 184 CO -0.00 0.33 0.01 0.40 -1.72 0.00 0.00 179.24 178.26 1fxo h ILE 185 N 0.12 1.25 -0.42 0.35 2.04 -0.96 -2.78 117.51 117.10 1fxo h ILE 185 Ca 0.02 -0.91 -0.08 0.00 1.00 0.00 0.00 64.86 64.89 1fxo h ILE 185 Cb 0.43 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1fxo h ILE 185 CO 0.03 0.29 -0.08 0.00 0.00 0.00 0.00 178.15 178.39 1fxo h ALA 186 N 0.85 1.06 -0.01 1.87 0.00 -0.45 -2.40 119.26 120.18 1fxo h ALA 186 Ca 0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 1fxo h ALA 186 Cb 0.41 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1fxo h ALA 186 CO 0.01 0.58 -0.13 0.00 0.00 0.00 0.00 179.25 179.71 1fxo h ARG 187 N 0.68 0.02 0.00 0.00 3.08 -0.76 -2.18 114.38 115.22 1fxo h ARG 187 Ca 0.12 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1fxo h ARG 187 Cb 0.54 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 1fxo h ARG 187 CO 0.03 0.15 -0.33 -0.25 -1.07 0.00 0.00 179.97 178.50 1fxo n ASP 188 N -4.37 0.38 -4.76 7.04 8.00 -0.92 -4.91 116.55 117.00 1fxo n ASP 188 Ca -0.02 0.09 -0.36 0.00 0.71 0.00 0.00 54.79 55.20 1fxo n ASP 188 Cb 0.21 -0.06 0.01 0.00 -0.02 0.00 0.00 41.12 41.26 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 -3.25 3.81 0.15 0.64 1.43 -0.82 -5.06 118.68 115.57 1fxo s LEU 189 Ca 0.11 2.34 0.10 0.00 -1.03 0.00 0.00 54.13 55.65 1fxo s LEU 189 Cb 0.17 -4.46 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1fxo s LEU 189 CO 0.64 -1.28 -0.20 -0.54 0.23 0.00 0.00 176.35 175.20 1fxo s LYS 190 N -3.09 1.67 0.34 1.70 -0.14 -1.26 -5.07 119.74 113.89 1fxo s LYS 190 Ca 0.71 -1.31 -0.27 0.00 -1.36 0.00 0.00 55.97 53.74 1fxo s LYS 190 Cb -0.29 -2.01 -0.12 0.00 -1.68 0.00 0.00 37.83 33.73 1fxo s LYS 190 CO 0.33 0.45 1.16 -2.30 -0.76 0.00 0.00 175.35 174.22 1fxo n PRO 191 N 0.60 1.75 -1.67 -1.68 -0.02 -1.26 -4.77 135.00 127.94 1fxo n PRO 191 Ca -0.15 0.62 -0.29 0.00 -2.02 0.00 0.00 63.50 61.65 1fxo n PRO 191 Cb 0.54 -2.13 0.22 0.00 -0.02 0.00 0.00 33.50 32.10 1fxo n PRO 191 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1fxo n SER 192 N 0.83 -0.48 0.14 2.55 3.41 0.28 -4.83 113.62 115.52 1fxo n SER 192 Ca 0.07 -1.40 0.05 0.00 -0.26 0.00 0.00 58.87 57.34 1fxo n SER 192 Cb 0.35 -1.01 0.50 0.00 -0.26 0.00 0.00 64.21 63.79 1fxo n SER 192 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1fxo h PRO 193 N 0.00 0.23 -0.86 4.33 0.10 -1.95 -1.51 132.00 132.34 1fxo h PRO 193 Ca -0.42 -0.03 -0.14 0.00 0.10 0.00 0.00 66.00 65.51 1fxo h PRO 193 Cb 1.20 -0.05 -0.08 0.00 0.10 0.00 0.00 31.00 32.17 1fxo h PRO 193 CO 0.29 0.22 0.17 2.89 0.10 0.00 0.00 178.00 181.68 1fxo n ARG 194 N -4.43 2.65 -1.25 1.05 1.85 -1.26 -4.90 116.66 110.36 1fxo n ARG 194 Ca -0.00 -1.85 -0.09 0.00 -1.00 0.00 0.00 57.85 54.91 1fxo n ARG 194 Cb 0.14 -1.85 -0.04 0.00 -1.05 0.00 0.00 32.46 29.66 1fxo n ARG 194 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1fxo n GLY 195 N -0.00 0.99 3.41 2.89 0.00 -0.57 -5.02 105.19 106.89 1fxo n GLY 195 Ca 0.25 -0.31 -0.27 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.48 1.47 -0.55 1.61 0.41 -1.26 -4.71 118.70 113.20 1fxo s GLU 196 Ca 0.00 -1.47 -0.23 0.00 -0.41 0.00 0.00 54.97 52.86 1fxo s GLU 196 Cb 0.00 -1.84 0.05 0.00 -1.78 0.00 0.00 34.13 30.55 1fxo s GLU 196 CO 0.00 0.41 0.90 -0.51 -0.49 0.00 0.00 175.26 175.57 1fxo s LEU 197 N -2.48 4.23 -0.07 1.80 1.43 0.05 -0.56 118.68 123.08 1fxo s LEU 197 Ca 0.18 -0.46 -0.19 0.00 -1.03 0.00 0.00 54.13 52.64 1fxo s LEU 197 Cb -0.08 -2.76 -0.05 0.00 0.03 0.00 0.00 46.19 43.33 1fxo s LEU 197 CO 0.09 -1.19 0.51 -1.61 0.23 0.00 0.00 176.35 174.38 1fxo s GLU 198 N 3.77 4.29 0.47 1.70 0.41 -1.26 -1.43 118.70 126.65 1fxo s GLU 198 Ca 0.28 0.55 0.16 0.00 -0.41 0.00 0.00 54.97 55.55 1fxo s GLU 198 Cb -0.14 -3.39 1.10 0.00 -1.78 0.00 0.00 34.13 29.92 1fxo s GLU 198 CO 0.18 0.27 2.02 0.97 -0.49 0.00 0.00 175.26 178.21 1fxo h ILE 199 N 4.45 1.04 -0.29 -1.63 6.09 -1.94 -1.50 117.51 123.74 1fxo h ILE 199 Ca -0.43 -0.55 -0.03 0.00 -1.37 0.00 0.00 64.86 62.48 1fxo h ILE 199 Cb 1.19 1.30 -0.02 0.00 0.47 0.00 0.00 36.82 39.76 1fxo h ILE 199 CO 0.72 0.15 0.03 0.74 -3.07 0.00 0.00 178.15 176.73 1fxo h THR 200 N 0.00 1.16 -0.20 2.19 2.02 -1.99 -0.55 112.91 115.55 1fxo h THR 200 Ca -0.00 -0.61 -0.13 0.00 0.77 0.00 0.00 66.41 66.44 1fxo h THR 200 Cb 0.29 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 1fxo h THR 200 CO 0.02 0.21 -0.41 0.44 0.37 0.00 0.00 175.52 176.15 1fxo h ASP 201 N 0.42 0.49 -0.33 4.18 3.32 -1.69 0.39 116.42 123.21 1fxo h ASP 201 Ca 0.10 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1fxo h ASP 201 Cb 0.23 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1fxo h ASP 201 CO 0.00 0.85 0.18 0.58 -1.72 0.00 0.00 179.24 179.13 1fxo h VAL 202 N 0.38 1.14 -0.43 -1.35 2.07 -1.04 -2.08 116.25 114.93 1fxo h VAL 202 Ca 0.03 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 1fxo h VAL 202 Cb 0.89 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1fxo h VAL 202 CO 0.08 0.14 -0.09 0.78 0.02 0.00 0.00 177.57 178.49 1fxo h ASN 203 N 0.41 0.75 -0.71 0.57 2.35 -0.77 -1.98 115.58 116.20 1fxo h ASN 203 Ca 0.12 -0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1fxo h ASN 203 Cb 0.06 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.20 1fxo h ASN 203 CO -0.02 0.87 0.38 -0.09 -1.65 0.00 0.00 177.43 176.92 1fxo h ARG 204 N 0.70 1.03 -0.46 0.81 2.43 -0.82 -0.33 114.38 117.73 1fxo h ARG 204 Ca 0.12 -0.13 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1fxo h ARG 204 Cb 0.56 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 1fxo h ARG 204 CO 0.03 0.77 0.26 0.00 -1.51 0.00 0.00 179.97 179.53 1fxo h ALA 205 N 1.39 0.59 -0.51 2.80 0.00 -0.65 0.16 119.26 123.04 1fxo h ALA 205 Ca 0.26 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1fxo h ALA 205 Cb 0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1fxo h ALA 205 CO -0.04 -0.06 0.25 1.88 0.00 0.00 0.00 179.25 181.28 1fxo h TYR 206 N 0.53 0.73 -0.74 0.00 -1.99 -1.06 -2.98 116.97 111.46 1fxo h TYR 206 Ca 0.19 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.88 1fxo h TYR 206 Cb 0.04 -0.23 -0.04 0.00 2.00 0.00 0.00 36.73 38.50 1fxo h TYR 206 CO -0.08 0.57 0.46 1.25 -0.00 0.00 0.00 178.16 180.37 1fxo h LEU 207 N 0.68 0.88 -1.94 3.88 5.85 -0.08 -0.52 115.31 124.05 1fxo h LEU 207 Ca 0.18 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1fxo h LEU 207 Cb 0.11 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.92 1fxo h LEU 207 CO -0.02 0.67 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.41 1fxo h GLU 208 N 1.01 0.03 -0.29 1.25 5.08 -0.66 -0.28 114.58 120.71 1fxo h GLU 208 Ca 0.27 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1fxo h GLU 208 Cb -0.06 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1fxo h GLU 208 CO -0.05 0.04 0.00 0.54 -1.00 0.00 0.00 179.01 178.54 1fxo n ARG 209 N -4.51 1.92 -2.26 2.33 1.74 -0.61 -4.93 116.66 110.35 1fxo n ARG 209 Ca -0.03 -1.41 -0.15 0.00 -0.77 0.00 0.00 57.85 55.50 1fxo n ARG 209 Cb 0.10 -1.38 -0.01 0.00 -1.02 0.00 0.00 32.46 30.15 1fxo n ARG 209 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fxo n GLY 210 N 1.19 -0.19 0.09 -0.13 0.00 -0.12 -4.91 105.19 101.13 1fxo n GLY 210 Ca 0.16 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.42 1.47 -3.54 1.61 6.02 -0.30 -4.97 117.38 115.24 1fxo n GLN 211 Ca -0.17 -2.17 -0.40 0.00 -0.01 0.00 0.00 57.00 54.25 1fxo n GLN 211 Cb 0.63 -1.28 -0.11 0.00 1.02 0.00 0.00 30.24 30.50 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 -2.17 4.42 -0.33 1.08 2.96 -1.22 -1.11 118.68 122.31 1fxo s LEU 212 Ca 0.22 -0.34 -0.16 0.00 -0.22 0.00 0.00 54.13 53.62 1fxo s LEU 212 Cb 0.19 -2.13 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 1fxo s LEU 212 CO 0.02 -0.20 0.42 -0.55 -1.32 0.00 0.00 176.35 174.72 1fxo s SER 213 N 1.73 6.24 -0.37 3.68 0.15 0.72 -4.92 113.70 120.93 1fxo s SER 213 Ca 0.06 -0.08 -0.10 0.00 0.70 0.00 0.00 55.95 56.53 1fxo s SER 213 Cb -0.17 -2.22 0.04 0.00 -1.71 0.00 0.00 66.02 61.95 1fxo s SER 213 CO 0.11 -0.37 0.18 -0.69 1.20 0.00 0.00 173.24 173.67 1fxo s VAL 214 N 2.16 4.32 -0.15 4.45 1.01 -1.26 -1.50 120.40 129.43 1fxo s VAL 214 Ca 0.15 -0.99 -0.08 0.00 0.00 0.00 0.00 61.98 61.06 1fxo s VAL 214 Cb -0.16 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 1fxo s VAL 214 CO 0.12 -0.25 0.13 -1.61 0.00 0.00 0.00 175.10 173.50 1fxo s GLU 215 N 1.50 3.73 0.16 2.72 0.41 -0.36 -4.94 118.70 121.92 1fxo s GLU 215 Ca 0.01 -0.17 -0.31 0.00 -0.41 0.00 0.00 54.97 54.09 1fxo s GLU 215 Cb -0.20 -3.27 -0.08 0.00 -1.78 0.00 0.00 34.13 28.80 1fxo s GLU 215 CO 0.05 0.59 1.35 0.42 -0.49 0.00 0.00 175.26 177.18 1fxo s ILE 216 N -0.47 3.25 -0.43 -1.63 -1.09 -1.26 -1.33 121.20 118.23 1fxo s ILE 216 Ca 0.12 0.97 -0.13 0.00 -2.23 0.00 0.00 60.65 59.37 1fxo s ILE 216 Cb -0.12 -3.62 0.05 0.00 -1.58 0.00 0.00 42.46 37.20 1fxo s ILE 216 CO 0.02 0.11 0.31 -0.32 -1.23 0.00 0.00 174.94 173.83 1fxo s MET 217 N 0.45 2.89 0.91 2.79 -2.45 -0.10 -4.84 119.30 118.93 1fxo s MET 217 Ca 0.60 -1.23 -0.11 0.00 -1.25 0.00 0.00 55.69 53.70 1fxo s MET 217 Cb -0.37 -3.96 0.14 0.00 1.25 0.00 0.00 34.83 31.89 1fxo s MET 217 CO 0.35 -0.88 1.09 0.20 1.05 0.00 0.00 175.02 176.83 1fxo s GLY 218 N 2.08 1.63 0.51 2.11 0.00 -1.26 -4.46 107.32 107.92 1fxo s GLY 218 Ca 0.04 0.04 0.34 0.00 0.00 0.00 0.00 44.72 45.14 1fxo s GLY 218 CO 0.07 0.53 2.04 0.07 0.00 0.00 0.00 173.10 175.81 1fxo h ARG 219 N -1.63 0.00 0.00 2.90 0.11 -1.97 -1.42 114.38 112.37 1fxo h ARG 219 Ca -0.49 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 59.57 1fxo h ARG 219 Cb 1.28 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.36 1fxo h ARG 219 CO 0.52 0.00 -0.07 0.78 0.10 0.00 0.00 179.97 181.30 1fxo h GLY 220 N 0.37 0.00 -3.22 0.08 0.00 -1.98 -3.43 103.07 94.89 1fxo h GLY 220 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.82 1fxo h GLY 220 CO 0.00 0.00 0.05 -0.19 0.00 0.00 0.00 176.54 176.40 1fxo s TYR 221 N -3.86 3.44 -0.22 5.60 1.51 -0.54 -4.70 117.35 118.58 1fxo s TYR 221 Ca -0.01 1.17 -0.14 0.00 -1.01 0.00 0.00 57.07 57.08 1fxo s TYR 221 Cb 0.11 -2.49 -0.04 0.00 -0.11 0.00 0.00 41.96 39.43 1fxo s TYR 221 CO 0.55 0.19 0.32 0.00 -1.11 0.00 0.00 175.55 175.49 1fxo s ALA 222 N -1.85 3.57 -0.26 3.71 0.00 0.64 -4.95 121.76 122.62 1fxo s ALA 222 Ca 0.50 -0.69 0.02 0.00 0.00 0.00 0.00 51.96 51.80 1fxo s ALA 222 Cb -0.12 -2.55 0.06 0.00 0.00 0.00 0.00 23.12 20.51 1fxo s ALA 222 CO 0.19 -0.33 -0.08 -0.46 0.00 0.00 0.00 175.76 175.08 1fxo s TRP 223 N 1.36 3.02 0.20 0.00 -0.00 -1.26 -0.59 118.94 121.66 1fxo s TRP 223 Ca 0.15 -2.19 0.11 0.00 -0.00 0.00 0.00 56.10 54.17 1fxo s TRP 223 Cb -0.15 -1.87 -0.04 0.00 -0.00 0.00 0.00 33.47 31.41 1fxo s TRP 223 CO 0.07 -0.85 -0.21 -0.51 -0.00 0.00 0.00 176.95 175.45 1fxo s LEU 224 N 1.18 2.55 -0.14 5.86 1.43 0.53 -4.99 118.68 125.10 1fxo s LEU 224 Ca -0.07 -0.82 -0.00 0.00 -1.03 0.00 0.00 54.13 52.20 1fxo s LEU 224 Cb -0.20 -1.26 0.03 0.00 0.03 0.00 0.00 46.19 44.79 1fxo s LEU 224 CO -0.06 0.11 -0.09 -0.62 0.23 0.00 0.00 176.35 175.92 1fxo s ASP 225 N -2.77 2.52 -0.07 2.29 -1.08 -1.26 -0.93 116.67 115.38 1fxo s ASP 225 Ca 0.22 -0.46 0.00 0.00 -0.52 0.00 0.00 52.55 51.80 1fxo s ASP 225 Cb -0.08 -0.98 0.07 0.00 -1.46 0.00 0.00 42.92 40.47 1fxo s ASP 225 CO 0.11 -0.11 1.51 0.35 0.52 0.00 0.00 175.17 177.55 1fxo n THR 226 N 4.87 1.68 0.53 1.71 -2.24 -0.95 -4.54 114.28 115.34 1fxo n THR 226 Ca -0.14 -0.48 0.12 0.00 -2.27 0.00 0.00 64.05 61.28 1fxo n THR 226 Cb 0.49 -1.17 0.45 0.00 -2.10 0.00 0.00 70.33 68.01 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 0.71 -1.44 3.41 3.38 0.00 -1.26 -4.58 105.19 105.41 1fxo n GLY 227 Ca 0.07 0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.19 1.27 0.16 2.61 -4.23 -1.26 -4.85 115.64 106.15 1fxo s THR 228 Ca 0.07 -2.05 -0.15 0.00 -1.18 0.00 0.00 61.69 58.39 1fxo s THR 228 Cb 0.11 -2.56 0.03 0.00 1.34 0.00 0.00 72.50 71.42 1fxo s THR 228 CO 0.47 -0.19 1.81 0.45 -0.54 0.00 0.00 174.62 176.62 1fxo h HIS 229 N 2.27 0.50 -0.39 3.99 3.86 -1.97 -1.58 115.15 121.83 1fxo h HIS 229 Ca -0.40 0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 58.76 1fxo h HIS 229 Cb 1.23 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 29.53 1fxo h HIS 229 CO 0.61 0.29 -0.03 -0.44 0.86 0.00 0.00 177.93 179.22 1fxo h ASP 230 N 0.53 0.70 0.40 2.45 3.32 -1.97 -2.55 116.42 119.30 1fxo h ASP 230 Ca 0.17 -0.33 -0.12 0.00 0.02 0.00 0.00 57.03 56.78 1fxo h ASP 230 Cb -0.01 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.34 1fxo h ASP 230 CO -0.07 0.86 -0.50 0.77 -1.72 0.00 0.00 179.24 178.58 1fxo h SER 231 N 0.52 0.13 -0.50 6.45 4.64 -1.84 -1.14 113.55 121.81 1fxo h SER 231 Ca 0.11 -0.06 -0.09 0.00 -0.47 0.00 0.00 61.79 61.28 1fxo h SER 231 Cb 0.51 -0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1fxo h SER 231 CO 0.03 0.61 -0.02 0.25 -0.87 0.00 0.00 176.83 176.83 1fxo h LEU 232 N 0.09 0.88 -0.19 5.97 5.85 -1.22 -1.01 115.31 125.68 1fxo h LEU 232 Ca 0.00 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1fxo h LEU 232 Cb 0.93 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1fxo h LEU 232 CO 0.07 0.99 0.12 0.25 -0.34 0.00 0.00 178.44 179.53 1fxo h LEU 233 N 0.76 0.22 -0.81 2.25 5.85 -1.15 -0.64 115.31 121.79 1fxo h LEU 233 Ca 0.14 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.89 1fxo h LEU 233 Cb 0.55 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 1fxo h LEU 233 CO 0.03 0.18 0.50 -0.33 -0.34 0.00 0.00 178.44 178.48 1fxo h GLU 234 N 0.24 0.90 -0.35 1.25 5.08 -1.12 -1.69 114.58 118.89 1fxo h GLU 234 Ca 0.07 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 1fxo h GLU 234 Cb -0.01 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1fxo h GLU 234 CO -0.01 0.60 -0.25 0.00 -1.00 0.00 0.00 179.01 178.35 1fxo h ALA 235 N 1.38 0.91 -0.60 3.43 0.00 -0.93 -0.90 119.26 122.54 1fxo h ALA 235 Ca 0.35 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1fxo h ALA 235 Cb 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1fxo h ALA 235 CO -0.16 0.62 0.30 0.78 0.00 0.00 0.00 179.25 180.79 1fxo h GLY 236 N 0.98 0.93 1.19 0.00 0.00 -0.62 -1.98 103.07 103.57 1fxo h GLY 236 Ca 0.08 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.87 1fxo h GLY 236 CO 0.06 0.43 -0.01 1.46 0.00 0.00 0.00 176.54 178.47 1fxo h GLN 237 N 0.82 0.97 -0.09 4.80 4.20 -1.03 -1.26 115.11 123.52 1fxo h GLN 237 Ca 0.21 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1fxo h GLN 237 Cb 0.11 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 1fxo h GLN 237 CO -0.03 0.96 0.06 0.35 -0.67 0.00 0.00 178.83 179.50 1fxo h PHE 238 N 0.89 0.11 -0.63 2.96 3.57 -0.94 -0.20 116.94 122.70 1fxo h PHE 238 Ca 0.16 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.59 1fxo h PHE 238 Cb 0.54 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 1fxo h PHE 238 CO 0.03 0.07 0.11 0.82 -2.23 0.00 0.00 178.31 177.11 1fxo h ILE 239 N 0.12 1.26 -0.48 1.41 1.08 -1.29 -2.32 117.51 117.29 1fxo h ILE 239 Ca 0.03 -1.00 -0.01 0.00 -0.39 0.00 0.00 64.86 63.50 1fxo h ILE 239 Cb -0.01 0.69 -0.02 0.00 -3.07 0.00 0.00 36.82 34.41 1fxo h ILE 239 CO -0.01 0.37 0.27 0.00 -0.69 0.00 0.00 178.15 178.10 1fxo h ALA 240 N 1.03 0.62 -0.10 1.87 0.00 -0.97 0.62 119.26 122.33 1fxo h ALA 240 Ca 0.19 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1fxo h ALA 240 Cb 0.42 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1fxo h ALA 240 CO 0.01 0.13 0.05 1.15 0.00 0.00 0.00 179.25 180.59 1fxo h THR 241 N 0.64 1.11 -0.32 0.00 2.02 -0.89 -0.54 112.91 114.92 1fxo h THR 241 Ca 0.17 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1fxo h THR 241 Cb 0.04 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 1fxo h THR 241 CO -0.03 0.09 0.21 -0.07 0.37 0.00 0.00 175.52 176.09 1fxo h LEU 242 N 0.04 0.38 -0.46 2.58 3.38 -1.18 -2.19 115.31 117.86 1fxo h LEU 242 Ca 0.03 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1fxo h LEU 242 Cb 0.10 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1fxo h LEU 242 CO -0.00 0.29 0.11 -0.33 0.09 0.00 0.00 178.44 178.60 1fxo h GLU 243 N 0.43 0.73 0.00 1.13 5.08 -0.60 -1.35 114.58 120.00 1fxo h GLU 243 Ca 0.12 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 1fxo h GLU 243 Cb -0.03 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1fxo h GLU 243 CO -0.02 0.73 -0.47 -0.91 -1.00 0.00 0.00 179.01 177.34 1fxo h ASN 244 N 0.61 0.00 -0.19 1.42 2.35 -1.14 -0.04 115.58 118.59 1fxo h ASN 244 Ca 0.14 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.76 1fxo h ASN 244 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1fxo h ASN 244 CO 0.00 0.47 -0.42 -0.09 -1.65 0.00 0.00 177.43 175.74 1fxo h ARG 245 N 0.00 0.62 0.00 0.81 9.65 -1.09 -3.37 114.38 120.99 1fxo h ARG 245 Ca -0.00 -0.41 -0.21 0.00 -1.10 0.00 0.00 59.98 58.26 1fxo h ARG 245 Cb 0.88 0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 29.48 1fxo h ARG 245 CO 0.06 1.03 -1.63 1.04 2.80 0.00 0.00 179.97 183.27 1fxo n GLN 246 N -4.23 0.63 -1.52 0.20 6.02 -0.53 -4.95 117.38 112.99 1fxo n GLN 246 Ca -0.06 0.18 -0.11 0.00 -0.01 0.00 0.00 57.00 57.01 1fxo n GLN 246 Cb 0.55 -1.75 -0.04 0.00 1.02 0.00 0.00 30.24 30.02 1fxo n GLN 246 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1fxo n GLY 247 N 1.46 0.89 3.43 1.08 0.00 -0.04 -5.02 105.19 106.98 1fxo n GLY 247 Ca -0.14 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.56 2.56 -0.04 0.99 1.43 -1.24 -5.09 118.68 114.73 1fxo s LEU 248 Ca 0.00 -1.00 0.05 0.00 -1.03 0.00 0.00 54.13 52.15 1fxo s LEU 248 Cb 0.00 -1.00 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1fxo s LEU 248 CO 0.00 -0.00 -0.18 -0.54 0.23 0.00 0.00 176.35 175.86 1fxo s LYS 249 N -3.40 2.36 -0.03 1.70 1.02 -1.26 -4.33 119.74 115.80 1fxo s LYS 249 Ca 0.27 -0.78 -0.24 0.00 0.02 0.00 0.00 55.97 55.24 1fxo s LYS 249 Cb -0.04 -2.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.96 1fxo s LYS 249 CO 0.12 0.60 0.72 0.08 -0.92 0.00 0.00 175.35 175.96 1fxo s VAL 250 N -0.71 4.96 -1.02 3.17 1.01 -1.26 -4.48 120.40 122.07 1fxo s VAL 250 Ca 0.11 1.51 -0.06 0.00 0.00 0.00 0.00 61.98 63.54 1fxo s VAL 250 Cb -0.10 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 32.22 1fxo s VAL 250 CO 0.00 0.28 0.89 0.00 0.00 0.00 0.00 175.10 176.27 1fxo n ALA 251 N 3.50 -1.02 -2.60 5.51 0.00 -1.26 -4.96 120.51 119.68 1fxo n ALA 251 Ca -0.01 0.29 -0.43 0.00 0.00 0.00 0.00 53.44 53.28 1fxo n ALA 251 Cb 0.51 -4.16 -0.04 0.00 0.00 0.00 0.00 19.45 15.75 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 9.16 0.67 -0.53 0.00 0.11 -1.93 -1.83 132.00 137.65 1fxo h PRO 253 Ca -0.25 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.82 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 1.04 0.45 0.35 0.93 -0.21 0.00 0.00 178.00 180.55 1fxo h GLU 254 N 0.69 0.70 -0.02 1.05 3.07 -1.95 -0.41 114.58 117.71 1fxo h GLU 254 Ca 0.22 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 1fxo h GLU 254 Cb 0.02 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 27.77 1fxo h GLU 254 CO -0.05 0.47 0.01 1.49 -1.40 0.00 0.00 179.01 179.53 1fxo h GLU 255 N 0.71 0.03 -0.51 2.33 4.81 -1.77 -2.12 114.58 118.06 1fxo h GLU 255 Ca 0.19 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1fxo h GLU 255 Cb -0.07 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1fxo h GLU 255 CO -0.04 0.04 0.14 0.82 -0.73 0.00 0.00 179.01 179.24 1fxo h ILE 256 N 0.01 1.24 -0.70 2.32 2.04 -1.16 0.49 117.51 121.74 1fxo h ILE 256 Ca 0.01 -0.82 0.03 0.00 1.00 0.00 0.00 64.86 65.08 1fxo h ILE 256 Cb 0.01 0.80 -0.05 0.00 -0.74 0.00 0.00 36.82 36.85 1fxo h ILE 256 CO -0.00 0.30 0.44 0.00 0.00 0.00 0.00 178.15 178.88 1fxo h ALA 257 N 1.01 0.92 -0.39 1.87 0.00 -1.07 -0.08 119.26 121.53 1fxo h ALA 257 Ca 0.16 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1fxo h ALA 257 Cb 0.31 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1fxo h ALA 257 CO -0.00 0.21 0.16 -0.92 0.00 0.00 0.00 179.25 178.70 1fxo h TYR 258 N 0.85 0.58 -0.29 0.00 3.20 -0.92 0.10 116.97 120.48 1fxo h TYR 258 Ca 0.29 -0.04 -0.07 0.00 3.14 0.00 0.00 58.73 62.05 1fxo h TYR 258 Cb 0.03 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 1fxo h TYR 258 CO -0.04 0.51 -0.10 0.00 -1.64 0.00 0.00 178.16 176.89 1fxo h ARG 259 N 0.48 0.49 -0.00 1.82 3.08 -0.33 -1.50 114.38 118.42 1fxo h ARG 259 Ca 0.13 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1fxo h ARG 259 Cb 0.17 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1fxo h ARG 259 CO -0.01 0.59 -0.03 1.04 -1.07 0.00 0.00 179.97 180.49 1fxo n GLN 260 N -4.22 0.78 -1.81 0.04 1.13 -0.10 -4.91 117.38 108.29 1fxo n GLN 260 Ca 0.01 -0.12 -0.13 0.00 -1.94 0.00 0.00 57.00 54.82 1fxo n GLN 260 Cb 0.30 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.12 1fxo n GLN 260 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1fxo n LYS 261 N -1.01 -0.98 0.18 -1.09 5.02 -0.56 -4.90 118.16 114.82 1fxo n LYS 261 Ca 0.18 0.80 0.07 0.00 -2.02 0.00 0.00 58.31 57.34 1fxo n LYS 261 Cb 0.21 -4.94 0.16 0.00 -0.02 0.00 0.00 35.03 30.43 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 -3.90 2.13 6.55 -1.22 -3.45 115.95 116.07 1fxo h TRP 262 Ca -0.29 0.00 -0.25 0.00 0.95 0.00 0.00 58.89 59.30 1fxo h TRP 262 Cb 1.04 0.00 -0.18 0.00 -0.86 0.00 0.00 29.16 29.16 1fxo h TRP 262 CO 0.36 0.29 -0.72 0.96 -1.05 0.00 0.00 178.44 178.28 1fxo s ILE 263 N -3.17 0.62 0.56 1.49 -4.36 -1.14 -4.38 121.20 110.82 1fxo s ILE 263 Ca 0.04 -1.51 0.08 0.00 -0.26 0.00 0.00 60.65 59.01 1fxo s ILE 263 Cb 0.07 -1.15 0.10 0.00 1.25 0.00 0.00 42.46 42.73 1fxo s ILE 263 CO 0.70 -0.63 0.78 -0.90 0.24 0.00 0.00 174.94 175.13 1fxo n ASP 264 N 0.71 1.93 -0.33 4.36 5.68 -1.26 -4.39 116.55 123.25 1fxo n ASP 264 Ca -0.17 -2.42 -0.04 0.00 -0.50 0.00 0.00 54.79 51.66 1fxo n ASP 264 Cb 0.58 -0.42 0.09 0.00 -1.14 0.00 0.00 41.12 40.23 1fxo n ASP 264 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1fxo h ALA 265 N 0.07 1.17 -0.50 2.12 0.00 -1.98 -0.12 119.26 120.02 1fxo h ALA 265 Ca -0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 1fxo h ALA 265 Cb 1.18 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1fxo h ALA 265 CO 0.36 0.67 0.18 0.00 0.00 0.00 0.00 179.25 180.46 1fxo h ALA 266 N 1.28 0.65 -0.46 0.00 0.00 -1.99 0.11 119.26 118.84 1fxo h ALA 266 Ca 0.32 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1fxo h ALA 266 Cb 0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1fxo h ALA 266 CO -0.05 0.27 -0.00 1.96 0.00 0.00 0.00 179.25 181.43 1fxo h GLN 267 N 0.66 0.82 -0.74 0.00 4.20 -1.82 -2.33 115.11 115.91 1fxo h GLN 267 Ca 0.16 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.61 1fxo h GLN 267 Cb 0.22 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 1fxo h GLN 267 CO -0.01 0.87 0.44 1.25 -0.67 0.00 0.00 178.83 180.71 1fxo h LEU 268 N 0.67 0.89 -0.69 1.46 5.85 -0.66 -1.94 115.31 120.88 1fxo h LEU 268 Ca 0.13 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1fxo h LEU 268 Cb 0.51 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1fxo h LEU 268 CO 0.02 0.69 0.45 -0.08 -0.34 0.00 0.00 178.44 179.18 1fxo h GLU 269 N 1.01 0.92 -0.81 1.25 4.81 -0.64 -1.87 114.58 119.25 1fxo h GLU 269 Ca 0.26 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 1fxo h GLU 269 Cb -0.03 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.11 1fxo h GLU 269 CO -0.05 0.63 0.48 -0.22 -0.73 0.00 0.00 179.01 179.12 1fxo h LYS 270 N 0.94 1.10 -0.01 1.92 3.64 -0.83 -2.62 116.57 120.71 1fxo h LYS 270 Ca 0.25 -0.10 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 1fxo h LYS 270 Cb -0.08 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.49 1fxo h LYS 270 CO -0.05 0.77 -0.44 -0.07 -2.27 0.00 0.00 179.45 177.38 1fxo h LEU 271 N 1.11 0.01 -0.31 5.20 3.38 -0.82 -3.14 115.31 120.75 1fxo h LEU 271 Ca 0.29 -0.01 -0.20 0.00 0.09 0.00 0.00 57.88 58.06 1fxo h LEU 271 Cb -0.04 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1fxo h LEU 271 CO -0.05 0.45 -0.84 0.00 0.09 0.00 0.00 178.44 178.09 1fxo h ALA 272 N 1.55 0.52 -0.30 1.53 0.00 -1.01 -3.37 119.26 118.17 1fxo h ALA 272 Ca -0.00 -0.68 0.06 0.00 0.00 0.00 0.00 54.91 54.29 1fxo h ALA 272 Cb 0.79 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.46 1fxo h ALA 272 CO 0.06 0.84 -0.10 0.00 0.00 0.00 0.00 179.25 180.05 1fxo h ALA 273 N 0.92 0.17 0.00 0.00 0.00 -1.42 0.28 119.26 119.20 1fxo h ALA 273 Ca -0.05 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1fxo h ALA 273 Cb 1.45 0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1fxo h ALA 273 CO 0.14 -0.49 0.00 -0.35 0.00 0.00 0.00 179.25 178.55 1fxo n PRO 274 N -5.28 0.14 -0.18 0.00 -0.04 -1.26 -2.03 135.00 126.36 1fxo n PRO 274 Ca 0.00 0.48 0.07 0.00 -0.04 0.00 0.00 63.50 64.01 1fxo n PRO 274 Cb 0.19 -1.84 0.17 0.00 -0.04 0.00 0.00 33.50 31.98 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 -2.12 2.99 0.05 1.53 4.77 0.82 -4.75 117.00 120.28 1fxo n LEU 275 Ca 0.01 -1.85 0.17 0.00 -0.03 0.00 0.00 56.01 54.31 1fxo n LEU 275 Cb 0.14 -0.24 0.67 0.00 -2.33 0.00 0.00 43.42 41.66 1fxo n LEU 275 CO 0.14 0.73 1.16 0.00 -1.33 0.00 0.00 177.39 178.09 1fxo h ALA 276 N 2.51 2.37 -0.00 -1.18 0.00 -0.51 -1.31 119.26 121.15 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 0.75 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1fxo h ALA 276 CO 0.00 -0.49 -0.00 1.63 0.00 0.00 0.00 179.25 180.39 1fxo n LYS 277 N -4.42 1.06 -4.49 0.00 4.76 -1.26 -4.31 118.16 109.49 1fxo n LYS 277 Ca 0.07 -0.15 -0.23 0.00 -2.87 0.00 0.00 58.31 55.13 1fxo n LYS 277 Cb 0.48 -1.50 -0.11 0.00 -1.84 0.00 0.00 35.03 32.07 1fxo n LYS 277 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1fxo s ASN 278 N -2.04 2.97 0.46 4.39 2.20 -0.51 -5.04 114.94 117.36 1fxo s ASN 278 Ca 0.45 -1.30 0.13 0.00 -0.94 0.00 0.00 52.86 51.19 1fxo s ASN 278 Cb 0.22 -0.21 1.06 0.00 -2.00 0.00 0.00 41.25 40.32 1fxo s ASN 278 CO 0.37 -0.46 2.07 1.23 -2.94 0.00 0.00 177.10 177.37 1fxo h GLY 279 N 2.07 0.36 0.61 0.45 0.00 -1.88 -1.03 103.07 103.65 1fxo h GLY 279 Ca -0.41 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 46.75 1fxo h GLY 279 CO 0.72 0.11 -0.12 -1.82 0.00 0.00 0.00 176.54 175.43 1fxo h TYR 280 N 0.31 0.26 -0.58 5.60 3.20 -1.96 -0.30 116.97 123.50 1fxo h TYR 280 Ca 0.14 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 1fxo h TYR 280 Cb 0.15 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 1fxo h TYR 280 CO -0.00 0.70 0.24 0.78 -1.64 0.00 0.00 178.16 178.24 1fxo h GLY 281 N -0.26 0.93 0.97 1.82 0.00 -1.24 -1.32 103.07 103.97 1fxo h GLY 281 Ca 0.01 -0.50 0.06 0.00 0.00 0.00 0.00 47.33 46.90 1fxo h GLY 281 CO 0.03 0.47 0.53 1.46 0.00 0.00 0.00 176.54 179.03 1fxo h GLN 282 N 0.80 0.87 -0.16 4.80 4.20 -1.14 -1.68 115.11 122.82 1fxo h GLN 282 Ca 0.20 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1fxo h GLN 282 Cb 0.19 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 1fxo h GLN 282 CO -0.02 0.58 -0.06 -0.92 -0.67 0.00 0.00 178.83 177.74 1fxo h TYR 283 N 0.90 0.36 -0.31 2.96 3.20 -0.39 -1.58 116.97 122.11 1fxo h TYR 283 Ca 0.34 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 1fxo h TYR 283 Cb 0.20 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 1fxo h TYR 283 CO -0.00 0.62 0.19 -0.07 -1.64 0.00 0.00 178.16 177.26 1fxo h LEU 284 N 0.01 0.36 -0.34 2.82 3.38 -0.85 -1.55 115.31 119.15 1fxo h LEU 284 Ca 0.04 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1fxo h LEU 284 Cb 0.51 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1fxo h LEU 284 CO 0.02 0.28 -0.13 0.11 0.09 0.00 0.00 178.44 178.81 1fxo h LYS 285 N 0.43 0.68 -0.67 1.13 1.57 -0.98 -2.93 116.57 115.80 1fxo h LYS 285 Ca 0.11 -0.28 0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1fxo h LYS 285 Cb -0.02 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.22 1fxo h LYS 285 CO -0.02 0.87 0.44 -0.09 -0.57 0.00 0.00 179.45 180.08 1fxo h ARG 286 N 0.46 0.70 0.00 3.15 2.43 -0.31 -2.13 114.38 118.67 1fxo h ARG 286 Ca 0.08 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1fxo h ARG 286 Cb 0.65 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 1fxo h ARG 286 CO 0.04 0.46 0.05 -0.07 -1.51 0.00 0.00 179.97 178.94 1fxo h LEU 287 N 0.72 0.00 -0.75 3.80 3.38 -1.21 -1.43 115.31 119.82 1fxo h LEU 287 Ca 0.28 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 1fxo h LEU 287 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1fxo h LEU 287 CO -0.09 0.00 -0.19 -0.07 0.09 0.00 0.00 178.44 178.19 1fxo h LEU 288 N 0.00 0.00 -2.42 1.67 3.38 -1.48 -3.31 115.31 113.15 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 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1fxo h LEU 288 CO 0.00 0.19 -0.07 0.35 0.09 0.00 0.00 178.44 178.99 1fxo n THR 289 N -3.24 0.87 -5.00 0.22 -2.24 -0.57 -5.01 114.28 99.30 1fxo n THR 289 Ca 0.01 -0.97 -0.29 0.00 -2.27 0.00 0.00 64.05 60.54 1fxo n THR 289 Cb 0.48 0.42 -0.16 0.00 -2.10 0.00 0.00 70.33 68.96 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 -1.13 2.26 -0.15 -0.78 2.12 -1.00 -5.11 118.70 114.91 1fxo s GLU 290 Ca 0.08 -0.72 -0.17 0.00 0.36 0.00 0.00 54.97 54.52 1fxo s GLU 290 Cb 0.07 -1.86 -0.04 0.00 0.26 0.00 0.00 34.13 32.56 1fxo s GLU 290 CO 0.01 0.23 0.45 0.99 -0.54 0.00 0.00 175.26 176.40 1fxo s THR 291 N 0.15 5.19 -0.17 -1.70 2.01 -1.26 -4.81 115.64 115.05 1fxo s THR 291 Ca -0.09 0.87 0.01 0.00 0.31 0.00 0.00 61.69 62.79 1fxo s THR 291 Cb -0.14 -3.79 0.02 0.00 0.01 0.00 0.00 72.50 68.60 1fxo s THR 291 CO 0.04 0.29 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.39 1fxo s VAL 292 N 0.93 1.90 -2.43 3.82 1.01 -1.26 -5.20 120.40 119.17 1fxo s VAL 292 Ca 0.23 -0.84 0.29 0.00 0.00 0.00 0.00 61.98 61.65 1fxo s VAL 292 Cb -0.15 -1.73 0.60 0.00 0.00 0.00 0.00 36.38 35.10 1fxo s VAL 292 CO 0.09 0.51 1.81 -1.22 0.00 0.00 0.00 175.10 176.30