#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oal n SER 2 N 0.00 1.21 -4.98 6.12 2.88 -1.26 -4.66 113.62 112.94 2oal n SER 2 Ca 0.00 -1.64 -0.21 0.00 -1.33 0.00 0.00 58.87 55.70 2oal n SER 2 Cb 0.00 -0.31 0.01 0.00 -0.75 0.00 0.00 64.21 63.16 2oal n SER 2 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2oal s GLY 3 N 2.60 1.65 1.04 0.46 0.00 -1.26 -4.83 107.32 106.98 2oal s GLY 3 Ca 0.12 -1.30 -0.12 0.00 0.00 0.00 0.00 44.72 43.41 2oal s GLY 3 CO 0.00 -1.15 1.08 -1.59 0.00 0.00 0.00 173.10 171.44 2oal s LYS 4 N -4.42 0.06 0.18 2.90 -2.85 -1.26 -1.93 119.74 112.43 2oal s LYS 4 Ca 0.49 0.61 -0.31 0.00 -1.00 0.00 0.00 55.97 55.76 2oal s LYS 4 Cb -0.10 -1.69 -0.09 0.00 -2.06 0.00 0.00 37.83 33.90 2oal s LYS 4 CO 0.35 -3.00 1.39 0.42 0.10 0.00 0.00 175.35 174.60 2oal s ILE 5 N -2.83 3.06 -0.19 3.79 -1.09 -1.26 -4.52 121.20 118.16 2oal s ILE 5 Ca 0.66 0.83 0.03 0.00 -2.23 0.00 0.00 60.65 59.94 2oal s ILE 5 Cb -0.20 -3.53 -0.13 0.00 -1.58 0.00 0.00 42.46 37.01 2oal s ILE 5 CO 0.59 0.10 -0.15 0.47 -1.23 0.00 0.00 174.94 174.73 2oal n ASP 6 N 3.08 2.35 -4.16 3.58 8.00 -1.26 -4.75 116.55 123.38 2oal n ASP 6 Ca 0.09 -0.09 -0.25 0.00 0.71 0.00 0.00 54.79 55.24 2oal n ASP 6 Cb 0.42 -0.18 -0.15 0.00 -0.02 0.00 0.00 41.12 41.18 2oal n ASP 6 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2oal s LYS 7 N -2.39 1.46 -0.05 -1.24 1.02 -1.26 -0.65 119.74 116.62 2oal s LYS 7 Ca -0.24 -0.62 0.03 0.00 0.02 0.00 0.00 55.97 55.15 2oal s LYS 7 Cb 0.07 -1.39 0.01 0.00 -0.52 0.00 0.00 37.83 36.00 2oal s LYS 7 CO 0.47 0.36 -0.12 0.42 -0.92 0.00 0.00 175.35 175.55 2oal s ILE 8 N -0.35 1.11 -0.18 2.17 1.01 -0.33 -0.30 121.20 124.34 2oal s ILE 8 Ca 0.05 -0.49 -0.01 0.00 0.00 0.00 0.00 60.65 60.20 2oal s ILE 8 Cb -0.07 -1.01 -0.00 0.00 0.01 0.00 0.00 42.46 41.39 2oal s ILE 8 CO -0.00 0.34 -0.12 -0.22 0.00 0.00 0.00 174.94 174.94 2oal s LEU 9 N 0.49 2.57 -0.26 2.97 2.96 -0.70 -1.76 118.68 124.95 2oal s LEU 9 Ca -0.11 -0.47 -0.10 0.00 -0.22 0.00 0.00 54.13 53.23 2oal s LEU 9 Cb -0.14 -1.61 -0.05 0.00 0.50 0.00 0.00 46.19 44.89 2oal s LEU 9 CO 0.03 0.03 0.16 -0.63 -1.32 0.00 0.00 176.35 174.62 2oal s ILE 10 N 1.13 5.16 -0.33 6.68 1.01 0.10 -1.21 121.20 133.74 2oal s ILE 10 Ca 0.01 0.11 -0.10 0.00 0.00 0.00 0.00 60.65 60.67 2oal s ILE 10 Cb -0.14 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 38.90 2oal s ILE 10 CO -0.04 0.30 0.17 -0.69 0.00 0.00 0.00 174.94 174.68 2oal s VAL 11 N 1.49 4.59 0.00 2.92 1.01 -0.55 -0.16 120.40 129.71 2oal s VAL 11 Ca 0.07 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.48 2oal s VAL 11 Cb -0.15 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.81 2oal s VAL 11 CO 0.08 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 175.75 2oal n GLY 12 N 4.99 3.75 1.73 4.51 0.00 -0.02 -0.22 105.19 119.93 2oal n GLY 12 Ca -0.13 -1.15 -0.18 0.00 0.00 0.00 0.00 46.02 44.56 2oal n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oal n GLY 13 N 0.00 6.14 0.00 -0.02 0.00 -1.26 -4.11 105.19 105.94 2oal n GLY 13 Ca 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 46.02 43.64 2oal n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oal n GLY 14 N -0.80 1.42 0.14 -0.02 0.00 -1.26 -4.69 105.19 99.98 2oal n GLY 14 Ca 0.39 -1.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.65 2oal n GLY 14 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2oal h THR 15 N 0.00 1.30 -0.50 2.61 2.02 -1.94 -2.75 112.91 113.64 2oal h THR 15 Ca 0.00 -1.07 -0.02 0.00 0.77 0.00 0.00 66.41 66.09 2oal h THR 15 Cb 0.00 1.61 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 2oal h THR 15 CO 0.00 0.32 0.24 0.00 0.37 0.00 0.00 175.52 176.46 2oal h ALA 16 N 0.71 0.64 -0.04 6.16 0.00 -1.92 -1.33 119.26 123.48 2oal h ALA 16 Ca 0.05 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2oal h ALA 16 Cb 0.52 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2oal h ALA 16 CO 0.02 0.20 -0.12 0.78 0.00 0.00 0.00 179.25 180.13 2oal h GLY 17 N 0.66 -0.11 2.00 0.00 0.00 -1.70 -0.02 103.07 103.90 2oal h GLY 17 Ca 0.17 0.14 -0.02 0.00 0.00 0.00 0.00 47.33 47.63 2oal h GLY 17 CO -0.02 -0.12 -0.07 1.49 0.00 0.00 0.00 176.54 177.81 2oal h TRP 18 N -0.18 0.00 -0.18 5.60 4.06 -1.44 -0.77 115.95 123.04 2oal h TRP 18 Ca 0.06 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.83 2oal h TRP 18 Cb 0.26 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.42 2oal h TRP 18 CO -0.20 0.07 -0.59 0.52 -3.56 0.00 0.00 178.44 174.69 2oal h MET 19 N 0.00 0.71 -0.35 0.49 2.86 -0.92 -1.62 114.93 116.11 2oal h MET 19 Ca -0.00 -0.53 -0.04 0.00 -2.06 0.00 0.00 59.70 57.07 2oal h MET 19 Cb 0.81 0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 2oal h MET 19 CO 0.01 1.15 0.07 0.00 1.06 0.00 0.00 176.91 179.20 2oal h ALA 20 N 0.57 0.47 -0.80 6.32 0.00 -0.73 0.93 119.26 126.02 2oal h ALA 20 Ca -0.02 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2oal h ALA 20 Cb 1.22 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.83 2oal h ALA 20 CO 0.13 0.16 0.49 0.00 0.00 0.00 0.00 179.25 180.02 2oal h ALA 21 N 0.91 1.02 -0.14 0.00 0.00 -1.16 -0.03 119.26 119.86 2oal h ALA 21 Ca 0.11 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2oal h ALA 21 Cb 0.33 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2oal h ALA 21 CO 0.00 0.47 -0.15 0.77 0.00 0.00 0.00 179.25 180.35 2oal h SER 22 N 1.09 0.38 -0.00 0.00 0.02 -1.09 -0.66 113.55 113.30 2oal h SER 22 Ca 0.29 -0.49 -0.00 0.00 -0.84 0.00 0.00 61.79 60.75 2oal h SER 22 Cb -0.05 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 2oal h SER 22 CO -0.06 0.79 -0.00 0.22 -1.14 0.00 0.00 176.83 176.65 2oal h TYR 23 N -0.02 0.00 -0.31 3.45 5.03 -0.68 -0.90 116.97 123.55 2oal h TYR 23 Ca 0.02 -0.00 -0.11 0.00 2.58 0.00 0.00 58.73 61.22 2oal h TYR 23 Cb 0.69 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 38.95 2oal h TYR 23 CO 0.09 0.37 -0.27 -0.07 -1.32 0.00 0.00 178.16 176.95 2oal h LEU 24 N -0.36 0.63 -0.83 2.82 3.38 -1.11 0.17 115.31 120.01 2oal h LEU 24 Ca 0.00 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 2oal h LEU 24 Cb 0.36 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 2oal h LEU 24 CO 0.00 0.88 0.22 1.23 0.09 0.00 0.00 178.44 180.87 2oal h GLY 25 N 1.01 1.18 0.62 0.83 0.00 -1.08 0.16 103.07 105.78 2oal h GLY 25 Ca 0.07 -0.68 -0.08 0.00 0.00 0.00 0.00 47.33 46.64 2oal h GLY 25 CO 0.06 0.64 -0.27 1.70 0.00 0.00 0.00 176.54 178.67 2oal h LYS 26 N 1.05 0.28 -0.76 4.80 1.63 -0.88 -1.87 116.57 120.83 2oal h LYS 26 Ca 0.23 -0.23 -0.06 0.00 -0.85 0.00 0.00 60.65 59.75 2oal h LYS 26 Cb 0.29 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.94 2oal h LYS 26 CO -0.01 0.87 0.25 0.00 -3.45 0.00 0.00 179.45 177.12 2oal h ALA 27 N 0.41 0.99 -0.49 5.00 0.00 -0.52 -3.08 119.26 121.57 2oal h ALA 27 Ca -0.02 -0.22 -0.17 0.00 0.00 0.00 0.00 54.91 54.51 2oal h ALA 27 Cb 0.92 -0.29 -0.10 0.00 0.00 0.00 0.00 17.79 18.32 2oal h ALA 27 CO 0.06 0.66 0.11 1.28 0.00 0.00 0.00 179.25 181.35 2oal n LEU 28 N -4.26 4.84 -4.48 0.00 4.77 0.54 -5.03 117.00 113.38 2oal n LEU 28 Ca 0.06 -3.38 -0.56 0.00 -0.03 0.00 0.00 56.01 52.10 2oal n LEU 28 Cb 0.22 -0.66 -0.09 0.00 -2.33 0.00 0.00 43.42 40.56 2oal n LEU 28 CO 0.41 0.94 1.62 1.67 -1.33 0.00 0.00 177.39 180.70 2oal n GLN 29 N -0.68 0.70 -0.79 3.23 7.27 -0.70 -1.00 117.38 125.42 2oal n GLN 29 Ca 0.34 0.22 0.00 0.00 0.07 0.00 0.00 57.00 57.63 2oal n GLN 29 Cb 1.15 -2.02 0.00 0.00 2.41 0.00 0.00 30.24 31.78 2oal n GLN 29 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2oal n GLY 30 N 6.07 0.81 0.07 1.69 0.00 -1.26 -4.88 105.19 107.68 2oal n GLY 30 Ca 0.41 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.46 2oal n GLY 30 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oal n THR 31 N -2.24 0.98 -3.61 2.61 -2.24 -0.17 -5.04 114.28 104.57 2oal n THR 31 Ca 0.00 -1.08 -0.14 0.00 -2.27 0.00 0.00 64.05 60.56 2oal n THR 31 Cb 0.00 0.38 -0.07 0.00 -2.10 0.00 0.00 70.33 68.54 2oal n THR 31 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oal s ALA 32 N -1.25 -1.82 -0.31 6.98 0.00 -1.23 -4.77 121.76 119.36 2oal s ALA 32 Ca 0.09 1.86 -0.15 0.00 0.00 0.00 0.00 51.96 53.76 2oal s ALA 32 Cb 0.08 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.18 2oal s ALA 32 CO 0.01 -0.33 0.34 -0.51 0.00 0.00 0.00 175.76 175.27 2oal s ASP 33 N 0.01 6.18 -0.15 0.00 1.01 0.18 -4.95 116.67 118.94 2oal s ASP 33 Ca -0.02 -0.05 -0.04 0.00 0.71 0.00 0.00 52.55 53.16 2oal s ASP 33 Cb -0.04 -2.19 -0.03 0.00 1.01 0.00 0.00 42.92 41.67 2oal s ASP 33 CO 0.01 -0.25 -0.03 -0.63 0.21 0.00 0.00 175.17 174.48 2oal s ILE 34 N 2.00 4.01 -0.02 0.77 1.01 -1.26 -1.18 121.20 126.52 2oal s ILE 34 Ca 0.12 -0.32 0.04 0.00 0.00 0.00 0.00 60.65 60.49 2oal s ILE 34 Cb -0.16 -2.75 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 2oal s ILE 34 CO 0.11 0.51 -0.14 -0.89 0.00 0.00 0.00 174.94 174.53 2oal s THR 35 N 0.18 1.12 -0.11 2.92 2.01 -0.72 -0.88 115.64 120.15 2oal s THR 35 Ca -0.01 -0.59 0.03 0.00 0.31 0.00 0.00 61.69 61.43 2oal s THR 35 Cb -0.14 -0.94 0.01 0.00 0.01 0.00 0.00 72.50 71.44 2oal s THR 35 CO 0.03 0.32 -0.20 -0.22 -0.69 0.00 0.00 174.62 173.86 2oal s LEU 36 N -0.22 1.95 -0.25 4.42 0.20 0.74 0.02 118.68 125.53 2oal s LEU 36 Ca 0.03 -0.51 -0.12 0.00 0.69 0.00 0.00 54.13 54.22 2oal s LEU 36 Cb -0.07 -1.27 -0.05 0.00 -0.43 0.00 0.00 46.19 44.37 2oal s LEU 36 CO -0.00 0.08 0.21 -0.76 -0.29 0.00 0.00 176.35 175.59 2oal s LEU 37 N 0.72 4.08 -0.05 -0.68 1.43 0.78 -1.00 118.68 123.95 2oal s LEU 37 Ca -0.11 0.13 0.01 0.00 -1.03 0.00 0.00 54.13 53.13 2oal s LEU 37 Cb -0.16 -2.18 0.02 0.00 0.03 0.00 0.00 46.19 43.90 2oal s LEU 37 CO 0.02 -0.01 -0.04 -1.58 0.23 0.00 0.00 176.35 174.97 2oal s GLN 38 N 1.40 0.87 0.10 1.70 0.74 -0.17 -0.84 119.66 123.47 2oal s GLN 38 Ca 0.09 -0.09 0.06 0.00 0.05 0.00 0.00 55.36 55.47 2oal s GLN 38 Cb -0.15 -0.93 -0.04 0.00 1.10 0.00 0.00 33.01 33.00 2oal s GLN 38 CO 0.07 -0.12 -0.08 0.00 -0.55 0.00 0.00 175.29 174.62 2oal s ALA 39 N 1.12 3.04 0.14 1.58 0.00 -1.20 -1.78 121.76 124.65 2oal s ALA 39 Ca -0.08 -1.21 -0.32 0.00 0.00 0.00 0.00 51.96 50.36 2oal s ALA 39 Cb -0.14 -0.97 -0.11 0.00 0.00 0.00 0.00 23.12 21.89 2oal s ALA 39 CO -0.01 0.66 1.79 -2.30 0.00 0.00 0.00 175.76 175.90 2oal n PRO 40 N 0.70 2.70 -4.18 0.00 -0.02 -1.26 -4.97 135.00 127.97 2oal n PRO 40 Ca -0.13 0.98 -0.26 0.00 -2.02 0.00 0.00 63.50 62.07 2oal n PRO 40 Cb 0.52 -2.85 -0.07 0.00 -0.02 0.00 0.00 33.50 31.08 2oal n PRO 40 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2oal s ASP 41 N 2.25 4.93 -0.04 2.55 1.11 -1.26 -5.07 116.67 121.15 2oal s ASP 41 Ca 0.81 -0.35 -0.30 0.00 0.18 0.00 0.00 52.55 52.89 2oal s ASP 41 Cb -0.52 -1.10 -0.05 0.00 1.07 0.00 0.00 42.92 42.32 2oal s ASP 41 CO 0.37 0.08 1.50 -0.63 1.18 0.00 0.00 175.17 177.67 2oal s ILE 42 N -1.76 3.69 0.54 0.77 1.01 -1.26 -4.94 121.20 119.25 2oal s ILE 42 Ca 0.28 0.96 -0.20 0.00 0.00 0.00 0.00 60.65 61.70 2oal s ILE 42 Cb -0.09 -3.62 -0.08 0.00 0.01 0.00 0.00 42.46 38.68 2oal s ILE 42 CO 0.20 -0.05 0.81 -2.65 0.00 0.00 0.00 174.94 173.25 2oal n PRO 43 N 6.24 0.85 -4.23 2.79 -0.02 -1.26 -5.04 135.00 134.34 2oal n PRO 43 Ca 0.15 0.32 -0.13 0.00 -2.02 0.00 0.00 63.50 61.82 2oal n PRO 43 Cb 0.43 -1.95 -0.10 0.00 -0.02 0.00 0.00 33.50 31.86 2oal n PRO 43 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2oal s THR 44 N -1.53 1.05 0.53 3.45 -4.23 -1.26 -5.14 115.64 108.51 2oal s THR 44 Ca 0.70 -2.01 -0.20 0.00 -1.18 0.00 0.00 61.69 59.00 2oal s THR 44 Cb -0.47 -1.79 -0.06 0.00 1.34 0.00 0.00 72.50 71.52 2oal s THR 44 CO 0.52 -0.77 1.11 -0.76 -0.54 0.00 0.00 174.62 174.18 2oal s LEU 45 N -3.11 3.77 -0.84 4.79 1.43 -1.26 -4.94 118.68 118.51 2oal s LEU 45 Ca 0.15 2.12 -0.23 0.00 -1.03 0.00 0.00 54.13 55.14 2oal s LEU 45 Cb 0.03 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.73 2oal s LEU 45 CO -0.01 -1.13 1.24 -0.83 0.23 0.00 0.00 176.35 175.85 2oal s GLY 46 N -1.83 1.28 0.00 -3.19 0.00 -1.26 -4.82 107.32 97.50 2oal s GLY 46 Ca 0.72 -1.99 0.25 0.00 0.00 0.00 0.00 44.72 43.69 2oal s GLY 46 CO 0.26 2.43 1.75 3.33 0.00 0.00 0.00 173.10 180.87 2oal n VAL 47 N 6.30 0.07 0.00 1.40 0.24 -1.26 -4.61 118.33 120.47 2oal n VAL 47 Ca 0.15 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.24 2oal n VAL 47 Cb 0.49 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.04 2oal n VAL 47 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oal n GLY 48 N 1.08 0.17 2.91 7.63 0.00 -1.26 -3.41 105.19 112.31 2oal n GLY 48 Ca 0.18 -1.53 -0.17 0.00 0.00 0.00 0.00 46.02 44.50 2oal n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oal s GLU 49 N -4.32 0.48 0.05 1.61 0.41 -0.27 -4.90 118.70 111.76 2oal s GLU 49 Ca 0.00 -0.11 0.04 0.00 -0.41 0.00 0.00 54.97 54.49 2oal s GLU 49 Cb 0.00 -0.51 -0.04 0.00 -1.78 0.00 0.00 34.13 31.80 2oal s GLU 49 CO 0.00 0.01 -0.00 0.00 -0.49 0.00 0.00 175.26 174.78 2oal s ALA 50 N 0.35 3.27 0.09 5.21 0.00 -1.26 -2.05 121.76 127.37 2oal s ALA 50 Ca -0.04 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 50.88 2oal s ALA 50 Cb -0.07 -1.24 -0.00 0.00 0.00 0.00 0.00 23.12 21.80 2oal s ALA 50 CO -0.00 0.68 0.03 0.25 0.00 0.00 0.00 175.76 176.71 2oal n THR 51 N 0.91 0.00 -4.30 0.00 -2.24 -0.39 -4.72 114.28 103.54 2oal n THR 51 Ca -0.12 -0.51 -0.20 0.00 -2.27 0.00 0.00 64.05 60.95 2oal n THR 51 Cb 0.52 0.18 -0.11 0.00 -2.10 0.00 0.00 70.33 68.82 2oal n THR 51 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 2oal s ILE 52 N -1.83 1.63 0.33 2.28 -4.36 -1.26 -4.45 121.20 113.54 2oal s ILE 52 Ca 0.04 -1.92 0.12 0.00 -0.26 0.00 0.00 60.65 58.63 2oal s ILE 52 Cb 0.00 -1.79 0.34 0.00 1.25 0.00 0.00 42.46 42.26 2oal s ILE 52 CO 0.03 -0.42 1.63 -0.65 0.24 0.00 0.00 174.94 175.77 2oal h PRO 53 N 3.18 0.18 0.00 0.37 0.11 -1.95 -1.94 132.00 131.94 2oal h PRO 53 Ca -0.40 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2oal h PRO 53 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2oal h PRO 53 CO 0.53 0.12 0.00 0.27 -0.21 0.00 0.00 178.00 178.71 2oal n ASN 54 N -5.19 0.00 -0.20 -2.05 0.23 -1.26 -2.47 115.26 104.32 2oal n ASN 54 Ca 0.30 -0.17 0.01 0.00 -0.53 0.00 0.00 54.58 54.19 2oal n ASN 54 Cb 0.97 -0.13 0.26 0.00 -2.08 0.00 0.00 39.78 38.81 2oal n ASN 54 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2oal h LEU 55 N 0.00 0.83 0.12 -4.53 5.85 -1.74 0.45 115.31 116.29 2oal h LEU 55 Ca 0.00 -0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.51 2oal h LEU 55 Cb 0.05 -0.21 0.02 0.00 0.37 0.00 0.00 40.66 40.90 2oal h LEU 55 CO 0.00 0.60 -0.83 -0.61 -0.34 0.00 0.00 178.44 177.26 2oal h GLN 56 N 0.98 0.35 0.03 1.25 5.75 -1.73 -2.19 115.11 119.54 2oal h GLN 56 Ca 0.26 -0.54 -0.21 0.00 -0.15 0.00 0.00 58.65 58.01 2oal h GLN 56 Cb -0.11 0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 2oal h GLN 56 CO -0.06 1.23 -0.99 1.79 -2.65 0.00 0.00 178.83 178.15 2oal h THR 57 N -0.26 1.60 0.00 2.39 1.35 -1.65 0.36 112.91 116.70 2oal h THR 57 Ca -0.14 -3.06 0.00 0.00 -0.55 0.00 0.00 66.41 62.66 2oal h THR 57 Cb 1.62 2.73 0.00 0.00 -1.73 0.00 0.00 68.15 70.77 2oal h THR 57 CO 0.16 0.88 -1.74 0.00 -0.25 0.00 0.00 175.52 174.57 2oal n ALA 58 N -2.42 2.89 -0.08 6.62 0.00 0.16 -4.38 120.51 123.28 2oal n ALA 58 Ca -0.03 -0.47 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2oal n ALA 58 Cb 0.90 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2oal n ALA 58 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2oal n PHE 59 N -2.28 0.00 -0.13 0.00 7.35 -0.97 -4.56 117.46 116.88 2oal n PHE 59 Ca -0.03 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 56.67 2oal n PHE 59 Cb 0.55 0.00 0.29 0.00 0.35 0.00 0.00 39.48 40.67 2oal n PHE 59 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2oal h PHE 60 N 0.00 0.78 -0.38 -5.13 0.04 -1.39 -1.70 116.94 109.17 2oal h PHE 60 Ca 0.00 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.67 2oal h PHE 60 Cb 0.00 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.88 2oal h PHE 60 CO 0.00 0.53 -0.20 -0.44 -0.60 0.00 0.00 178.31 177.60 2oal h ASP 61 N 0.82 0.73 -0.69 2.17 3.32 -0.46 0.19 116.42 122.51 2oal h ASP 61 Ca 0.22 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 2oal h ASP 61 Cb -0.02 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 2oal h ASP 61 CO -0.04 0.92 0.36 0.15 -1.72 0.00 0.00 179.24 178.91 2oal h PHE 62 N 0.64 0.98 0.00 4.55 3.57 -1.60 -1.21 116.94 123.87 2oal h PHE 62 Ca 0.09 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.56 2oal h PHE 62 Cb 0.69 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.12 2oal h PHE 62 CO 0.03 0.71 0.00 -0.07 -2.23 0.00 0.00 178.31 176.75 2oal h LEU 63 N 0.96 0.00 0.00 0.59 3.38 -0.98 -3.47 115.31 115.79 2oal h LEU 63 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2oal h LEU 63 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2oal h LEU 63 CO -0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.11 2oal n GLY 64 N 0.41 0.66 3.37 0.83 0.00 -0.36 -5.05 105.19 105.05 2oal n GLY 64 Ca 0.03 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.92 2oal n GLY 64 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oal s ILE 65 N -2.00 4.24 0.48 -0.61 1.01 0.52 -5.00 121.20 119.84 2oal s ILE 65 Ca 0.00 -0.67 -0.24 0.00 0.00 0.00 0.00 60.65 59.74 2oal s ILE 65 Cb 0.00 -3.22 -0.07 0.00 0.01 0.00 0.00 42.46 39.17 2oal s ILE 65 CO 0.00 0.01 1.39 -2.65 0.00 0.00 0.00 174.94 173.69 2oal n PRO 66 N 4.92 2.04 -0.20 2.79 -0.02 -1.26 -4.31 135.00 138.96 2oal n PRO 66 Ca -0.14 0.73 0.01 0.00 -2.02 0.00 0.00 63.50 62.08 2oal n PRO 66 Cb 0.48 -2.59 0.10 0.00 -0.02 0.00 0.00 33.50 31.47 2oal n PRO 66 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2oal h GLU 67 N 1.98 0.20 -0.11 -0.52 4.81 -1.96 -1.28 114.58 117.70 2oal h GLU 67 Ca -0.50 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 2oal h GLU 67 Cb 1.28 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 2oal h GLU 67 CO 0.59 0.13 0.01 -0.44 -0.73 0.00 0.00 179.01 178.57 2oal h ASP 68 N 0.20 0.14 0.29 1.04 3.32 -1.99 -1.73 116.42 117.69 2oal h ASP 68 Ca 0.31 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 2oal h ASP 68 Cb 0.48 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.00 2oal h ASP 68 CO -0.44 0.16 -0.14 -0.08 -1.72 0.00 0.00 179.24 177.03 2oal h GLU 69 N 0.15 -0.37 -0.01 3.56 4.81 -1.59 -2.70 114.58 118.43 2oal h GLU 69 Ca 0.04 0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.13 2oal h GLU 69 Cb 0.10 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 2oal h GLU 69 CO 0.00 -0.07 -0.75 0.11 -0.73 0.00 0.00 179.01 177.57 2oal h TRP 70 N -0.69 0.08 -0.18 0.92 5.08 -1.48 -3.10 115.95 116.58 2oal h TRP 70 Ca -0.04 -0.04 -0.00 0.00 1.08 0.00 0.00 58.89 59.89 2oal h TRP 70 Cb 0.48 -0.01 -0.01 0.00 -3.00 0.00 0.00 29.16 26.62 2oal h TRP 70 CO 0.02 0.78 0.09 0.52 -1.28 0.00 0.00 178.44 178.57 2oal h MET 71 N 0.04 0.25 -0.70 0.12 2.86 -1.37 -1.19 114.93 114.93 2oal h MET 71 Ca -0.01 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 2oal h MET 71 Cb 1.32 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.90 2oal h MET 71 CO 0.10 0.26 0.31 0.00 1.06 0.00 0.00 176.91 178.65 2oal h ARG 72 N 0.17 1.02 0.00 1.72 3.08 -1.53 -0.50 114.38 118.34 2oal h ARG 72 Ca 0.06 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.96 2oal h ARG 72 Cb 0.09 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.96 2oal h ARG 72 CO -0.01 0.80 0.00 0.39 -1.07 0.00 0.00 179.97 180.09 2oal n GLU 73 N -4.32 0.27 -0.14 0.04 1.02 -1.13 -3.38 120.64 113.00 2oal n GLU 73 Ca 0.07 0.22 0.04 0.00 -0.02 0.00 0.00 57.16 57.47 2oal n GLU 73 Cb 0.15 -1.81 0.12 0.00 -0.02 0.00 0.00 31.44 29.88 2oal n GLU 73 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2oal n ASN 75 N 0.31 -2.08 -4.89 0.00 3.02 -0.24 -4.41 115.26 106.96 2oal n ASN 75 Ca 0.09 -1.17 -0.29 0.00 -0.03 0.00 0.00 54.58 53.17 2oal n ASN 75 Cb 0.39 -2.29 -0.03 0.00 -0.61 0.00 0.00 39.78 37.24 2oal n ASN 75 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oal s ALA 76 N -3.85 3.48 0.53 5.41 0.00 -0.91 -4.23 121.76 122.19 2oal s ALA 76 Ca 0.24 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.83 2oal s ALA 76 Cb -0.12 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.50 2oal s ALA 76 CO 0.94 0.10 0.05 0.45 0.00 0.00 0.00 175.76 177.30 2oal s SER 77 N -3.18 4.21 -0.02 0.00 0.15 -0.38 -4.88 113.70 109.60 2oal s SER 77 Ca 0.48 -1.65 -0.01 0.00 0.70 0.00 0.00 55.95 55.46 2oal s SER 77 Cb -0.10 0.64 -0.04 0.00 -1.71 0.00 0.00 66.02 64.80 2oal s SER 77 CO 0.31 -0.94 0.08 -0.31 1.20 0.00 0.00 173.24 173.59 2oal s TYR 78 N -2.89 3.31 -0.14 3.44 2.02 -1.26 -1.85 117.35 119.99 2oal s TYR 78 Ca 0.05 0.24 0.01 0.00 -0.37 0.00 0.00 57.07 57.00 2oal s TYR 78 Cb 0.00 -1.76 0.02 0.00 -0.40 0.00 0.00 41.96 39.82 2oal s TYR 78 CO 0.03 0.56 -0.15 0.21 -1.57 0.00 0.00 175.55 174.64 2oal s LYS 79 N -1.61 2.29 -0.02 -0.62 2.20 -0.31 -4.06 119.74 117.61 2oal s LYS 79 Ca 0.22 -0.57 0.16 0.00 -0.36 0.00 0.00 55.97 55.42 2oal s LYS 79 Cb -0.12 -2.04 -0.25 0.00 -1.51 0.00 0.00 37.83 33.91 2oal s LYS 79 CO 0.12 -0.17 0.34 0.28 -0.36 0.00 0.00 175.35 175.56 2oal n VAL 80 N 4.57 0.02 -3.91 4.02 0.31 0.54 0.58 118.33 124.46 2oal n VAL 80 Ca -0.18 -0.37 -0.02 0.00 -0.01 0.00 0.00 64.34 63.76 2oal n VAL 80 Cb 0.50 0.12 0.02 0.00 -0.91 0.00 0.00 33.84 33.58 2oal n VAL 80 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oal s ALA 81 N -3.09 -1.71 -0.13 3.52 0.00 -1.25 -3.00 121.76 116.09 2oal s ALA 81 Ca -0.06 -0.31 -0.00 0.00 0.00 0.00 0.00 51.96 51.59 2oal s ALA 81 Cb 0.10 0.79 -0.02 0.00 0.00 0.00 0.00 23.12 24.00 2oal s ALA 81 CO 0.66 -1.08 -0.13 0.42 0.00 0.00 0.00 175.76 175.64 2oal s ILE 82 N -2.11 3.09 -0.30 0.00 1.01 -0.70 -1.35 121.20 120.84 2oal s ILE 82 Ca 0.23 -0.65 -0.07 0.00 0.00 0.00 0.00 60.65 60.16 2oal s ILE 82 Cb -0.02 -2.30 0.01 0.00 0.01 0.00 0.00 42.46 40.16 2oal s ILE 82 CO 0.05 0.52 0.09 -0.75 0.00 0.00 0.00 174.94 174.85 2oal s LYS 83 N 0.32 3.12 -0.37 2.79 2.20 0.13 -1.54 119.74 126.39 2oal s LYS 83 Ca -0.10 -0.84 -0.21 0.00 -0.36 0.00 0.00 55.97 54.46 2oal s LYS 83 Cb -0.16 -3.41 0.01 0.00 -1.51 0.00 0.00 37.83 32.76 2oal s LYS 83 CO 0.05 -0.44 0.66 -0.06 -0.36 0.00 0.00 175.35 175.21 2oal s PHE 84 N 1.52 3.13 -0.15 4.03 0.08 -0.25 -0.73 117.98 125.61 2oal s PHE 84 Ca 0.03 0.34 -0.03 0.00 0.12 0.00 0.00 56.93 57.39 2oal s PHE 84 Cb -0.17 -3.21 -0.02 0.00 -0.57 0.00 0.00 43.02 39.04 2oal s PHE 84 CO 0.03 -0.68 -0.06 0.42 -0.10 0.00 0.00 175.22 174.83 2oal s ILE 85 N 2.80 3.64 -1.32 0.64 1.01 -0.56 -2.20 121.20 125.22 2oal s ILE 85 Ca 0.26 -0.45 -0.00 0.00 0.00 0.00 0.00 60.65 60.45 2oal s ILE 85 Cb -0.14 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 39.75 2oal s ILE 85 CO 0.16 0.50 0.06 0.59 0.00 0.00 0.00 174.94 176.25 2oal n ASN 86 N 3.56 -4.74 0.04 3.58 3.02 -0.12 -0.96 115.26 119.64 2oal n ASN 86 Ca -0.18 -0.04 0.13 0.00 -0.03 0.00 0.00 54.58 54.46 2oal n ASN 86 Cb 0.52 -3.83 0.39 0.00 -0.61 0.00 0.00 39.78 36.25 2oal n ASN 86 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 2oal n TRP 87 N -4.04 0.34 0.26 3.10 7.02 -1.26 -3.86 117.44 118.99 2oal n TRP 87 Ca -0.17 0.10 0.04 0.00 -1.02 0.00 0.00 57.50 56.45 2oal n TRP 87 Cb 0.64 -0.58 0.05 0.00 -2.42 0.00 0.00 31.31 29.00 2oal n TRP 87 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 2oal n ARG 88 N -1.81 0.79 -4.41 -0.99 1.74 -1.26 -4.19 116.66 106.54 2oal n ARG 88 Ca 0.06 -1.22 -0.21 0.00 -0.77 0.00 0.00 57.85 55.71 2oal n ARG 88 Cb 0.38 -1.18 -0.14 0.00 -1.02 0.00 0.00 32.46 30.51 2oal n ARG 88 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2oal s THR 89 N -0.79 1.17 0.59 0.55 -4.23 -1.25 -4.69 115.64 107.00 2oal s THR 89 Ca 0.12 -0.99 -0.16 0.00 -1.18 0.00 0.00 61.69 59.48 2oal s THR 89 Cb 0.08 -1.05 -0.03 0.00 1.34 0.00 0.00 72.50 72.84 2oal s THR 89 CO 0.11 0.05 1.07 0.00 -0.54 0.00 0.00 174.62 175.32 2oal s ALA 90 N -0.80 2.69 0.00 3.99 0.00 -1.26 -4.96 121.76 121.41 2oal s ALA 90 Ca 0.03 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2oal s ALA 90 Cb -0.08 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.78 2oal s ALA 90 CO 0.01 -0.86 0.00 0.41 0.00 0.00 0.00 175.76 175.32 2oal n GLY 91 N -0.72 2.41 3.60 0.00 0.00 -1.26 -5.09 105.19 104.14 2oal n GLY 91 Ca 0.09 -1.73 -0.28 0.00 0.00 0.00 0.00 46.02 44.10 2oal n GLY 91 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oal s GLU 92 N -1.73 -0.18 -0.46 1.61 0.41 -1.26 -4.59 118.70 112.49 2oal s GLU 92 Ca 0.00 0.57 -0.27 0.00 -0.41 0.00 0.00 54.97 54.86 2oal s GLU 92 Cb 0.00 -1.66 0.03 0.00 -1.78 0.00 0.00 34.13 30.72 2oal s GLU 92 CO 0.00 -3.16 1.04 0.20 -0.49 0.00 0.00 175.26 172.85 2oal s GLY 93 N -3.15 1.39 0.07 -1.39 0.00 -1.26 -4.83 107.32 98.15 2oal s GLY 93 Ca 0.67 -0.58 0.02 0.00 0.00 0.00 0.00 44.72 44.82 2oal s GLY 93 CO 0.60 2.24 -0.07 -1.08 0.00 0.00 0.00 173.10 174.79 2oal s THR 94 N 4.09 0.62 -0.88 0.90 -1.32 -1.26 -4.53 115.64 113.26 2oal s THR 94 Ca 0.43 -1.56 0.27 0.00 -1.21 0.00 0.00 61.69 59.62 2oal s THR 94 Cb -0.09 -1.21 0.23 0.00 -1.51 0.00 0.00 72.50 69.92 2oal s THR 94 CO 0.28 -0.66 1.80 -1.54 -2.21 0.00 0.00 174.62 172.29 2oal n SER 95 N 0.62 0.37 -4.72 8.08 3.41 -1.26 -4.79 113.62 115.34 2oal n SER 95 Ca -0.17 0.45 -0.37 0.00 -0.26 0.00 0.00 58.87 58.52 2oal n SER 95 Cb 0.58 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 63.95 2oal n SER 95 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2oal s GLU 96 N -3.05 4.27 0.23 4.33 0.41 -1.26 -5.05 118.70 118.58 2oal s GLU 96 Ca 0.12 0.23 -0.30 0.00 -0.41 0.00 0.00 54.97 54.61 2oal s GLU 96 Cb 0.16 -3.45 -0.10 0.00 -1.78 0.00 0.00 34.13 28.97 2oal s GLU 96 CO 0.58 0.17 1.39 0.00 -0.49 0.00 0.00 175.26 176.90 2oal s ALA 97 N 0.66 3.59 0.75 5.21 0.00 -1.26 -4.97 121.76 125.74 2oal s ALA 97 Ca 0.20 1.24 -0.12 0.00 0.00 0.00 0.00 51.96 53.29 2oal s ALA 97 Cb -0.14 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.50 2oal s ALA 97 CO 0.07 -0.66 1.13 1.03 0.00 0.00 0.00 175.76 177.32 2oal s ARG 98 N -0.26 2.48 0.16 0.00 0.52 -1.26 -4.70 118.95 115.89 2oal s ARG 98 Ca 0.58 0.30 -0.24 0.00 -0.52 0.00 0.00 55.73 55.85 2oal s ARG 98 Cb -0.40 -2.00 -0.08 0.00 0.52 0.00 0.00 34.95 33.00 2oal s ARG 98 CO 0.41 -1.26 0.74 -2.00 0.02 0.00 0.00 175.30 173.21 2oal s GLU 99 N -5.44 4.48 -0.14 3.54 2.56 -1.26 0.37 118.70 122.80 2oal s GLU 99 Ca 0.60 1.06 -0.05 0.00 0.00 0.00 0.00 54.97 56.58 2oal s GLU 99 Cb -0.11 -3.21 0.07 0.00 2.00 0.00 0.00 34.13 32.88 2oal s GLU 99 CO 0.50 0.56 0.27 -1.17 -0.56 0.00 0.00 175.26 174.87 2oal s LEU 100 N -1.24 -0.32 -1.51 2.70 0.20 0.20 -4.78 118.68 113.93 2oal s LEU 100 Ca 0.35 0.54 -0.05 0.00 0.69 0.00 0.00 54.13 55.67 2oal s LEU 100 Cb -0.22 0.73 0.04 0.00 -0.43 0.00 0.00 46.19 46.31 2oal s LEU 100 CO 0.25 -0.25 0.45 0.47 -0.29 0.00 0.00 176.35 176.98 2oal n ASP 101 N 5.35 -0.89 0.00 3.68 8.00 -1.26 -1.70 116.55 129.72 2oal n ASP 101 Ca -0.06 -1.05 0.00 0.00 0.71 0.00 0.00 54.79 54.39 2oal n ASP 101 Cb 0.50 -2.74 0.00 0.00 -0.02 0.00 0.00 41.12 38.86 2oal n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oal n GLY 102 N -1.92 0.83 3.51 0.44 0.00 -1.26 -5.02 105.19 101.77 2oal n GLY 102 Ca -0.21 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.68 2oal n GLY 102 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oal s GLY 103 N -1.77 1.22 0.46 -0.02 0.00 -0.69 -5.15 107.32 101.38 2oal s GLY 103 Ca 0.00 -1.35 -0.23 0.00 0.00 0.00 0.00 44.72 43.14 2oal s GLY 103 CO 0.00 -0.91 1.17 2.56 0.00 0.00 0.00 173.10 175.92 2oal s PRO 104 N -3.31 3.75 -1.22 2.90 0.04 -1.26 0.62 135.00 136.52 2oal s PRO 104 Ca 0.29 1.79 -0.20 0.00 0.04 0.00 0.00 61.00 62.92 2oal s PRO 104 Cb -0.00 -2.41 0.05 0.00 0.04 0.00 0.00 34.50 32.18 2oal s PRO 104 CO 0.17 -0.57 1.69 0.34 0.04 0.00 0.00 177.00 178.67 2oal s ASP 105 N -1.35 6.61 0.11 6.66 2.15 0.16 -4.69 116.67 126.32 2oal s ASP 105 Ca 0.64 -2.12 -0.14 0.00 0.43 0.00 0.00 52.55 51.36 2oal s ASP 105 Cb -0.29 -2.58 0.02 0.00 -0.30 0.00 0.00 42.92 39.78 2oal s ASP 105 CO 0.35 -1.40 0.33 -1.38 -0.17 0.00 0.00 175.17 172.90 2oal s HIS 106 N 4.96 -0.10 -0.03 -5.34 -3.43 -1.26 -0.95 115.29 109.14 2oal s HIS 106 Ca 0.53 -0.23 -0.22 0.00 -0.80 0.00 0.00 55.06 54.35 2oal s HIS 106 Cb 0.03 0.15 0.04 0.00 -1.43 0.00 0.00 32.58 31.37 2oal s HIS 106 CO 0.04 -0.64 0.47 -0.59 -2.00 0.00 0.00 174.74 172.02 2oal s PHE 107 N -3.68 -0.39 0.06 0.38 -0.12 -0.93 -4.98 117.98 108.31 2oal s PHE 107 Ca 0.03 0.64 0.02 0.00 -0.05 0.00 0.00 56.93 57.57 2oal s PHE 107 Cb 0.02 0.24 -0.04 0.00 -0.63 0.00 0.00 43.02 42.61 2oal s PHE 107 CO -0.11 -0.49 0.07 0.71 -0.05 0.00 0.00 175.22 175.35 2oal s TYR 108 N -1.28 3.19 -0.46 3.49 2.02 -1.26 -1.09 117.35 121.96 2oal s TYR 108 Ca -0.12 0.10 0.03 0.00 -0.37 0.00 0.00 57.07 56.71 2oal s TYR 108 Cb -0.03 -1.64 0.13 0.00 -0.40 0.00 0.00 41.96 40.01 2oal s TYR 108 CO 0.07 0.52 0.22 -1.58 -1.57 0.00 0.00 175.55 173.20 2oal s HIS 109 N -1.32 2.78 0.57 2.71 5.65 -0.59 -4.84 115.29 120.26 2oal s HIS 109 Ca 0.27 -2.83 0.08 0.00 0.25 0.00 0.00 55.06 52.83 2oal s HIS 109 Cb -0.12 -2.47 0.08 0.00 -1.18 0.00 0.00 32.58 28.89 2oal s HIS 109 CO 0.19 -0.79 0.79 -1.54 -0.65 0.00 0.00 174.74 172.74 2oal s SER 110 N 0.18 5.08 0.00 9.88 1.04 -1.26 -1.72 113.70 126.91 2oal s SER 110 Ca 0.16 -0.68 0.28 0.00 0.48 0.00 0.00 55.95 56.19 2oal s SER 110 Cb -0.24 0.06 1.00 0.00 0.10 0.00 0.00 66.02 66.93 2oal s SER 110 CO -0.02 -1.32 1.72 0.49 0.98 0.00 0.00 173.24 175.08 2oal n PHE 111 N -2.27 0.00 -1.02 5.02 3.72 -1.16 -4.93 117.46 116.82 2oal n PHE 111 Ca 0.14 0.00 -0.35 0.00 -0.05 0.00 0.00 57.45 57.19 2oal n PHE 111 Cb 0.61 -0.18 0.09 0.00 -0.94 0.00 0.00 39.48 39.06 2oal n PHE 111 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oal n GLY 112 N 1.33 -2.01 3.60 1.37 0.00 -1.26 -4.86 105.19 103.36 2oal n GLY 112 Ca 0.12 -0.59 -0.34 0.00 0.00 0.00 0.00 46.02 45.22 2oal n GLY 112 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2oal s LEU 113 N 0.04 3.55 -0.12 0.99 -0.00 -1.26 -5.02 118.68 116.85 2oal s LEU 113 Ca 0.59 0.03 -0.29 0.00 -0.00 0.00 0.00 54.13 54.46 2oal s LEU 113 Cb -0.27 -1.86 -0.03 0.00 -0.00 0.00 0.00 46.19 44.03 2oal s LEU 113 CO 0.64 0.23 1.47 -0.76 -0.00 0.00 0.00 176.35 177.94 2oal s LEU 114 N -0.00 4.22 0.28 1.48 1.43 -1.26 -4.97 118.68 119.85 2oal s LEU 114 Ca 0.03 1.92 -0.30 0.00 -1.03 0.00 0.00 54.13 54.76 2oal s LEU 114 Cb -0.13 -3.54 -0.10 0.00 0.03 0.00 0.00 46.19 42.46 2oal s LEU 114 CO 0.02 -0.88 1.40 -0.75 0.23 0.00 0.00 176.35 176.37 2oal s LYS 115 N 3.86 4.28 0.22 1.70 2.36 -1.26 -4.79 119.74 126.11 2oal s LYS 115 Ca 0.65 2.29 -0.10 0.00 -2.55 0.00 0.00 55.97 56.25 2oal s LYS 115 Cb -0.27 -3.09 -0.07 0.00 -1.05 0.00 0.00 37.83 33.34 2oal s LYS 115 CO 0.23 -0.36 0.55 0.71 1.55 0.00 0.00 175.35 178.03 2oal s TYR 116 N -0.38 3.45 -0.12 4.03 1.51 -1.26 -1.42 117.35 123.17 2oal s TYR 116 Ca 0.56 0.90 -0.03 0.00 -1.01 0.00 0.00 57.07 57.49 2oal s TYR 116 Cb -0.41 -2.28 0.05 0.00 -0.11 0.00 0.00 41.96 39.20 2oal s TYR 116 CO 0.47 0.29 0.06 -1.58 -1.11 0.00 0.00 175.55 173.68 2oal s HIS 117 N -1.76 0.31 -1.42 2.71 2.46 0.12 -4.81 115.29 112.90 2oal s HIS 117 Ca 0.46 -0.18 -0.09 0.00 0.47 0.00 0.00 55.06 55.72 2oal s HIS 117 Cb -0.12 -0.68 0.04 0.00 -0.13 0.00 0.00 32.58 31.70 2oal s HIS 117 CO 0.21 -0.40 1.00 0.39 -2.47 0.00 0.00 174.74 173.47 2oal n GLU 118 N 5.24 -6.23 -1.02 2.88 -0.58 -1.26 -1.46 120.64 118.22 2oal n GLU 118 Ca -0.06 0.69 -0.01 0.00 -0.42 0.00 0.00 57.16 57.36 2oal n GLU 118 Cb 0.49 -5.58 -0.00 0.00 -0.57 0.00 0.00 31.44 25.78 2oal n GLU 118 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2oal n GLN 119 N -4.67 -0.79 -4.80 3.49 1.13 -1.26 -5.01 117.38 105.47 2oal n GLN 119 Ca -0.05 0.24 -0.27 0.00 -1.94 0.00 0.00 57.00 54.99 2oal n GLN 119 Cb 0.57 -3.86 -0.16 0.00 0.11 0.00 0.00 30.24 26.89 2oal n GLN 119 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2oal s ILE 120 N -1.65 1.42 0.28 5.09 1.01 -0.53 -5.09 121.20 121.73 2oal s ILE 120 Ca 0.00 -0.67 -0.30 0.00 0.00 0.00 0.00 60.65 59.69 2oal s ILE 120 Cb 0.00 -1.25 -0.13 0.00 0.01 0.00 0.00 42.46 41.09 2oal s ILE 120 CO 0.00 0.42 1.34 -2.65 0.00 0.00 0.00 174.94 174.04 2oal n PRO 121 N 3.54 2.03 -0.05 2.79 -0.02 -1.26 -0.70 135.00 141.33 2oal n PRO 121 Ca -0.21 0.72 0.24 0.00 -2.02 0.00 0.00 63.50 62.24 2oal n PRO 121 Cb 0.52 -2.33 0.72 0.00 -0.02 0.00 0.00 33.50 32.40 2oal n PRO 121 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2oal h LEU 122 N 3.42 0.00 -1.21 2.45 5.85 -1.54 -0.58 115.31 123.69 2oal h LEU 122 Ca -0.45 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.35 2oal h LEU 122 Cb 1.28 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.25 2oal h LEU 122 CO 0.70 0.00 0.57 0.77 -0.34 0.00 0.00 178.44 180.13 2oal h SER 123 N 0.00 0.82 -0.19 1.25 4.64 -1.88 -0.30 113.55 117.89 2oal h SER 123 Ca 0.31 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.52 2oal h SER 123 Cb 1.43 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 2oal h SER 123 CO -0.00 0.50 -0.31 0.45 -0.87 0.00 0.00 176.83 176.60 2oal h HIS 124 N 0.92 0.80 -0.12 4.77 3.86 -1.45 -1.17 115.15 122.76 2oal h HIS 124 Ca 0.39 -0.21 -0.16 0.00 -1.16 0.00 0.00 60.37 59.24 2oal h HIS 124 Cb 0.32 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.60 2oal h HIS 124 CO -0.00 0.91 -0.60 1.88 0.86 0.00 0.00 177.93 180.98 2oal h TYR 125 N 0.59 0.50 0.00 2.45 0.05 -1.46 -1.73 116.97 117.38 2oal h TYR 125 Ca 0.07 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.66 2oal h TYR 125 Cb 0.82 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.47 2oal h TYR 125 CO 0.04 0.89 -0.00 2.35 -1.05 0.00 0.00 178.16 180.39 2oal h TRP 126 N 0.29 -0.01 -0.57 4.88 7.01 -0.81 -2.57 115.95 124.18 2oal h TRP 126 Ca -0.00 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 60.94 2oal h TRP 126 Cb 1.13 0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 28.17 2oal h TRP 126 CO 0.03 0.28 0.11 0.35 -2.79 0.00 0.00 178.44 176.43 2oal h PHE 127 N -0.29 0.93 -0.45 2.65 3.57 -1.21 -0.72 116.94 121.42 2oal h PHE 127 Ca -0.00 -0.10 0.06 0.00 3.53 0.00 0.00 57.97 61.46 2oal h PHE 127 Cb 0.29 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 2oal h PHE 127 CO 0.02 0.78 0.15 0.22 -2.23 0.00 0.00 178.31 177.26 2oal h ASP 128 N 0.85 0.14 -0.15 0.41 3.58 -1.25 0.34 116.42 120.34 2oal h ASP 128 Ca 0.18 0.06 -0.14 0.00 0.42 0.00 0.00 57.03 57.54 2oal h ASP 128 Cb 0.34 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.43 2oal h ASP 128 CO 0.00 0.11 -0.41 0.03 -2.88 0.00 0.00 179.24 176.10 2oal h ARG 129 N 0.31 0.69 -0.23 0.28 3.08 -1.13 -2.18 114.38 115.20 2oal h ARG 129 Ca 0.21 -0.36 -0.04 0.00 0.07 0.00 0.00 59.98 59.86 2oal h ARG 129 Cb 0.22 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2oal h ARG 129 CO -0.23 0.97 -0.02 1.03 -1.07 0.00 0.00 179.97 180.65 2oal h SER 130 N 0.56 0.42 -0.58 7.04 0.87 -0.62 0.58 113.55 121.83 2oal h SER 130 Ca 0.04 -0.33 -0.02 0.00 -1.23 0.00 0.00 61.79 60.25 2oal h SER 130 Cb 0.95 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.76 2oal h SER 130 CO 0.09 0.65 0.30 0.22 -0.53 0.00 0.00 176.83 177.56 2oal h TYR 131 N 0.18 0.83 -0.20 2.24 5.03 -0.29 -1.50 116.97 123.26 2oal h TYR 131 Ca 0.06 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.35 2oal h TYR 131 Cb 0.45 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.47 2oal h TYR 131 CO 0.04 0.61 0.00 0.54 -1.32 0.00 0.00 178.16 178.03 2oal n ARG 132 N -4.36 1.58 -1.29 1.82 1.74 -0.83 -4.91 116.66 110.41 2oal n ARG 132 Ca 0.06 -0.89 -0.10 0.00 -0.77 0.00 0.00 57.85 56.15 2oal n ARG 132 Cb 0.12 -1.27 -0.04 0.00 -1.02 0.00 0.00 32.46 30.25 2oal n ARG 132 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2oal n GLY 133 N 0.97 1.13 0.08 -0.13 0.00 -0.56 -4.89 105.19 101.78 2oal n GLY 133 Ca 0.12 -0.59 0.13 0.00 0.00 0.00 0.00 46.02 45.68 2oal n GLY 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oal n LYS 134 N -2.71 0.24 -3.71 1.61 4.76 0.20 -4.89 118.16 113.66 2oal n LYS 134 Ca -0.10 0.14 -0.11 0.00 -2.87 0.00 0.00 58.31 55.38 2oal n LYS 134 Cb 0.32 -1.73 -0.06 0.00 -1.84 0.00 0.00 35.03 31.73 2oal n LYS 134 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 2oal s THR 135 N -3.11 0.09 0.00 -0.18 -1.32 -1.11 -4.95 115.64 105.05 2oal s THR 135 Ca 0.09 -0.71 0.00 0.00 -1.21 0.00 0.00 61.69 59.86 2oal s THR 135 Cb 0.13 -1.12 0.00 0.00 -1.51 0.00 0.00 72.50 70.00 2oal s THR 135 CO 0.64 -0.39 0.25 0.55 -2.21 0.00 0.00 174.62 173.46 2oal n VAL 136 N 0.10 0.01 -2.15 5.08 3.14 -1.26 -4.42 118.33 118.83 2oal n VAL 136 Ca -0.17 -0.24 -0.41 0.00 -2.96 0.00 0.00 64.34 60.56 2oal n VAL 136 Cb 0.62 1.51 -0.02 0.00 -1.06 0.00 0.00 33.84 34.88 2oal n VAL 136 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 2oal s GLU 137 N -0.01 4.38 0.70 1.45 2.12 -1.26 -4.98 118.70 121.09 2oal s GLU 137 Ca 0.00 2.18 -0.16 0.00 0.36 0.00 0.00 54.97 57.35 2oal s GLU 137 Cb 0.00 -3.09 0.02 0.00 0.26 0.00 0.00 34.13 31.32 2oal s GLU 137 CO 0.00 -0.16 1.20 -2.14 -0.54 0.00 0.00 175.26 173.61 2oal s PRO 138 N -1.64 2.36 0.16 4.30 0.02 -1.26 -4.82 135.00 134.12 2oal s PRO 138 Ca 0.49 1.72 -0.18 0.00 0.02 0.00 0.00 61.00 63.06 2oal s PRO 138 Cb -0.39 -1.86 0.08 0.00 0.02 0.00 0.00 34.50 32.34 2oal s PRO 138 CO 0.51 -1.66 1.66 0.35 -0.33 0.00 0.00 177.00 177.54 2oal h PHE 139 N -0.06 -0.27 -0.60 6.54 3.57 -1.93 -1.59 116.94 122.60 2oal h PHE 139 Ca -0.48 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.03 2oal h PHE 139 Cb 1.29 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 2oal h PHE 139 CO 0.48 -0.19 0.27 0.38 -2.23 0.00 0.00 178.31 177.01 2oal h ASP 140 N -0.04 0.80 0.39 0.41 2.03 -1.92 -0.48 116.42 117.62 2oal h ASP 140 Ca 0.18 -0.15 -0.11 0.00 -0.73 0.00 0.00 57.03 56.22 2oal h ASP 140 Cb 0.31 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.59 2oal h ASP 140 CO -0.40 0.72 -0.50 1.88 -1.03 0.00 0.00 179.24 179.92 2oal h TYR 141 N 0.82 0.15 0.05 4.15 -1.99 -1.77 -0.88 116.97 117.49 2oal h TYR 141 Ca 0.20 -0.05 -0.25 0.00 2.00 0.00 0.00 58.73 60.63 2oal h TYR 141 Cb 0.15 -0.03 0.01 0.00 2.00 0.00 0.00 36.73 38.86 2oal h TYR 141 CO 0.00 0.60 -1.07 0.00 -0.00 0.00 0.00 178.16 177.69 2oal h ALA 142 N 1.40 0.22 0.00 3.88 0.00 -1.06 -3.38 119.26 120.31 2oal h ALA 142 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2oal h ALA 142 Cb 0.91 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2oal h ALA 142 CO 0.07 0.80 -1.49 0.00 0.00 0.00 0.00 179.25 178.63 2oal s TYR 144 N -3.12 2.12 -0.42 0.00 1.51 -0.34 -4.82 117.35 112.27 2oal s TYR 144 Ca -0.01 -0.40 0.23 0.00 -1.01 0.00 0.00 57.07 55.88 2oal s TYR 144 Cb 0.13 -1.21 0.23 0.00 -0.11 0.00 0.00 41.96 41.00 2oal s TYR 144 CO 0.79 0.20 1.31 1.57 -1.11 0.00 0.00 175.55 178.31 2oal h LYS 145 N 4.41 0.00 -0.19 -0.62 2.10 -1.86 -3.39 116.57 117.02 2oal h LYS 145 Ca -0.47 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.19 2oal h LYS 145 Cb 1.16 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.47 2oal h LYS 145 CO 0.42 0.00 0.08 0.93 -2.00 0.00 0.00 179.45 178.88 2oal h GLU 146 N 0.00 0.18 -0.85 0.07 3.07 -1.95 -3.27 114.58 111.83 2oal h GLU 146 Ca 0.00 -0.01 0.21 0.00 -0.50 0.00 0.00 59.36 59.06 2oal h GLU 146 Cb 0.92 -0.04 -0.15 0.00 -0.84 0.00 0.00 28.75 28.64 2oal h GLU 146 CO 0.00 0.12 0.04 -1.35 -1.40 0.00 0.00 179.01 176.42 2oal h PRO 147 N 0.19 0.09 -0.14 2.33 0.11 -1.85 0.97 132.00 133.70 2oal h PRO 147 Ca 0.08 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.17 2oal h PRO 147 Cb 0.03 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 2oal h PRO 147 CO -0.06 0.06 0.04 0.28 -0.21 0.00 0.00 178.00 178.11 2oal h VAL 148 N 0.09 1.18 0.00 3.15 2.07 -1.86 -1.12 116.25 119.76 2oal h VAL 148 Ca 0.49 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 2oal h VAL 148 Cb 0.93 1.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.98 2oal h VAL 148 CO -0.75 0.17 -0.31 0.16 0.02 0.00 0.00 177.57 176.86 2oal h ILE 149 N 0.04 0.79 -0.05 4.57 3.07 -1.47 -2.80 117.51 121.66 2oal h ILE 149 Ca 0.04 -1.28 -0.19 0.00 1.55 0.00 0.00 64.86 64.98 2oal h ILE 149 Cb 0.22 1.80 -0.00 0.00 -0.27 0.00 0.00 36.82 38.57 2oal h ILE 149 CO -0.00 0.30 -0.80 -0.07 -1.05 0.00 0.00 178.15 176.53 2oal h LEU 150 N 0.00 0.45 -2.20 0.16 3.38 -0.62 -0.51 115.31 115.97 2oal h LEU 150 Ca -0.00 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.65 2oal h LEU 150 Cb 0.77 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2oal h LEU 150 CO 0.04 1.08 0.00 0.44 0.09 0.00 0.00 178.44 180.09 2oal h ASP 151 N 0.23 0.00 -0.46 -0.43 3.32 -0.94 -0.45 116.42 117.70 2oal h ASP 151 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2oal h ASP 151 Cb 1.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.94 2oal h ASP 151 CO 0.13 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.65 2oal n ALA 152 N -2.01 2.51 -3.41 3.45 0.00 -1.00 -4.97 120.51 115.07 2oal n ALA 152 Ca -0.01 -1.44 -0.25 0.00 0.00 0.00 0.00 53.44 51.74 2oal n ALA 152 Cb 0.14 -0.67 0.02 0.00 0.00 0.00 0.00 19.45 18.93 2oal n ALA 152 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2oal n ASN 153 N 0.67 -4.68 -4.78 0.00 5.03 -0.18 -4.90 115.26 106.43 2oal n ASN 153 Ca 0.18 -0.46 -0.33 0.00 0.87 0.00 0.00 54.58 54.84 2oal n ASN 153 Cb 0.62 -3.80 0.05 0.00 -1.02 0.00 0.00 39.78 35.63 2oal n ASN 153 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2oal s ARG 154 N -6.09 2.80 0.39 3.52 1.81 -0.23 -1.16 118.95 119.99 2oal s ARG 154 Ca 0.45 1.32 -0.19 0.00 -1.72 0.00 0.00 55.73 55.58 2oal s ARG 154 Cb -0.22 -1.96 -0.10 0.00 -0.45 0.00 0.00 34.95 32.22 2oal s ARG 154 CO 0.55 -1.24 0.87 0.45 -0.68 0.00 0.00 175.30 175.25 2oal s SER 155 N -2.77 6.88 0.00 0.23 0.15 -0.54 -4.28 113.70 113.36 2oal s SER 155 Ca 0.65 1.54 0.30 0.00 0.70 0.00 0.00 55.95 59.14 2oal s SER 155 Cb -0.19 -2.48 1.46 0.00 -1.71 0.00 0.00 66.02 63.10 2oal s SER 155 CO 0.43 -0.30 2.03 -0.81 1.20 0.00 0.00 173.24 175.79 2oal n PRO 156 N -0.54 0.34 -4.29 5.44 -0.04 -1.26 -4.78 135.00 129.87 2oal n PRO 156 Ca 0.06 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.34 2oal n PRO 156 Cb 0.54 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 2oal n PRO 156 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2oal s ARG 157 N -2.66 0.67 0.76 0.54 0.52 -1.26 -1.31 118.95 116.21 2oal s ARG 157 Ca 0.26 -0.39 -0.11 0.00 -0.52 0.00 0.00 55.73 54.96 2oal s ARG 157 Cb 0.20 -0.63 0.05 0.00 0.52 0.00 0.00 34.95 35.08 2oal s ARG 157 CO 0.47 0.17 1.08 1.03 0.02 0.00 0.00 175.30 178.07 2oal s ARG 158 N -0.44 2.39 0.53 3.54 0.52 0.42 -4.76 118.95 121.15 2oal s ARG 158 Ca 0.02 0.80 0.24 0.00 -0.52 0.00 0.00 55.73 56.26 2oal s ARG 158 Cb -0.04 -1.94 1.39 0.00 0.52 0.00 0.00 34.95 34.88 2oal s ARG 158 CO -0.00 -1.45 2.03 -0.07 0.02 0.00 0.00 175.30 175.83 2oal h LEU 159 N -0.97 0.00 0.00 2.53 3.38 -1.95 0.49 115.31 118.79 2oal h LEU 159 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2oal h LEU 159 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2oal h LEU 159 CO 0.58 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.21 2oal n ASP 160 N -4.36 0.00 0.00 -0.43 5.68 -1.26 -4.87 116.55 111.30 2oal n ASP 160 Ca 0.07 -0.59 0.00 0.00 -0.50 0.00 0.00 54.79 53.77 2oal n ASP 160 Cb 0.48 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 2oal n ASP 160 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2oal n GLY 161 N 0.74 2.18 3.72 6.12 0.00 0.17 -5.05 105.19 113.07 2oal n GLY 161 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2oal n GLY 161 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oal s SER 162 N -1.47 6.50 0.00 1.61 1.04 -1.25 -4.59 113.70 115.53 2oal s SER 162 Ca 0.00 2.72 -0.27 0.00 0.48 0.00 0.00 55.95 58.88 2oal s SER 162 Cb 0.00 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.49 2oal s SER 162 CO 0.00 -0.89 0.84 -0.75 0.98 0.00 0.00 173.24 173.42 2oal s LYS 163 N 1.28 4.52 0.00 4.02 2.20 -1.26 -0.44 119.74 130.06 2oal s LYS 163 Ca 0.73 1.17 0.09 0.00 -0.36 0.00 0.00 55.97 57.60 2oal s LYS 163 Cb -0.46 -3.42 -0.04 0.00 -1.51 0.00 0.00 37.83 32.40 2oal s LYS 163 CO 0.32 0.09 0.49 1.33 -0.36 0.00 0.00 175.35 177.22 2oal n VAL 164 N 3.48 0.00 -3.48 4.02 0.24 -0.43 -4.98 118.33 117.18 2oal n VAL 164 Ca 0.01 -0.36 -0.12 0.00 -2.04 0.00 0.00 64.34 61.83 2oal n VAL 164 Cb 0.51 1.06 -0.03 0.00 -1.47 0.00 0.00 33.84 33.91 2oal n VAL 164 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2oal s THR 165 N -1.48 0.02 0.36 3.34 -1.32 -1.23 -5.08 115.64 110.25 2oal s THR 165 Ca 0.06 -0.14 -0.26 0.00 -1.21 0.00 0.00 61.69 60.13 2oal s THR 165 Cb 0.07 -1.04 -0.09 0.00 -1.51 0.00 0.00 72.50 69.93 2oal s THR 165 CO 0.27 -0.08 1.11 0.20 -2.21 0.00 0.00 174.62 173.91 2oal s ASN 166 N -2.67 6.82 0.19 8.08 0.02 -1.26 -4.94 114.94 121.18 2oal s ASN 166 Ca 0.01 2.22 -0.17 0.00 -1.02 0.00 0.00 52.86 53.90 2oal s ASN 166 Cb -0.00 -2.61 0.03 0.00 0.02 0.00 0.00 41.25 38.69 2oal s ASN 166 CO -0.11 -0.46 0.52 -0.72 0.02 0.00 0.00 177.10 176.34 2oal s TYR 167 N -1.42 -0.10 0.00 2.20 -0.85 -1.26 -4.69 117.35 111.22 2oal s TYR 167 Ca 0.54 -0.24 0.00 0.00 -0.52 0.00 0.00 57.07 56.84 2oal s TYR 167 Cb -0.28 0.38 0.00 0.00 0.38 0.00 0.00 41.96 42.44 2oal s TYR 167 CO 0.36 -0.91 0.00 0.00 -1.52 0.00 0.00 175.55 173.48 2oal n ALA 168 N -0.34 0.00 -2.26 9.51 0.00 0.20 -4.25 120.51 123.37 2oal n ALA 168 Ca -0.10 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.19 2oal n ALA 168 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.97 2oal n ALA 168 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2oal s TRP 169 N 0.77 1.31 -0.06 0.00 0.51 -1.26 -1.16 118.94 119.06 2oal s TRP 169 Ca 0.00 -0.74 0.05 0.00 -2.12 0.00 0.00 56.10 53.29 2oal s TRP 169 Cb 0.00 -0.66 -0.01 0.00 -0.81 0.00 0.00 33.47 31.99 2oal s TRP 169 CO 0.00 0.11 -0.22 -1.01 -0.51 0.00 0.00 176.95 175.32 2oal s HIS 170 N -3.29 2.15 0.06 -1.98 3.76 -0.77 -1.26 115.29 113.95 2oal s HIS 170 Ca 0.17 -0.67 -0.28 0.00 -0.15 0.00 0.00 55.06 54.14 2oal s HIS 170 Cb 0.02 -1.43 0.09 0.00 1.11 0.00 0.00 32.58 32.38 2oal s HIS 170 CO 0.01 -0.22 1.11 -0.59 -0.85 0.00 0.00 174.74 174.20 2oal s PHE 171 N -0.00 -0.10 -0.41 1.40 -0.12 -0.87 -1.24 117.98 116.62 2oal s PHE 171 Ca -0.06 -0.09 -0.23 0.00 -0.05 0.00 0.00 56.93 56.50 2oal s PHE 171 Cb -0.13 0.59 0.02 0.00 -0.63 0.00 0.00 43.02 42.86 2oal s PHE 171 CO 0.04 -0.55 0.78 0.34 -0.05 0.00 0.00 175.22 175.78 2oal s ASP 172 N -2.89 6.47 0.32 1.98 -1.08 -1.26 -1.11 116.67 119.08 2oal s ASP 172 Ca 0.12 0.08 0.09 0.00 -0.52 0.00 0.00 52.55 52.33 2oal s ASP 172 Cb 0.01 -2.39 0.87 0.00 -1.46 0.00 0.00 42.92 39.95 2oal s ASP 172 CO -0.01 -0.83 1.74 0.00 0.52 0.00 0.00 175.17 176.58 2oal h ALA 173 N 8.77 1.78 -1.01 3.66 0.00 -1.92 -0.37 119.26 130.18 2oal h ALA 173 Ca -0.25 0.12 0.13 0.00 0.00 0.00 0.00 54.91 54.91 2oal h ALA 173 Cb 1.09 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.79 2oal h ALA 173 CO 0.94 -0.24 0.63 0.45 0.00 0.00 0.00 179.25 181.03 2oal h HIS 174 N 0.61 1.14 -0.39 0.00 3.86 -1.99 0.46 115.15 118.84 2oal h HIS 174 Ca 0.63 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.76 2oal h HIS 174 Cb 1.18 -0.36 -0.01 0.00 1.06 0.00 0.00 27.41 29.27 2oal h HIS 174 CO -0.01 0.43 -0.24 -0.07 0.86 0.00 0.00 177.93 178.91 2oal h LEU 175 N 0.98 0.82 -0.50 2.43 3.38 -1.43 -1.77 115.31 119.21 2oal h LEU 175 Ca 0.51 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 2oal h LEU 175 Cb 0.53 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2oal h LEU 175 CO -0.28 1.02 -0.22 0.58 0.09 0.00 0.00 178.44 179.64 2oal h VAL 176 N 0.69 1.27 -0.49 1.22 2.07 -1.10 -1.26 116.25 118.65 2oal h VAL 176 Ca 0.09 -1.38 0.01 0.00 0.82 0.00 0.00 66.70 66.24 2oal h VAL 176 Cb 0.76 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.63 2oal h VAL 176 CO 0.06 0.48 0.31 0.00 0.02 0.00 0.00 177.57 178.44 2oal h ALA 177 N 0.88 0.63 -0.58 1.67 0.00 -0.74 -0.76 119.26 120.36 2oal h ALA 177 Ca 0.11 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2oal h ALA 177 Cb 0.80 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2oal h ALA 177 CO 0.07 0.04 0.12 -0.44 0.00 0.00 0.00 179.25 179.04 2oal h ASP 178 N 0.64 0.89 -0.55 0.00 3.32 -1.16 0.71 116.42 120.28 2oal h ASP 178 Ca 0.19 -0.24 0.03 0.00 0.02 0.00 0.00 57.03 57.03 2oal h ASP 178 Cb -0.04 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.23 2oal h ASP 178 CO -0.06 0.91 0.31 0.15 -1.72 0.00 0.00 179.24 178.83 2oal h PHE 179 N 0.84 0.59 -0.38 4.55 3.57 -0.83 -1.86 116.94 123.41 2oal h PHE 179 Ca 0.18 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.54 2oal h PHE 179 Cb 0.37 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.92 2oal h PHE 179 CO 0.03 0.32 -0.40 -0.07 -2.23 0.00 0.00 178.31 175.95 2oal h LEU 180 N 0.62 1.01 -0.55 0.59 3.38 -0.84 -1.56 115.31 117.96 2oal h LEU 180 Ca 0.23 -0.47 0.06 0.00 0.09 0.00 0.00 57.88 57.79 2oal h LEU 180 Cb 0.06 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 2oal h LEU 180 CO -0.12 1.28 0.25 -0.09 0.09 0.00 0.00 178.44 179.85 2oal h ARG 181 N 0.76 0.47 -0.62 1.13 2.43 -0.59 0.37 114.38 118.34 2oal h ARG 181 Ca 0.06 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 59.12 2oal h ARG 181 Cb 1.00 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.42 2oal h ARG 181 CO 0.10 0.31 0.07 0.00 -1.51 0.00 0.00 179.97 178.93 2oal h ARG 182 N 0.48 1.05 -0.13 0.20 3.08 -1.24 -1.53 114.38 116.29 2oal h ARG 182 Ca 0.25 -0.30 -0.02 0.00 0.07 0.00 0.00 59.98 59.98 2oal h ARG 182 Cb 0.21 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2oal h ARG 182 CO -0.21 1.00 0.02 0.35 -1.07 0.00 0.00 179.97 180.06 2oal h PHE 183 N 0.96 0.24 -0.12 3.04 3.57 -0.33 -0.65 116.94 123.65 2oal h PHE 183 Ca 0.18 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 2oal h PHE 183 Cb 0.48 -0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.15 2oal h PHE 183 CO 0.04 0.42 0.02 0.00 -2.23 0.00 0.00 178.31 176.55 2oal h ALA 184 N 0.79 0.16 -0.21 2.41 0.00 -0.25 0.19 119.26 122.35 2oal h ALA 184 Ca 0.04 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 2oal h ALA 184 Cb 0.32 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2oal h ALA 184 CO 0.00 -0.19 -0.61 1.79 0.00 0.00 0.00 179.25 180.25 2oal h THR 185 N -0.03 1.30 0.18 0.00 1.35 -1.34 -1.28 112.91 113.08 2oal h THR 185 Ca 0.04 -1.84 -0.33 0.00 -0.55 0.00 0.00 66.41 63.72 2oal h THR 185 Cb 0.30 1.79 0.01 0.00 -1.73 0.00 0.00 68.15 68.52 2oal h THR 185 CO 0.00 0.58 -1.59 -0.33 -0.25 0.00 0.00 175.52 173.93 2oal h GLU 186 N 0.52 0.37 0.00 4.72 5.08 -1.16 -3.34 114.58 120.78 2oal h GLU 186 Ca -0.00 -0.63 -0.04 0.00 -1.00 0.00 0.00 59.36 57.68 2oal h GLU 186 Cb 1.19 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.67 2oal h GLU 186 CO 0.12 1.27 -1.80 1.63 -1.00 0.00 0.00 179.01 179.24 2oal n LYS 187 N -3.57 0.64 -0.05 2.33 4.01 0.66 -4.62 118.16 117.56 2oal n LYS 187 Ca -0.19 -0.13 0.04 0.00 -0.51 0.00 0.00 58.31 57.51 2oal n LYS 187 Cb 1.07 -1.39 0.07 0.00 -0.51 0.00 0.00 35.03 34.26 2oal n LYS 187 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2oal n LEU 188 N -2.14 2.09 -1.17 -0.35 4.77 -0.54 -5.00 117.00 114.66 2oal n LEU 188 Ca -0.06 -1.43 -0.13 0.00 -0.03 0.00 0.00 56.01 54.35 2oal n LEU 188 Cb 0.51 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 2oal n LEU 188 CO 0.35 0.48 -0.14 0.61 -1.33 0.00 0.00 177.39 177.35 2oal n GLY 189 N 0.35 0.99 3.74 -0.72 0.00 -0.93 -4.91 105.19 103.71 2oal n GLY 189 Ca 0.06 -0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 2oal n GLY 189 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oal s VAL 190 N -2.55 3.92 -0.18 1.61 1.01 -0.88 -4.76 120.40 118.58 2oal s VAL 190 Ca 0.00 1.66 -0.19 0.00 0.00 0.00 0.00 61.98 63.45 2oal s VAL 190 Cb 0.00 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2oal s VAL 190 CO 0.00 0.29 0.52 -0.60 0.00 0.00 0.00 175.10 175.31 2oal s ARG 191 N -0.36 4.23 -0.21 2.72 3.52 -0.06 -4.23 118.95 124.56 2oal s ARG 191 Ca 0.49 0.45 -0.09 0.00 -0.13 0.00 0.00 55.73 56.45 2oal s ARG 191 Cb -0.29 -3.53 -0.05 0.00 -1.56 0.00 0.00 34.95 29.53 2oal s ARG 191 CO 0.34 -0.08 0.11 -1.58 -0.81 0.00 0.00 175.30 173.29 2oal s HIS 192 N 1.39 3.31 -0.13 5.12 5.65 -1.26 -0.19 115.29 129.19 2oal s HIS 192 Ca 0.25 0.17 -0.00 0.00 0.25 0.00 0.00 55.06 55.73 2oal s HIS 192 Cb -0.15 -2.17 0.02 0.00 -1.18 0.00 0.00 32.58 29.10 2oal s HIS 192 CO 0.10 0.15 -0.10 0.08 -0.65 0.00 0.00 174.74 174.32 2oal s VAL 193 N 0.62 1.21 -0.80 0.89 1.01 -0.17 -4.95 120.40 118.20 2oal s VAL 193 Ca 0.06 -0.41 -0.20 0.00 0.00 0.00 0.00 61.98 61.42 2oal s VAL 193 Cb -0.12 -1.20 0.11 0.00 0.00 0.00 0.00 36.38 35.16 2oal s VAL 193 CO 0.01 0.39 1.03 -1.61 0.00 0.00 0.00 175.10 174.92 2oal s GLU 194 N 1.63 3.38 0.16 2.72 2.02 -1.26 -0.99 118.70 126.35 2oal s GLU 194 Ca 0.05 -1.39 -0.13 0.00 0.02 0.00 0.00 54.97 53.52 2oal s GLU 194 Cb -0.13 -4.62 0.01 0.00 0.10 0.00 0.00 34.13 29.50 2oal s GLU 194 CO -0.09 -1.77 0.36 0.34 0.02 0.00 0.00 175.26 174.12 2oal s ASP 195 N 3.66 -0.09 -0.15 -0.19 -1.08 -0.73 -4.93 116.67 113.15 2oal s ASP 195 Ca 0.27 -0.62 -0.02 0.00 -0.52 0.00 0.00 52.55 51.65 2oal s ASP 195 Cb -0.11 0.47 -0.02 0.00 -1.46 0.00 0.00 42.92 41.80 2oal s ASP 195 CO -0.01 -0.91 -0.07 -0.60 0.52 0.00 0.00 175.17 174.10 2oal s ARG 196 N -3.89 3.54 0.02 4.34 3.52 -1.26 -3.26 118.95 121.95 2oal s ARG 196 Ca 0.10 -0.59 -0.30 0.00 -0.13 0.00 0.00 55.73 54.81 2oal s ARG 196 Cb 0.02 -2.82 -0.07 0.00 -1.56 0.00 0.00 34.95 30.52 2oal s ARG 196 CO -0.05 0.19 1.65 0.08 -0.81 0.00 0.00 175.30 176.36 2oal s VAL 197 N 0.46 3.28 -0.17 7.11 1.01 -1.26 -0.25 120.40 130.58 2oal s VAL 197 Ca -0.06 0.59 0.09 0.00 0.00 0.00 0.00 61.98 62.60 2oal s VAL 197 Cb -0.15 -3.38 -0.16 0.00 0.00 0.00 0.00 36.38 32.69 2oal s VAL 197 CO 0.03 -0.02 -0.04 1.21 0.00 0.00 0.00 175.10 176.28 2oal n GLU 198 N 6.18 1.10 -3.73 2.72 2.13 0.58 -4.83 120.64 124.79 2oal n GLU 198 Ca 0.16 0.04 -0.13 0.00 0.66 0.00 0.00 57.16 57.90 2oal n GLU 198 Cb 0.42 -1.39 -0.10 0.00 0.27 0.00 0.00 31.44 30.63 2oal n GLU 198 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2oal s HIS 199 N -2.38 -0.45 -0.23 4.31 5.04 -0.49 -4.99 115.29 116.10 2oal s HIS 199 Ca -0.15 1.08 -0.04 0.00 -1.54 0.00 0.00 55.06 54.41 2oal s HIS 199 Cb 0.05 0.16 -0.00 0.00 0.04 0.00 0.00 32.58 32.83 2oal s HIS 199 CO 0.55 -0.22 -0.04 0.08 -2.34 0.00 0.00 174.74 172.77 2oal s VAL 200 N 0.33 3.33 -0.30 0.89 1.01 -1.26 0.62 120.40 125.03 2oal s VAL 200 Ca -0.01 -0.61 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 2oal s VAL 200 Cb -0.03 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 2oal s VAL 200 CO -0.01 0.35 0.38 -1.58 0.00 0.00 0.00 175.10 174.24 2oal s GLN 201 N 1.45 3.84 0.23 2.72 2.00 1.00 -5.00 119.66 125.91 2oal s GLN 201 Ca 0.05 -0.12 0.06 0.00 -2.00 0.00 0.00 55.36 53.34 2oal s GLN 201 Cb -0.15 -3.71 -0.03 0.00 0.80 0.00 0.00 33.01 29.91 2oal s GLN 201 CO -0.03 -0.38 0.23 1.03 -0.50 0.00 0.00 175.29 175.64 2oal s ARG 202 N 2.08 3.08 0.46 1.67 0.52 -1.26 0.14 118.95 125.64 2oal s ARG 202 Ca 0.14 -0.93 0.05 0.00 -0.52 0.00 0.00 55.73 54.48 2oal s ARG 202 Cb -0.16 -2.68 0.08 0.00 0.52 0.00 0.00 34.95 32.71 2oal s ARG 202 CO 0.11 0.43 0.63 -0.40 0.02 0.00 0.00 175.30 176.09 2oal n ASP 203 N -1.08 1.44 0.16 0.23 5.68 0.47 -4.77 116.55 118.68 2oal n ASP 203 Ca -0.08 -2.08 0.12 0.00 -0.50 0.00 0.00 54.79 52.26 2oal n ASP 203 Cb 0.57 -0.36 0.55 0.00 -1.14 0.00 0.00 41.12 40.74 2oal n ASP 203 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2oal h ALA 204 N 0.02 1.00 -0.01 2.12 0.00 -2.01 -0.95 119.26 119.43 2oal h ALA 204 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2oal h ALA 204 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2oal h ALA 204 CO 0.28 0.00 -0.05 0.09 0.00 0.00 0.00 179.25 179.57 2oal n ASN 205 N -2.33 1.54 0.00 0.00 5.03 -1.26 -4.93 115.26 113.31 2oal n ASN 205 Ca 0.01 -1.43 0.00 0.00 0.87 0.00 0.00 54.58 54.03 2oal n ASN 205 Cb 0.18 0.03 0.00 0.00 -1.02 0.00 0.00 39.78 38.97 2oal n ASN 205 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2oal n GLY 206 N 1.22 0.86 3.88 7.41 0.00 -0.36 -5.04 105.19 113.16 2oal n GLY 206 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2oal n GLY 206 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oal s ASN 207 N -2.98 6.34 -0.04 1.61 0.02 -1.26 -4.76 114.94 113.88 2oal s ASN 207 Ca 0.00 1.19 -0.29 0.00 -1.02 0.00 0.00 52.86 52.74 2oal s ASN 207 Cb 0.00 -2.36 -0.03 0.00 0.02 0.00 0.00 41.25 38.88 2oal s ASN 207 CO 0.00 -0.63 0.94 -0.63 0.02 0.00 0.00 177.10 176.80 2oal s ILE 208 N -2.79 4.88 -0.18 0.60 1.01 -1.26 -0.39 121.20 123.06 2oal s ILE 208 Ca 0.52 1.96 -0.20 0.00 0.00 0.00 0.00 60.65 62.93 2oal s ILE 208 Cb -0.10 -4.28 -0.21 0.00 0.01 0.00 0.00 42.46 37.88 2oal s ILE 208 CO 0.43 0.14 0.30 -0.08 0.00 0.00 0.00 174.94 175.73 2oal h GLU 209 N 6.87 0.05 -2.28 2.79 4.81 0.86 -3.46 114.58 124.23 2oal h GLU 209 Ca -0.39 -0.09 0.19 0.00 -0.13 0.00 0.00 59.36 58.94 2oal h GLU 209 Cb 1.20 0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.54 2oal h GLU 209 CO 0.77 1.04 0.54 -1.54 -0.73 0.00 0.00 179.01 179.10 2oal s SER 210 N -6.85 -0.12 -0.05 1.04 1.04 -0.95 -4.00 113.70 103.80 2oal s SER 210 Ca -0.27 -0.44 0.04 0.00 0.48 0.00 0.00 55.95 55.76 2oal s SER 210 Cb 0.05 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.63 2oal s SER 210 CO 0.63 -0.86 -0.15 0.68 0.98 0.00 0.00 173.24 174.52 2oal s VAL 211 N -2.96 1.33 -0.16 5.02 -7.23 -0.35 -0.00 120.40 116.04 2oal s VAL 211 Ca 0.14 -0.64 -0.06 0.00 -1.81 0.00 0.00 61.98 59.61 2oal s VAL 211 Cb -0.01 -1.16 -0.04 0.00 0.56 0.00 0.00 36.38 35.73 2oal s VAL 211 CO 0.02 0.39 0.05 -0.60 -0.31 0.00 0.00 175.10 174.66 2oal s ARG 212 N 0.24 3.80 0.69 4.82 3.52 0.20 -0.66 118.95 131.56 2oal s ARG 212 Ca -0.08 -0.35 -0.03 0.00 -0.13 0.00 0.00 55.73 55.15 2oal s ARG 212 Cb -0.13 -3.14 0.09 0.00 -1.56 0.00 0.00 34.95 30.21 2oal s ARG 212 CO 0.03 0.36 0.96 0.95 -0.81 0.00 0.00 175.30 176.79 2oal s THR 213 N 0.10 2.32 0.47 4.11 -4.23 0.92 -0.30 115.64 119.03 2oal s THR 213 Ca 0.05 -0.48 0.21 0.00 -1.18 0.00 0.00 61.69 60.28 2oal s THR 213 Cb -0.12 -2.84 0.25 0.00 1.34 0.00 0.00 72.50 71.13 2oal s THR 213 CO 0.01 0.00 2.08 0.00 -0.54 0.00 0.00 174.62 176.17 2oal h ALA 214 N -0.46 1.60 -0.00 3.99 0.00 -0.94 -1.23 119.26 122.22 2oal h ALA 214 Ca -0.41 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2oal h ALA 214 Cb 1.29 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2oal h ALA 214 CO 0.49 0.14 -0.04 0.25 0.00 0.00 0.00 179.25 180.09 2oal n THR 215 N -4.09 0.00 -0.16 0.00 -2.24 -1.26 -4.89 114.28 101.64 2oal n THR 215 Ca -0.02 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2oal n THR 215 Cb 0.19 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 2oal n THR 215 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oal n GLY 216 N 1.17 0.61 3.77 3.38 0.00 -0.46 -5.06 105.19 108.60 2oal n GLY 216 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 2oal n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2oal s ARG 217 N -0.79 4.33 -0.17 1.61 0.52 -1.26 -4.75 118.95 118.44 2oal s ARG 217 Ca 0.00 1.70 -0.00 0.00 -0.52 0.00 0.00 55.73 56.91 2oal s ARG 217 Cb 0.00 -2.83 0.00 0.00 0.52 0.00 0.00 34.95 32.64 2oal s ARG 217 CO 0.00 -0.04 -0.14 0.08 0.02 0.00 0.00 175.30 175.22 2oal s VAL 218 N -1.40 2.67 -0.23 3.52 1.01 -1.26 -0.06 120.40 124.65 2oal s VAL 218 Ca 0.52 -0.76 -0.04 0.00 0.00 0.00 0.00 61.98 61.71 2oal s VAL 218 Cb -0.28 -2.14 -0.00 0.00 0.00 0.00 0.00 36.38 33.96 2oal s VAL 218 CO 0.35 0.51 -0.04 -0.36 0.00 0.00 0.00 175.10 175.56 2oal s PHE 219 N 0.99 2.99 0.18 5.22 0.40 0.17 -4.95 117.98 122.99 2oal s PHE 219 Ca -0.02 -1.06 0.06 0.00 -0.60 0.00 0.00 56.93 55.31 2oal s PHE 219 Cb -0.15 -2.11 -0.04 0.00 0.51 0.00 0.00 43.02 41.24 2oal s PHE 219 CO -0.03 -0.59 0.13 0.16 0.70 0.00 0.00 175.22 175.59 2oal s ASP 220 N 1.45 5.41 0.15 1.36 -4.77 -1.26 -1.22 116.67 117.79 2oal s ASP 220 Ca 0.05 -0.19 -0.25 0.00 -3.30 0.00 0.00 52.55 48.86 2oal s ASP 220 Cb -0.15 -1.37 0.06 0.00 -1.09 0.00 0.00 42.92 40.37 2oal s ASP 220 CO -0.03 0.05 0.91 0.00 0.70 0.00 0.00 175.17 176.80 2oal s ALA 221 N -1.82 -1.62 -0.04 2.11 0.00 -1.26 -4.88 121.76 114.26 2oal s ALA 221 Ca 0.31 0.21 0.06 0.00 0.00 0.00 0.00 51.96 52.54 2oal s ALA 221 Cb -0.10 0.64 -0.24 0.00 0.00 0.00 0.00 23.12 23.43 2oal s ALA 221 CO 0.23 -0.98 0.68 -0.44 0.00 0.00 0.00 175.76 175.25 2oal h ASP 222 N 2.00 0.13 -3.64 0.00 3.32 -1.03 -3.47 116.42 113.74 2oal h ASP 222 Ca -0.23 -0.26 -0.38 0.00 0.02 0.00 0.00 57.03 56.18 2oal h ASP 222 Cb 1.24 -0.04 -0.32 0.00 0.22 0.00 0.00 39.33 40.43 2oal h ASP 222 CO 0.26 1.22 -0.77 -0.22 -1.72 0.00 0.00 179.24 178.02 2oal s LEU 223 N -6.44 1.56 -0.11 1.55 2.96 -0.98 -4.89 118.68 112.32 2oal s LEU 223 Ca -0.08 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 2oal s LEU 223 Cb 0.08 -0.38 -0.02 0.00 0.50 0.00 0.00 46.19 46.36 2oal s LEU 223 CO 0.82 -0.01 -0.11 -0.36 -1.32 0.00 0.00 176.35 175.37 2oal s PHE 224 N 0.54 2.84 -0.27 5.38 0.40 0.20 -1.73 117.98 125.33 2oal s PHE 224 Ca -0.07 -0.42 -0.03 0.00 -0.60 0.00 0.00 56.93 55.81 2oal s PHE 224 Cb -0.10 -1.80 0.03 0.00 0.51 0.00 0.00 43.02 41.65 2oal s PHE 224 CO -0.00 -0.04 -0.00 0.08 0.70 0.00 0.00 175.22 175.95 2oal s VAL 225 N 0.01 3.24 -0.56 -0.44 1.01 -0.35 -0.71 120.40 122.59 2oal s VAL 225 Ca -0.03 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.70 2oal s VAL 225 Cb -0.14 -2.70 0.04 0.00 0.00 0.00 0.00 36.38 33.58 2oal s VAL 225 CO 0.04 0.09 0.99 -0.62 0.00 0.00 0.00 175.10 175.60 2oal s ASP 226 N 1.36 6.34 -0.26 3.32 -1.08 0.49 -1.47 116.67 125.37 2oal s ASP 226 Ca -0.00 -0.32 0.09 0.00 -0.52 0.00 0.00 52.55 51.80 2oal s ASP 226 Cb -0.17 -2.45 0.45 0.00 -1.46 0.00 0.00 42.92 39.28 2oal s ASP 226 CO -0.02 -1.29 1.19 0.00 0.52 0.00 0.00 175.17 175.58 2oal n SER 228 N -0.77 0.93 0.00 0.00 3.41 -0.97 -4.18 113.62 112.05 2oal n SER 228 Ca 0.35 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 57.42 2oal n SER 228 Cb 0.90 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 2oal n SER 228 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2oal n GLY 229 N 1.00 -1.39 0.50 5.00 0.00 -1.26 -4.19 105.19 104.85 2oal n GLY 229 Ca 0.16 -1.29 0.32 0.00 0.00 0.00 0.00 46.02 45.21 2oal n GLY 229 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2oal h PHE 230 N 0.00 0.12 0.00 1.61 0.04 -1.94 0.53 116.94 117.30 2oal h PHE 230 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2oal h PHE 230 Cb 0.00 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.12 2oal h PHE 230 CO 0.00 0.01 0.00 2.89 -0.60 0.00 0.00 178.31 180.61 2oal n ARG 231 N -4.28 0.05 -3.98 1.51 1.85 -1.26 -4.93 116.66 105.63 2oal n ARG 231 Ca 0.24 0.13 -0.38 0.00 -1.00 0.00 0.00 57.85 56.84 2oal n ARG 231 Cb 1.13 -1.56 0.01 0.00 -1.05 0.00 0.00 32.46 30.99 2oal n ARG 231 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2oal n GLY 232 N 0.96 -0.76 0.35 2.89 0.00 0.17 -4.51 105.19 104.28 2oal n GLY 232 Ca 0.06 0.31 0.15 0.00 0.00 0.00 0.00 46.02 46.54 2oal n GLY 232 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2oal h LEU 233 N -1.55 0.70 0.00 0.99 5.85 -1.86 -1.17 115.31 118.27 2oal h LEU 233 Ca -0.60 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2oal h LEU 233 Cb 1.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2oal h LEU 233 CO 0.42 0.19 -0.52 0.18 -0.34 0.00 0.00 178.44 178.37 2oal n LEU 234 N -4.84 1.40 -0.29 2.25 4.77 -1.26 -2.38 117.00 116.66 2oal n LEU 234 Ca 0.24 0.44 0.04 0.00 -0.03 0.00 0.00 56.01 56.70 2oal n LEU 234 Cb 0.64 -0.75 0.25 0.00 -2.33 0.00 0.00 43.42 41.23 2oal n LEU 234 CO 0.19 -0.43 1.25 -0.29 -1.33 0.00 0.00 177.39 176.78 2oal h ILE 235 N -0.76 1.08 0.00 -0.08 6.09 -1.94 0.20 117.51 122.11 2oal h ILE 235 Ca 0.00 -0.35 -0.37 0.00 -1.37 0.00 0.00 64.86 62.77 2oal h ILE 235 Cb 0.52 -0.03 -0.06 0.00 0.47 0.00 0.00 36.82 37.73 2oal h ILE 235 CO 0.00 0.19 -2.17 0.59 -3.07 0.00 0.00 178.15 173.68 2oal n ASN 236 N -4.48 1.94 0.20 2.19 4.13 -0.53 -1.82 115.26 116.89 2oal n ASN 236 Ca 0.13 0.35 -0.13 0.00 1.68 0.00 0.00 54.58 56.61 2oal n ASN 236 Cb 0.18 -0.83 -0.08 0.00 -1.54 0.00 0.00 39.78 37.52 2oal n ASN 236 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 2oal h LYS 237 N -1.00 -0.50 0.13 3.52 3.64 -1.43 -1.07 116.57 119.85 2oal h LYS 237 Ca -0.56 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 2oal h LYS 237 Cb 1.48 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 2oal h LYS 237 CO -0.34 -0.19 -0.06 0.00 -2.27 0.00 0.00 179.45 176.59 2oal h ALA 238 N -0.43 -0.17 0.00 5.00 0.00 -1.07 -3.33 119.26 119.25 2oal h ALA 238 Ca -0.05 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2oal h ALA 238 Cb 0.54 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2oal h ALA 238 CO 0.09 -0.19 0.00 -1.33 0.00 0.00 0.00 179.25 177.82 2oal n MET 239 N -4.86 0.05 -1.79 0.00 2.81 0.68 -4.90 117.12 109.10 2oal n MET 239 Ca -0.06 0.18 -0.19 0.00 -1.81 0.00 0.00 57.70 55.83 2oal n MET 239 Cb 0.21 -1.58 -0.06 0.00 -0.71 0.00 0.00 33.22 31.08 2oal n MET 239 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2oal n GLU 240 N -1.67 -1.52 -2.20 0.03 1.02 -0.40 -4.93 120.64 110.97 2oal n GLU 240 Ca 0.05 1.09 -0.42 0.00 -0.02 0.00 0.00 57.16 57.85 2oal n GLU 240 Cb 0.26 -5.53 -0.03 0.00 -0.02 0.00 0.00 31.44 26.12 2oal n GLU 240 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2oal s GLU 241 N -4.02 4.35 0.53 3.49 2.56 -0.76 -4.97 118.70 119.87 2oal s GLU 241 Ca 0.00 2.05 -0.21 0.00 0.00 0.00 0.00 54.97 56.82 2oal s GLU 241 Cb 0.00 -3.24 -0.06 0.00 2.00 0.00 0.00 34.13 32.84 2oal s GLU 241 CO 0.00 -0.37 1.18 -2.14 -0.56 0.00 0.00 175.26 173.36 2oal s PRO 242 N 0.74 3.39 -0.16 4.30 0.02 -1.26 -4.49 135.00 137.54 2oal s PRO 242 Ca 0.62 1.76 -0.05 0.00 0.02 0.00 0.00 61.00 63.34 2oal s PRO 242 Cb -0.36 -2.14 -0.03 0.00 0.02 0.00 0.00 34.50 31.98 2oal s PRO 242 CO 0.33 -0.85 0.02 0.12 -0.33 0.00 0.00 177.00 176.28 2oal s PHE 243 N -1.62 3.15 -0.53 6.54 5.36 -1.26 -0.71 117.98 128.91 2oal s PHE 243 Ca 0.71 -0.07 -0.20 0.00 -0.96 0.00 0.00 56.93 56.41 2oal s PHE 243 Cb -0.28 -2.01 0.06 0.00 -0.34 0.00 0.00 43.02 40.46 2oal s PHE 243 CO 0.32 0.10 0.71 -0.51 -1.46 0.00 0.00 175.22 174.38 2oal s LEU 244 N 0.26 4.86 0.00 6.12 1.43 0.22 -4.89 118.68 126.67 2oal s LEU 244 Ca 0.01 -0.90 -0.30 0.00 -1.03 0.00 0.00 54.13 51.90 2oal s LEU 244 Cb -0.13 -2.48 -0.05 0.00 0.03 0.00 0.00 46.19 43.56 2oal s LEU 244 CO 0.01 -1.01 1.27 -0.62 0.23 0.00 0.00 176.35 176.24 2oal s ASP 245 N 2.90 6.98 -0.38 2.29 -1.08 -1.26 -2.47 116.67 123.65 2oal s ASP 245 Ca 0.17 1.99 0.05 0.00 -0.52 0.00 0.00 52.55 54.24 2oal s ASP 245 Cb -0.19 -2.57 0.46 0.00 -1.46 0.00 0.00 42.92 39.17 2oal s ASP 245 CO 0.12 -0.60 1.40 0.23 0.52 0.00 0.00 175.17 176.84 2oal n MET 246 N 4.87 3.27 0.00 4.34 2.81 -1.16 -4.71 117.12 126.54 2oal n MET 246 Ca 0.11 -3.90 0.06 0.00 -1.81 0.00 0.00 57.70 52.16 2oal n MET 246 Cb 0.45 -2.24 0.33 0.00 -0.71 0.00 0.00 33.22 31.05 2oal n MET 246 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2oal n SER 247 N -0.79 0.00 -0.24 7.83 3.41 -1.26 -1.12 113.62 121.45 2oal n SER 247 Ca 0.47 -0.09 0.14 0.00 -0.26 0.00 0.00 58.87 59.13 2oal n SER 247 Cb 0.90 -0.17 0.62 0.00 -0.26 0.00 0.00 64.21 65.29 2oal n SER 247 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2oal n ASP 248 N -1.17 0.82 0.00 4.04 5.75 -1.26 -3.79 116.55 120.94 2oal n ASP 248 Ca 0.07 -1.03 0.00 0.00 -0.01 0.00 0.00 54.79 53.82 2oal n ASP 248 Cb 0.07 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 2oal n ASP 248 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2oal n HIS 249 N -0.52 0.00 -3.84 2.11 8.25 -0.28 -4.28 115.22 116.67 2oal n HIS 249 Ca 0.18 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.36 2oal n HIS 249 Cb 0.28 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.23 2oal n HIS 249 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2oal s LEU 250 N -3.46 1.38 0.25 2.41 1.43 -0.82 -4.68 118.68 115.18 2oal s LEU 250 Ca 0.00 -0.62 0.13 0.00 -1.03 0.00 0.00 54.13 52.61 2oal s LEU 250 Cb 0.00 -0.77 0.01 0.00 0.03 0.00 0.00 46.19 45.46 2oal s LEU 250 CO 0.00 -0.22 1.41 -0.07 0.23 0.00 0.00 176.35 177.70 2oal h LEU 251 N 8.18 0.00 -9.39 1.79 3.38 -1.89 -3.37 115.31 114.01 2oal h LEU 251 Ca -0.21 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.21 2oal h LEU 251 Cb 1.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2oal h LEU 251 CO 0.36 0.60 0.70 0.20 0.09 0.00 0.00 178.44 180.40 2oal s ASN 252 N -6.51 6.99 0.00 -0.43 0.02 -1.26 -4.43 114.94 109.31 2oal s ASN 252 Ca 0.03 1.98 0.00 0.00 -1.02 0.00 0.00 52.86 53.85 2oal s ASN 252 Cb 0.08 -2.57 0.00 0.00 0.02 0.00 0.00 41.25 38.78 2oal s ASN 252 CO 0.76 -0.60 0.34 -0.90 0.02 0.00 0.00 177.10 176.72 2oal n ASP 253 N 4.85 0.13 -3.91 -1.22 5.68 -0.87 -4.86 116.55 116.35 2oal n ASP 253 Ca 0.11 -1.05 -0.13 0.00 -0.50 0.00 0.00 54.79 53.23 2oal n ASP 253 Cb 0.45 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.36 2oal n ASP 253 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2oal s SER 254 N -0.05 0.38 -0.05 -1.12 0.01 -0.67 0.13 113.70 112.33 2oal s SER 254 Ca 0.00 -1.33 -0.30 0.00 1.31 0.00 0.00 55.95 55.63 2oal s SER 254 Cb 0.00 0.49 0.08 0.00 0.21 0.00 0.00 66.02 66.81 2oal s SER 254 CO 0.00 -1.01 0.75 0.00 0.41 0.00 0.00 173.24 173.39 2oal s ALA 255 N -3.88 -1.79 -0.10 1.44 0.00 0.46 -1.30 121.76 116.58 2oal s ALA 255 Ca 0.34 1.29 0.01 0.00 0.00 0.00 0.00 51.96 53.60 2oal s ALA 255 Cb 0.03 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.12 2oal s ALA 255 CO 0.14 -0.41 -0.11 0.54 0.00 0.00 0.00 175.76 175.93 2oal s VAL 256 N -1.48 1.21 0.12 0.00 0.11 -0.84 -0.08 120.40 119.44 2oal s VAL 256 Ca -0.07 -0.45 -0.04 0.00 -2.93 0.00 0.00 61.98 58.49 2oal s VAL 256 Cb -0.00 -1.15 -0.03 0.00 -1.53 0.00 0.00 36.38 33.67 2oal s VAL 256 CO 0.05 0.39 0.11 0.00 -3.33 0.00 0.00 175.10 172.32 2oal s ALA 257 N 1.22 0.51 0.21 1.54 0.00 -0.39 -0.64 121.76 124.21 2oal s ALA 257 Ca -0.03 -1.22 -0.07 0.00 0.00 0.00 0.00 51.96 50.64 2oal s ALA 257 Cb -0.14 0.73 0.03 0.00 0.00 0.00 0.00 23.12 23.74 2oal s ALA 257 CO -0.03 -0.51 0.40 -2.37 0.00 0.00 0.00 175.76 173.25 2oal n THR 258 N -0.09 0.00 -4.81 0.00 5.66 -0.62 -0.47 114.28 113.96 2oal n THR 258 Ca -0.08 -0.60 -0.26 0.00 -3.05 0.00 0.00 64.05 60.06 2oal n THR 258 Cb 0.63 0.54 -0.16 0.00 -1.55 0.00 0.00 70.33 69.79 2oal n THR 258 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 2oal s GLN 259 N -2.11 1.85 -0.14 1.09 0.74 -1.26 -2.07 119.66 117.76 2oal s GLN 259 Ca 0.10 -0.58 0.01 0.00 0.05 0.00 0.00 55.36 54.94 2oal s GLN 259 Cb -0.02 -1.57 -0.00 0.00 1.10 0.00 0.00 33.01 32.52 2oal s GLN 259 CO 0.07 0.19 -0.18 0.08 -0.55 0.00 0.00 175.29 174.91 2oal s VAL 260 N 0.20 2.53 0.58 1.34 1.01 0.31 -4.97 120.40 121.39 2oal s VAL 260 Ca -0.07 -0.83 -0.20 0.00 0.00 0.00 0.00 61.98 60.87 2oal s VAL 260 Cb -0.13 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 2oal s VAL 260 CO 0.03 0.53 1.33 -2.84 0.00 0.00 0.00 175.10 174.15 2oal s PRO 261 N 0.62 2.96 -0.04 2.72 0.02 -1.26 -1.01 135.00 139.01 2oal s PRO 261 Ca -0.10 2.15 -0.03 0.00 0.02 0.00 0.00 61.00 63.04 2oal s PRO 261 Cb -0.16 -2.11 0.01 0.00 0.02 0.00 0.00 34.50 32.26 2oal s PRO 261 CO 0.03 -1.31 0.09 -1.58 -0.33 0.00 0.00 177.00 173.90 2oal s HIS 262 N -1.35 -0.10 -0.87 6.54 2.46 0.04 -4.79 115.29 117.22 2oal s HIS 262 Ca 0.75 0.26 -0.17 0.00 0.47 0.00 0.00 55.06 56.37 2oal s HIS 262 Cb -0.39 0.01 0.15 0.00 -0.13 0.00 0.00 32.58 32.23 2oal s HIS 262 CO 0.44 -0.06 0.98 0.34 -2.47 0.00 0.00 174.74 173.97 2oal s ASP 263 N 0.18 6.62 0.51 9.88 -1.08 -1.26 -4.13 116.67 127.39 2oal s ASP 263 Ca -0.01 -2.17 0.27 0.00 -0.52 0.00 0.00 52.55 50.12 2oal s ASP 263 Cb -0.02 -2.34 1.37 0.00 -1.46 0.00 0.00 42.92 40.47 2oal s ASP 263 CO -0.01 -0.93 2.04 0.44 0.52 0.00 0.00 175.17 177.23 2oal h ASP 264 N 8.56 0.00 -0.39 -0.34 3.32 -1.91 -1.63 116.42 124.03 2oal h ASP 264 Ca 0.10 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.02 2oal h ASP 264 Cb 1.03 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 2oal h ASP 264 CO 1.00 0.14 -0.22 0.44 -1.72 0.00 0.00 179.24 178.88 2oal h ASP 265 N 0.00 0.92 0.26 6.45 3.32 -1.90 0.25 116.42 125.72 2oal h ASP 265 Ca -0.00 -0.34 -0.34 0.00 0.02 0.00 0.00 57.03 56.37 2oal h ASP 265 Cb 0.39 -0.25 0.02 0.00 0.22 0.00 0.00 39.33 39.71 2oal h ASP 265 CO 0.02 1.10 -1.63 0.00 -1.72 0.00 0.00 179.24 177.01 2oal h ALA 266 N 0.97 0.06 0.00 3.45 0.00 -1.89 -3.40 119.26 118.46 2oal h ALA 266 Ca 0.10 -1.04 0.00 0.00 0.00 0.00 0.00 54.91 53.97 2oal h ALA 266 Cb 0.77 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2oal h ALA 266 CO 0.06 0.93 -0.75 0.09 0.00 0.00 0.00 179.25 179.59 2oal n ASN 267 N -3.61 0.82 -0.10 0.00 4.13 -0.65 -5.12 115.26 110.73 2oal n ASN 267 Ca -0.21 -0.67 0.01 0.00 1.68 0.00 0.00 54.58 55.39 2oal n ASN 267 Cb 1.08 1.09 -0.00 0.00 -1.54 0.00 0.00 39.78 40.41 2oal n ASN 267 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2oal n GLY 268 N 1.37 -2.18 3.08 7.41 0.00 0.08 -4.92 105.19 110.03 2oal n GLY 268 Ca 0.02 -1.48 -0.25 0.00 0.00 0.00 0.00 46.02 44.30 2oal n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oal s VAL 269 N -0.77 1.29 -0.02 1.61 1.01 -1.26 -4.64 120.40 117.61 2oal s VAL 269 Ca 0.00 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 2oal s VAL 269 Cb 0.00 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 2oal s VAL 269 CO 0.00 0.38 1.03 -1.61 0.00 0.00 0.00 175.10 174.90 2oal s GLU 270 N 0.38 4.50 -0.17 2.72 2.02 -1.26 -4.50 118.70 122.39 2oal s GLU 270 Ca -0.10 1.48 -0.01 0.00 0.02 0.00 0.00 54.97 56.35 2oal s GLU 270 Cb -0.14 -3.47 0.08 0.00 0.10 0.00 0.00 34.13 30.70 2oal s GLU 270 CO 0.03 -0.17 2.15 -0.35 0.02 0.00 0.00 175.26 176.94 2oal n PRO 271 N 4.26 1.50 -3.45 0.39 -0.04 -1.26 -4.78 135.00 131.61 2oal n PRO 271 Ca 0.07 -0.89 -0.12 0.00 -0.04 0.00 0.00 63.50 62.53 2oal n PRO 271 Cb 0.50 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.53 2oal n PRO 271 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2oal s PHE 272 N -0.85 -0.51 0.06 0.54 -0.12 -1.26 -0.34 117.98 115.50 2oal s PHE 272 Ca 0.21 0.40 -0.20 0.00 -0.05 0.00 0.00 56.93 57.29 2oal s PHE 272 Cb 0.15 0.54 -0.06 0.00 -0.63 0.00 0.00 43.02 43.01 2oal s PHE 272 CO -0.01 -0.76 0.58 0.99 -0.05 0.00 0.00 175.22 175.97 2oal s THR 273 N -3.30 4.76 -0.09 -4.49 2.01 -0.46 -4.59 115.64 109.48 2oal s THR 273 Ca 0.00 1.24 -0.02 0.00 0.31 0.00 0.00 61.69 63.22 2oal s THR 273 Cb -0.01 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 2oal s THR 273 CO -0.09 0.53 0.02 -0.44 -0.69 0.00 0.00 174.62 173.95 2oal s SER 274 N -0.96 5.38 -0.35 3.53 0.01 -0.81 0.22 113.70 120.72 2oal s SER 274 Ca 0.29 0.18 0.03 0.00 1.31 0.00 0.00 55.95 57.76 2oal s SER 274 Cb -0.19 -1.54 0.10 0.00 0.21 0.00 0.00 66.02 64.59 2oal s SER 274 CO 0.19 0.38 0.08 0.00 0.41 0.00 0.00 173.24 174.30 2oal s ALA 275 N -0.91 2.59 -0.36 1.44 0.00 0.09 -1.59 121.76 123.02 2oal s ALA 275 Ca 0.14 -2.39 -0.17 0.00 0.00 0.00 0.00 51.96 49.54 2oal s ALA 275 Cb -0.11 -1.90 -0.00 0.00 0.00 0.00 0.00 23.12 21.10 2oal s ALA 275 CO 0.03 -1.72 0.48 0.42 0.00 0.00 0.00 175.76 174.97 2oal s ILE 276 N 0.97 5.05 0.35 0.00 1.01 0.14 -1.49 121.20 127.23 2oal s ILE 276 Ca 0.11 0.21 -0.28 0.00 0.00 0.00 0.00 60.65 60.69 2oal s ILE 276 Cb -0.19 -3.95 -0.11 0.00 0.01 0.00 0.00 42.46 38.22 2oal s ILE 276 CO -0.11 -0.22 1.40 0.00 0.00 0.00 0.00 174.94 176.01 2oal s ALA 277 N 2.30 3.54 0.20 9.38 0.00 -0.14 0.65 121.76 137.70 2oal s ALA 277 Ca 0.17 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.55 2oal s ALA 277 Cb -0.16 -3.55 -0.00 0.00 0.00 0.00 0.00 23.12 19.41 2oal s ALA 277 CO 0.13 -0.85 0.01 -1.33 0.00 0.00 0.00 175.76 173.72 2oal n MET 278 N 0.72 1.42 0.08 0.00 0.00 0.42 -4.57 117.12 115.18 2oal n MET 278 Ca 0.01 -1.49 -0.08 0.00 0.00 0.00 0.00 57.70 56.14 2oal n MET 278 Cb 0.40 0.44 0.03 0.00 0.00 0.00 0.00 33.22 34.10 2oal n MET 278 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 2oal h LYS 279 N 0.00 0.22 -0.39 0.03 1.57 -1.88 -3.35 116.57 112.76 2oal h LYS 279 Ca -0.17 -0.21 -0.28 0.00 -1.87 0.00 0.00 60.65 58.12 2oal h LYS 279 Cb 0.51 0.05 -0.37 0.00 0.08 0.00 0.00 32.23 32.51 2oal h LYS 279 CO 0.27 0.90 -0.97 0.43 -0.57 0.00 0.00 179.45 179.51 2oal n SER 280 N -3.73 2.31 0.00 0.86 7.64 -1.26 -4.48 113.62 114.96 2oal n SER 280 Ca -0.03 -2.62 0.00 0.00 1.01 0.00 0.00 58.87 57.23 2oal n SER 280 Cb 0.75 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 2oal n SER 280 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oal n GLY 281 N -0.48 -0.34 3.37 0.23 0.00 -1.26 -2.34 105.19 104.37 2oal n GLY 281 Ca 0.17 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.42 2oal n GLY 281 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2oal s TRP 282 N -4.00 -0.23 -0.05 1.61 1.48 -0.26 -0.44 118.94 117.04 2oal s TRP 282 Ca 0.00 -0.07 0.05 0.00 -1.06 0.00 0.00 56.10 55.02 2oal s TRP 282 Cb 0.00 0.32 -0.01 0.00 -1.16 0.00 0.00 33.47 32.63 2oal s TRP 282 CO 0.00 -0.76 -0.22 0.99 -4.06 0.00 0.00 176.95 172.90 2oal s THR 283 N -3.81 1.82 0.20 0.66 2.01 0.21 -0.06 115.64 116.66 2oal s THR 283 Ca 0.04 -0.93 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 2oal s THR 283 Cb 0.01 -1.55 -0.05 0.00 0.01 0.00 0.00 72.50 70.92 2oal s THR 283 CO -0.10 0.51 0.41 -1.66 -0.69 0.00 0.00 174.62 173.08 2oal s TRP 284 N -0.06 3.48 -0.12 4.92 -2.14 0.09 0.27 118.94 125.38 2oal s TRP 284 Ca -0.04 0.43 -0.02 0.00 2.66 0.00 0.00 56.10 59.12 2oal s TRP 284 Cb -0.13 -1.92 0.04 0.00 -3.10 0.00 0.00 33.47 28.36 2oal s TRP 284 CO 0.03 0.37 0.03 0.21 -2.66 0.00 0.00 176.95 174.93 2oal s LYS 285 N -3.18 0.52 -0.34 3.25 2.20 -0.62 -2.25 119.74 119.31 2oal s LYS 285 Ca 0.40 -0.07 0.02 0.00 -0.36 0.00 0.00 55.97 55.96 2oal s LYS 285 Cb -0.11 -1.41 0.09 0.00 -1.51 0.00 0.00 37.83 34.89 2oal s LYS 285 CO 0.28 -0.46 0.07 0.42 -0.36 0.00 0.00 175.35 175.30 2oal s ILE 286 N 1.97 2.56 0.09 5.43 1.01 0.17 -1.93 121.20 130.50 2oal s ILE 286 Ca 0.03 -2.13 -0.31 0.00 0.00 0.00 0.00 60.65 58.24 2oal s ILE 286 Cb -0.14 -2.78 -0.08 0.00 0.01 0.00 0.00 42.46 39.47 2oal s ILE 286 CO -0.06 -0.52 1.41 -2.84 0.00 0.00 0.00 174.94 172.92 2oal s PRO 287 N 1.00 4.30 0.00 2.79 0.02 -1.26 -0.83 135.00 141.03 2oal s PRO 287 Ca 0.07 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.16 2oal s PRO 287 Cb -0.20 -3.33 0.00 0.00 0.02 0.00 0.00 34.50 30.99 2oal s PRO 287 CO -0.06 -0.48 0.00 -1.33 -0.33 0.00 0.00 177.00 174.79 2oal n MET 288 N 4.32 3.12 -3.08 5.54 2.81 0.13 -4.66 117.12 125.30 2oal n MET 288 Ca 0.12 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.59 2oal n MET 288 Cb 0.42 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.87 2oal n MET 288 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2oal s LEU 289 N 0.00 4.34 -0.16 4.03 1.43 -1.26 -4.02 118.68 123.03 2oal s LEU 289 Ca 0.00 -0.06 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 2oal s LEU 289 Cb 0.00 -2.80 0.00 0.00 0.03 0.00 0.00 46.19 43.42 2oal s LEU 289 CO 0.00 -0.71 0.00 0.61 0.23 0.00 0.00 176.35 176.48 2oal n GLY 290 N 4.84 0.49 3.66 -3.19 0.00 -1.26 -4.96 105.19 104.77 2oal n GLY 290 Ca -0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 46.02 45.78 2oal n GLY 290 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2oal s ARG 291 N -1.07 0.66 -0.01 1.61 3.03 -1.26 -0.78 118.95 121.14 2oal s ARG 291 Ca 0.00 -0.36 -0.02 0.00 2.03 0.00 0.00 55.73 57.38 2oal s ARG 291 Cb 0.00 0.23 -0.00 0.00 -1.03 0.00 0.00 34.95 34.15 2oal s ARG 291 CO 0.00 -0.30 0.05 -0.59 -1.13 0.00 0.00 175.30 173.33 2oal s PHE 292 N -2.72 0.02 0.09 5.89 -0.12 -0.18 -0.69 117.98 120.27 2oal s PHE 292 Ca 0.13 -0.03 -0.08 0.00 -0.05 0.00 0.00 56.93 56.89 2oal s PHE 292 Cb 0.02 -0.03 -0.06 0.00 -0.63 0.00 0.00 43.02 42.32 2oal s PHE 292 CO -0.02 -0.10 0.38 0.20 -0.05 0.00 0.00 175.22 175.63 2oal s GLY 293 N -0.50 2.31 -0.11 1.99 0.00 -0.01 -0.53 107.32 110.46 2oal s GLY 293 Ca -0.06 -0.44 -0.17 0.00 0.00 0.00 0.00 44.72 44.05 2oal s GLY 293 CO 0.00 -0.26 0.44 -1.08 0.00 0.00 0.00 173.10 172.20 2oal s THR 294 N -1.45 0.02 -0.17 0.90 -1.32 -0.88 0.45 115.64 113.18 2oal s THR 294 Ca 0.34 -0.14 -0.18 0.00 -1.21 0.00 0.00 61.69 60.51 2oal s THR 294 Cb -0.13 -0.67 0.05 0.00 -1.51 0.00 0.00 72.50 70.23 2oal s THR 294 CO 0.19 -0.08 0.49 -0.83 -2.21 0.00 0.00 174.62 172.19 2oal s GLY 295 N -0.40 -0.37 -0.43 6.08 0.00 -0.95 -1.59 107.32 109.66 2oal s GLY 295 Ca -0.05 1.33 -0.18 0.00 0.00 0.00 0.00 44.72 45.82 2oal s GLY 295 CO 0.03 1.13 0.50 -0.47 0.00 0.00 0.00 173.10 174.29 2oal s TYR 296 N 0.11 3.14 -0.28 1.90 5.04 0.19 -0.73 117.35 126.72 2oal s TYR 296 Ca -0.01 -0.28 -0.21 0.00 -2.44 0.00 0.00 57.07 54.13 2oal s TYR 296 Cb -0.03 -3.03 -0.01 0.00 0.35 0.00 0.00 41.96 39.24 2oal s TYR 296 CO 0.01 -0.75 0.65 0.08 -1.34 0.00 0.00 175.55 174.20 2oal s VAL 297 N 2.33 4.95 0.29 3.14 1.01 0.91 -1.98 120.40 131.05 2oal s VAL 297 Ca 0.15 1.05 0.03 0.00 0.00 0.00 0.00 61.98 63.21 2oal s VAL 297 Cb -0.16 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2oal s VAL 297 CO 0.15 -0.05 0.15 -0.72 0.00 0.00 0.00 175.10 174.63 2oal s TYR 298 N 2.58 1.57 -0.27 5.22 1.13 -0.42 -1.11 117.35 126.05 2oal s TYR 298 Ca 0.26 -1.34 -0.08 0.00 -1.41 0.00 0.00 57.07 54.50 2oal s TYR 298 Cb -0.15 -0.85 -0.02 0.00 -1.10 0.00 0.00 41.96 39.84 2oal s TYR 298 CO 0.10 -0.50 0.10 0.45 -2.51 0.00 0.00 175.55 173.19 2oal s SER 299 N -3.35 5.30 0.40 -0.18 0.15 -0.99 -1.68 113.70 113.35 2oal s SER 299 Ca 0.36 -0.31 0.26 0.00 0.70 0.00 0.00 55.95 56.96 2oal s SER 299 Cb 0.06 -1.95 1.41 0.00 -1.71 0.00 0.00 66.02 63.82 2oal s SER 299 CO 0.17 -0.09 1.78 0.77 1.20 0.00 0.00 173.24 177.07 2oal h SER 300 N 8.28 0.00 1.26 5.45 4.64 -1.79 0.65 113.55 132.04 2oal h SER 300 Ca -0.36 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.90 2oal h SER 300 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 2oal h SER 300 CO 0.59 0.00 -0.27 -0.09 -0.87 0.00 0.00 176.83 176.19 2oal h ARG 301 N 0.00 0.00 -0.00 4.77 2.43 -1.93 -3.33 114.38 116.32 2oal h ARG 301 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2oal h ARG 301 Cb 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 2oal h ARG 301 CO 0.00 0.27 -0.11 1.19 -1.51 0.00 0.00 179.97 179.81 2oal n PHE 302 N -3.28 0.00 -3.75 2.20 3.72 0.15 -5.02 117.46 111.47 2oal n PHE 302 Ca 0.01 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.29 2oal n PHE 302 Cb 0.54 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.96 2oal n PHE 302 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oal s ALA 303 N -1.10 -0.77 0.65 4.37 0.00 -0.74 -4.97 121.76 119.20 2oal s ALA 303 Ca 0.02 0.96 -0.11 0.00 0.00 0.00 0.00 51.96 52.83 2oal s ALA 303 Cb 0.02 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 2oal s ALA 303 CO 0.10 -0.17 1.04 0.95 0.00 0.00 0.00 175.76 177.68 2oal s THR 304 N 0.45 4.17 0.29 0.00 -4.23 -1.26 -4.24 115.64 110.82 2oal s THR 304 Ca -0.02 0.64 0.01 0.00 -1.18 0.00 0.00 61.69 61.13 2oal s THR 304 Cb -0.04 -3.69 0.28 0.00 1.34 0.00 0.00 72.50 70.39 2oal s THR 304 CO -0.02 -0.89 1.89 -0.08 -0.54 0.00 0.00 174.62 174.98 2oal h GLU 305 N -0.42 1.01 -0.38 3.99 4.81 -1.98 -0.44 114.58 121.17 2oal h GLU 305 Ca -0.45 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 58.69 2oal h GLU 305 Cb 1.22 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 30.36 2oal h GLU 305 CO 0.63 0.67 0.10 -0.44 -0.73 0.00 0.00 179.01 179.23 2oal h ASP 306 N 1.04 0.57 -0.68 1.04 3.32 -1.99 -0.66 116.42 119.07 2oal h ASP 306 Ca 0.43 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 2oal h ASP 306 Cb 0.28 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.65 2oal h ASP 306 CO -0.18 0.65 0.24 -0.33 -1.72 0.00 0.00 179.24 177.89 2oal h GLU 307 N 0.47 1.06 -0.56 3.56 5.08 -1.75 -0.99 114.58 121.45 2oal h GLU 307 Ca 0.12 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.21 2oal h GLU 307 Cb 0.29 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 2oal h GLU 307 CO 0.00 0.89 0.09 0.00 -1.00 0.00 0.00 179.01 178.99 2oal h ALA 308 N 1.23 0.74 -0.73 3.43 0.00 -0.88 -1.13 119.26 121.92 2oal h ALA 308 Ca 0.23 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2oal h ALA 308 Cb 0.26 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2oal h ALA 308 CO -0.01 0.49 0.34 0.28 0.00 0.00 0.00 179.25 180.35 2oal h VAL 309 N 0.82 1.24 -0.10 0.00 2.07 -0.75 -1.40 116.25 118.13 2oal h VAL 309 Ca 0.17 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 2oal h VAL 309 Cb 0.42 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2oal h VAL 309 CO 0.01 0.29 -0.05 -0.09 0.02 0.00 0.00 177.57 177.75 2oal h ARG 310 N 1.03 0.21 -0.82 1.57 2.43 -0.90 -0.95 114.38 116.95 2oal h ARG 310 Ca 0.25 -0.09 0.04 0.00 -0.81 0.00 0.00 59.98 59.37 2oal h ARG 310 Cb 0.14 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.63 2oal h ARG 310 CO -0.03 0.57 0.52 0.93 -1.51 0.00 0.00 179.97 180.45 2oal h GLU 311 N -0.16 0.96 -0.05 0.20 5.08 -1.15 -0.21 114.58 119.26 2oal h GLU 311 Ca 0.02 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2oal h GLU 311 Cb 0.51 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2oal h GLU 311 CO 0.02 0.64 -0.02 0.35 -1.00 0.00 0.00 179.01 178.99 2oal h PHE 312 N 0.99 0.11 -0.48 4.33 3.57 -1.21 -2.49 116.94 121.76 2oal h PHE 312 Ca 0.34 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.74 2oal h PHE 312 Cb 0.07 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 2oal h PHE 312 CO -0.03 0.48 0.04 0.00 -2.23 0.00 0.00 178.31 176.56 2oal h GLU 314 N 0.69 1.22 -0.53 0.00 5.08 -1.08 0.32 114.58 120.28 2oal h GLU 314 Ca 0.14 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2oal h GLU 314 Cb 0.46 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2oal h GLU 314 CO 0.02 0.90 0.35 1.98 -1.00 0.00 0.00 179.01 181.25 2oal h MET 315 N 1.23 0.70 -0.32 2.33 1.85 -1.34 -1.93 114.93 117.46 2oal h MET 315 Ca 0.31 -0.04 0.00 0.00 -0.61 0.00 0.00 59.70 59.35 2oal h MET 315 Cb 0.03 -0.16 0.00 0.00 0.43 0.00 0.00 31.60 31.90 2oal h MET 315 CO -0.05 0.47 0.00 0.91 -0.40 0.00 0.00 176.91 177.84 2oal n TRP 316 N -4.45 0.40 -3.44 1.39 7.02 -0.83 -4.52 117.44 113.01 2oal n TRP 316 Ca 0.05 -0.21 -0.18 0.00 -1.02 0.00 0.00 57.50 56.13 2oal n TRP 316 Cb 0.05 -0.00 0.09 0.00 -2.42 0.00 0.00 31.31 29.03 2oal n TRP 316 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 2oal n HIS 317 N 1.39 -2.31 -4.27 -5.99 8.25 0.76 -5.02 115.22 108.03 2oal n HIS 317 Ca 0.18 0.94 -0.25 0.00 -0.26 0.00 0.00 57.72 58.33 2oal n HIS 317 Cb 0.58 -5.02 -0.08 0.00 1.12 0.00 0.00 29.99 26.60 2oal n HIS 317 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2oal s LEU 318 N -6.49 3.18 -0.45 2.41 1.43 0.77 -5.00 118.68 114.54 2oal s LEU 318 Ca 0.13 -0.57 -0.25 0.00 -1.03 0.00 0.00 54.13 52.42 2oal s LEU 318 Cb -0.06 -1.77 0.03 0.00 0.03 0.00 0.00 46.19 44.42 2oal s LEU 318 CO 0.72 0.04 0.92 -0.62 0.23 0.00 0.00 176.35 177.64 2oal s ASP 319 N -3.31 6.52 0.34 2.29 -1.08 -1.26 -4.37 116.67 115.79 2oal s ASP 319 Ca 0.29 0.17 0.07 0.00 -0.52 0.00 0.00 52.55 52.56 2oal s ASP 319 Cb -0.08 -2.45 0.74 0.00 -1.46 0.00 0.00 42.92 39.68 2oal s ASP 319 CO 0.19 -1.02 1.87 -0.65 0.52 0.00 0.00 175.17 176.08 2oal h PRO 320 N 8.99 0.75 0.00 4.34 0.11 -1.93 0.24 132.00 144.51 2oal h PRO 320 Ca -0.24 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.78 2oal h PRO 320 Cb 1.08 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2oal h PRO 320 CO 1.02 0.50 -0.21 0.93 -0.21 0.00 0.00 178.00 180.02 2oal h GLU 321 N 0.78 0.00 0.00 1.05 4.39 -1.99 -3.36 114.58 115.44 2oal h GLU 321 Ca 0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.15 2oal h GLU 321 Cb 0.63 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 2oal h GLU 321 CO -0.22 0.21 0.00 0.25 -1.16 0.00 0.00 179.01 178.10 2oal n THR 322 N -3.48 0.00 -2.09 1.13 -2.24 -0.87 -5.05 114.28 101.68 2oal n THR 322 Ca -0.00 -0.24 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 2oal n THR 322 Cb 0.39 1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 69.70 2oal n THR 322 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2oal s GLN 323 N -0.38 4.27 -0.06 -0.78 2.00 0.81 -4.94 119.66 120.58 2oal s GLN 323 Ca 0.00 2.15 -0.30 0.00 -2.00 0.00 0.00 55.36 55.21 2oal s GLN 323 Cb 0.00 -3.35 -0.05 0.00 0.80 0.00 0.00 33.01 30.41 2oal s GLN 323 CO 0.00 -0.55 1.49 -1.25 -0.50 0.00 0.00 175.29 174.49 2oal s PRO 324 N 1.62 4.22 0.12 1.67 0.04 -1.26 -4.97 135.00 136.44 2oal s PRO 324 Ca 0.67 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.79 2oal s PRO 324 Cb -0.38 -3.80 -0.04 0.00 0.04 0.00 0.00 34.50 30.33 2oal s PRO 324 CO 0.30 -0.73 -0.17 -0.51 0.04 0.00 0.00 177.00 175.93 2oal s LEU 325 N 3.38 2.36 -0.30 -3.56 1.43 -1.26 -4.71 118.68 116.02 2oal s LEU 325 Ca 0.66 -0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 52.94 2oal s LEU 325 Cb -0.30 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.25 2oal s LEU 325 CO 0.25 -0.06 0.08 0.20 0.23 0.00 0.00 176.35 177.05 2oal s ASN 326 N -2.25 5.15 -0.26 2.29 0.02 0.39 -4.95 114.94 115.33 2oal s ASN 326 Ca 0.08 -0.80 -0.12 0.00 -1.02 0.00 0.00 52.86 50.99 2oal s ASN 326 Cb -0.07 -1.88 -0.05 0.00 0.02 0.00 0.00 41.25 39.28 2oal s ASN 326 CO 0.04 -0.22 0.26 -0.13 0.02 0.00 0.00 177.10 177.07 2oal s ARG 327 N 1.48 4.01 -0.02 -0.60 0.52 -1.26 -1.26 118.95 121.82 2oal s ARG 327 Ca 0.02 -0.16 0.04 0.00 -0.52 0.00 0.00 55.73 55.11 2oal s ARG 327 Cb -0.18 -3.62 -0.01 0.00 0.52 0.00 0.00 34.95 31.66 2oal s ARG 327 CO 0.02 -0.15 -0.14 0.42 0.02 0.00 0.00 175.30 175.48 2oal s ILE 328 N 1.68 1.10 -0.24 1.52 1.01 0.88 -5.01 121.20 122.14 2oal s ILE 328 Ca 0.11 -0.57 -0.02 0.00 0.00 0.00 0.00 60.65 60.16 2oal s ILE 328 Cb -0.15 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.40 2oal s ILE 328 CO 0.09 0.32 -0.06 -0.60 0.00 0.00 0.00 174.94 174.69 2oal s ARG 329 N -0.15 2.98 0.53 2.79 6.06 -1.26 -0.40 118.95 129.49 2oal s ARG 329 Ca 0.02 -0.88 -0.08 0.00 -2.50 0.00 0.00 55.73 52.29 2oal s ARG 329 Cb -0.07 -2.97 -0.04 0.00 0.06 0.00 0.00 34.95 31.92 2oal s ARG 329 CO 0.00 -0.34 0.89 -0.06 -2.50 0.00 0.00 175.30 173.29 2oal s PHE 330 N 1.36 3.58 -0.36 5.12 0.08 0.36 -4.97 117.98 123.15 2oal s PHE 330 Ca 0.02 1.04 -0.04 0.00 0.12 0.00 0.00 56.93 58.06 2oal s PHE 330 Cb -0.16 -2.49 0.07 0.00 -0.57 0.00 0.00 43.02 39.87 2oal s PHE 330 CO -0.05 -0.43 0.13 0.50 -0.10 0.00 0.00 175.22 175.27 2oal s ARG 331 N -4.82 2.36 -0.22 0.44 3.52 -1.26 -4.83 118.95 114.13 2oal s ARG 331 Ca 0.51 -1.45 -0.10 0.00 -0.13 0.00 0.00 55.73 54.55 2oal s ARG 331 Cb -0.11 -3.46 -0.05 0.00 -1.56 0.00 0.00 34.95 29.77 2oal s ARG 331 CO 0.47 -0.83 0.15 0.08 -0.81 0.00 0.00 175.30 174.36 2oal s VAL 332 N 1.28 5.38 -3.53 7.11 1.01 -1.26 -4.42 120.40 125.96 2oal s VAL 332 Ca 0.01 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2oal s VAL 332 Cb -0.21 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2oal s VAL 332 CO -0.01 0.38 0.00 0.61 0.00 0.00 0.00 175.10 176.09 2oal n GLY 333 N 3.96 0.63 3.37 4.51 0.00 -0.11 -3.00 105.19 114.54 2oal n GLY 333 Ca -0.15 -1.59 -0.11 0.00 0.00 0.00 0.00 46.02 44.17 2oal n GLY 333 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2oal s ARG 334 N -1.77 1.18 0.61 1.61 1.70 -1.03 -0.97 118.95 120.28 2oal s ARG 334 Ca 0.00 -0.61 -0.17 0.00 -0.47 0.00 0.00 55.73 54.48 2oal s ARG 334 Cb 0.00 0.53 -0.02 0.00 -0.57 0.00 0.00 34.95 34.88 2oal s ARG 334 CO 0.00 -0.49 1.14 -0.80 -1.08 0.00 0.00 175.30 174.07 2oal s ASN 335 N -2.78 5.27 0.25 -2.89 0.01 -0.81 0.69 114.94 114.66 2oal s ASN 335 Ca 0.02 2.16 -0.04 0.00 -0.71 0.00 0.00 52.86 54.30 2oal s ASN 335 Cb 0.00 -2.57 0.39 0.00 0.41 0.00 0.00 41.25 39.48 2oal s ASN 335 CO -0.12 -1.53 1.82 -0.09 -1.51 0.00 0.00 177.10 175.68 2oal h ARG 336 N 0.59 0.83 -3.77 -0.60 2.43 -1.26 -3.40 114.38 109.20 2oal h ARG 336 Ca -0.49 -0.05 -0.38 0.00 -0.81 0.00 0.00 59.98 58.26 2oal h ARG 336 Cb 1.27 -0.19 -0.35 0.00 -0.42 0.00 0.00 29.97 30.28 2oal h ARG 336 CO 0.55 0.55 -0.76 1.03 -1.51 0.00 0.00 179.97 179.83 2oal s ARG 337 N -6.03 0.47 0.22 0.20 0.52 -1.26 -5.05 118.95 108.02 2oal s ARG 337 Ca -0.12 0.05 -0.03 0.00 -0.52 0.00 0.00 55.73 55.11 2oal s ARG 337 Cb 0.19 -0.66 0.22 0.00 0.52 0.00 0.00 34.95 35.22 2oal s ARG 337 CO 0.79 -0.16 1.61 0.00 0.02 0.00 0.00 175.30 177.56 2oal h ALA 338 N 7.47 0.88 -3.20 2.13 0.00 -1.88 -3.42 119.26 121.24 2oal h ALA 338 Ca -0.36 -0.40 -0.59 0.00 0.00 0.00 0.00 54.91 53.56 2oal h ALA 338 Cb 1.14 -0.13 -0.35 0.00 0.00 0.00 0.00 17.79 18.45 2oal h ALA 338 CO 0.42 0.63 -0.83 -0.46 0.00 0.00 0.00 179.25 179.01 2oal s TRP 339 N -4.41 2.03 -0.05 0.00 -0.00 -1.26 -1.31 118.94 113.93 2oal s TRP 339 Ca -0.08 -1.04 0.02 0.00 -0.00 0.00 0.00 56.10 55.00 2oal s TRP 339 Cb 0.13 -1.48 0.02 0.00 -0.00 0.00 0.00 33.47 32.13 2oal s TRP 339 CO 0.83 -0.56 -0.08 0.08 -0.00 0.00 0.00 176.95 177.22 2oal s VAL 340 N 1.23 0.83 0.00 5.86 1.01 -0.25 -4.93 120.40 124.15 2oal s VAL 340 Ca -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.66 2oal s VAL 340 Cb -0.14 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.45 2oal s VAL 340 CO -0.06 0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.94 2oal n GLY 341 N 3.86 3.95 1.38 4.51 0.00 -1.26 -0.91 105.19 116.72 2oal n GLY 341 Ca -0.24 0.02 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 2oal n GLY 341 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2oal n ASN 342 N 7.21 3.19 -4.10 1.61 6.94 -1.26 -4.92 115.26 123.93 2oal n ASN 342 Ca 0.00 -3.55 -0.33 0.00 -0.02 0.00 0.00 54.58 50.68 2oal n ASN 342 Cb 0.00 -0.67 -0.15 0.00 -2.36 0.00 0.00 39.78 36.60 2oal n ASN 342 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2oal s VAL 344 N 1.18 3.97 -0.09 0.00 1.01 0.11 -1.09 120.40 125.49 2oal s VAL 344 Ca -0.05 -0.30 -0.18 0.00 0.00 0.00 0.00 61.98 61.45 2oal s VAL 344 Cb -0.18 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 2oal s VAL 344 CO -0.06 0.41 0.50 -0.94 0.00 0.00 0.00 175.10 175.00 2oal s SER 345 N 1.19 6.76 -0.06 3.32 1.04 -0.43 -0.38 113.70 125.14 2oal s SER 345 Ca 0.03 0.90 0.02 0.00 0.48 0.00 0.00 55.95 57.38 2oal s SER 345 Cb -0.14 -2.30 0.02 0.00 0.10 0.00 0.00 66.02 63.69 2oal s SER 345 CO 0.01 0.05 -0.09 -0.63 0.98 0.00 0.00 173.24 173.56 2oal s ILE 346 N 0.32 0.90 0.00 -1.02 -1.09 -0.62 -4.64 121.20 115.04 2oal s ILE 346 Ca 0.27 -0.33 0.00 0.00 -2.23 0.00 0.00 60.65 58.36 2oal s ILE 346 Cb -0.16 -0.85 0.00 0.00 -1.58 0.00 0.00 42.46 39.87 2oal s ILE 346 CO 0.12 0.30 0.00 0.61 -1.23 0.00 0.00 174.94 174.74 2oal n GLY 347 N 3.95 -0.27 0.12 6.18 0.00 -1.26 -4.29 105.19 109.62 2oal n GLY 347 Ca -0.23 -1.83 0.12 0.00 0.00 0.00 0.00 46.02 44.07 2oal n GLY 347 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oal n THR 348 N 0.00 0.82 0.22 2.61 -2.24 -1.26 -1.26 114.28 113.17 2oal n THR 348 Ca 0.00 0.20 0.09 0.00 -2.27 0.00 0.00 64.05 62.07 2oal n THR 348 Cb 0.00 -1.12 0.45 0.00 -2.10 0.00 0.00 70.33 67.56 2oal n THR 348 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2oal h SER 349 N 0.00 0.00 0.00 3.42 4.64 -1.73 -3.31 113.55 116.57 2oal h SER 349 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 2oal h SER 349 Cb 0.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 2oal h SER 349 CO 0.00 0.25 -0.80 -1.28 -0.87 0.00 0.00 176.83 174.12 2oal h SER 350 N 0.00 0.00 -5.00 4.97 0.87 -1.42 -3.45 113.55 109.52 2oal h SER 350 Ca -0.00 -0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.31 2oal h SER 350 Cb 0.75 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 62.61 2oal h SER 350 CO 0.03 1.08 0.22 0.00 -0.53 0.00 0.00 176.83 177.63 2oal s PHE 352 N -3.81 -0.71 -0.01 0.00 5.36 -0.14 -3.99 117.98 114.68 2oal s PHE 352 Ca 0.05 1.70 -0.07 0.00 -0.96 0.00 0.00 56.93 57.65 2oal s PHE 352 Cb -0.03 0.30 0.00 0.00 -0.34 0.00 0.00 43.02 42.96 2oal s PHE 352 CO -0.06 -0.37 0.15 0.54 -1.46 0.00 0.00 175.22 174.02 2oal s VAL 353 N 0.22 0.06 0.43 3.12 0.11 -1.26 -0.94 120.40 122.14 2oal s VAL 353 Ca -0.00 -0.53 -0.23 0.00 -2.93 0.00 0.00 61.98 58.28 2oal s VAL 353 Cb -0.05 -0.39 -0.11 0.00 -1.53 0.00 0.00 36.38 34.30 2oal s VAL 353 CO 0.00 -0.29 0.81 -1.84 -3.33 0.00 0.00 175.10 170.45 2oal n GLU 354 N 1.80 0.98 -0.01 1.54 0.28 -1.26 -4.80 120.64 119.16 2oal n GLU 354 Ca -0.20 0.35 0.00 0.00 -0.16 0.00 0.00 57.16 57.15 2oal n GLU 354 Cb 0.56 -1.81 0.00 0.00 1.43 0.00 0.00 31.44 31.62 2oal n GLU 354 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 2oal n PRO 355 N 0.27 0.44 0.25 3.44 -0.04 -1.26 -4.37 135.00 133.73 2oal n PRO 355 Ca 0.11 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.65 2oal n PRO 355 Cb 0.39 -1.28 0.64 0.00 -0.04 0.00 0.00 33.50 33.21 2oal n PRO 355 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2oal h LEU 356 N 1.70 0.00 -2.93 1.53 5.85 -2.01 -3.00 115.31 116.45 2oal h LEU 356 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2oal h LEU 356 Cb 0.44 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 2oal h LEU 356 CO 0.00 0.09 -0.46 -0.62 -0.34 0.00 0.00 178.44 177.11 2oal n GLU 357 N -4.25 1.17 -3.71 1.25 -0.58 -1.26 -5.03 120.64 108.23 2oal n GLU 357 Ca -0.03 -2.78 -0.33 0.00 -0.42 0.00 0.00 57.16 53.61 2oal n GLU 357 Cb 0.17 -1.28 0.04 0.00 -0.57 0.00 0.00 31.44 29.80 2oal n GLU 357 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2oal n SER 358 N -0.88 -5.17 -0.18 1.62 7.64 -1.13 -4.93 113.62 110.58 2oal n SER 358 Ca 0.15 -1.04 0.03 0.00 1.01 0.00 0.00 58.87 59.03 2oal n SER 358 Cb 0.75 -3.27 0.01 0.00 -1.01 0.00 0.00 64.21 60.69 2oal n SER 358 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2oal n THR 359 N -4.25 0.00 0.11 0.44 -2.24 -1.26 -4.48 114.28 102.60 2oal n THR 359 Ca -0.10 -0.45 -0.15 0.00 -2.27 0.00 0.00 64.05 61.08 2oal n THR 359 Cb 0.59 1.10 -0.08 0.00 -2.10 0.00 0.00 70.33 69.83 2oal n THR 359 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2oal h GLY 360 N 1.40 -0.97 1.60 3.38 0.00 -1.90 0.14 103.07 106.73 2oal h GLY 360 Ca 0.00 0.56 -0.15 0.00 0.00 0.00 0.00 47.33 47.75 2oal h GLY 360 CO 0.00 -0.27 -0.53 -2.22 0.00 0.00 0.00 176.54 173.52 2oal h ILE 361 N -0.69 1.34 -0.40 2.60 2.04 -1.89 -3.07 117.51 117.43 2oal h ILE 361 Ca 0.01 -1.78 0.05 0.00 1.00 0.00 0.00 64.86 64.14 2oal h ILE 361 Cb 0.72 1.80 -0.05 0.00 -0.74 0.00 0.00 36.82 38.55 2oal h ILE 361 CO -0.27 0.54 0.13 0.22 0.00 0.00 0.00 178.15 178.77 2oal h TYR 362 N 0.33 0.23 -0.45 1.37 3.20 -1.75 -1.07 116.97 118.84 2oal h TYR 362 Ca 0.01 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.01 2oal h TYR 362 Cb 1.04 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 39.24 2oal h TYR 362 CO 0.03 0.08 0.31 0.74 -1.64 0.00 0.00 178.16 177.69 2oal h PHE 363 N 0.28 0.09 0.35 -3.82 0.04 -0.62 -0.00 116.94 113.27 2oal h PHE 363 Ca 0.19 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.94 2oal h PHE 363 Cb 0.18 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.31 2oal h PHE 363 CO -0.16 0.04 -0.17 0.28 -0.60 0.00 0.00 178.31 177.70 2oal h VAL 364 N 0.09 0.33 0.00 -0.55 2.07 -1.21 -2.59 116.25 114.40 2oal h VAL 364 Ca 0.21 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.97 2oal h VAL 364 Cb 0.73 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2oal h VAL 364 CO -0.02 0.08 -0.19 0.10 0.02 0.00 0.00 177.57 177.55 2oal h TYR 365 N -1.02 0.00 -0.45 1.57 -0.00 -1.28 -1.48 116.97 114.31 2oal h TYR 365 Ca -0.05 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.56 2oal h TYR 365 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.21 2oal h TYR 365 CO 0.03 0.19 -0.19 0.00 -0.00 0.00 0.00 178.16 178.19 2oal h ALA 366 N 1.81 0.63 -0.21 0.10 0.00 -1.09 -0.65 119.26 119.84 2oal h ALA 366 Ca -0.00 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.39 2oal h ALA 366 Cb 0.80 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2oal h ALA 366 CO 0.03 0.59 -0.45 0.00 0.00 0.00 0.00 179.25 179.42 2oal h ALA 367 N 0.85 0.82 -0.21 0.00 0.00 -1.15 -1.51 119.26 118.05 2oal h ALA 367 Ca 0.10 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.42 2oal h ALA 367 Cb 0.76 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2oal h ALA 367 CO 0.06 0.66 -0.41 -0.07 0.00 0.00 0.00 179.25 179.49 2oal h LEU 368 N 0.43 0.53 -0.44 0.00 3.38 -1.10 0.16 115.31 118.26 2oal h LEU 368 Ca 0.03 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 2oal h LEU 368 Cb 0.96 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 2oal h LEU 368 CO 0.09 0.88 0.02 0.22 0.09 0.00 0.00 178.44 179.73 2oal h TYR 369 N 0.41 0.84 -0.23 1.13 5.03 -0.93 -2.20 116.97 121.02 2oal h TYR 369 Ca 0.04 -0.14 -0.09 0.00 2.58 0.00 0.00 58.73 61.12 2oal h TYR 369 Cb 0.89 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.94 2oal h TYR 369 CO 0.03 0.81 -0.24 1.96 -1.32 0.00 0.00 178.16 179.41 2oal h GLN 370 N 0.62 0.43 -0.17 1.82 1.08 -0.92 -1.76 115.11 116.21 2oal h GLN 370 Ca 0.13 -0.16 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 2oal h GLN 370 Cb 0.47 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.86 2oal h GLN 370 CO 0.02 0.65 0.00 1.25 -0.95 0.00 0.00 178.83 179.80 2oal h LEU 371 N 0.39 0.29 -0.83 1.46 5.85 -0.46 -1.19 115.31 120.83 2oal h LEU 371 Ca 0.06 -0.31 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 2oal h LEU 371 Cb 0.63 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 2oal h LEU 371 CO 0.05 0.52 0.28 0.58 -0.34 0.00 0.00 178.44 179.53 2oal h VAL 372 N 0.05 1.26 -0.86 1.05 2.07 -1.34 0.14 116.25 118.61 2oal h VAL 372 Ca 0.05 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2oal h VAL 372 Cb 0.37 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.47 2oal h VAL 372 CO 0.01 0.34 0.54 0.50 0.02 0.00 0.00 177.57 178.98 2oal h LYS 373 N 1.12 1.16 -0.68 1.57 3.64 -1.16 -2.27 116.57 119.94 2oal h LYS 373 Ca 0.25 -0.09 -0.34 0.00 -1.27 0.00 0.00 60.65 59.20 2oal h LYS 373 Cb 0.24 -0.25 -0.20 0.00 -0.41 0.00 0.00 32.23 31.61 2oal h LYS 373 CO -0.02 0.79 0.29 0.72 -2.27 0.00 0.00 179.45 178.97 2oal n HIS 374 N -4.38 2.11 -1.74 1.91 8.25 -0.46 -5.03 115.22 115.88 2oal n HIS 374 Ca 0.10 -1.68 -0.42 0.00 -0.26 0.00 0.00 57.72 55.46 2oal n HIS 374 Cb 0.05 -0.72 -0.03 0.00 1.12 0.00 0.00 29.99 30.41 2oal n HIS 374 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2oal s PHE 375 N -3.25 2.89 0.61 4.41 5.36 0.45 -4.76 117.98 123.68 2oal s PHE 375 Ca 0.51 0.41 0.05 0.00 -0.96 0.00 0.00 56.93 56.94 2oal s PHE 375 Cb 0.44 -4.13 0.09 0.00 -0.34 0.00 0.00 43.02 39.09 2oal s PHE 375 CO 0.06 -4.20 0.84 -1.25 -1.46 0.00 0.00 175.22 169.22 2oal s PRO 376 N 0.93 2.15 0.00 10.12 0.04 -1.26 -5.07 135.00 141.91 2oal s PRO 376 Ca 0.73 -1.33 0.00 0.00 0.04 0.00 0.00 61.00 60.44 2oal s PRO 376 Cb -0.49 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.52 2oal s PRO 376 CO 0.34 -1.00 0.00 -0.40 0.04 0.00 0.00 177.00 175.98 2oal n ASP 377 N -2.43 1.51 0.26 6.66 5.68 -1.26 -4.51 116.55 122.46 2oal n ASP 377 Ca 0.14 -0.94 0.18 0.00 -0.50 0.00 0.00 54.79 53.67 2oal n ASP 377 Cb 0.61 0.00 0.91 0.00 -1.14 0.00 0.00 41.12 41.50 2oal n ASP 377 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 2oal h LYS 378 N 0.00 0.00 0.00 0.11 1.57 -1.62 -1.98 116.57 114.65 2oal h LYS 378 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2oal h LYS 378 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2oal h LYS 378 CO 0.00 0.00 0.00 -1.13 -0.57 0.00 0.00 179.45 177.75 2oal n SER 379 N -2.76 0.75 -3.71 0.86 3.41 -1.26 -3.75 113.62 107.16 2oal n SER 379 Ca -0.02 0.60 -0.32 0.00 -0.26 0.00 0.00 58.87 58.88 2oal n SER 379 Cb 0.10 -0.79 0.04 0.00 -0.26 0.00 0.00 64.21 63.30 2oal n SER 379 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oal n LEU 380 N -2.24 -2.66 -4.67 1.04 4.77 -0.75 -4.77 117.00 107.72 2oal n LEU 380 Ca 0.05 -1.01 -0.53 0.00 -0.03 0.00 0.00 56.01 54.48 2oal n LEU 380 Cb 0.37 -2.30 -0.06 0.00 -2.33 0.00 0.00 43.42 39.09 2oal n LEU 380 CO 0.27 0.45 1.45 -3.20 -1.33 0.00 0.00 177.39 175.03 2oal n ASN 381 N -2.58 2.83 0.32 -1.43 2.85 -1.26 -4.80 115.26 111.19 2oal n ASN 381 Ca -0.10 0.97 0.19 0.00 -0.11 0.00 0.00 54.58 55.53 2oal n ASN 381 Cb 0.59 -1.25 1.01 0.00 1.24 0.00 0.00 39.78 41.37 2oal n ASN 381 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2oal h PRO 382 N 8.61 0.00 -0.06 1.20 0.13 -2.01 -1.91 132.00 137.96 2oal h PRO 382 Ca -0.45 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.52 2oal h PRO 382 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 2oal h PRO 382 CO 0.96 0.00 -0.66 0.28 -0.23 0.00 0.00 178.00 178.35 2oal h VAL 383 N 0.00 1.40 -0.28 1.56 2.07 -1.99 -0.75 116.25 118.26 2oal h VAL 383 Ca 0.01 -2.10 -0.07 0.00 0.82 0.00 0.00 66.70 65.36 2oal h VAL 383 Cb 0.33 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.18 2oal h VAL 383 CO -0.00 0.62 -0.11 -0.07 0.02 0.00 0.00 177.57 178.03 2oal h LEU 384 N 0.19 0.58 -0.42 2.57 3.38 -1.68 -1.45 115.31 118.47 2oal h LEU 384 Ca -0.01 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.54 2oal h LEU 384 Cb 1.19 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 2oal h LEU 384 CO 0.10 0.84 0.19 0.74 0.09 0.00 0.00 178.44 180.41 2oal h THR 385 N 0.31 1.19 -0.51 0.22 2.02 -1.52 -1.12 112.91 113.50 2oal h THR 385 Ca 0.06 -0.54 -0.05 0.00 0.77 0.00 0.00 66.41 66.65 2oal h THR 385 Cb 0.61 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 2oal h THR 385 CO 0.04 0.20 0.13 0.00 0.37 0.00 0.00 175.52 176.26 2oal h ALA 386 N 1.04 0.67 -0.67 6.16 0.00 -1.08 -0.93 119.26 124.45 2oal h ALA 386 Ca 0.14 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2oal h ALA 386 Cb 0.14 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2oal h ALA 386 CO -0.02 0.36 0.14 0.00 0.00 0.00 0.00 179.25 179.73 2oal h ARG 387 N 0.71 1.07 0.14 0.00 2.47 -1.14 -1.41 114.38 116.22 2oal h ARG 387 Ca 0.16 -0.26 -0.01 0.00 -1.26 0.00 0.00 59.98 58.61 2oal h ARG 387 Cb 0.32 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2oal h ARG 387 CO -0.00 0.96 -0.07 0.35 0.56 0.00 0.00 179.97 181.77 2oal h PHE 388 N 1.01 -0.18 -0.56 3.04 3.57 -0.94 -2.18 116.94 120.70 2oal h PHE 388 Ca 0.21 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.74 2oal h PHE 388 Cb 0.39 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.16 2oal h PHE 388 CO 0.03 -0.09 0.37 -0.91 -2.23 0.00 0.00 178.31 175.48 2oal h ASN 389 N -0.21 0.55 -0.40 0.41 2.35 -0.95 -1.89 115.58 115.45 2oal h ASN 389 Ca -0.02 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 2oal h ASN 389 Cb 0.17 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2oal h ASN 389 CO 0.03 0.38 -0.05 -0.09 -1.65 0.00 0.00 177.43 176.05 2oal h ARG 390 N 0.64 0.74 -0.40 0.81 2.43 -0.95 -1.07 114.38 116.58 2oal h ARG 390 Ca 0.23 -0.26 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 2oal h ARG 390 Cb 0.10 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 2oal h ARG 390 CO -0.06 0.86 0.26 0.93 -1.51 0.00 0.00 179.97 180.45 2oal h GLU 391 N 0.56 0.52 -0.43 0.20 4.39 -0.74 -1.55 114.58 117.53 2oal h GLU 391 Ca 0.11 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.72 2oal h GLU 391 Cb 0.56 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.08 2oal h GLU 391 CO 0.03 0.34 0.05 0.82 -1.16 0.00 0.00 179.01 179.10 2oal h ILE 392 N 0.53 1.25 -0.51 3.13 1.08 -1.32 -0.97 117.51 120.69 2oal h ILE 392 Ca 0.15 -0.91 0.03 0.00 -0.39 0.00 0.00 64.86 63.74 2oal h ILE 392 Cb -0.05 1.02 -0.04 0.00 -3.07 0.00 0.00 36.82 34.68 2oal h ILE 392 CO -0.04 0.32 0.29 -0.08 -0.69 0.00 0.00 178.15 177.94 2oal h GLU 393 N 0.57 0.55 -0.02 2.37 4.81 -1.02 -0.75 114.58 121.08 2oal h GLU 393 Ca 0.13 -0.03 -0.22 0.00 -0.13 0.00 0.00 59.36 59.11 2oal h GLU 393 Cb 0.40 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.66 2oal h GLU 393 CO 0.01 0.36 -0.90 1.79 -0.73 0.00 0.00 179.01 179.54 2oal h THR 394 N 0.56 1.39 -0.29 0.32 1.35 -1.22 -0.96 112.91 114.06 2oal h THR 394 Ca 0.22 -2.37 0.03 0.00 -0.55 0.00 0.00 66.41 63.74 2oal h THR 394 Cb 0.08 2.34 -0.03 0.00 -1.73 0.00 0.00 68.15 68.81 2oal h THR 394 CO -0.12 0.71 0.10 -0.03 -0.25 0.00 0.00 175.52 175.93 2oal h MET 395 N 0.26 0.23 0.24 4.72 1.85 -0.87 -1.41 114.93 119.94 2oal h MET 395 Ca -0.07 -0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 58.99 2oal h MET 395 Cb 1.52 -0.05 0.00 0.00 0.43 0.00 0.00 31.60 33.51 2oal h MET 395 CO 0.16 0.15 -0.11 0.35 -0.40 0.00 0.00 176.91 177.05 2oal h PHE 396 N 0.24 -0.30 -0.72 1.39 3.57 -1.13 -3.10 116.94 116.90 2oal h PHE 396 Ca 0.13 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.70 2oal h PHE 396 Cb 0.09 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.88 2oal h PHE 396 CO -0.13 0.08 0.47 -0.44 -2.23 0.00 0.00 178.31 176.07 2oal h ASP 397 N -0.85 0.61 -0.36 0.41 3.32 -1.17 0.25 116.42 118.62 2oal h ASP 397 Ca -0.03 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 56.95 2oal h ASP 397 Cb 0.51 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2oal h ASP 397 CO 0.05 0.38 -0.04 0.44 -1.72 0.00 0.00 179.24 178.36 2oal h ASP 398 N 0.69 0.74 -0.06 6.45 3.32 -1.34 -0.53 116.42 125.69 2oal h ASP 398 Ca 0.32 -0.19 -0.22 0.00 0.02 0.00 0.00 57.03 56.96 2oal h ASP 398 Cb 0.36 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.72 2oal h ASP 398 CO -0.11 0.83 -0.80 0.74 -1.72 0.00 0.00 179.24 178.18 2oal h THR 399 N 0.70 1.30 -0.27 0.35 2.02 -1.05 -1.62 112.91 114.34 2oal h THR 399 Ca 0.13 -2.03 0.03 0.00 0.77 0.00 0.00 66.41 65.31 2oal h THR 399 Cb 0.49 2.04 -0.03 0.00 -1.74 0.00 0.00 68.15 68.91 2oal h THR 399 CO 0.03 0.64 0.07 -0.09 0.37 0.00 0.00 175.52 176.53 2oal h ARG 400 N 0.48 0.17 -0.38 6.66 2.43 -0.31 0.37 114.38 123.80 2oal h ARG 400 Ca -0.06 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2oal h ARG 400 Cb 1.42 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.92 2oal h ARG 400 CO 0.16 0.11 0.16 -0.44 -1.51 0.00 0.00 179.97 178.46 2oal h ASP 401 N 0.18 0.51 -0.49 -3.80 3.32 -1.05 -0.98 116.42 114.10 2oal h ASP 401 Ca 0.12 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 57.03 2oal h ASP 401 Cb 0.11 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 2oal h ASP 401 CO -0.15 0.52 0.32 0.15 -1.72 0.00 0.00 179.24 178.36 2oal h PHE 402 N 0.47 0.60 -0.27 4.55 3.57 -0.93 -2.14 116.94 122.79 2oal h PHE 402 Ca 0.13 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 2oal h PHE 402 Cb 0.16 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 2oal h PHE 402 CO -0.01 0.37 0.08 0.82 -2.23 0.00 0.00 178.31 177.35 2oal h ILE 403 N 0.65 1.20 -0.95 1.41 2.04 -0.79 -2.84 117.51 118.23 2oal h ILE 403 Ca 0.19 -0.65 0.12 0.00 1.00 0.00 0.00 64.86 65.51 2oal h ILE 403 Cb -0.05 1.12 -0.08 0.00 -0.74 0.00 0.00 36.82 37.07 2oal h ILE 403 CO -0.05 0.21 0.61 -0.61 0.00 0.00 0.00 178.15 178.31 2oal h GLN 404 N 0.27 0.88 -0.16 2.37 4.15 -0.95 -0.64 115.11 121.04 2oal h GLN 404 Ca 0.09 -0.05 0.05 0.00 0.77 0.00 0.00 58.65 59.50 2oal h GLN 404 Cb 0.25 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 2oal h GLN 404 CO -0.00 0.58 0.12 0.00 -1.93 0.00 0.00 178.83 177.59 2oal h ALA 405 N 1.55 2.11 -0.46 3.38 0.00 -1.14 0.11 119.26 124.81 2oal h ALA 405 Ca 0.46 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 2oal h ALA 405 Cb 0.51 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2oal h ALA 405 CO -0.23 -0.20 0.23 0.45 0.00 0.00 0.00 179.25 179.51 2oal h HIS 406 N 0.00 0.63 0.07 0.00 3.86 -1.11 -2.03 115.15 116.57 2oal h HIS 406 Ca 0.07 -0.01 -0.33 0.00 -1.16 0.00 0.00 60.37 58.94 2oal h HIS 406 Cb 0.31 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.54 2oal h HIS 406 CO 0.00 0.46 -1.84 1.19 0.86 0.00 0.00 177.93 178.61 2oal n PHE 407 N -4.40 1.01 -0.35 2.45 3.72 -0.51 -3.75 117.46 115.63 2oal n PHE 407 Ca 0.04 0.29 0.01 0.00 -0.05 0.00 0.00 57.45 57.73 2oal n PHE 407 Cb 0.12 -1.12 0.17 0.00 -0.94 0.00 0.00 39.48 37.70 2oal n PHE 407 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2oal h TYR 408 N -0.35 1.18 -0.50 1.38 3.20 -0.85 -2.73 116.97 118.30 2oal h TYR 408 Ca -0.43 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.47 2oal h TYR 408 Cb 1.76 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 39.64 2oal h TYR 408 CO 0.07 0.67 0.00 1.19 -1.64 0.00 0.00 178.16 178.45 2oal n PHE 409 N -4.45 0.67 -2.34 -3.82 3.72 -0.76 -4.72 117.46 105.76 2oal n PHE 409 Ca 0.13 -0.33 -0.40 0.00 -0.05 0.00 0.00 57.45 56.80 2oal n PHE 409 Cb 0.11 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.62 2oal n PHE 409 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2oal s SER 410 N -1.15 6.98 0.00 4.37 0.15 -1.03 -4.73 113.70 118.28 2oal s SER 410 Ca 0.38 2.40 0.28 0.00 0.70 0.00 0.00 55.95 59.71 2oal s SER 410 Cb 0.21 -2.63 1.37 0.00 -1.71 0.00 0.00 66.02 63.25 2oal s SER 410 CO 0.28 -0.36 1.94 -0.81 1.20 0.00 0.00 173.24 175.49 2oal n PRO 411 N 0.84 0.34 -1.88 5.44 -0.04 -1.26 -4.89 135.00 133.56 2oal n PRO 411 Ca 0.00 0.03 -0.41 0.00 -0.04 0.00 0.00 63.50 63.08 2oal n PRO 411 Cb 0.44 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.40 2oal n PRO 411 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2oal s ARG 412 N -2.63 4.17 -0.00 0.54 0.52 -1.26 -4.91 118.95 115.38 2oal s ARG 412 Ca 0.24 2.49 0.00 0.00 -0.52 0.00 0.00 55.73 57.94 2oal s ARG 412 Cb 0.18 -3.00 0.00 0.00 0.52 0.00 0.00 34.95 32.66 2oal s ARG 412 CO 0.43 -0.46 0.54 0.25 0.02 0.00 0.00 175.30 176.08 2oal n THR 413 N 0.67 0.00 0.41 0.02 -2.24 -1.26 -4.47 114.28 107.40 2oal n THR 413 Ca 0.01 -0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 2oal n THR 413 Cb 0.40 0.96 0.47 0.00 -2.10 0.00 0.00 70.33 70.06 2oal n THR 413 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 2oal h ASP 414 N 0.00 0.00 -4.37 3.42 2.03 -1.95 -3.44 116.42 112.11 2oal h ASP 414 Ca 0.00 0.00 -0.29 0.00 -0.73 0.00 0.00 57.03 56.01 2oal h ASP 414 Cb 1.03 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 39.38 2oal h ASP 414 CO 0.00 0.00 -0.68 0.42 -1.03 0.00 0.00 179.24 177.95 2oal s THR 415 N -3.33 0.81 0.34 1.15 -4.23 -1.26 -5.01 115.64 104.11 2oal s THR 415 Ca 0.06 -1.99 0.05 0.00 -1.18 0.00 0.00 61.69 58.63 2oal s THR 415 Cb 0.09 -1.98 0.30 0.00 1.34 0.00 0.00 72.50 72.25 2oal s THR 415 CO 0.52 -0.61 1.92 -0.65 -0.54 0.00 0.00 174.62 175.26 2oal h PRO 416 N 2.76 0.79 0.48 3.99 0.11 -1.89 -2.13 132.00 136.12 2oal h PRO 416 Ca -0.36 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 2oal h PRO 416 Cb 1.19 -0.18 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2oal h PRO 416 CO 0.63 0.52 -0.30 0.35 -0.21 0.00 0.00 178.00 179.00 2oal h PHE 417 N 0.82 -0.78 -0.36 0.65 3.57 -1.94 0.59 116.94 119.49 2oal h PHE 417 Ca 0.37 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.83 2oal h PHE 417 Cb 0.35 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 2oal h PHE 417 CO -0.00 -0.45 0.09 -1.49 -2.23 0.00 0.00 178.31 174.22 2oal h TRP 418 N -0.74 0.53 -0.29 0.41 4.06 -1.73 -2.38 115.95 115.82 2oal h TRP 418 Ca -0.06 -0.03 -0.11 0.00 2.06 0.00 0.00 58.89 60.75 2oal h TRP 418 Cb 0.60 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 2oal h TRP 418 CO -0.09 0.47 -0.25 0.00 -3.56 0.00 0.00 178.44 175.00 2oal h ARG 419 N 0.52 0.68 -0.60 0.49 3.08 -1.16 -3.21 114.38 114.18 2oal h ARG 419 Ca 0.12 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.79 2oal h ARG 419 Cb 0.20 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 2oal h ARG 419 CO -0.00 0.95 0.23 0.00 -1.07 0.00 0.00 179.97 180.08 2oal h ALA 420 N 0.72 1.28 -0.80 0.04 0.00 -0.58 -2.54 119.26 117.37 2oal h ALA 420 Ca 0.05 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.93 2oal h ALA 420 Cb 0.81 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2oal h ALA 420 CO 0.06 0.53 0.53 -0.91 0.00 0.00 0.00 179.25 179.46 2oal h ASN 421 N 0.86 0.54 0.93 0.00 2.35 -1.43 0.27 115.58 119.10 2oal h ASN 421 Ca 0.20 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 2oal h ASN 421 Cb 0.18 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2oal h ASN 421 CO -0.02 0.29 0.00 0.29 -1.65 0.00 0.00 177.43 176.34 2oal n LYS 422 N -4.51 0.21 0.03 0.81 5.02 -0.96 -2.68 118.16 116.08 2oal n LYS 422 Ca 0.15 0.36 0.12 0.00 -2.02 0.00 0.00 58.31 56.92 2oal n LYS 422 Cb 0.45 -1.85 0.22 0.00 -0.02 0.00 0.00 35.03 33.83 2oal n LYS 422 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2oal n GLU 423 N -2.24 0.17 -1.84 1.97 -0.58 0.93 -4.88 120.64 114.16 2oal n GLU 423 Ca 0.03 0.05 -0.30 0.00 -0.42 0.00 0.00 57.16 56.52 2oal n GLU 423 Cb 0.28 -1.61 0.06 0.00 -0.57 0.00 0.00 31.44 29.61 2oal n GLU 423 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2oal s LEU 424 N -3.70 2.77 0.03 -4.62 1.43 -1.09 -5.06 118.68 108.43 2oal s LEU 424 Ca 0.08 1.08 0.03 0.00 -1.03 0.00 0.00 54.13 54.29 2oal s LEU 424 Cb 0.15 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 2oal s LEU 424 CO 0.71 -1.55 -0.02 -0.13 0.23 0.00 0.00 176.35 175.58 2oal s ARG 425 N -5.38 2.63 0.33 1.70 0.52 -1.26 -5.06 118.95 112.44 2oal s ARG 425 Ca 0.59 -0.72 -0.21 0.00 -0.52 0.00 0.00 55.73 54.88 2oal s ARG 425 Cb -0.11 -2.57 -0.10 0.00 0.52 0.00 0.00 34.95 32.69 2oal s ARG 425 CO 0.52 0.59 0.86 -0.51 0.02 0.00 0.00 175.30 176.77 2oal s LEU 426 N -1.72 4.17 0.73 2.53 1.43 -1.26 -4.80 118.68 119.77 2oal s LEU 426 Ca 0.20 1.59 -0.15 0.00 -1.03 0.00 0.00 54.13 54.75 2oal s LEU 426 Cb -0.11 -4.08 0.04 0.00 0.03 0.00 0.00 46.19 42.06 2oal s LEU 426 CO 0.11 -0.16 1.19 0.00 0.23 0.00 0.00 176.35 177.73 2oal s ALA 427 N -1.83 2.14 0.28 4.21 0.00 -1.26 -4.70 121.76 120.59 2oal s ALA 427 Ca 0.53 0.81 0.00 0.00 0.00 0.00 0.00 51.96 53.30 2oal s ALA 427 Cb -0.14 -3.44 0.54 0.00 0.00 0.00 0.00 23.12 20.07 2oal s ALA 427 CO 0.19 -1.84 1.82 -0.44 0.00 0.00 0.00 175.76 175.49 2oal h ASP 428 N -0.35 0.85 -0.30 0.00 3.32 -1.99 -0.32 116.42 117.63 2oal h ASP 428 Ca -0.47 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 56.60 2oal h ASP 428 Cb 1.29 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 2oal h ASP 428 CO 0.50 0.44 0.08 1.23 -1.72 0.00 0.00 179.24 179.77 2oal h GLY 429 N 0.92 0.60 1.18 2.75 0.00 -2.00 -1.32 103.07 105.20 2oal h GLY 429 Ca 0.48 -0.32 -0.26 0.00 0.00 0.00 0.00 47.33 47.23 2oal h GLY 429 CO -0.28 0.30 -1.01 1.98 0.00 0.00 0.00 176.54 177.53 2oal h MET 430 N 0.55 0.69 -0.54 4.80 1.85 -1.50 -2.90 114.93 117.89 2oal h MET 430 Ca 0.13 -0.74 0.00 0.00 -0.61 0.00 0.00 59.70 58.48 2oal h MET 430 Cb 0.23 0.21 -0.03 0.00 0.43 0.00 0.00 31.60 32.45 2oal h MET 430 CO -0.00 1.32 0.35 0.37 -0.40 0.00 0.00 176.91 178.54 2oal h GLN 431 N 0.36 0.71 -0.60 0.39 5.75 -0.80 -0.78 115.11 120.14 2oal h GLN 431 Ca -0.13 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.23 2oal h GLN 431 Cb 1.67 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 30.04 2oal h GLN 431 CO 0.20 0.47 -0.03 1.49 -2.65 0.00 0.00 178.83 178.32 2oal h GLU 432 N 0.73 1.07 -0.73 1.69 4.81 -1.18 0.87 114.58 121.84 2oal h GLU 432 Ca 0.20 -0.36 -0.05 0.00 -0.13 0.00 0.00 59.36 59.02 2oal h GLU 432 Cb -0.08 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 2oal h GLU 432 CO -0.04 1.06 0.27 0.87 -0.73 0.00 0.00 179.01 180.44 2oal h LYS 433 N 0.97 1.11 -0.53 1.92 1.57 -1.10 -0.76 116.57 119.75 2oal h LYS 433 Ca 0.17 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 2oal h LYS 433 Cb 0.59 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 2oal h LYS 433 CO 0.04 0.91 -0.11 0.82 -0.57 0.00 0.00 179.45 180.53 2oal h ILE 434 N 1.07 1.27 -0.84 1.86 1.08 -0.68 0.12 117.51 121.40 2oal h ILE 434 Ca 0.24 -1.27 -0.01 0.00 -0.39 0.00 0.00 64.86 63.44 2oal h ILE 434 Cb 0.24 0.97 -0.04 0.00 -3.07 0.00 0.00 36.82 34.92 2oal h ILE 434 CO -0.02 0.45 0.49 0.44 -0.69 0.00 0.00 178.15 178.83 2oal h ASP 435 N 0.90 1.01 -0.36 1.72 3.32 -0.41 0.55 116.42 123.15 2oal h ASP 435 Ca 0.14 -0.07 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 2oal h ASP 435 Cb 0.68 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2oal h ASP 435 CO 0.05 0.79 0.04 0.24 -1.72 0.00 0.00 179.24 178.63 2oal h MET 436 N 1.15 0.61 -0.14 3.56 2.86 -0.68 -1.65 114.93 120.63 2oal h MET 436 Ca 0.30 -0.18 0.02 0.00 -2.06 0.00 0.00 59.70 57.78 2oal h MET 436 Cb -0.03 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 2oal h MET 436 CO -0.05 0.70 0.03 -0.92 1.06 0.00 0.00 176.91 177.72 2oal h TYR 437 N 0.44 0.06 0.00 -0.22 3.20 -0.30 -0.56 116.97 119.58 2oal h TYR 437 Ca 0.11 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 2oal h TYR 437 Cb 0.40 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2oal h TYR 437 CO 0.03 0.02 -0.05 0.00 -1.64 0.00 0.00 178.16 176.52 2oal h ARG 438 N 0.09 0.00 -0.06 1.82 3.08 -0.79 0.18 114.38 118.70 2oal h ARG 438 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2oal h ARG 438 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2oal h ARG 438 CO -0.08 0.05 0.00 0.00 -1.07 0.00 0.00 179.97 178.87 2oal n ALA 439 N -2.50 2.55 -0.81 0.04 0.00 -0.63 -0.99 120.51 118.16 2oal n ALA 439 Ca -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.21 2oal n ALA 439 Cb 0.13 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.43 2oal n ALA 439 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oal n GLY 440 N 0.79 0.69 3.86 0.00 0.00 0.05 -4.79 105.19 105.79 2oal n GLY 440 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 2oal n GLY 440 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2oal s MET 441 N -0.19 3.79 0.45 1.61 -1.94 -0.28 -4.57 119.30 118.16 2oal s MET 441 Ca 0.00 0.68 -0.20 0.00 -1.71 0.00 0.00 55.69 54.45 2oal s MET 441 Cb 0.00 -2.24 -0.10 0.00 2.01 0.00 0.00 34.83 34.50 2oal s MET 441 CO 0.00 -0.23 0.96 0.00 -0.01 0.00 0.00 175.02 175.74 2oal s ALA 442 N -2.64 3.04 -0.34 3.03 0.00 -1.26 -4.20 121.76 119.37 2oal s ALA 442 Ca 0.54 0.37 -0.07 0.00 0.00 0.00 0.00 51.96 52.80 2oal s ALA 442 Cb -0.10 -3.15 0.04 0.00 0.00 0.00 0.00 23.12 19.91 2oal s ALA 442 CO 0.37 0.06 0.12 0.42 0.00 0.00 0.00 175.76 176.73 2oal s ILE 443 N -2.24 3.93 -1.28 0.00 -1.09 -1.26 -4.64 121.20 114.62 2oal s ILE 443 Ca 0.62 -1.07 -0.06 0.00 -2.23 0.00 0.00 60.65 57.91 2oal s ILE 443 Cb -0.09 -3.22 -0.01 0.00 -1.58 0.00 0.00 42.46 37.56 2oal s ILE 443 CO 0.16 -0.18 0.66 0.59 -1.23 0.00 0.00 174.94 174.94 2oal n ASN 444 N 4.85 -2.29 -4.77 3.58 3.02 -1.26 0.67 115.26 119.06 2oal n ASN 444 Ca -0.12 -0.92 -0.40 0.00 -0.03 0.00 0.00 54.58 53.11 2oal n ASN 444 Cb 0.45 -3.67 0.01 0.00 -0.61 0.00 0.00 39.78 35.95 2oal n ASN 444 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oal s ALA 445 N -3.68 3.39 0.53 5.41 0.00 -1.26 -2.77 121.76 123.38 2oal s ALA 445 Ca 0.15 1.48 -0.22 0.00 0.00 0.00 0.00 51.96 53.37 2oal s ALA 445 Cb -0.05 -3.58 -0.05 0.00 0.00 0.00 0.00 23.12 19.44 2oal s ALA 445 CO 0.84 -1.08 1.30 -1.25 0.00 0.00 0.00 175.76 175.57 2oal s PRO 446 N -2.25 3.27 0.50 0.00 0.04 -1.26 -4.86 135.00 130.43 2oal s PRO 446 Ca 0.57 2.08 0.22 0.00 0.04 0.00 0.00 61.00 63.91 2oal s PRO 446 Cb -0.44 -2.26 1.28 0.00 0.04 0.00 0.00 34.50 33.12 2oal s PRO 446 CO 0.58 -1.04 1.97 0.00 0.04 0.00 0.00 177.00 178.55 2oal h ALA 447 N 1.54 2.38 -2.64 8.56 0.00 -1.98 -3.42 119.26 123.70 2oal h ALA 447 Ca -0.50 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.32 2oal h ALA 447 Cb 1.29 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 2oal h ALA 447 CO 0.58 -0.56 -0.17 -1.54 0.00 0.00 0.00 179.25 177.56 2oal s SER 448 N -6.11 -0.14 -0.32 0.00 1.04 -1.26 -5.04 113.70 101.86 2oal s SER 448 Ca -0.06 -0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.06 2oal s SER 448 Cb 0.20 0.42 0.44 0.00 0.10 0.00 0.00 66.02 67.18 2oal s SER 448 CO 0.74 -0.77 1.66 -0.90 0.98 0.00 0.00 173.24 174.96 2oal n ASP 449 N 0.02 3.84 -4.40 7.02 5.75 -1.26 -4.82 116.55 122.69 2oal n ASP 449 Ca -0.16 -3.11 -0.44 0.00 -0.01 0.00 0.00 54.79 51.06 2oal n ASP 449 Cb 0.62 -0.76 -0.05 0.00 -1.03 0.00 0.00 41.12 39.91 2oal n ASP 449 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2oal s ASP 450 N -0.56 6.19 0.40 -1.12 -1.08 -1.26 -4.92 116.67 114.32 2oal s ASP 450 Ca 0.39 -1.24 0.11 0.00 -0.52 0.00 0.00 52.55 51.29 2oal s ASP 450 Cb 0.33 -2.32 0.92 0.00 -1.46 0.00 0.00 42.92 40.38 2oal s ASP 450 CO 0.07 -1.14 1.93 0.00 0.52 0.00 0.00 175.17 176.55 2oal h ALA 451 N 9.23 1.93 0.20 3.66 0.00 -1.98 -2.13 119.26 130.17 2oal h ALA 451 Ca -0.29 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2oal h ALA 451 Cb 1.08 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2oal h ALA 451 CO 1.09 -0.10 -0.10 -0.56 0.00 0.00 0.00 179.25 179.59 2oal h GLN 452 N 0.56 -0.26 -0.16 0.00 -0.00 -1.97 -0.50 115.11 112.79 2oal h GLN 452 Ca 0.35 0.02 0.05 0.00 -0.00 0.00 0.00 58.65 59.06 2oal h GLN 452 Cb 0.60 0.06 -0.01 0.00 -0.00 0.00 0.00 27.48 28.13 2oal h GLN 452 CO -0.12 0.04 0.17 -0.07 -0.00 0.00 0.00 178.83 178.84 2oal h LEU 453 N -0.56 0.00 0.00 0.06 3.38 -1.88 0.40 115.31 116.71 2oal h LEU 453 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2oal h LEU 453 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2oal h LEU 453 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.58 2oal n TYR 454 N -3.89 0.00 1.18 1.13 9.36 -0.83 -2.92 117.16 121.20 2oal n TYR 454 Ca 0.01 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.33 2oal n TYR 454 Cb 0.29 -0.48 0.57 0.00 -0.63 0.00 0.00 39.34 39.09 2oal n TYR 454 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2oal n TYR 455 N -1.93 0.00 -0.07 2.98 4.01 -0.22 -2.91 117.16 119.01 2oal n TYR 455 Ca 0.00 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.67 2oal n TYR 455 Cb 0.00 -0.03 -0.16 0.00 -0.31 0.00 0.00 39.34 38.84 2oal n TYR 455 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oal n GLY 456 N 0.23 -1.01 3.14 2.72 0.00 0.14 -4.62 105.19 105.79 2oal n GLY 456 Ca 0.14 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 2oal n GLY 456 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2oal s ASN 457 N -5.42 4.92 0.22 1.61 3.84 -1.15 -4.94 114.94 114.02 2oal s ASN 457 Ca -0.09 -1.53 -0.08 0.00 0.21 0.00 0.00 52.86 51.38 2oal s ASN 457 Cb 0.07 -1.72 0.25 0.00 -0.55 0.00 0.00 41.25 39.31 2oal s ASN 457 CO 0.84 -0.32 1.85 0.15 -2.79 0.00 0.00 177.10 176.83 2oal h PHE 458 N 7.95 0.91 -0.77 0.43 3.57 -1.88 -1.83 116.94 125.33 2oal h PHE 458 Ca -0.18 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.38 2oal h PHE 458 Cb 1.05 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.45 2oal h PHE 458 CO 0.59 0.50 0.50 1.49 -2.23 0.00 0.00 178.31 179.16 2oal h GLU 459 N 0.93 0.91 -0.03 1.11 4.57 -1.95 0.37 114.58 120.49 2oal h GLU 459 Ca 0.32 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.44 2oal h GLU 459 Cb 0.07 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 28.45 2oal h GLU 459 CO -0.13 0.60 -0.00 1.49 -1.18 0.00 0.00 179.01 179.79 2oal h GLU 460 N 0.94 0.06 -0.37 1.92 4.57 -1.70 -2.98 114.58 117.03 2oal h GLU 460 Ca 0.30 -0.02 -0.16 0.00 -1.18 0.00 0.00 59.36 58.31 2oal h GLU 460 Cb 0.05 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 2oal h GLU 460 CO -0.09 0.35 -0.38 1.49 -1.18 0.00 0.00 179.01 179.20 2oal h GLU 461 N -0.24 0.90 -0.67 1.92 4.81 -0.84 -2.89 114.58 117.58 2oal h GLU 461 Ca 0.01 -0.48 0.05 0.00 -0.13 0.00 0.00 59.36 58.81 2oal h GLU 461 Cb 0.33 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 2oal h GLU 461 CO 0.00 1.13 0.38 0.35 -0.73 0.00 0.00 179.01 180.14 2oal h PHE 462 N 0.71 0.70 0.00 0.92 3.57 -0.33 0.23 116.94 122.74 2oal h PHE 462 Ca 0.06 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.51 2oal h PHE 462 Cb 0.98 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.49 2oal h PHE 462 CO 0.07 0.35 -0.31 0.00 -2.23 0.00 0.00 178.31 176.18 2oal h ARG 463 N 0.71 0.00 -1.18 1.11 3.08 -1.54 -3.21 114.38 113.35 2oal h ARG 463 Ca 0.29 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.84 2oal h ARG 463 Cb 0.16 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 29.79 2oal h ARG 463 CO -0.17 0.31 -0.88 -1.71 -1.07 0.00 0.00 179.97 176.46 2oal n ASN 464 N -3.57 3.81 0.43 7.04 5.15 -0.76 -4.92 115.26 122.45 2oal n ASN 464 Ca -0.01 -3.38 -0.19 0.00 -0.60 0.00 0.00 54.58 50.40 2oal n ASN 464 Cb 0.45 -0.45 -0.10 0.00 -0.53 0.00 0.00 39.78 39.15 2oal n ASN 464 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2oal h PHE 465 N 2.60 -1.27 -3.19 1.20 3.57 -0.58 -3.35 116.94 115.92 2oal h PHE 465 Ca 0.19 -0.01 -0.71 0.00 3.53 0.00 0.00 57.97 60.96 2oal h PHE 465 Cb 1.12 0.45 -0.21 0.00 2.79 0.00 0.00 35.95 40.10 2oal h PHE 465 CO 0.73 -0.72 -0.10 -1.58 -2.23 0.00 0.00 178.31 174.42 2oal s TRP 466 N -5.81 3.13 0.54 0.41 0.23 -1.26 -5.01 118.94 111.17 2oal s TRP 466 Ca -0.18 -0.83 0.08 0.00 -2.03 0.00 0.00 56.10 53.13 2oal s TRP 466 Cb 0.03 -3.53 0.06 0.00 0.03 0.00 0.00 33.47 30.05 2oal s TRP 466 CO 0.57 -1.00 0.59 0.54 0.96 0.00 0.00 176.95 178.61 2oal s ASN 467 N 2.94 4.92 0.32 2.95 2.20 -1.26 -4.78 114.94 122.23 2oal s ASN 467 Ca 0.09 -0.99 0.09 0.00 -0.94 0.00 0.00 52.86 51.11 2oal s ASN 467 Cb -0.23 0.24 0.87 0.00 -2.00 0.00 0.00 41.25 40.13 2oal s ASN 467 CO 0.08 -1.17 1.73 -1.13 -2.94 0.00 0.00 177.10 173.67 2oal h ASN 468 N 0.50 0.64 -0.10 3.54 -1.24 0.43 -0.85 115.58 118.50 2oal h ASN 468 Ca -0.34 0.14 -0.00 0.00 0.71 0.00 0.00 56.30 56.81 2oal h ASN 468 Cb 1.29 0.04 -0.00 0.00 0.73 0.00 0.00 38.32 40.38 2oal h ASN 468 CO 0.49 0.10 0.06 0.28 -1.29 0.00 0.00 177.43 177.06 2oal h SER 469 N 0.57 0.13 -0.24 1.15 0.02 -1.90 -0.59 113.55 112.69 2oal h SER 469 Ca 0.63 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 61.54 2oal h SER 469 Cb 1.20 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 63.68 2oal h SER 469 CO -0.48 0.16 0.06 0.78 -1.14 0.00 0.00 176.83 176.22 2oal h ASN 470 N 0.08 0.05 -0.65 3.07 -0.26 -1.57 -0.86 115.58 115.45 2oal h ASN 470 Ca 0.04 0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 55.78 2oal h ASN 470 Cb 0.06 0.03 -0.03 0.00 -1.06 0.00 0.00 38.32 37.33 2oal h ASN 470 CO -0.01 0.06 0.29 1.88 -1.06 0.00 0.00 177.43 178.59 2oal h TYR 471 N 0.17 0.96 -0.50 1.19 0.05 -1.17 -2.43 116.97 115.23 2oal h TYR 471 Ca 0.11 -0.06 -0.13 0.00 0.05 0.00 0.00 58.73 58.70 2oal h TYR 471 Cb 0.09 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.53 2oal h TYR 471 CO -0.14 0.74 -0.19 1.88 -1.05 0.00 0.00 178.16 179.40 2oal h TYR 472 N 0.90 1.15 -0.36 4.88 -1.99 -0.89 0.20 116.97 120.86 2oal h TYR 472 Ca 0.22 -0.27 0.06 0.00 2.00 0.00 0.00 58.73 60.74 2oal h TYR 472 Cb 0.16 -0.27 -0.05 0.00 2.00 0.00 0.00 36.73 38.57 2oal h TYR 472 CO 0.01 1.10 0.02 0.00 -0.00 0.00 0.00 178.16 179.29 2oal h VAL 474 N 0.13 1.62 0.27 0.00 2.07 -1.33 -2.41 116.25 116.60 2oal h VAL 474 Ca 0.17 -1.95 -0.01 0.00 0.82 0.00 0.00 66.70 65.73 2oal h VAL 474 Cb 0.23 2.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 2oal h VAL 474 CO -0.27 0.50 -0.13 -0.07 0.02 0.00 0.00 177.57 177.62 2oal h LEU 475 N -0.85 -0.31 -0.96 2.57 3.38 -0.60 -0.93 115.31 117.61 2oal h LEU 475 Ca -0.00 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 2oal h LEU 475 Cb 0.82 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2oal h LEU 475 CO 0.00 -0.00 0.04 0.00 0.09 0.00 0.00 178.44 178.57 2oal h ALA 476 N -0.00 1.14 -0.48 1.53 0.00 -0.91 0.10 119.26 120.65 2oal h ALA 476 Ca -0.04 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.67 2oal h ALA 476 Cb 0.45 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2oal h ALA 476 CO 0.06 0.56 0.23 0.78 0.00 0.00 0.00 179.25 180.88 2oal h GLY 477 N 0.97 0.66 2.00 0.00 0.00 -1.32 -0.88 103.07 104.50 2oal h GLY 477 Ca 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 2oal h GLY 477 CO 0.01 0.10 -0.07 1.41 0.00 0.00 0.00 176.54 177.99 2oal h LEU 478 N 0.46 0.00 0.00 3.11 3.38 -0.83 -3.47 115.31 117.96 2oal h LEU 478 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2oal h LEU 478 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2oal h LEU 478 CO -0.15 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.05 2oal n GLY 479 N 0.17 1.32 3.65 0.83 0.00 -0.33 -4.52 105.19 106.30 2oal n GLY 479 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2oal n GLY 479 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2oal s LEU 480 N 0.00 4.04 0.28 0.99 2.96 0.26 -4.92 118.68 122.28 2oal s LEU 480 Ca 0.00 1.35 0.06 0.00 -0.22 0.00 0.00 54.13 55.32 2oal s LEU 480 Cb 0.00 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 43.09 2oal s LEU 480 CO 0.00 -0.83 -0.05 0.68 -1.32 0.00 0.00 176.35 174.83 2oal s VAL 481 N 3.63 1.60 0.84 1.68 -7.23 -1.26 -2.95 120.40 116.71 2oal s VAL 481 Ca 0.50 -2.12 -0.12 0.00 -1.81 0.00 0.00 61.98 58.43 2oal s VAL 481 Cb -0.16 -2.45 0.09 0.00 0.56 0.00 0.00 36.38 34.42 2oal s VAL 481 CO 0.14 -0.29 1.11 -2.65 -0.31 0.00 0.00 175.10 173.10 2oal n PRO 482 N -0.58 -0.02 0.20 4.82 -0.02 -1.26 -4.84 135.00 133.30 2oal n PRO 482 Ca -0.05 0.07 0.05 0.00 -2.02 0.00 0.00 63.50 61.55 2oal n PRO 482 Cb 0.63 -2.36 0.44 0.00 -0.02 0.00 0.00 33.50 32.19 2oal n PRO 482 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2oal h ASP 483 N -1.20 0.00 -4.94 2.55 3.32 -1.35 -3.46 116.42 111.34 2oal h ASP 483 Ca -0.45 0.00 0.07 0.00 0.02 0.00 0.00 57.03 56.67 2oal h ASP 483 Cb 1.29 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.73 2oal h ASP 483 CO 0.44 0.31 0.36 0.00 -1.72 0.00 0.00 179.24 178.62 2oal s ALA 484 N -4.16 -1.62 0.78 3.45 0.00 -1.26 -5.13 121.76 113.82 2oal s ALA 484 Ca -0.03 0.47 -0.14 0.00 0.00 0.00 0.00 51.96 52.27 2oal s ALA 484 Cb 0.14 0.68 0.07 0.00 0.00 0.00 0.00 23.12 24.01 2oal s ALA 484 CO 0.69 -0.84 1.19 -2.14 0.00 0.00 0.00 175.76 174.67 2oal s PRO 485 N -3.49 1.83 0.04 0.00 0.02 -1.26 -4.42 135.00 127.73 2oal s PRO 485 Ca 0.06 1.71 -0.31 0.00 0.02 0.00 0.00 61.00 62.48 2oal s PRO 485 Cb -0.02 -1.80 -0.10 0.00 0.02 0.00 0.00 34.50 32.60 2oal s PRO 485 CO -0.06 -2.06 1.91 0.45 -0.33 0.00 0.00 177.00 176.91 2oal n SER 486 N -3.14 3.98 -0.10 2.53 2.88 -1.26 -4.85 113.62 113.66 2oal n SER 486 Ca 0.13 0.94 0.26 0.00 -1.33 0.00 0.00 58.87 58.87 2oal n SER 486 Cb 0.51 -1.50 0.72 0.00 -0.75 0.00 0.00 64.21 63.18 2oal n SER 486 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2oal h PRO 487 N 9.63 0.00 -0.96 -1.46 0.11 -1.90 -1.79 132.00 135.63 2oal h PRO 487 Ca -0.49 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.65 2oal h PRO 487 Cb 1.24 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.30 2oal h PRO 487 CO 0.94 0.00 0.63 0.00 -0.21 0.00 0.00 178.00 179.37 2oal h ARG 488 N 0.00 1.21 -0.44 1.05 3.08 -1.99 -2.92 114.38 114.36 2oal h ARG 488 Ca 0.36 -0.07 0.09 0.00 0.07 0.00 0.00 59.98 60.43 2oal h ARG 488 Cb 1.52 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 31.28 2oal h ARG 488 CO -0.00 0.80 0.30 -0.07 -1.07 0.00 0.00 179.97 179.93 2oal h LEU 489 N 1.24 0.16 -2.10 3.04 3.38 -1.70 0.10 115.31 119.43 2oal h LEU 489 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 2oal h LEU 489 Cb -0.04 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2oal h LEU 489 CO -0.11 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.52 2oal h ALA 490 N 1.78 1.00 -0.73 1.53 0.00 -1.69 -1.29 119.26 119.86 2oal h ALA 490 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2oal h ALA 490 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2oal h ALA 490 CO -0.03 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.94 2oal n HIS 491 N -3.07 0.98 -2.91 0.00 8.25 0.02 -4.48 115.22 114.02 2oal n HIS 491 Ca -0.01 -0.49 -0.20 0.00 -0.26 0.00 0.00 57.72 56.77 2oal n HIS 491 Cb 0.20 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.29 2oal n HIS 491 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 2oal n MET 492 N 1.62 1.98 -0.10 -0.41 2.00 -0.49 -4.93 117.12 116.80 2oal n MET 492 Ca 0.24 -3.92 0.14 0.00 0.00 0.00 0.00 57.70 54.17 2oal n MET 492 Cb 0.62 -1.83 0.53 0.00 0.00 0.00 0.00 33.22 32.53 2oal n MET 492 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 2oal h PRO 493 N 2.93 0.34 -0.34 0.03 0.13 -1.79 -1.04 132.00 132.27 2oal h PRO 493 Ca 0.10 -0.02 -0.17 0.00 -0.87 0.00 0.00 66.00 65.04 2oal h PRO 493 Cb 0.88 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 31.93 2oal h PRO 493 CO 0.64 0.22 -0.46 1.96 -0.23 0.00 0.00 178.00 180.13 2oal h GLN 494 N 0.35 0.89 -0.15 0.86 4.20 -1.94 -2.57 115.11 116.75 2oal h GLN 494 Ca 0.30 -0.51 -0.07 0.00 0.06 0.00 0.00 58.65 58.44 2oal h GLN 494 Cb 0.71 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.53 2oal h GLN 494 CO -0.08 1.15 -0.18 0.00 -0.67 0.00 0.00 178.83 179.05 2oal h ALA 495 N 0.76 0.22 0.00 3.87 0.00 -1.69 -0.88 119.26 121.54 2oal h ALA 495 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2oal h ALA 495 Cb 1.05 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2oal h ALA 495 CO 0.11 0.13 0.00 0.25 0.00 0.00 0.00 179.25 179.73 2oal n THR 496 N -4.52 0.97 -0.06 0.00 -2.24 -0.49 -1.49 114.28 106.44 2oal n THR 496 Ca -0.06 0.42 -0.22 0.00 -2.27 0.00 0.00 64.05 61.92 2oal n THR 496 Cb 0.39 -1.37 -0.12 0.00 -2.10 0.00 0.00 70.33 67.12 2oal n THR 496 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2oal n GLU 497 N -2.17 0.64 0.00 -0.78 -0.58 -0.97 -4.24 120.64 112.54 2oal n GLU 497 Ca 0.01 0.44 0.12 0.00 -0.42 0.00 0.00 57.16 57.31 2oal n GLU 497 Cb 0.15 -1.72 0.61 0.00 -0.57 0.00 0.00 31.44 29.90 2oal n GLU 497 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2oal n SER 498 N -4.05 0.00 0.22 1.62 3.41 -0.36 -3.13 113.62 111.34 2oal n SER 498 Ca -0.33 0.01 0.12 0.00 -0.26 0.00 0.00 58.87 58.41 2oal n SER 498 Cb 0.84 -0.31 0.29 0.00 -0.26 0.00 0.00 64.21 64.76 2oal n SER 498 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 2oal h VAL 499 N 0.00 0.15 -0.08 -3.33 3.04 -1.44 -3.21 116.25 111.38 2oal h VAL 499 Ca 0.00 -1.05 0.02 0.00 -1.01 0.00 0.00 66.70 64.66 2oal h VAL 499 Cb 0.26 1.93 -0.00 0.00 -2.01 0.00 0.00 31.29 31.46 2oal h VAL 499 CO 0.00 0.08 0.18 -0.78 -1.01 0.00 0.00 177.57 176.04 2oal h ASP 500 N 0.00 0.00 0.18 3.17 3.58 -1.78 0.27 116.42 121.84 2oal h ASP 500 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2oal h ASP 500 Cb 0.92 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.97 2oal h ASP 500 CO 0.01 0.00 -0.66 -1.84 -2.88 0.00 0.00 179.24 173.87 2oal n GLU 501 N -3.35 0.33 0.09 0.28 0.28 -1.21 -2.55 120.64 114.50 2oal n GLU 501 Ca -0.01 -0.24 -0.14 0.00 -0.16 0.00 0.00 57.16 56.61 2oal n GLU 501 Cb 0.26 -1.49 -0.14 0.00 1.43 0.00 0.00 31.44 31.50 2oal n GLU 501 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 2oal h VAL 502 N 0.59 1.47 0.00 3.84 2.07 -0.64 -1.94 116.25 121.66 2oal h VAL 502 Ca 0.00 -3.09 -0.16 0.00 0.82 0.00 0.00 66.70 64.27 2oal h VAL 502 Cb 0.55 2.88 -0.02 0.00 -1.52 0.00 0.00 31.29 33.18 2oal h VAL 502 CO 0.00 0.89 -0.76 -0.26 0.02 0.00 0.00 177.57 177.46 2oal h PHE 503 N 0.06 0.00 -0.25 1.57 0.04 -1.51 -3.02 116.94 113.83 2oal h PHE 503 Ca -0.13 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.47 2oal h PHE 503 Cb 1.94 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 40.08 2oal h PHE 503 CO 0.05 0.76 -0.52 0.78 -0.60 0.00 0.00 178.31 178.78 2oal h GLY 504 N 2.57 0.77 1.17 -1.45 0.00 -1.43 -2.48 103.07 102.22 2oal h GLY 504 Ca -0.01 -0.87 -0.06 0.00 0.00 0.00 0.00 47.33 46.39 2oal h GLY 504 CO 0.10 0.78 0.17 0.00 0.00 0.00 0.00 176.54 177.60 2oal h ALA 505 N 0.87 1.06 -0.24 3.60 0.00 -1.31 -1.40 119.26 121.84 2oal h ALA 505 Ca 0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2oal h ALA 505 Cb 1.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 2oal h ALA 505 CO 0.11 0.63 0.13 0.28 0.00 0.00 0.00 179.25 180.39 2oal h VAL 506 N 0.99 1.11 -0.70 0.00 2.07 -1.41 -0.87 116.25 117.43 2oal h VAL 506 Ca 0.21 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.47 2oal h VAL 506 Cb 0.33 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 2oal h VAL 506 CO -0.00 0.11 0.46 0.11 0.02 0.00 0.00 177.57 178.27 2oal h LYS 507 N 0.28 0.88 -0.37 1.57 1.79 -1.12 0.88 116.57 120.48 2oal h LYS 507 Ca 0.08 -0.05 -0.16 0.00 -2.18 0.00 0.00 60.65 58.34 2oal h LYS 507 Cb 0.05 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.50 2oal h LYS 507 CO -0.01 0.58 -0.40 -0.44 -1.08 0.00 0.00 179.45 178.10 2oal h ASP 508 N 0.91 0.99 -0.40 0.86 3.32 -0.79 -1.25 116.42 120.05 2oal h ASP 508 Ca 0.27 -0.46 -0.12 0.00 0.02 0.00 0.00 57.03 56.74 2oal h ASP 508 Cb -0.04 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.21 2oal h ASP 508 CO -0.07 1.26 -0.18 0.03 -1.72 0.00 0.00 179.24 178.56 2oal h ARG 509 N 0.75 0.89 -0.16 3.56 2.47 -0.58 -0.26 114.38 121.04 2oal h ARG 509 Ca 0.06 -0.35 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 2oal h ARG 509 Cb 1.00 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 29.26 2oal h ARG 509 CO 0.10 1.00 0.10 1.96 0.56 0.00 0.00 179.97 183.69 2oal h GLN 510 N 0.78 0.21 -0.27 0.04 4.20 -0.68 -0.82 115.11 118.57 2oal h GLN 510 Ca 0.11 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 2oal h GLN 510 Cb 0.72 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 2oal h GLN 510 CO 0.06 0.15 -0.04 -0.09 -0.67 0.00 0.00 178.83 178.24 2oal h ARG 511 N 0.21 0.51 -0.41 1.46 2.43 -1.07 -2.24 114.38 115.27 2oal h ARG 511 Ca 0.06 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 58.94 2oal h ARG 511 Cb -0.01 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2oal h ARG 511 CO -0.01 0.70 -0.18 -0.91 -1.51 0.00 0.00 179.97 178.06 2oal h ASN 512 N 0.27 0.86 -0.04 -3.80 2.35 -0.99 -2.53 115.58 111.70 2oal h ASN 512 Ca 0.07 -0.40 -0.12 0.00 -0.55 0.00 0.00 56.30 55.31 2oal h ASN 512 Cb 0.50 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 2oal h ASN 512 CO 0.02 1.06 -0.34 -0.07 -1.65 0.00 0.00 177.43 176.46 2oal h LEU 513 N 0.65 0.54 -1.42 1.61 3.38 -1.21 -1.79 115.31 117.07 2oal h LEU 513 Ca 0.09 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2oal h LEU 513 Cb 0.73 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 2oal h LEU 513 CO 0.06 0.84 -0.19 0.25 0.09 0.00 0.00 178.44 179.49 2oal h LEU 514 N 0.45 0.13 0.00 1.67 5.85 -1.30 -0.80 115.31 121.30 2oal h LEU 514 Ca 0.05 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2oal h LEU 514 Cb 0.80 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.80 2oal h LEU 514 CO 0.07 0.34 -0.86 -0.62 -0.34 0.00 0.00 178.44 177.02 2oal n GLU 515 N -4.25 0.37 -0.00 1.25 1.02 -0.96 -4.50 120.64 113.56 2oal n GLU 515 Ca -0.01 0.06 0.02 0.00 -0.02 0.00 0.00 57.16 57.21 2oal n GLU 515 Cb 0.29 -1.69 -0.03 0.00 -0.02 0.00 0.00 31.44 29.99 2oal n GLU 515 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2oal n THR 516 N -2.20 0.01 -2.63 2.62 -2.24 -0.70 -5.04 114.28 104.10 2oal n THR 516 Ca 0.02 -0.09 -0.38 0.00 -2.27 0.00 0.00 64.05 61.33 2oal n THR 516 Cb 0.47 0.36 -0.05 0.00 -2.10 0.00 0.00 70.33 69.01 2oal n THR 516 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2oal s LEU 517 N -3.31 4.37 0.86 3.22 1.43 -0.32 -5.00 118.68 119.92 2oal s LEU 517 Ca -0.01 2.02 -0.13 0.00 -1.03 0.00 0.00 54.13 54.97 2oal s LEU 517 Cb 0.02 -3.93 0.12 0.00 0.03 0.00 0.00 46.19 42.44 2oal s LEU 517 CO 0.16 -0.19 1.22 -2.16 0.23 0.00 0.00 176.35 175.61 2oal s PRO 518 N -1.94 1.50 0.62 1.29 0.04 -1.26 -4.86 135.00 130.39 2oal s PRO 518 Ca 0.50 -0.04 -0.12 0.00 0.04 0.00 0.00 61.00 61.39 2oal s PRO 518 Cb -0.24 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2oal s PRO 518 CO 0.30 -1.89 1.03 -1.54 0.04 0.00 0.00 177.00 174.94 2oal s SER 519 N -4.64 6.16 0.23 6.66 1.04 -1.26 -1.47 113.70 120.42 2oal s SER 519 Ca 0.66 1.46 -0.07 0.00 0.48 0.00 0.00 55.95 58.48 2oal s SER 519 Cb -0.09 -2.48 0.27 0.00 0.10 0.00 0.00 66.02 63.82 2oal s SER 519 CO 0.50 -0.91 1.86 0.25 0.98 0.00 0.00 173.24 175.92 2oal h LEU 520 N -0.24 0.85 -0.36 2.42 5.85 -1.32 -1.82 115.31 120.68 2oal h LEU 520 Ca -0.44 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.29 2oal h LEU 520 Cb 1.19 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 2oal h LEU 520 CO 0.61 0.57 0.23 -0.74 -0.34 0.00 0.00 178.44 178.77 2oal h HIS 521 N 0.99 0.43 -0.35 1.25 2.76 -1.82 0.47 115.15 118.87 2oal h HIS 521 Ca 0.34 0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.58 2oal h HIS 521 Cb 0.06 -0.14 -0.05 0.00 1.55 0.00 0.00 27.41 28.83 2oal h HIS 521 CO -0.03 0.26 0.04 0.93 -1.30 0.00 0.00 177.93 177.83 2oal h GLU 522 N 0.47 0.15 -0.63 5.26 5.08 -1.76 0.16 114.58 123.30 2oal h GLU 522 Ca 0.14 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2oal h GLU 522 Cb -0.03 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2oal h GLU 522 CO -0.05 0.10 0.22 0.35 -1.00 0.00 0.00 179.01 178.63 2oal h PHE 523 N 0.15 1.00 -0.77 4.33 3.57 -1.01 -2.48 116.94 121.73 2oal h PHE 523 Ca 0.17 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 2oal h PHE 523 Cb 0.21 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 2oal h PHE 523 CO -0.21 0.81 0.35 -0.07 -2.23 0.00 0.00 178.31 176.95 2oal h LEU 524 N 0.90 1.02 0.28 0.59 3.38 -0.15 -2.59 115.31 118.73 2oal h LEU 524 Ca 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2oal h LEU 524 Cb 0.26 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2oal h LEU 524 CO -0.01 0.87 -0.15 0.03 0.09 0.00 0.00 178.44 179.27 2oal h ARG 525 N 1.10 -0.39 0.00 1.13 3.08 -0.38 -2.29 114.38 116.63 2oal h ARG 525 Ca 0.26 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2oal h ARG 525 Cb 0.14 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2oal h ARG 525 CO -0.03 -0.26 0.00 0.00 -1.07 0.00 0.00 179.97 178.61 2oal n GLN 526 N -5.27 0.09 0.00 0.04 10.64 -0.96 -5.12 117.38 116.80 2oal n GLN 526 Ca -0.10 0.51 0.12 0.00 -1.83 0.00 0.00 57.00 55.71 2oal n GLN 526 Cb 0.19 -1.76 0.11 0.00 -0.86 0.00 0.00 30.24 27.92 2oal n GLN 526 CO 0.00 0.00 0.00 0.94 -1.83 0.00 0.00 177.06 176.17