#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oal n GLY 3 N 0.00 2.57 3.73 5.00 0.00 -1.26 -4.74 105.19 110.49 2oal n GLY 3 Ca 0.00 -1.71 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 2oal n GLY 3 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oal s LYS 4 N -4.15 0.87 -0.01 1.61 -2.85 -1.26 -0.34 119.74 113.61 2oal s LYS 4 Ca 0.00 0.47 -0.30 0.00 -1.00 0.00 0.00 55.97 55.14 2oal s LYS 4 Cb 0.00 -1.79 -0.05 0.00 -2.06 0.00 0.00 37.83 33.93 2oal s LYS 4 CO 0.00 -2.42 1.36 0.42 0.10 0.00 0.00 175.35 174.81 2oal s ILE 5 N -3.09 3.80 -0.22 3.79 -1.09 -1.26 -4.50 121.20 118.64 2oal s ILE 5 Ca 0.64 1.18 0.06 0.00 -2.23 0.00 0.00 60.65 60.31 2oal s ILE 5 Cb -0.17 -3.76 -0.18 0.00 -1.58 0.00 0.00 42.46 36.78 2oal s ILE 5 CO 0.56 -0.00 -0.12 0.47 -1.23 0.00 0.00 174.94 174.61 2oal n ASP 6 N 5.32 1.62 -4.13 3.58 8.00 -1.26 -4.66 116.55 125.02 2oal n ASP 6 Ca 0.13 -0.09 -0.25 0.00 0.71 0.00 0.00 54.79 55.29 2oal n ASP 6 Cb 0.44 0.05 -0.16 0.00 -0.02 0.00 0.00 41.12 41.43 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 -2.46 1.63 -0.06 -1.24 1.02 -1.26 -0.14 119.74 117.22 2oal s LYS 7 Ca -0.25 -0.58 0.04 0.00 0.02 0.00 0.00 55.97 55.20 2oal s LYS 7 Cb 0.07 -1.45 0.00 0.00 -0.52 0.00 0.00 37.83 35.93 2oal s LYS 7 CO 0.61 0.26 -0.18 0.42 -0.92 0.00 0.00 175.35 175.54 2oal s ILE 8 N -0.04 1.53 -0.18 2.17 1.01 0.04 -0.48 121.20 125.24 2oal s ILE 8 Ca -0.01 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.90 2oal s ILE 8 Cb -0.10 -1.33 0.02 0.00 0.01 0.00 0.00 42.46 41.06 2oal s ILE 8 CO 0.01 0.44 -0.18 -0.22 0.00 0.00 0.00 174.94 174.99 2oal s LEU 9 N 0.24 2.22 -0.24 2.97 2.96 -0.76 -1.33 118.68 124.73 2oal s LEU 9 Ca -0.09 -0.62 -0.11 0.00 -0.22 0.00 0.00 54.13 53.08 2oal s LEU 9 Cb -0.14 -1.51 -0.05 0.00 0.50 0.00 0.00 46.19 44.99 2oal s LEU 9 CO 0.04 0.00 0.20 -0.63 -1.32 0.00 0.00 176.35 174.64 2oal s ILE 10 N 1.29 5.33 -0.35 6.68 1.01 0.53 -0.88 121.20 134.80 2oal s ILE 10 Ca 0.04 0.25 -0.10 0.00 0.00 0.00 0.00 60.65 60.85 2oal s ILE 10 Cb -0.13 -3.54 0.02 0.00 0.01 0.00 0.00 42.46 38.82 2oal s ILE 10 CO -0.11 0.31 0.17 -0.69 0.00 0.00 0.00 174.94 174.62 2oal s VAL 11 N 1.23 4.46 0.00 2.92 1.01 0.01 -0.36 120.40 129.67 2oal s VAL 11 Ca 0.09 -0.75 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2oal s VAL 11 Cb -0.14 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.82 2oal s VAL 11 CO 0.06 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.65 2oal n GLY 12 N 4.96 4.02 1.08 4.51 0.00 0.40 0.15 105.19 120.30 2oal n GLY 12 Ca -0.13 -1.19 -0.04 0.00 0.00 0.00 0.00 46.02 44.67 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 5.48 0.00 -0.02 0.00 -1.26 -4.18 105.19 105.21 2oal n GLY 13 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.34 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 -1.01 0.73 0.25 -0.02 0.00 -1.26 -4.66 105.19 99.22 2oal n GLY 14 Ca 0.28 -1.66 -0.07 0.00 0.00 0.00 0.00 46.02 44.57 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 1.21 0.10 2.61 2.02 -1.95 -2.44 112.91 114.47 2oal h THR 15 Ca 0.00 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.54 2oal h THR 15 Cb 0.00 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 2oal h THR 15 CO 0.00 0.25 -0.05 0.00 0.37 0.00 0.00 175.52 176.09 2oal h ALA 16 N 1.09 -0.14 -0.35 6.16 0.00 -1.92 -1.78 119.26 122.32 2oal h ALA 16 Ca 0.19 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.07 2oal h ALA 16 Cb 0.16 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2oal h ALA 16 CO -0.02 -0.51 -0.04 0.78 0.00 0.00 0.00 179.25 179.47 2oal h GLY 17 N -0.28 0.31 2.00 0.00 0.00 -1.71 0.09 103.07 103.47 2oal h GLY 17 Ca -0.01 0.07 -0.07 0.00 0.00 0.00 0.00 47.33 47.32 2oal h GLY 17 CO 0.02 -0.10 -0.32 1.49 0.00 0.00 0.00 176.54 177.63 2oal h TRP 18 N 0.06 0.00 -0.09 5.60 4.06 -1.42 -0.62 115.95 123.53 2oal h TRP 18 Ca 0.17 0.00 -0.20 0.00 2.06 0.00 0.00 58.89 60.92 2oal h TRP 18 Cb 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.40 2oal h TRP 18 CO -0.27 0.32 -0.77 0.52 -3.56 0.00 0.00 178.44 174.68 2oal h MET 19 N 0.00 0.52 -0.31 0.49 2.86 -0.84 -1.87 114.93 115.78 2oal h MET 19 Ca -0.00 -0.44 -0.06 0.00 -2.06 0.00 0.00 59.70 57.14 2oal h MET 19 Cb 0.85 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 2oal h MET 19 CO 0.04 1.07 -0.02 0.00 1.06 0.00 0.00 176.91 179.06 2oal h ALA 20 N 0.80 0.42 -0.88 6.32 0.00 -0.58 0.40 119.26 125.73 2oal h ALA 20 Ca -0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2oal h ALA 20 Cb 1.37 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 2oal h ALA 20 CO 0.14 0.20 0.47 0.00 0.00 0.00 0.00 179.25 180.06 2oal h ALA 21 N 0.83 1.13 0.08 0.00 0.00 -1.10 0.05 119.26 120.25 2oal h ALA 21 Ca 0.09 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2oal h ALA 21 Cb 0.48 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2oal h ALA 21 CO 0.02 0.66 -0.04 0.77 0.00 0.00 0.00 179.25 180.66 2oal h SER 22 N 1.24 -0.10 -0.22 0.00 0.02 -1.18 0.44 113.55 113.75 2oal h SER 22 Ca 0.31 -0.42 -0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2oal h SER 22 Cb 0.06 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2oal h SER 22 CO -0.05 0.39 0.12 0.22 -1.14 0.00 0.00 176.83 176.38 2oal h TYR 23 N -0.62 0.30 -0.37 3.45 5.03 -0.85 -0.47 116.97 123.44 2oal h TYR 23 Ca -0.01 -0.01 -0.16 0.00 2.58 0.00 0.00 58.73 61.13 2oal h TYR 23 Cb 0.51 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.69 2oal h TYR 23 CO 0.08 0.26 -0.38 -0.07 -1.32 0.00 0.00 178.16 176.73 2oal h LEU 24 N 0.25 0.98 -1.50 2.82 3.38 -1.08 -0.51 115.31 119.65 2oal h LEU 24 Ca 0.08 -0.47 0.02 0.00 0.09 0.00 0.00 57.88 57.59 2oal h LEU 24 Cb 0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2oal h LEU 24 CO -0.01 1.25 0.35 1.23 0.09 0.00 0.00 178.44 181.35 2oal h GLY 25 N 0.73 0.72 0.20 0.83 0.00 -0.74 0.35 103.07 105.15 2oal h GLY 25 Ca 0.06 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 2oal h GLY 25 CO 0.09 0.25 -0.05 1.70 0.00 0.00 0.00 176.54 178.53 2oal h LYS 26 N 0.67 0.03 -0.02 4.80 1.63 -0.88 -2.39 116.57 120.42 2oal h LYS 26 Ca 0.20 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.92 2oal h LYS 26 Cb -0.01 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 2oal h LYS 26 CO -0.05 0.88 -0.22 0.00 -3.45 0.00 0.00 179.45 176.61 2oal h ALA 27 N 0.16 1.60 -0.25 5.00 0.00 -0.89 -2.94 119.26 121.94 2oal h ALA 27 Ca -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2oal h ALA 27 Cb 0.90 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2oal h ALA 27 CO 0.01 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.84 2oal n LEU 28 N -4.26 3.35 -3.02 0.00 4.77 0.09 -5.04 117.00 112.88 2oal n LEU 28 Ca -0.02 -2.67 -0.43 0.00 -0.03 0.00 0.00 56.01 52.86 2oal n LEU 28 Cb 0.29 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 40.88 2oal n LEU 28 CO 0.37 0.68 1.15 1.67 -1.33 0.00 0.00 177.39 179.94 2oal n GLN 29 N -0.30 0.00 -1.02 3.23 -0.06 -0.90 -0.45 117.38 117.88 2oal n GLN 29 Ca 0.17 0.00 -0.01 0.00 -2.00 0.00 0.00 57.00 55.16 2oal n GLN 29 Cb 0.69 -1.05 -0.00 0.00 -4.06 0.00 0.00 30.24 25.82 2oal n GLN 29 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2oal n GLY 30 N 4.90 0.46 0.00 1.69 0.00 -1.26 -4.86 105.19 106.12 2oal n GLY 30 Ca 0.36 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -2.85 0.43 -3.64 2.61 -2.24 0.40 -5.04 114.28 103.95 2oal n THR 31 Ca -0.01 -0.50 -0.12 0.00 -2.27 0.00 0.00 64.05 61.15 2oal n THR 31 Cb 0.09 0.88 -0.07 0.00 -2.10 0.00 0.00 70.33 69.13 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 -0.43 -1.70 -0.23 6.98 0.00 -1.23 -4.70 121.76 120.44 2oal s ALA 32 Ca 0.00 2.01 -0.17 0.00 0.00 0.00 0.00 51.96 53.79 2oal s ALA 32 Cb 0.00 -1.17 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 2oal s ALA 32 CO 0.00 -0.33 0.48 -0.51 0.00 0.00 0.00 175.76 175.40 2oal s ASP 33 N 0.65 6.45 -0.12 0.00 1.01 0.80 -4.94 116.67 120.53 2oal s ASP 33 Ca -0.02 0.54 -0.00 0.00 0.71 0.00 0.00 52.55 53.78 2oal s ASP 33 Cb -0.05 -2.27 -0.02 0.00 1.01 0.00 0.00 42.92 41.59 2oal s ASP 33 CO -0.04 -0.20 -0.11 -0.63 0.21 0.00 0.00 175.17 174.40 2oal s ILE 34 N 1.89 3.29 -0.06 0.77 1.01 -1.26 -0.78 121.20 126.06 2oal s ILE 34 Ca 0.21 -0.59 0.03 0.00 0.00 0.00 0.00 60.65 60.30 2oal s ILE 34 Cb -0.15 -2.38 0.00 0.00 0.01 0.00 0.00 42.46 39.95 2oal s ILE 34 CO 0.09 0.54 -0.16 -0.89 0.00 0.00 0.00 174.94 174.52 2oal s THR 35 N 0.07 1.37 -0.18 2.92 2.01 -0.44 -1.27 115.64 120.12 2oal s THR 35 Ca -0.04 -0.65 -0.03 0.00 0.31 0.00 0.00 61.69 61.29 2oal s THR 35 Cb -0.14 -1.21 -0.02 0.00 0.01 0.00 0.00 72.50 71.14 2oal s THR 35 CO 0.04 0.40 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.09 2oal s LEU 36 N 0.36 2.99 -0.19 4.42 0.20 0.76 -0.35 118.68 126.86 2oal s LEU 36 Ca -0.11 -0.28 -0.03 0.00 0.69 0.00 0.00 54.13 54.41 2oal s LEU 36 Cb -0.14 -1.73 -0.01 0.00 -0.43 0.00 0.00 46.19 43.88 2oal s LEU 36 CO 0.04 0.09 -0.07 -0.22 -0.29 0.00 0.00 176.35 175.90 2oal s LEU 37 N 0.80 2.87 -0.06 -0.68 0.20 0.51 -0.73 118.68 121.59 2oal s LEU 37 Ca -0.02 -0.35 -0.05 0.00 0.69 0.00 0.00 54.13 54.40 2oal s LEU 37 Cb -0.15 -1.70 0.02 0.00 -0.43 0.00 0.00 46.19 43.93 2oal s LEU 37 CO 0.02 0.05 0.14 0.00 -0.29 0.00 0.00 176.35 176.27 2oal s GLN 38 N 1.07 0.15 -0.25 1.98 -2.07 -0.42 -0.46 119.66 119.67 2oal s GLN 38 Ca 0.01 0.22 -0.21 0.00 -1.82 0.00 0.00 55.36 53.56 2oal s GLN 38 Cb -0.15 0.04 -0.02 0.00 -1.09 0.00 0.00 33.01 31.80 2oal s GLN 38 CO -0.01 -0.04 0.65 0.00 -1.32 0.00 0.00 175.29 174.57 2oal s ALA 39 N 0.25 3.61 -0.14 2.60 0.00 -1.11 -1.88 121.76 125.09 2oal s ALA 39 Ca -0.01 -0.40 -0.29 0.00 0.00 0.00 0.00 51.96 51.26 2oal s ALA 39 Cb -0.03 -3.05 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 2oal s ALA 39 CO -0.01 -0.80 1.46 -2.14 0.00 0.00 0.00 175.76 174.28 2oal s PRO 40 N 2.48 4.13 0.25 0.00 0.02 -1.26 -4.96 135.00 135.66 2oal s PRO 40 Ca 0.27 1.84 0.05 0.00 0.02 0.00 0.00 61.00 63.18 2oal s PRO 40 Cb -0.15 -3.89 -0.02 0.00 0.02 0.00 0.00 34.50 30.45 2oal s PRO 40 CO 0.08 -0.87 0.19 -0.40 -0.33 0.00 0.00 177.00 175.68 2oal n ASP 41 N 7.13 -0.26 -4.47 2.53 5.68 -1.26 -5.09 116.55 120.81 2oal n ASP 41 Ca 0.16 -2.59 -0.49 0.00 -0.50 0.00 0.00 54.79 51.37 2oal n ASP 41 Cb 0.44 1.14 -0.07 0.00 -1.14 0.00 0.00 41.12 41.50 2oal n ASP 41 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 2oal n ILE 42 N -0.49 0.19 -1.46 2.12 5.41 -1.26 -4.95 119.36 118.92 2oal n ILE 42 Ca 0.04 -0.30 -0.31 0.00 1.00 0.00 0.00 62.75 63.19 2oal n ILE 42 Cb 0.44 -1.77 0.08 0.00 -0.71 0.00 0.00 39.64 37.67 2oal n ILE 42 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2oal s PRO 43 N 6.35 2.42 0.48 0.38 0.02 -1.26 -5.07 135.00 138.32 2oal s PRO 43 Ca 1.09 0.92 0.05 0.00 0.02 0.00 0.00 61.00 63.08 2oal s PRO 43 Cb -0.78 -1.93 -0.01 0.00 0.02 0.00 0.00 34.50 31.80 2oal s PRO 43 CO 0.47 -1.46 0.24 0.95 -0.33 0.00 0.00 177.00 176.87 2oal s THR 44 N -3.03 1.84 0.31 0.99 -4.23 -1.26 -5.11 115.64 105.16 2oal s THR 44 Ca 0.60 -1.66 -0.29 0.00 -1.18 0.00 0.00 61.69 59.16 2oal s THR 44 Cb -0.15 -2.51 -0.10 0.00 1.34 0.00 0.00 72.50 71.09 2oal s THR 44 CO 0.55 0.00 1.14 -0.76 -0.54 0.00 0.00 174.62 175.01 2oal s LEU 45 N -4.05 4.47 -1.14 4.79 1.43 -1.26 -4.93 118.68 117.99 2oal s LEU 45 Ca 0.32 2.34 -0.21 0.00 -1.03 0.00 0.00 54.13 55.54 2oal s LEU 45 Cb 0.01 -3.70 0.01 0.00 0.03 0.00 0.00 46.19 42.53 2oal s LEU 45 CO 0.18 -0.28 1.75 -0.83 0.23 0.00 0.00 176.35 177.40 2oal s GLY 46 N -0.88 0.96 0.00 -3.19 0.00 -1.26 -4.77 107.32 98.18 2oal s GLY 46 Ca 0.47 -2.35 0.11 0.00 0.00 0.00 0.00 44.72 42.96 2oal s GLY 46 CO 0.42 3.04 1.27 3.33 0.00 0.00 0.00 173.10 181.16 2oal n VAL 47 N 7.10 0.00 0.00 1.40 0.24 -1.26 -4.68 118.33 121.13 2oal n VAL 47 Ca 0.43 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.73 2oal n VAL 47 Cb 0.47 -0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.50 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 0.41 -2.01 3.02 7.63 0.00 -1.26 -3.38 105.19 109.60 2oal n GLY 48 Ca 0.09 -1.31 -0.22 0.00 0.00 0.00 0.00 46.02 44.58 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 -4.84 1.14 0.04 1.61 0.41 0.34 -4.88 118.70 112.51 2oal s GLU 49 Ca 0.00 -0.35 0.02 0.00 -0.41 0.00 0.00 54.97 54.23 2oal s GLU 49 Cb 0.00 -1.04 -0.04 0.00 -1.78 0.00 0.00 34.13 31.28 2oal s GLU 49 CO 0.00 0.12 0.04 0.00 -0.49 0.00 0.00 175.26 174.92 2oal s ALA 50 N 0.24 3.42 0.08 5.21 0.00 -1.26 -2.01 121.76 127.45 2oal s ALA 50 Ca -0.05 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.94 2oal s ALA 50 Cb -0.10 -1.38 -0.00 0.00 0.00 0.00 0.00 23.12 21.63 2oal s ALA 50 CO 0.01 0.70 0.04 0.25 0.00 0.00 0.00 175.76 176.76 2oal n THR 51 N 0.92 0.00 -4.34 0.00 -2.24 -0.67 -4.70 114.28 103.25 2oal n THR 51 Ca -0.12 -0.53 -0.20 0.00 -2.27 0.00 0.00 64.05 60.94 2oal n THR 51 Cb 0.52 0.21 -0.10 0.00 -2.10 0.00 0.00 70.33 68.86 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 -2.00 1.77 0.31 2.28 -4.36 -1.26 -4.40 121.20 113.54 2oal s ILE 52 Ca 0.06 -2.11 0.06 0.00 -0.26 0.00 0.00 60.65 58.40 2oal s ILE 52 Cb 0.00 -1.97 0.36 0.00 1.25 0.00 0.00 42.46 42.10 2oal s ILE 52 CO 0.04 -0.50 1.61 -0.65 0.24 0.00 0.00 174.94 175.68 2oal h PRO 53 N 2.80 0.10 0.00 0.37 0.11 -1.95 -2.24 132.00 131.20 2oal h PRO 53 Ca -0.39 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2oal h PRO 53 Cb 1.22 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2oal h PRO 53 CO 0.58 0.07 0.00 0.27 -0.21 0.00 0.00 178.00 178.71 2oal n ASN 54 N -5.32 0.00 -0.13 -2.05 0.23 -1.26 -2.62 115.26 104.10 2oal n ASN 54 Ca 0.25 -0.75 -0.08 0.00 -0.53 0.00 0.00 54.58 53.47 2oal n ASN 54 Cb 0.83 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.59 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 0.90 0.01 -4.53 5.85 -1.78 0.11 115.31 115.86 2oal h LEU 55 Ca 0.00 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.40 2oal h LEU 55 Cb 0.00 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.79 2oal h LEU 55 CO 0.00 1.04 -0.10 -0.61 -0.34 0.00 0.00 178.44 178.43 2oal h GLN 56 N 0.80 0.05 -0.28 1.25 5.75 -1.76 -1.86 115.11 119.06 2oal h GLN 56 Ca 0.12 -0.07 -0.17 0.00 -0.15 0.00 0.00 58.65 58.38 2oal h GLN 56 Cb 0.67 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.24 2oal h GLN 56 CO 0.05 0.92 -0.51 1.79 -2.65 0.00 0.00 178.83 178.43 2oal h THR 57 N -0.79 1.29 0.00 2.39 1.35 -1.70 0.57 112.91 116.02 2oal h THR 57 Ca -0.01 -1.71 -0.27 0.00 -0.55 0.00 0.00 66.41 63.87 2oal h THR 57 Cb 0.96 1.61 -0.04 0.00 -1.73 0.00 0.00 68.15 68.95 2oal h THR 57 CO 0.02 0.55 -1.51 0.00 -0.25 0.00 0.00 175.52 174.33 2oal h ALA 58 N 0.80 0.66 -0.36 6.62 0.00 -0.95 -3.39 119.26 122.65 2oal h ALA 58 Ca 0.02 -1.31 0.00 0.00 0.00 0.00 0.00 54.91 53.62 2oal h ALA 58 Cb 1.09 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.19 2oal h ALA 58 CO 0.11 1.50 0.00 0.34 0.00 0.00 0.00 179.25 181.20 2oal n PHE 59 N -3.13 0.00 -0.12 0.00 7.35 -0.84 -4.47 117.46 116.24 2oal n PHE 59 Ca -0.12 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.60 2oal n PHE 59 Cb 1.02 0.00 0.33 0.00 0.35 0.00 0.00 39.48 41.18 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 0.75 -0.04 -5.13 0.04 -1.27 -1.74 116.94 109.55 2oal h PHE 60 Ca 0.00 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.68 2oal h PHE 60 Cb 0.00 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 37.89 2oal h PHE 60 CO 0.00 0.46 -0.45 -0.44 -0.60 0.00 0.00 178.31 177.28 2oal h ASP 61 N 0.79 0.11 -0.07 2.17 3.32 -0.05 -0.35 116.42 122.35 2oal h ASP 61 Ca 0.23 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.14 2oal h ASP 61 Cb -0.04 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 2oal h ASP 61 CO -0.05 0.55 -0.22 0.15 -1.72 0.00 0.00 179.24 177.94 2oal h PHE 62 N 0.08 0.53 0.00 4.55 3.57 -1.52 -2.33 116.94 121.82 2oal h PHE 62 Ca 0.00 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.40 2oal h PHE 62 Cb 0.83 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.44 2oal h PHE 62 CO 0.01 0.67 -0.15 -0.07 -2.23 0.00 0.00 178.31 176.53 2oal h LEU 63 N 0.43 0.00 -0.14 0.59 3.38 -0.98 -3.48 115.31 115.10 2oal h LEU 63 Ca 0.07 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2oal h LEU 63 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2oal h LEU 63 CO 0.04 0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.20 2oal n GLY 64 N 1.29 0.68 3.24 0.83 0.00 -0.52 -5.05 105.19 105.66 2oal n GLY 64 Ca 0.05 -0.72 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.14 3.51 0.60 -0.61 1.01 -0.26 -5.02 121.20 118.29 2oal s ILE 65 Ca 0.00 -1.19 -0.20 0.00 0.00 0.00 0.00 60.65 59.27 2oal s ILE 65 Cb 0.00 -2.98 -0.03 0.00 0.01 0.00 0.00 42.46 39.46 2oal s ILE 65 CO 0.00 -0.13 1.32 -2.16 0.00 0.00 0.00 174.94 173.97 2oal s PRO 66 N 1.36 2.81 0.23 2.79 0.04 -1.26 -4.38 135.00 136.58 2oal s PRO 66 Ca -0.03 2.14 -0.07 0.00 0.04 0.00 0.00 61.00 63.08 2oal s PRO 66 Cb -0.19 -2.02 0.37 0.00 0.04 0.00 0.00 34.50 32.69 2oal s PRO 66 CO 0.01 -1.42 1.71 1.49 0.04 0.00 0.00 177.00 178.84 2oal h GLU 67 N 0.94 0.31 -0.72 4.56 4.81 -1.97 -1.64 114.58 120.88 2oal h GLU 67 Ca -0.51 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 58.71 2oal h GLU 67 Cb 1.32 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.59 2oal h GLU 67 CO 0.55 0.21 0.48 -0.44 -0.73 0.00 0.00 179.01 179.07 2oal h ASP 68 N 0.32 0.82 0.22 1.04 3.32 -1.99 -2.17 116.42 117.98 2oal h ASP 68 Ca 0.36 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.38 2oal h ASP 68 Cb 0.54 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2oal h ASP 68 CO -0.41 0.59 -0.11 -0.08 -1.72 0.00 0.00 179.24 177.51 2oal h GLU 69 N 0.97 -0.29 -0.01 3.56 4.81 -1.66 -3.03 114.58 118.94 2oal h GLU 69 Ca 0.27 0.02 -0.25 0.00 -0.13 0.00 0.00 59.36 59.26 2oal h GLU 69 Cb -0.10 0.06 0.02 0.00 0.63 0.00 0.00 28.75 29.36 2oal h GLU 69 CO -0.06 -0.03 -1.00 0.11 -0.73 0.00 0.00 179.01 177.30 2oal h TRP 70 N -0.51 0.94 0.00 0.92 5.08 -1.47 -3.14 115.95 117.76 2oal h TRP 70 Ca -0.03 -0.50 -0.06 0.00 1.08 0.00 0.00 58.89 59.38 2oal h TRP 70 Cb 0.38 -0.11 -0.01 0.00 -3.00 0.00 0.00 29.16 26.43 2oal h TRP 70 CO -0.00 1.34 -0.28 0.00 -1.28 0.00 0.00 178.44 178.22 2oal h MET 71 N 0.37 0.00 0.00 0.12 -0.00 -1.51 -0.78 114.93 113.13 2oal h MET 71 Ca -0.11 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.37 2oal h MET 71 Cb 1.64 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 33.24 2oal h MET 71 CO 0.19 0.28 -0.92 0.00 -0.00 0.00 0.00 176.91 176.46 2oal h ARG 72 N 0.00 0.34 0.00 -0.10 3.08 -1.62 -0.37 114.38 115.71 2oal h ARG 72 Ca -0.00 -0.37 0.00 0.00 0.07 0.00 0.00 59.98 59.68 2oal h ARG 72 Cb 0.79 0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.95 2oal h ARG 72 CO 0.04 1.06 0.00 1.49 -1.07 0.00 0.00 179.97 181.48 2oal h GLU 73 N 0.19 0.00 -0.27 0.04 4.81 -1.44 -3.14 114.58 114.77 2oal h GLU 73 Ca -0.07 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2oal h GLU 73 Cb 1.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.93 2oal h GLU 73 CO 0.15 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.43 2oal n ASN 75 N -0.25 -0.09 -4.89 0.00 3.02 -0.69 -4.37 115.26 107.98 2oal n ASN 75 Ca 0.18 -1.20 -0.29 0.00 -0.03 0.00 0.00 54.58 53.24 2oal n ASN 75 Cb 0.75 -1.48 -0.02 0.00 -0.61 0.00 0.00 39.78 38.42 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 -4.16 3.41 0.51 5.41 0.00 -0.23 -4.32 121.76 122.39 2oal s ALA 76 Ca 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 51.96 51.66 2oal s ALA 76 Cb -0.05 -2.59 0.00 0.00 0.00 0.00 0.00 23.12 20.48 2oal s ALA 76 CO 0.93 -0.14 0.01 0.45 0.00 0.00 0.00 175.76 177.01 2oal n SER 77 N -1.72 3.39 -4.77 0.00 2.88 0.07 -4.88 113.62 108.60 2oal n SER 77 Ca 0.01 -3.22 -0.34 0.00 -1.33 0.00 0.00 58.87 53.99 2oal n SER 77 Cb 0.55 0.34 -0.07 0.00 -0.75 0.00 0.00 64.21 64.28 2oal n SER 77 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2oal s TYR 78 N -2.83 3.28 -0.14 0.66 1.51 -1.26 -1.83 117.35 116.74 2oal s TYR 78 Ca 0.01 0.22 0.01 0.00 -1.01 0.00 0.00 57.07 56.30 2oal s TYR 78 Cb -0.00 -1.76 0.02 0.00 -0.11 0.00 0.00 41.96 40.11 2oal s TYR 78 CO 0.01 0.55 -0.15 0.21 -1.11 0.00 0.00 175.55 175.06 2oal s LYS 79 N -1.54 2.30 -0.02 -0.62 2.20 -0.24 -3.97 119.74 117.86 2oal s LYS 79 Ca 0.21 -0.57 0.16 0.00 -0.36 0.00 0.00 55.97 55.40 2oal s LYS 79 Cb -0.12 -2.05 -0.23 0.00 -1.51 0.00 0.00 37.83 33.92 2oal s LYS 79 CO 0.11 -0.18 0.40 0.28 -0.36 0.00 0.00 175.35 175.61 2oal n VAL 80 N 4.57 0.00 -3.94 4.02 0.31 0.16 0.12 118.33 123.57 2oal n VAL 80 Ca -0.18 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 63.84 2oal n VAL 80 Cb 0.50 0.31 0.02 0.00 -0.91 0.00 0.00 33.84 33.76 2oal n VAL 80 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2oal n ALA 81 N -1.91 -2.99 -3.45 3.52 0.00 -1.25 -2.78 120.51 111.64 2oal n ALA 81 Ca -0.02 -0.86 -0.33 0.00 0.00 0.00 0.00 53.44 52.24 2oal n ALA 81 Cb 0.38 0.33 -0.15 0.00 0.00 0.00 0.00 19.45 20.00 2oal n ALA 81 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2oal s ILE 82 N -2.05 2.57 -0.37 0.00 1.01 -0.85 -1.22 121.20 120.29 2oal s ILE 82 Ca 0.25 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.97 2oal s ILE 82 Cb -0.02 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.39 2oal s ILE 82 CO 0.02 0.52 0.23 -0.75 0.00 0.00 0.00 174.94 174.96 2oal s LYS 83 N 0.76 3.07 -0.25 2.79 2.20 0.74 -1.87 119.74 127.18 2oal s LYS 83 Ca -0.07 -0.92 -0.23 0.00 -0.36 0.00 0.00 55.97 54.39 2oal s LYS 83 Cb -0.16 -3.78 -0.01 0.00 -1.51 0.00 0.00 37.83 32.38 2oal s LYS 83 CO 0.01 -0.62 0.78 -0.06 -0.36 0.00 0.00 175.35 175.10 2oal s PHE 84 N 1.63 3.30 -0.12 4.03 0.40 -0.34 -1.17 117.98 125.70 2oal s PHE 84 Ca 0.04 1.04 0.01 0.00 -0.60 0.00 0.00 56.93 57.42 2oal s PHE 84 Cb -0.18 -3.01 -0.01 0.00 0.51 0.00 0.00 43.02 40.33 2oal s PHE 84 CO 0.08 -0.39 -0.16 0.42 0.70 0.00 0.00 175.22 175.87 2oal s ILE 85 N 2.77 2.75 -1.49 0.64 1.01 -0.37 -2.09 121.20 124.41 2oal s ILE 85 Ca 0.33 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 60.20 2oal s ILE 85 Cb -0.15 -2.13 0.00 0.00 0.01 0.00 0.00 42.46 40.19 2oal s ILE 85 CO 0.08 0.53 0.11 0.59 0.00 0.00 0.00 174.94 176.25 2oal n ASN 86 N 3.57 -5.28 -0.07 3.58 3.02 -0.28 -0.76 115.26 119.03 2oal n ASN 86 Ca -0.18 -0.06 0.13 0.00 -0.03 0.00 0.00 54.58 54.44 2oal n ASN 86 Cb 0.53 -4.31 0.48 0.00 -0.61 0.00 0.00 39.78 35.87 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 -4.08 0.00 0.28 3.10 7.02 -1.26 -3.81 117.44 118.68 2oal n TRP 87 Ca -0.19 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 56.32 2oal n TRP 87 Cb 0.65 -0.26 0.02 0.00 -2.42 0.00 0.00 31.31 29.30 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 -1.19 0.89 -4.66 -0.99 1.74 -1.26 -4.20 116.66 107.00 2oal n ARG 88 Ca 0.10 -0.73 -0.24 0.00 -0.77 0.00 0.00 57.85 56.21 2oal n ARG 88 Cb 0.32 -1.06 -0.14 0.00 -1.02 0.00 0.00 32.46 30.55 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 -0.74 1.44 0.80 0.55 -4.23 -1.25 -4.65 115.64 107.57 2oal s THR 89 Ca 0.07 -0.99 -0.11 0.00 -1.18 0.00 0.00 61.69 59.49 2oal s THR 89 Cb 0.05 -1.24 0.07 0.00 1.34 0.00 0.00 72.50 72.72 2oal s THR 89 CO 0.11 0.24 1.10 0.00 -0.54 0.00 0.00 174.62 175.53 2oal s ALA 90 N -0.66 2.10 0.00 3.99 0.00 -1.26 -4.97 121.76 120.96 2oal s ALA 90 Ca 0.06 0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.30 2oal s ALA 90 Cb -0.08 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.75 2oal s ALA 90 CO 0.01 -1.94 0.00 0.41 0.00 0.00 0.00 175.76 174.24 2oal n GLY 91 N -1.03 1.40 3.93 0.00 0.00 -1.26 -5.08 105.19 103.15 2oal n GLY 91 Ca 0.09 -1.94 -0.29 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.18 1.05 -0.48 1.61 0.41 -1.26 -4.64 118.70 114.21 2oal s GLU 92 Ca 0.00 -0.35 -0.26 0.00 -0.41 0.00 0.00 54.97 53.95 2oal s GLU 92 Cb 0.00 -1.91 0.03 0.00 -1.78 0.00 0.00 34.13 30.46 2oal s GLU 92 CO 0.00 -2.13 0.98 0.20 -0.49 0.00 0.00 175.26 173.82 2oal s GLY 93 N -4.80 1.41 0.06 -1.39 0.00 -1.26 -4.84 107.32 96.50 2oal s GLY 93 Ca 0.70 -0.78 0.04 0.00 0.00 0.00 0.00 44.72 44.69 2oal s GLY 93 CO 0.51 2.14 -0.11 -1.08 0.00 0.00 0.00 173.10 174.56 2oal s THR 94 N 3.98 0.87 -1.14 0.90 -1.32 -1.26 -4.54 115.64 113.12 2oal s THR 94 Ca 0.39 -1.20 0.23 0.00 -1.21 0.00 0.00 61.69 59.90 2oal s THR 94 Cb -0.10 -0.87 0.27 0.00 -1.51 0.00 0.00 72.50 70.29 2oal s THR 94 CO 0.27 -0.29 1.76 -1.54 -2.21 0.00 0.00 174.62 172.61 2oal n SER 95 N 1.37 0.00 -4.64 8.08 3.41 -1.26 -4.74 113.62 115.84 2oal n SER 95 Ca -0.22 0.31 -0.35 0.00 -0.26 0.00 0.00 58.87 58.36 2oal n SER 95 Cb 0.54 -0.43 -0.10 0.00 -0.26 0.00 0.00 64.21 63.97 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 -2.86 3.99 0.20 4.33 2.02 -1.26 -5.07 118.70 120.06 2oal s GLU 96 Ca 0.15 -0.33 -0.31 0.00 0.02 0.00 0.00 54.97 54.50 2oal s GLU 96 Cb 0.15 -3.24 -0.10 0.00 0.10 0.00 0.00 34.13 31.05 2oal s GLU 96 CO 0.40 0.27 1.54 0.00 0.02 0.00 0.00 175.26 177.49 2oal s ALA 97 N 0.38 3.73 0.78 5.21 0.00 -1.26 -4.96 121.76 125.65 2oal s ALA 97 Ca 0.04 1.38 -0.12 0.00 0.00 0.00 0.00 51.96 53.26 2oal s ALA 97 Cb -0.12 -3.61 0.06 0.00 0.00 0.00 0.00 23.12 19.45 2oal s ALA 97 CO 0.00 -0.79 1.15 1.03 0.00 0.00 0.00 175.76 177.15 2oal s ARG 98 N 0.53 2.21 0.04 0.00 0.52 -1.26 -4.62 118.95 116.38 2oal s ARG 98 Ca 0.66 0.24 -0.21 0.00 -0.52 0.00 0.00 55.73 55.90 2oal s ARG 98 Cb -0.44 -1.97 -0.06 0.00 0.52 0.00 0.00 34.95 33.01 2oal s ARG 98 CO 0.36 -1.45 0.62 -1.21 0.02 0.00 0.00 175.30 173.64 2oal s GLU 99 N -5.49 4.31 -0.06 3.54 0.41 -1.26 0.10 118.70 120.25 2oal s GLU 99 Ca 0.61 0.80 -0.03 0.00 -0.41 0.00 0.00 54.97 55.94 2oal s GLU 99 Cb -0.11 -3.30 0.04 0.00 -1.78 0.00 0.00 34.13 28.97 2oal s GLU 99 CO 0.50 0.47 0.14 -1.17 -0.49 0.00 0.00 175.26 174.71 2oal s LEU 100 N -0.56 0.73 -1.63 1.80 2.96 0.47 -4.82 118.68 117.62 2oal s LEU 100 Ca 0.31 0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 54.44 2oal s LEU 100 Cb -0.19 0.36 0.08 0.00 0.50 0.00 0.00 46.19 46.93 2oal s LEU 100 CO 0.19 -0.15 0.20 0.47 -1.32 0.00 0.00 176.35 175.74 2oal n ASP 101 N 4.20 0.03 0.00 3.68 8.00 -1.26 -0.57 116.55 130.63 2oal n ASP 101 Ca -0.26 -1.25 0.00 0.00 0.71 0.00 0.00 54.79 53.99 2oal n ASP 101 Cb 0.52 -1.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.05 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 -2.06 0.42 3.81 0.44 0.00 -1.26 -5.03 105.19 101.51 2oal n GLY 102 Ca -0.18 -1.01 -0.04 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.95 -0.03 0.36 -0.02 0.00 0.27 -5.15 107.32 99.80 2oal s GLY 103 Ca 0.00 -0.16 -0.27 0.00 0.00 0.00 0.00 44.72 44.29 2oal s GLY 103 CO 0.00 0.87 1.20 2.56 0.00 0.00 0.00 173.10 177.73 2oal s PRO 104 N -2.78 4.21 -1.10 2.90 0.04 -1.26 0.18 135.00 137.19 2oal s PRO 104 Ca 0.16 1.95 -0.22 0.00 0.04 0.00 0.00 61.00 62.94 2oal s PRO 104 Cb -0.02 -2.86 0.03 0.00 0.04 0.00 0.00 34.50 31.69 2oal s PRO 104 CO 0.05 -0.22 1.63 0.34 0.04 0.00 0.00 177.00 178.84 2oal s ASP 105 N -0.90 6.32 0.13 6.66 2.15 0.29 -4.68 116.67 126.63 2oal s ASP 105 Ca 0.53 -1.66 -0.20 0.00 0.43 0.00 0.00 52.55 51.65 2oal s ASP 105 Cb -0.34 -2.57 0.05 0.00 -0.30 0.00 0.00 42.92 39.76 2oal s ASP 105 CO 0.43 -1.69 0.51 -1.38 -0.17 0.00 0.00 175.17 172.88 2oal s HIS 106 N 5.86 -0.39 0.02 -5.34 -3.43 -1.26 -1.13 115.29 109.63 2oal s HIS 106 Ca 0.53 0.17 -0.22 0.00 -0.80 0.00 0.00 55.06 54.75 2oal s HIS 106 Cb 0.00 0.41 0.05 0.00 -1.43 0.00 0.00 32.58 31.61 2oal s HIS 106 CO -0.02 -0.76 0.49 -0.59 -2.00 0.00 0.00 174.74 171.86 2oal s PHE 107 N -3.59 -0.39 0.13 0.38 -0.12 -0.89 -4.99 117.98 108.51 2oal s PHE 107 Ca 0.01 0.50 0.05 0.00 -0.05 0.00 0.00 56.93 57.44 2oal s PHE 107 Cb 0.00 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.64 2oal s PHE 107 CO -0.11 -0.58 0.07 0.71 -0.05 0.00 0.00 175.22 175.26 2oal s TYR 108 N -2.04 3.06 -0.40 3.49 2.02 -1.26 -1.20 117.35 121.02 2oal s TYR 108 Ca -0.08 -0.02 0.02 0.00 -0.37 0.00 0.00 57.07 56.62 2oal s TYR 108 Cb -0.01 -1.51 0.12 0.00 -0.40 0.00 0.00 41.96 40.15 2oal s TYR 108 CO 0.01 0.51 0.18 -1.58 -1.57 0.00 0.00 175.55 173.10 2oal s HIS 109 N -1.57 2.23 0.48 2.71 5.65 -0.78 -4.80 115.29 119.20 2oal s HIS 109 Ca 0.29 -2.37 -0.01 0.00 0.25 0.00 0.00 55.06 53.22 2oal s HIS 109 Cb -0.11 -2.05 -0.00 0.00 -1.18 0.00 0.00 32.58 29.24 2oal s HIS 109 CO 0.21 -0.83 0.71 -1.12 -0.65 0.00 0.00 174.74 173.07 2oal s SER 110 N 0.71 5.78 0.00 9.88 0.01 -1.26 -2.00 113.70 126.82 2oal s SER 110 Ca 0.15 0.35 0.26 0.00 1.31 0.00 0.00 55.95 58.02 2oal s SER 110 Cb -0.22 -1.55 0.71 0.00 0.21 0.00 0.00 66.02 65.18 2oal s SER 110 CO -0.08 -0.77 1.56 0.49 0.41 0.00 0.00 173.24 174.86 2oal n PHE 111 N -2.17 0.01 -1.53 2.43 3.72 -1.12 -4.92 117.46 113.89 2oal n PHE 111 Ca 0.02 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.03 2oal n PHE 111 Cb 0.58 -0.33 0.02 0.00 -0.94 0.00 0.00 39.48 38.81 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 1.50 -0.95 3.78 1.37 0.00 -1.26 -4.77 105.19 104.85 2oal n GLY 112 Ca 0.06 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2oal n GLY 112 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oal s LEU 113 N 0.21 4.15 -0.39 0.99 1.43 -1.26 -5.02 118.68 118.79 2oal s LEU 113 Ca 0.67 2.12 -0.12 0.00 -1.03 0.00 0.00 54.13 55.77 2oal s LEU 113 Cb -0.51 -4.14 0.03 0.00 0.03 0.00 0.00 46.19 41.60 2oal s LEU 113 CO 0.55 -0.55 0.23 -0.22 0.23 0.00 0.00 176.35 176.59 2oal s LEU 114 N -2.61 4.85 0.30 1.79 0.20 -1.26 -4.92 118.68 117.04 2oal s LEU 114 Ca 0.58 -1.03 -0.30 0.00 0.69 0.00 0.00 54.13 54.07 2oal s LEU 114 Cb -0.24 -2.05 -0.12 0.00 -0.43 0.00 0.00 46.19 43.35 2oal s LEU 114 CO 0.30 -0.42 1.58 0.29 -0.29 0.00 0.00 176.35 177.82 2oal n LYS 115 N 5.03 2.69 -2.25 1.98 5.02 -1.26 -4.75 118.16 124.62 2oal n LYS 115 Ca -0.12 0.96 -0.27 0.00 -2.02 0.00 0.00 58.31 56.86 2oal n LYS 115 Cb 0.46 -2.73 0.15 0.00 -0.02 0.00 0.00 35.03 32.89 2oal n LYS 115 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2oal s TYR 116 N -0.13 1.48 -0.30 2.13 2.02 -1.26 -0.90 117.35 120.39 2oal s TYR 116 Ca 0.63 -0.00 -0.08 0.00 -0.37 0.00 0.00 57.07 57.25 2oal s TYR 116 Cb -0.50 -3.60 0.19 0.00 -0.40 0.00 0.00 41.96 37.65 2oal s TYR 116 CO 0.50 -2.26 0.95 -1.58 -1.57 0.00 0.00 175.55 171.59 2oal s HIS 117 N -3.55 -0.77 -1.02 2.71 5.65 -0.17 -4.74 115.29 113.39 2oal s HIS 117 Ca 0.71 0.50 -0.04 0.00 0.25 0.00 0.00 55.06 56.48 2oal s HIS 117 Cb -0.04 0.15 0.00 0.00 -1.18 0.00 0.00 32.58 31.52 2oal s HIS 117 CO 0.49 -0.44 0.87 0.39 -0.65 0.00 0.00 174.74 175.40 2oal n GLU 118 N 5.23 -5.85 -1.41 2.88 -0.58 -1.26 -2.27 120.64 117.38 2oal n GLU 118 Ca 0.06 0.67 -0.14 0.00 -0.42 0.00 0.00 57.16 57.33 2oal n GLU 118 Cb 0.56 -5.19 -0.06 0.00 -0.57 0.00 0.00 31.44 26.18 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 -3.81 -1.07 -4.34 3.49 6.02 -1.26 -5.00 117.38 111.41 2oal n GLN 119 Ca -0.11 0.98 -0.23 0.00 -0.01 0.00 0.00 57.00 57.63 2oal n GLN 119 Cb 0.59 -5.11 -0.17 0.00 1.02 0.00 0.00 30.24 26.57 2oal n GLN 119 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2oal s ILE 120 N -2.47 0.88 0.36 5.09 1.01 -0.96 -5.12 121.20 119.99 2oal s ILE 120 Ca 0.00 -0.31 -0.27 0.00 0.00 0.00 0.00 60.65 60.07 2oal s ILE 120 Cb 0.00 -0.85 -0.12 0.00 0.01 0.00 0.00 42.46 41.50 2oal s ILE 120 CO 0.00 0.31 1.22 -2.65 0.00 0.00 0.00 174.94 173.82 2oal n PRO 121 N 4.05 1.91 0.12 2.79 -0.02 -1.26 -1.00 135.00 141.59 2oal n PRO 121 Ca -0.22 0.67 0.11 0.00 -2.02 0.00 0.00 63.50 62.05 2oal n PRO 121 Cb 0.51 -2.25 0.61 0.00 -0.02 0.00 0.00 33.50 32.36 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 2.29 0.10 -0.90 2.45 5.85 -1.31 -2.11 115.31 121.67 2oal h LEU 122 Ca -0.45 -0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.44 2oal h LEU 122 Cb 1.30 -0.02 -0.10 0.00 0.37 0.00 0.00 40.66 42.20 2oal h LEU 122 CO 0.61 0.07 0.48 0.77 -0.34 0.00 0.00 178.44 180.03 2oal h SER 123 N 0.11 0.56 -0.46 1.25 4.64 -1.89 -0.97 113.55 116.80 2oal h SER 123 Ca 0.12 0.11 -0.07 0.00 -0.47 0.00 0.00 61.79 61.48 2oal h SER 123 Cb 0.34 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 2oal h SER 123 CO -0.01 0.19 0.06 0.45 -0.87 0.00 0.00 176.83 176.65 2oal h HIS 124 N 0.62 0.88 -0.34 4.77 3.86 -1.74 -1.70 115.15 121.50 2oal h HIS 124 Ca 0.51 -0.11 -0.11 0.00 -1.16 0.00 0.00 60.37 59.51 2oal h HIS 124 Cb 0.80 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.02 2oal h HIS 124 CO -0.08 0.78 -0.21 1.88 0.86 0.00 0.00 177.93 181.17 2oal h TYR 125 N 0.79 0.86 0.01 2.45 -1.99 -1.33 -2.35 116.97 115.42 2oal h TYR 125 Ca 0.16 -0.23 0.02 0.00 2.00 0.00 0.00 58.73 60.69 2oal h TYR 125 Cb 0.40 -0.19 -0.03 0.00 2.00 0.00 0.00 36.73 38.90 2oal h TYR 125 CO 0.02 0.96 -0.16 2.35 -0.00 0.00 0.00 178.16 181.33 2oal h TRP 126 N 0.51 -0.41 -0.61 4.88 7.01 -0.94 -2.10 115.95 124.29 2oal h TRP 126 Ca 0.07 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.06 2oal h TRP 126 Cb 0.76 0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 27.97 2oal h TRP 126 CO 0.06 -0.23 0.29 0.35 -2.79 0.00 0.00 178.44 176.12 2oal h PHE 127 N -0.27 0.85 -0.14 2.65 3.57 -1.32 -0.10 116.94 122.19 2oal h PHE 127 Ca 0.05 -0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.55 2oal h PHE 127 Cb 0.33 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 2oal h PHE 127 CO -0.21 0.63 -0.05 0.22 -2.23 0.00 0.00 178.31 176.67 2oal h ASP 128 N 0.86 -0.17 -0.72 0.41 3.58 -0.95 0.47 116.42 119.89 2oal h ASP 128 Ca 0.21 0.05 -0.06 0.00 0.42 0.00 0.00 57.03 57.65 2oal h ASP 128 Cb 0.09 0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.22 2oal h ASP 128 CO -0.03 -0.07 0.21 0.03 -2.88 0.00 0.00 179.24 176.51 2oal h ARG 129 N -0.03 1.13 -0.32 0.28 3.08 -0.97 -1.36 114.38 116.20 2oal h ARG 129 Ca 0.07 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.83 2oal h ARG 129 Cb 0.13 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2oal h ARG 129 CO -0.16 0.98 0.04 1.03 -1.07 0.00 0.00 179.97 180.79 2oal h SER 130 N 1.08 0.51 -0.35 7.04 0.87 -0.50 0.77 113.55 122.97 2oal h SER 130 Ca 0.23 -0.27 -0.05 0.00 -1.23 0.00 0.00 61.79 60.47 2oal h SER 130 Cb 0.32 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.12 2oal h SER 130 CO -0.01 0.66 0.06 0.22 -0.53 0.00 0.00 176.83 177.23 2oal h TYR 131 N 0.35 0.69 -0.15 2.24 5.03 0.08 -1.95 116.97 123.26 2oal h TYR 131 Ca 0.09 -0.07 0.00 0.00 2.58 0.00 0.00 58.73 61.34 2oal h TYR 131 Cb 0.37 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.45 2oal h TYR 131 CO 0.03 0.62 0.00 0.54 -1.32 0.00 0.00 178.16 178.03 2oal n ARG 132 N -4.28 1.72 -1.88 1.82 1.74 -0.53 -4.93 116.66 110.32 2oal n ARG 132 Ca 0.03 -1.08 -0.06 0.00 -0.77 0.00 0.00 57.85 55.96 2oal n ARG 132 Cb 0.24 -1.40 -0.01 0.00 -1.02 0.00 0.00 32.46 30.27 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 1.13 0.30 0.05 -0.13 0.00 -0.57 -4.93 105.19 101.04 2oal n GLY 133 Ca 0.16 -0.66 0.12 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.91 0.16 -3.73 1.61 4.76 0.26 -4.92 118.16 114.39 2oal n LYS 134 Ca -0.07 -0.09 -0.11 0.00 -2.87 0.00 0.00 58.31 55.17 2oal n LYS 134 Cb 0.47 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.10 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 -2.91 0.09 0.00 -0.18 -1.32 -1.19 -4.95 115.64 105.18 2oal s THR 135 Ca 0.13 -0.72 0.00 0.00 -1.21 0.00 0.00 61.69 59.89 2oal s THR 135 Cb 0.18 -1.09 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 2oal s THR 135 CO 0.67 -0.40 0.33 0.52 -2.21 0.00 0.00 174.62 173.53 2oal n VAL 136 N 0.21 0.04 -2.33 5.08 0.31 -1.26 -4.51 118.33 115.87 2oal n VAL 136 Ca -0.17 -0.31 -0.41 0.00 -0.01 0.00 0.00 64.34 63.44 2oal n VAL 136 Cb 0.61 1.37 -0.03 0.00 -0.91 0.00 0.00 33.84 34.88 2oal n VAL 136 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2oal s GLU 137 N -0.04 4.50 0.60 5.55 2.12 -1.26 -5.00 118.70 125.16 2oal s GLU 137 Ca 0.00 1.96 -0.19 0.00 0.36 0.00 0.00 54.97 57.10 2oal s GLU 137 Cb 0.00 -3.17 -0.03 0.00 0.26 0.00 0.00 34.13 31.18 2oal s GLU 137 CO 0.00 -0.02 1.21 -2.14 -0.54 0.00 0.00 175.26 173.77 2oal s PRO 138 N -1.08 2.95 0.18 4.30 0.02 -1.26 -4.85 135.00 135.27 2oal s PRO 138 Ca 0.49 1.82 -0.16 0.00 0.02 0.00 0.00 61.00 63.17 2oal s PRO 138 Cb -0.35 -1.93 0.15 0.00 0.02 0.00 0.00 34.50 32.39 2oal s PRO 138 CO 0.43 -1.22 1.64 0.35 -0.33 0.00 0.00 177.00 177.87 2oal h PHE 139 N 0.85 -0.33 -0.77 6.54 3.57 -1.94 -2.21 116.94 122.64 2oal h PHE 139 Ca -0.50 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.01 2oal h PHE 139 Cb 1.30 0.22 -0.03 0.00 2.79 0.00 0.00 35.95 40.23 2oal h PHE 139 CO 0.47 -0.24 0.36 0.38 -2.23 0.00 0.00 178.31 177.05 2oal h ASP 140 N -0.03 1.01 1.14 0.41 2.03 -1.92 -1.55 116.42 117.51 2oal h ASP 140 Ca 0.24 -0.14 -0.02 0.00 -0.73 0.00 0.00 57.03 56.38 2oal h ASP 140 Cb 0.39 -0.26 -0.00 0.00 -0.83 0.00 0.00 39.33 38.63 2oal h ASP 140 CO -0.52 0.87 -0.09 1.88 -1.03 0.00 0.00 179.24 180.35 2oal h TYR 141 N 1.08 0.00 0.12 4.15 -1.99 -1.76 -2.04 116.97 116.54 2oal h TYR 141 Ca 0.26 0.00 -0.34 0.00 2.00 0.00 0.00 58.73 60.66 2oal h TYR 141 Cb 0.14 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.85 2oal h TYR 141 CO 0.01 0.09 -1.77 0.00 -0.00 0.00 0.00 178.16 176.49 2oal h ALA 142 N 1.91 0.37 0.00 3.88 0.00 -1.03 -3.40 119.26 120.99 2oal h ALA 142 Ca -0.00 -1.26 0.00 0.00 0.00 0.00 0.00 54.91 53.65 2oal h ALA 142 Cb 0.68 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2oal h ALA 142 CO 0.01 1.23 -1.38 0.00 0.00 0.00 0.00 179.25 179.11 2oal s TYR 144 N -3.19 2.41 -0.21 0.00 2.02 -0.77 -4.76 117.35 112.85 2oal s TYR 144 Ca 0.02 -0.34 0.19 0.00 -0.37 0.00 0.00 57.07 56.57 2oal s TYR 144 Cb 0.15 -1.37 0.01 0.00 -0.40 0.00 0.00 41.96 40.35 2oal s TYR 144 CO 0.88 0.25 1.11 1.57 -1.57 0.00 0.00 175.55 177.79 2oal h LYS 145 N 4.36 0.00 0.15 -0.62 2.10 -1.85 -3.40 116.57 117.31 2oal h LYS 145 Ca -0.48 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.18 2oal h LYS 145 Cb 1.16 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.46 2oal h LYS 145 CO 0.44 0.19 -0.23 0.93 -2.00 0.00 0.00 179.45 178.78 2oal h GLU 146 N 0.00 -0.43 -0.81 0.07 3.07 -1.95 -3.29 114.58 111.25 2oal h GLU 146 Ca -0.06 0.03 0.18 0.00 -0.50 0.00 0.00 59.36 59.01 2oal h GLU 146 Cb 1.27 0.10 -0.15 0.00 -0.84 0.00 0.00 28.75 29.13 2oal h GLU 146 CO 0.03 -0.29 -0.13 -2.30 -1.40 0.00 0.00 179.01 174.92 2oal n PRO 147 N -5.35 -0.07 -0.11 2.33 -0.02 -1.26 -1.07 135.00 129.45 2oal n PRO 147 Ca -0.07 1.24 -0.13 0.00 -2.02 0.00 0.00 63.50 62.52 2oal n PRO 147 Cb 0.26 -1.89 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 2oal n PRO 147 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2oal h VAL 148 N 0.00 1.29 0.00 -1.45 -1.51 -1.87 -1.73 116.25 110.98 2oal h VAL 148 Ca 0.42 -1.46 0.00 0.00 -1.23 0.00 0.00 66.70 64.43 2oal h VAL 148 Cb 0.73 1.47 0.00 0.00 -2.13 0.00 0.00 31.29 31.36 2oal h VAL 148 CO -0.81 0.48 0.00 0.16 -1.23 0.00 0.00 177.57 176.17 2oal h ILE 149 N 0.57 0.00 0.12 7.19 3.07 -1.31 -2.98 117.51 124.17 2oal h ILE 149 Ca 0.06 -0.48 -0.29 0.00 1.55 0.00 0.00 64.86 65.70 2oal h ILE 149 Cb 0.87 1.41 -0.00 0.00 -0.27 0.00 0.00 36.82 38.83 2oal h ILE 149 CO 0.08 0.00 -1.41 -0.07 -1.05 0.00 0.00 178.15 175.70 2oal h LEU 150 N 0.00 0.41 -2.36 0.16 3.38 -0.95 0.66 115.31 116.61 2oal h LEU 150 Ca 0.00 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.46 2oal h LEU 150 Cb 0.66 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.28 2oal h LEU 150 CO 0.00 1.41 -0.03 0.44 0.09 0.00 0.00 178.44 180.35 2oal h ASP 151 N 0.07 0.00 -0.57 -0.43 3.32 -1.17 -0.63 116.42 117.01 2oal h ASP 151 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.85 2oal h ASP 151 Cb 2.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.55 2oal h ASP 151 CO 0.18 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 177.73 2oal n ALA 152 N -2.16 2.56 -3.91 3.45 0.00 -1.17 -4.97 120.51 114.30 2oal n ALA 152 Ca -0.02 -1.41 -0.31 0.00 0.00 0.00 0.00 53.44 51.70 2oal n ALA 152 Cb 0.16 -0.80 0.02 0.00 0.00 0.00 0.00 19.45 18.83 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 1.05 -4.68 -4.80 0.00 5.03 -0.24 -4.90 115.26 106.71 2oal n ASN 153 Ca 0.21 -0.78 -0.32 0.00 0.87 0.00 0.00 54.58 54.56 2oal n ASN 153 Cb 0.66 -3.75 0.03 0.00 -1.02 0.00 0.00 39.78 35.70 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 -6.62 3.09 0.38 3.52 1.81 0.21 -1.29 118.95 120.05 2oal s ARG 154 Ca 0.66 1.15 -0.20 0.00 -1.72 0.00 0.00 55.73 55.63 2oal s ARG 154 Cb -0.34 -2.00 -0.10 0.00 -0.45 0.00 0.00 34.95 32.06 2oal s ARG 154 CO 0.82 -0.99 0.88 0.45 -0.68 0.00 0.00 175.30 175.78 2oal s SER 155 N -3.08 6.94 0.00 0.23 0.15 -0.23 -4.23 113.70 113.48 2oal s SER 155 Ca 0.62 1.58 0.31 0.00 0.70 0.00 0.00 55.95 59.16 2oal s SER 155 Cb -0.16 -2.49 1.68 0.00 -1.71 0.00 0.00 66.02 63.34 2oal s SER 155 CO 0.43 -0.28 2.10 -0.81 1.20 0.00 0.00 173.24 175.89 2oal n PRO 156 N -0.41 1.16 -4.08 5.44 -0.04 -1.26 -4.77 135.00 131.04 2oal n PRO 156 Ca 0.05 -0.23 -0.15 0.00 -0.04 0.00 0.00 63.50 63.13 2oal n PRO 156 Cb 0.53 -1.49 -0.15 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 -2.00 0.35 0.79 0.54 0.52 -1.26 -1.17 118.95 116.72 2oal s ARG 157 Ca 0.45 -0.12 -0.11 0.00 -0.52 0.00 0.00 55.73 55.43 2oal s ARG 157 Cb 0.21 -0.36 0.06 0.00 0.52 0.00 0.00 34.95 35.39 2oal s ARG 157 CO 0.36 0.06 1.09 1.03 0.02 0.00 0.00 175.30 177.85 2oal s ARG 158 N 0.06 2.15 0.49 3.54 0.52 -0.12 -4.75 118.95 120.84 2oal s ARG 158 Ca -0.00 1.06 0.22 0.00 -0.52 0.00 0.00 55.73 56.49 2oal s ARG 158 Cb -0.03 -1.89 1.27 0.00 0.52 0.00 0.00 34.95 34.81 2oal s ARG 158 CO -0.00 -1.69 1.96 -0.07 0.02 0.00 0.00 175.30 175.52 2oal h LEU 159 N -1.16 0.15 0.00 2.53 3.38 -1.94 0.80 115.31 119.07 2oal h LEU 159 Ca -0.45 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2oal h LEU 159 Cb 1.24 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.97 2oal h LEU 159 CO 0.53 0.08 0.00 -0.90 0.09 0.00 0.00 178.44 178.24 2oal n ASP 160 N -4.41 0.00 0.00 -0.43 5.68 -1.26 -4.89 116.55 111.24 2oal n ASP 160 Ca 0.12 0.36 0.00 0.00 -0.50 0.00 0.00 54.79 54.77 2oal n ASP 160 Cb 0.59 -0.44 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 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 0.58 0.33 3.74 6.12 0.00 0.28 -5.08 105.19 111.16 2oal n GLY 161 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 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 -2.10 6.91 0.04 1.61 1.04 -1.25 -4.65 113.70 115.29 2oal s SER 162 Ca 0.00 2.42 -0.26 0.00 0.48 0.00 0.00 55.95 58.59 2oal s SER 162 Cb 0.00 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 63.45 2oal s SER 162 CO 0.00 -0.50 0.80 -0.75 0.98 0.00 0.00 173.24 173.77 2oal s LYS 163 N -0.36 4.53 0.00 4.02 2.20 -1.26 -0.94 119.74 127.92 2oal s LYS 163 Ca 0.55 1.13 0.10 0.00 -0.36 0.00 0.00 55.97 57.40 2oal s LYS 163 Cb -0.36 -3.38 0.09 0.00 -1.51 0.00 0.00 37.83 32.66 2oal s LYS 163 CO 0.40 0.23 0.84 1.33 -0.36 0.00 0.00 175.35 177.78 2oal n VAL 164 N 2.98 0.01 -3.58 4.02 0.24 -0.32 -4.99 118.33 116.70 2oal n VAL 164 Ca -0.01 -0.51 -0.06 0.00 -2.04 0.00 0.00 64.34 61.73 2oal n VAL 164 Cb 0.50 1.21 -0.02 0.00 -1.47 0.00 0.00 33.84 34.06 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 -0.87 0.00 0.48 3.34 -1.32 -1.25 -5.09 115.64 110.92 2oal s THR 165 Ca 0.12 -0.13 -0.21 0.00 -1.21 0.00 0.00 61.69 60.26 2oal s THR 165 Cb 0.09 -1.26 -0.08 0.00 -1.51 0.00 0.00 72.50 69.74 2oal s THR 165 CO 0.13 0.00 1.06 0.20 -2.21 0.00 0.00 174.62 173.80 2oal s ASN 166 N -2.53 6.31 0.17 8.08 -0.87 -1.26 -4.97 114.94 119.86 2oal s ASN 166 Ca 0.08 2.02 -0.21 0.00 -1.57 0.00 0.00 52.86 53.17 2oal s ASN 166 Cb -0.00 -2.57 0.06 0.00 -0.02 0.00 0.00 41.25 38.71 2oal s ASN 166 CO -0.06 -0.81 0.57 -0.72 -2.57 0.00 0.00 177.10 173.52 2oal s TYR 167 N -1.85 -0.44 0.00 2.20 -0.85 -1.26 -4.64 117.35 110.51 2oal s TYR 167 Ca 0.66 0.18 0.00 0.00 -0.52 0.00 0.00 57.07 57.40 2oal s TYR 167 Cb -0.19 0.51 0.00 0.00 0.38 0.00 0.00 41.96 42.66 2oal s TYR 167 CO 0.23 -0.86 0.00 0.00 -1.52 0.00 0.00 175.55 173.41 2oal n ALA 168 N -0.36 0.00 -2.28 9.51 0.00 0.33 -4.21 120.51 123.49 2oal n ALA 168 Ca -0.16 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.13 2oal n ALA 168 Cb 0.64 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.99 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 0.69 1.39 -0.07 0.00 0.51 -1.26 -1.07 118.94 119.12 2oal s TRP 169 Ca 0.00 -0.75 0.04 0.00 -2.12 0.00 0.00 56.10 53.27 2oal s TRP 169 Cb 0.00 -0.71 0.00 0.00 -0.81 0.00 0.00 33.47 31.95 2oal s TRP 169 CO 0.00 0.12 -0.19 -1.01 -0.51 0.00 0.00 176.95 175.36 2oal s HIS 170 N -3.27 2.01 0.12 -1.98 3.76 -0.76 -1.67 115.29 113.50 2oal s HIS 170 Ca 0.19 -0.73 -0.25 0.00 -0.15 0.00 0.00 55.06 54.12 2oal s HIS 170 Cb 0.02 -1.37 0.07 0.00 1.11 0.00 0.00 32.58 32.41 2oal s HIS 170 CO 0.03 -0.30 0.88 -0.59 -0.85 0.00 0.00 174.74 173.91 2oal s PHE 171 N 0.32 -0.24 -0.26 1.40 -0.12 -0.85 -0.75 117.98 117.49 2oal s PHE 171 Ca -0.13 -0.03 -0.24 0.00 -0.05 0.00 0.00 56.93 56.48 2oal s PHE 171 Cb -0.15 0.61 -0.00 0.00 -0.63 0.00 0.00 43.02 42.84 2oal s PHE 171 CO 0.05 -0.80 0.81 0.34 -0.05 0.00 0.00 175.22 175.58 2oal s ASP 172 N -2.79 6.78 0.32 1.98 -1.08 -1.26 -0.50 116.67 120.12 2oal s ASP 172 Ca 0.09 0.94 0.07 0.00 -0.52 0.00 0.00 52.55 53.13 2oal s ASP 172 Cb -0.02 -2.42 0.76 0.00 -1.46 0.00 0.00 42.92 39.78 2oal s ASP 172 CO -0.02 -0.53 1.80 0.00 0.52 0.00 0.00 175.17 176.95 2oal h ALA 173 N 7.78 1.73 -0.66 3.66 0.00 -1.93 -1.59 119.26 128.26 2oal h ALA 173 Ca -0.23 0.06 0.10 0.00 0.00 0.00 0.00 54.91 54.84 2oal h ALA 173 Cb 1.10 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.71 2oal h ALA 173 CO 0.87 -0.07 0.27 0.45 0.00 0.00 0.00 179.25 180.77 2oal h HIS 174 N 0.75 0.47 -0.38 0.00 3.86 -1.98 0.29 115.15 118.17 2oal h HIS 174 Ca 0.55 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.69 2oal h HIS 174 Cb 0.87 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.21 2oal h HIS 174 CO -0.00 0.12 -0.15 -0.07 0.86 0.00 0.00 177.93 178.69 2oal h LEU 175 N 0.46 0.68 -0.35 2.43 3.38 -1.66 -1.58 115.31 118.67 2oal h LEU 175 Ca 0.34 -0.21 -0.09 0.00 0.09 0.00 0.00 57.88 58.01 2oal h LEU 175 Cb 0.42 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2oal h LEU 175 CO -0.32 0.85 -0.14 0.58 0.09 0.00 0.00 178.44 179.50 2oal h VAL 176 N 0.62 1.28 -0.91 1.22 2.07 -1.21 -0.61 116.25 118.72 2oal h VAL 176 Ca 0.10 -1.24 0.01 0.00 0.82 0.00 0.00 66.70 66.39 2oal h VAL 176 Cb 0.60 1.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.68 2oal h VAL 176 CO 0.04 0.41 0.60 0.00 0.02 0.00 0.00 177.57 178.64 2oal h ALA 177 N 0.79 1.34 -0.36 1.67 0.00 -0.75 -0.24 119.26 121.72 2oal h ALA 177 Ca 0.08 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2oal h ALA 177 Cb 0.67 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 2oal h ALA 177 CO 0.05 0.61 0.04 -0.44 0.00 0.00 0.00 179.25 179.50 2oal h ASP 178 N 1.23 0.60 -0.27 0.00 3.32 -1.04 0.01 116.42 120.27 2oal h ASP 178 Ca 0.33 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 57.11 2oal h ASP 178 Cb -0.14 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.23 2oal h ASP 178 CO -0.07 0.73 0.16 0.15 -1.72 0.00 0.00 179.24 178.49 2oal h PHE 179 N 0.45 0.30 -0.24 4.55 3.57 -0.56 -1.63 116.94 123.37 2oal h PHE 179 Ca 0.11 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.52 2oal h PHE 179 Cb 0.40 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 2oal h PHE 179 CO 0.03 0.18 -0.25 -0.07 -2.23 0.00 0.00 178.31 175.97 2oal h LEU 180 N 0.33 0.46 -0.36 0.59 3.38 -0.92 -1.22 115.31 117.57 2oal h LEU 180 Ca 0.11 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2oal h LEU 180 Cb -0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2oal h LEU 180 CO -0.05 0.71 0.14 -0.09 0.09 0.00 0.00 178.44 179.24 2oal h ARG 181 N 0.41 0.54 -0.59 1.13 2.43 -0.67 0.18 114.38 117.81 2oal h ARG 181 Ca 0.06 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2oal h ARG 181 Cb 0.65 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 2oal h ARG 181 CO 0.05 0.53 0.28 0.00 -1.51 0.00 0.00 179.97 179.32 2oal h ARG 182 N 0.43 0.85 0.19 0.20 3.08 -1.04 -1.37 114.38 116.72 2oal h ARG 182 Ca 0.12 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 2oal h ARG 182 Cb 0.20 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2oal h ARG 182 CO -0.01 0.69 -0.09 0.35 -1.07 0.00 0.00 179.97 179.84 2oal h PHE 183 N 0.80 -0.23 -0.34 3.04 3.57 -0.94 0.67 116.94 123.51 2oal h PHE 183 Ca 0.20 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.70 2oal h PHE 183 Cb 0.12 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 2oal h PHE 183 CO -0.00 -0.03 0.23 0.00 -2.23 0.00 0.00 178.31 176.28 2oal h ALA 184 N 0.40 0.44 -0.04 2.41 0.00 -0.59 0.92 119.26 122.80 2oal h ALA 184 Ca -0.03 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.63 2oal h ALA 184 Cb 0.30 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 17.97 2oal h ALA 184 CO 0.04 -0.10 -0.88 1.79 0.00 0.00 0.00 179.25 180.10 2oal h THR 185 N 0.47 1.31 0.18 0.00 1.35 -1.26 -2.08 112.91 112.87 2oal h THR 185 Ca 0.13 -2.13 -0.31 0.00 -0.55 0.00 0.00 66.41 63.54 2oal h THR 185 Cb -0.05 2.32 0.03 0.00 -1.73 0.00 0.00 68.15 68.72 2oal h THR 185 CO -0.03 0.65 -1.35 -0.33 -0.25 0.00 0.00 175.52 174.22 2oal h GLU 186 N 0.32 0.56 0.00 4.72 5.08 -0.86 -3.31 114.58 121.09 2oal h GLU 186 Ca -0.10 -0.85 0.00 0.00 -1.00 0.00 0.00 59.36 57.41 2oal h GLU 186 Cb 1.53 0.30 0.00 0.00 0.50 0.00 0.00 28.75 31.08 2oal h GLU 186 CO 0.17 1.40 -1.26 1.63 -1.00 0.00 0.00 179.01 179.95 2oal n LYS 187 N -3.74 1.23 0.00 2.33 5.02 0.30 -4.66 118.16 118.64 2oal n LYS 187 Ca -0.15 -0.08 0.04 0.00 -2.02 0.00 0.00 58.31 56.11 2oal n LYS 187 Cb 1.04 -1.24 0.03 0.00 -0.02 0.00 0.00 35.03 34.84 2oal n LYS 187 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2oal n LEU 188 N -1.73 1.58 -0.41 -0.35 4.77 -0.83 -5.01 117.00 115.03 2oal n LEU 188 Ca -0.01 -0.95 -0.05 0.00 -0.03 0.00 0.00 56.01 54.97 2oal n LEU 188 Cb 0.29 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 2oal n LEU 188 CO 0.27 0.32 -0.05 0.61 -1.33 0.00 0.00 177.39 177.21 2oal n GLY 189 N 0.55 0.77 3.73 -0.72 0.00 -0.97 -4.92 105.19 103.63 2oal n GLY 189 Ca 0.05 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.10 3.77 -0.08 1.61 1.01 -0.94 -4.76 120.40 118.91 2oal s VAL 190 Ca 0.00 1.40 -0.22 0.00 0.00 0.00 0.00 61.98 63.16 2oal s VAL 190 Cb 0.00 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2oal s VAL 190 CO 0.00 0.18 0.65 -0.60 0.00 0.00 0.00 175.10 175.34 2oal s ARG 191 N 0.24 4.42 -0.23 2.72 3.52 -0.40 -4.33 118.95 124.90 2oal s ARG 191 Ca 0.55 0.79 -0.08 0.00 -0.13 0.00 0.00 55.73 56.86 2oal s ARG 191 Cb -0.31 -3.45 -0.03 0.00 -1.56 0.00 0.00 34.95 29.60 2oal s ARG 191 CO 0.33 0.08 0.08 -1.58 -0.81 0.00 0.00 175.30 173.40 2oal s HIS 192 N 0.77 3.14 -0.16 5.12 5.65 -1.26 -0.17 115.29 128.37 2oal s HIS 192 Ca 0.35 -0.22 0.01 0.00 0.25 0.00 0.00 55.06 55.45 2oal s HIS 192 Cb -0.17 -2.19 0.02 0.00 -1.18 0.00 0.00 32.58 29.05 2oal s HIS 192 CO 0.16 -0.18 -0.19 0.08 -0.65 0.00 0.00 174.74 173.96 2oal s VAL 193 N 1.22 1.96 -0.65 0.89 1.01 0.09 -4.97 120.40 119.95 2oal s VAL 193 Ca 0.05 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 60.98 2oal s VAL 193 Cb -0.14 -1.77 0.15 0.00 0.00 0.00 0.00 36.38 34.61 2oal s VAL 193 CO 0.04 0.53 0.64 -1.61 0.00 0.00 0.00 175.10 174.70 2oal s GLU 194 N 1.22 3.21 0.20 2.72 2.02 -1.26 -1.29 118.70 125.51 2oal s GLU 194 Ca 0.02 -1.87 -0.19 0.00 0.02 0.00 0.00 54.97 52.95 2oal s GLU 194 Cb -0.14 -4.36 0.04 0.00 0.10 0.00 0.00 34.13 29.77 2oal s GLU 194 CO -0.10 -1.38 0.57 0.34 0.02 0.00 0.00 175.26 174.71 2oal s ASP 195 N 3.18 -0.34 -0.14 -0.19 -1.08 -0.79 -4.90 116.67 112.41 2oal s ASP 195 Ca 0.10 -0.36 -0.03 0.00 -0.52 0.00 0.00 52.55 51.74 2oal s ASP 195 Cb -0.22 0.60 -0.03 0.00 -1.46 0.00 0.00 42.92 41.81 2oal s ASP 195 CO -0.01 -1.07 -0.02 -0.60 0.52 0.00 0.00 175.17 174.00 2oal s ARG 196 N -3.84 3.49 0.12 4.34 3.52 -1.26 -2.75 118.95 122.56 2oal s ARG 196 Ca 0.07 -0.48 -0.31 0.00 -0.13 0.00 0.00 55.73 54.88 2oal s ARG 196 Cb -0.02 -2.89 -0.08 0.00 -1.56 0.00 0.00 34.95 30.40 2oal s ARG 196 CO -0.05 0.37 1.46 0.08 -0.81 0.00 0.00 175.30 176.35 2oal s VAL 197 N 0.01 3.12 -0.03 7.11 1.01 -1.26 -0.20 120.40 130.16 2oal s VAL 197 Ca 0.01 0.78 0.03 0.00 0.00 0.00 0.00 61.98 62.81 2oal s VAL 197 Cb -0.13 -3.50 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 2oal s VAL 197 CO 0.02 0.05 0.02 1.21 0.00 0.00 0.00 175.10 176.41 2oal n GLU 198 N 4.13 2.92 -3.70 2.72 2.13 0.80 -4.80 120.64 124.84 2oal n GLU 198 Ca 0.12 -0.01 -0.12 0.00 0.66 0.00 0.00 57.16 57.82 2oal n GLU 198 Cb 0.41 -1.10 -0.10 0.00 0.27 0.00 0.00 31.44 30.93 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 -2.12 -0.62 -0.21 4.31 5.04 -0.63 -4.99 115.29 116.08 2oal s HIS 199 Ca -0.02 1.39 -0.02 0.00 -1.54 0.00 0.00 55.06 54.87 2oal s HIS 199 Cb 0.01 0.26 0.00 0.00 0.04 0.00 0.00 32.58 32.90 2oal s HIS 199 CO 0.16 -0.32 -0.09 0.08 -2.34 0.00 0.00 174.74 172.23 2oal s VAL 200 N 0.82 2.93 -0.17 0.89 1.01 -1.26 0.86 120.40 125.49 2oal s VAL 200 Ca -0.05 -0.66 -0.13 0.00 0.00 0.00 0.00 61.98 61.14 2oal s VAL 200 Cb -0.05 -2.32 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 2oal s VAL 200 CO -0.06 0.45 0.27 -1.58 0.00 0.00 0.00 175.10 174.18 2oal s GLN 201 N 1.41 4.25 0.21 2.72 2.00 0.61 -4.99 119.66 125.87 2oal s GLN 201 Ca 0.05 0.05 0.08 0.00 -2.00 0.00 0.00 55.36 53.55 2oal s GLN 201 Cb -0.14 -3.43 -0.04 0.00 0.80 0.00 0.00 33.01 30.20 2oal s GLN 201 CO -0.06 0.24 -0.02 1.03 -0.50 0.00 0.00 175.29 175.98 2oal s ARG 202 N 0.48 2.31 0.29 1.67 0.52 -1.26 0.44 118.95 123.41 2oal s ARG 202 Ca 0.15 -1.24 0.01 0.00 -0.52 0.00 0.00 55.73 54.13 2oal s ARG 202 Cb -0.13 -2.26 0.06 0.00 0.52 0.00 0.00 34.95 33.14 2oal s ARG 202 CO 0.03 0.42 0.40 -0.40 0.02 0.00 0.00 175.30 175.78 2oal n ASP 203 N -0.36 0.61 0.25 0.23 5.68 0.28 -4.76 116.55 118.49 2oal n ASP 203 Ca -0.09 -1.50 0.12 0.00 -0.50 0.00 0.00 54.79 52.82 2oal n ASP 203 Cb 0.56 -0.26 0.66 0.00 -1.14 0.00 0.00 41.12 40.95 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 -0.39 1.19 -0.00 2.12 0.00 -2.01 -1.27 119.26 118.90 2oal h ALA 204 Ca -0.13 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2oal h ALA 204 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2oal h ALA 204 CO 0.15 0.18 -0.08 0.09 0.00 0.00 0.00 179.25 179.60 2oal n ASN 205 N -3.54 0.29 0.00 0.00 5.03 -1.26 -4.90 115.26 110.88 2oal n ASN 205 Ca -0.01 -0.42 0.00 0.00 0.87 0.00 0.00 54.58 55.02 2oal n ASN 205 Cb 0.29 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 38.91 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 1.28 0.76 3.88 7.41 0.00 -0.48 -5.05 105.19 112.99 2oal n GLY 206 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.97 6.17 0.02 1.61 0.02 -1.26 -4.74 114.94 113.79 2oal s ASN 207 Ca 0.00 1.29 -0.30 0.00 -1.02 0.00 0.00 52.86 52.83 2oal s ASN 207 Cb 0.00 -2.37 -0.04 0.00 0.02 0.00 0.00 41.25 38.86 2oal s ASN 207 CO 0.00 -0.85 1.10 -0.63 0.02 0.00 0.00 177.10 176.74 2oal s ILE 208 N -3.10 4.42 -0.21 0.60 1.01 -1.26 -0.55 121.20 122.10 2oal s ILE 208 Ca 0.54 1.73 -0.16 0.00 0.00 0.00 0.00 60.65 62.76 2oal s ILE 208 Cb -0.11 -4.11 -0.19 0.00 0.01 0.00 0.00 42.46 38.06 2oal s ILE 208 CO 0.52 0.12 0.09 1.21 0.00 0.00 0.00 174.94 176.88 2oal n GLU 209 N 4.08 0.61 -3.75 2.79 2.13 0.17 -4.84 120.64 121.84 2oal n GLU 209 Ca 0.08 0.42 -0.03 0.00 0.66 0.00 0.00 57.16 58.30 2oal n GLU 209 Cb 0.48 -1.67 -0.01 0.00 0.27 0.00 0.00 31.44 30.51 2oal n GLU 209 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2oal s SER 210 N -7.01 -0.15 -0.03 4.31 1.04 -0.89 -4.21 113.70 106.76 2oal s SER 210 Ca -0.30 -0.39 0.05 0.00 0.48 0.00 0.00 55.95 55.79 2oal s SER 210 Cb 0.08 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 2oal s SER 210 CO 0.61 -0.84 -0.17 0.68 0.98 0.00 0.00 173.24 174.50 2oal s VAL 211 N -3.13 1.41 -0.10 5.02 -7.23 -0.31 -0.28 120.40 115.78 2oal s VAL 211 Ca 0.13 -0.73 -0.00 0.00 -1.81 0.00 0.00 61.98 59.56 2oal s VAL 211 Cb -0.01 -1.19 -0.03 0.00 0.56 0.00 0.00 36.38 35.72 2oal s VAL 211 CO 0.02 0.40 -0.07 -0.60 -0.31 0.00 0.00 175.10 174.54 2oal s ARG 212 N -0.19 3.07 0.56 4.82 3.52 0.25 -0.90 118.95 130.08 2oal s ARG 212 Ca 0.02 -0.57 0.02 0.00 -0.13 0.00 0.00 55.73 55.07 2oal s ARG 212 Cb -0.09 -2.67 0.05 0.00 -1.56 0.00 0.00 34.95 30.68 2oal s ARG 212 CO 0.01 0.48 0.78 0.95 -0.81 0.00 0.00 175.30 176.71 2oal s THR 213 N -0.33 2.61 0.56 4.11 -4.23 0.67 -0.14 115.64 118.89 2oal s THR 213 Ca 0.04 -0.72 0.27 0.00 -1.18 0.00 0.00 61.69 60.11 2oal s THR 213 Cb -0.13 -2.89 0.33 0.00 1.34 0.00 0.00 72.50 71.16 2oal s THR 213 CO 0.02 0.00 2.22 0.00 -0.54 0.00 0.00 174.62 176.32 2oal h ALA 214 N 0.07 1.57 -0.06 3.99 0.00 -0.89 0.12 119.26 124.06 2oal h ALA 214 Ca -0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2oal h ALA 214 Cb 1.29 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2oal h ALA 214 CO 0.49 0.02 0.00 0.25 0.00 0.00 0.00 179.25 180.01 2oal n THR 215 N -3.93 0.07 -0.46 0.00 -2.24 -1.26 -4.90 114.28 101.55 2oal n THR 215 Ca -0.03 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.54 2oal n THR 215 Cb 0.10 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 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 1.09 0.73 3.77 3.38 0.00 0.03 -5.05 105.19 109.14 2oal n GLY 216 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.54 4.52 -0.13 1.61 0.52 -1.26 -4.74 118.95 118.93 2oal s ARG 217 Ca 0.00 1.67 0.01 0.00 -0.52 0.00 0.00 55.73 56.89 2oal s ARG 217 Cb 0.00 -2.99 -0.01 0.00 0.52 0.00 0.00 34.95 32.47 2oal s ARG 217 CO 0.00 0.14 -0.17 0.08 0.02 0.00 0.00 175.30 175.37 2oal s VAL 218 N -1.32 2.64 -0.08 3.52 1.01 -1.26 -0.24 120.40 124.66 2oal s VAL 218 Ca 0.48 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.71 2oal s VAL 218 Cb -0.28 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.01 2oal s VAL 218 CO 0.36 0.53 -0.23 -0.36 0.00 0.00 0.00 175.10 175.39 2oal s PHE 219 N 0.51 2.52 0.30 5.22 0.40 -0.07 -4.97 117.98 121.90 2oal s PHE 219 Ca -0.11 -0.83 0.11 0.00 -0.60 0.00 0.00 56.93 55.49 2oal s PHE 219 Cb -0.16 -1.66 -0.05 0.00 0.51 0.00 0.00 43.02 41.65 2oal s PHE 219 CO 0.04 -0.28 -0.11 0.16 0.70 0.00 0.00 175.22 175.73 2oal s ASP 220 N 0.05 3.87 0.20 1.36 1.47 -1.26 -1.16 116.67 121.20 2oal s ASP 220 Ca -0.10 -1.00 -0.23 0.00 1.18 0.00 0.00 52.55 52.39 2oal s ASP 220 Cb -0.15 -0.43 0.05 0.00 -0.34 0.00 0.00 42.92 42.05 2oal s ASP 220 CO 0.06 -0.07 0.91 0.00 0.68 0.00 0.00 175.17 176.74 2oal s ALA 221 N -2.51 -1.51 -0.11 2.11 0.00 -1.26 -4.86 121.76 113.63 2oal s ALA 221 Ca 0.32 -0.06 0.16 0.00 0.00 0.00 0.00 51.96 52.38 2oal s ALA 221 Cb -0.03 0.70 -0.20 0.00 0.00 0.00 0.00 23.12 23.59 2oal s ALA 221 CO 0.17 -1.04 0.60 -0.25 0.00 0.00 0.00 175.76 175.24 2oal n ASP 222 N -0.58 0.64 -3.79 0.00 8.00 0.36 -4.89 116.55 116.29 2oal n ASP 222 Ca -0.05 0.29 -0.15 0.00 0.71 0.00 0.00 54.79 55.59 2oal n ASP 222 Cb 0.60 0.38 -0.16 0.00 -0.02 0.00 0.00 41.12 41.92 2oal n ASP 222 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2oal s LEU 223 N -5.73 1.20 -0.15 0.64 2.96 -1.08 -4.89 118.68 111.62 2oal s LEU 223 Ca -0.05 0.02 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2oal s LEU 223 Cb 0.08 -0.09 -0.02 0.00 0.50 0.00 0.00 46.19 46.67 2oal s LEU 223 CO 0.83 -0.11 -0.10 -0.36 -1.32 0.00 0.00 176.35 175.29 2oal s PHE 224 N 0.94 2.88 -0.32 5.38 0.40 0.08 -1.83 117.98 125.50 2oal s PHE 224 Ca -0.08 -0.63 -0.09 0.00 -0.60 0.00 0.00 56.93 55.53 2oal s PHE 224 Cb -0.12 -1.91 0.00 0.00 0.51 0.00 0.00 43.02 41.51 2oal s PHE 224 CO -0.02 -0.23 0.13 0.08 0.70 0.00 0.00 175.22 175.88 2oal s VAL 225 N 0.53 4.36 -0.50 -0.44 1.01 -0.06 -0.75 120.40 124.56 2oal s VAL 225 Ca -0.07 -0.60 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 2oal s VAL 225 Cb -0.15 -3.27 0.04 0.00 0.00 0.00 0.00 36.38 32.99 2oal s VAL 225 CO 0.04 0.02 0.84 -0.62 0.00 0.00 0.00 175.10 175.37 2oal s ASP 226 N 1.56 6.37 -0.24 3.32 -1.08 0.57 -0.81 116.67 126.36 2oal s ASP 226 Ca 0.03 -0.28 0.11 0.00 -0.52 0.00 0.00 52.55 51.89 2oal s ASP 226 Cb -0.17 -2.40 0.45 0.00 -1.46 0.00 0.00 42.92 39.34 2oal s ASP 226 CO 0.05 -1.05 1.19 0.00 0.52 0.00 0.00 175.17 175.89 2oal n SER 228 N -0.76 0.43 0.00 0.00 3.41 -0.70 -4.18 113.62 111.81 2oal n SER 228 Ca 0.30 -1.47 0.00 0.00 -0.26 0.00 0.00 58.87 57.44 2oal n SER 228 Cb 0.87 -0.02 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 0.89 -1.66 0.45 5.00 0.00 -1.26 -4.12 105.19 104.49 2oal n GLY 229 Ca 0.15 -1.35 0.25 0.00 0.00 0.00 0.00 46.02 45.07 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 0.00 0.00 1.61 0.04 -1.94 -0.11 116.94 116.54 2oal h PHE 230 Ca 0.00 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 2oal h PHE 230 Cb 0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 2oal h PHE 230 CO 0.00 0.00 -0.19 0.00 -0.60 0.00 0.00 178.31 177.52 2oal h ARG 231 N 0.00 0.00 -6.47 1.51 3.08 -1.90 -3.47 114.38 107.13 2oal h ARG 231 Ca 0.34 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.90 2oal h ARG 231 Cb 1.74 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.77 2oal h ARG 231 CO -0.00 0.19 -0.91 0.41 -1.07 0.00 0.00 179.97 178.59 2oal n GLY 232 N -0.64 -0.42 0.34 0.04 0.00 -0.06 -4.53 105.19 99.92 2oal n GLY 232 Ca -0.02 0.23 0.15 0.00 0.00 0.00 0.00 46.02 46.38 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 -1.89 0.60 0.00 0.99 5.85 -1.86 -0.51 115.31 118.48 2oal h LEU 233 Ca -0.64 0.13 -0.13 0.00 0.84 0.00 0.00 57.88 58.08 2oal h LEU 233 Cb 1.37 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 2oal h LEU 233 CO 0.59 0.10 -1.32 0.18 -0.34 0.00 0.00 178.44 177.64 2oal n LEU 234 N -4.91 1.92 -0.12 2.25 4.77 -1.26 -2.38 117.00 117.27 2oal n LEU 234 Ca 0.25 0.39 -0.08 0.00 -0.03 0.00 0.00 56.01 56.53 2oal n LEU 234 Cb 0.69 -0.79 -0.00 0.00 -2.33 0.00 0.00 43.42 40.98 2oal n LEU 234 CO 0.16 -0.06 1.03 -0.29 -1.33 0.00 0.00 177.39 176.90 2oal h ILE 235 N -1.00 1.10 0.00 -0.08 6.09 -1.93 0.12 117.51 121.81 2oal h ILE 235 Ca -0.20 -0.19 -0.27 0.00 -1.37 0.00 0.00 64.86 62.84 2oal h ILE 235 Cb 1.10 0.55 -0.04 0.00 0.47 0.00 0.00 36.82 38.90 2oal h ILE 235 CO -0.12 0.10 -1.45 0.59 -3.07 0.00 0.00 178.15 174.19 2oal n ASN 236 N -4.82 1.88 0.11 2.19 5.03 -0.41 -1.83 115.26 117.40 2oal n ASN 236 Ca 0.00 0.40 -0.09 0.00 0.87 0.00 0.00 54.58 55.77 2oal n ASN 236 Cb 0.03 -0.94 -0.05 0.00 -1.02 0.00 0.00 39.78 37.79 2oal n ASN 236 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 2oal h LYS 237 N -0.97 -0.35 0.08 3.52 3.64 -1.27 -2.32 116.57 118.90 2oal h LYS 237 Ca -0.40 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.00 2oal h LYS 237 Cb 1.37 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.27 2oal h LYS 237 CO -0.23 -0.07 -0.04 0.00 -2.27 0.00 0.00 179.45 176.84 2oal h ALA 238 N -0.77 -0.10 0.00 5.00 0.00 -1.31 -3.29 119.26 118.79 2oal h ALA 238 Ca -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2oal h ALA 238 Cb 0.44 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2oal h ALA 238 CO 0.06 -0.25 0.00 -1.33 0.00 0.00 0.00 179.25 177.73 2oal n MET 239 N -4.86 0.10 -2.24 0.00 2.81 0.40 -4.93 117.12 108.40 2oal n MET 239 Ca -0.08 0.14 -0.21 0.00 -1.81 0.00 0.00 57.70 55.73 2oal n MET 239 Cb 0.29 -1.62 -0.03 0.00 -0.71 0.00 0.00 33.22 31.15 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 -1.80 -1.64 -2.59 0.03 1.02 -0.87 -4.96 120.64 109.83 2oal n GLU 240 Ca 0.06 1.06 -0.42 0.00 -0.02 0.00 0.00 57.16 57.84 2oal n GLU 240 Cb 0.34 -5.67 -0.03 0.00 -0.02 0.00 0.00 31.44 26.05 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 -4.79 4.49 0.35 3.49 2.56 -0.76 -4.99 118.70 119.04 2oal s GLU 241 Ca 0.00 1.55 -0.28 0.00 0.00 0.00 0.00 54.97 56.25 2oal s GLU 241 Cb 0.00 -3.44 -0.09 0.00 2.00 0.00 0.00 34.13 32.60 2oal s GLU 241 CO 0.00 -0.17 1.23 -2.14 -0.56 0.00 0.00 175.26 173.62 2oal s PRO 242 N 1.20 4.29 -0.04 4.30 0.02 -1.26 -4.34 135.00 139.17 2oal s PRO 242 Ca 0.54 2.03 -0.16 0.00 0.02 0.00 0.00 61.00 63.43 2oal s PRO 242 Cb -0.24 -2.96 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 2oal s PRO 242 CO 0.27 -0.17 0.43 0.12 -0.33 0.00 0.00 177.00 177.31 2oal s PHE 243 N -1.23 3.66 -0.46 6.54 5.36 -1.26 -1.20 117.98 129.39 2oal s PHE 243 Ca 0.51 0.95 -0.16 0.00 -0.96 0.00 0.00 56.93 57.28 2oal s PHE 243 Cb -0.36 -2.37 0.06 0.00 -0.34 0.00 0.00 43.02 40.01 2oal s PHE 243 CO 0.46 0.49 0.38 -0.51 -1.46 0.00 0.00 175.22 174.59 2oal s LEU 244 N -0.52 5.46 0.23 6.12 1.43 0.19 -4.87 118.68 126.71 2oal s LEU 244 Ca 0.24 -1.20 -0.30 0.00 -1.03 0.00 0.00 54.13 51.85 2oal s LEU 244 Cb -0.16 -2.19 -0.09 0.00 0.03 0.00 0.00 46.19 43.78 2oal s LEU 244 CO 0.12 -0.61 1.26 -0.62 0.23 0.00 0.00 176.35 176.73 2oal s ASP 245 N 2.37 6.96 -0.29 2.29 -1.08 -1.26 -2.27 116.67 123.40 2oal s ASP 245 Ca 0.05 2.39 0.12 0.00 -0.52 0.00 0.00 52.55 54.59 2oal s ASP 245 Cb -0.23 -2.62 0.47 0.00 -1.46 0.00 0.00 42.92 39.09 2oal s ASP 245 CO 0.08 -0.45 1.16 0.23 0.52 0.00 0.00 175.17 176.71 2oal n MET 246 N 2.16 3.02 0.00 4.34 2.81 0.17 -4.76 117.12 124.85 2oal n MET 246 Ca 0.04 -3.97 0.10 0.00 -1.81 0.00 0.00 57.70 52.05 2oal n MET 246 Cb 0.43 -2.06 0.58 0.00 -0.71 0.00 0.00 33.22 31.45 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 -0.66 0.00 -0.09 7.83 3.41 -1.26 -1.42 113.62 121.44 2oal n SER 247 Ca 0.32 -0.69 0.14 0.00 -0.26 0.00 0.00 58.87 58.37 2oal n SER 247 Cb 0.91 0.00 0.52 0.00 -0.26 0.00 0.00 64.21 65.38 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 -0.97 0.45 -0.01 4.04 5.75 -1.26 -3.71 116.55 120.84 2oal n ASP 248 Ca 0.15 -0.36 -0.00 0.00 -0.01 0.00 0.00 54.79 54.56 2oal n ASP 248 Cb 0.07 -0.06 -0.03 0.00 -1.03 0.00 0.00 41.12 40.06 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 -1.12 0.00 -3.70 2.11 8.25 -0.51 -4.29 115.22 115.97 2oal n HIS 249 Ca 0.11 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.36 2oal n HIS 249 Cb 0.30 -0.15 -0.18 0.00 1.12 0.00 0.00 29.99 31.08 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 -3.86 0.28 0.30 2.41 1.43 -1.06 -4.70 118.68 113.48 2oal s LEU 250 Ca -0.02 0.03 0.16 0.00 -1.03 0.00 0.00 54.13 53.27 2oal s LEU 250 Cb 0.02 -0.23 0.23 0.00 0.03 0.00 0.00 46.19 46.24 2oal s LEU 250 CO 0.17 -0.23 1.52 -0.07 0.23 0.00 0.00 176.35 177.97 2oal h LEU 251 N 8.40 0.00 -9.61 1.79 3.38 -1.90 -3.37 115.31 114.00 2oal h LEU 251 Ca -0.14 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.30 2oal h LEU 251 Cb 1.12 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.89 2oal h LEU 251 CO 0.18 0.50 0.63 0.20 0.09 0.00 0.00 178.44 180.05 2oal s ASN 252 N -6.46 6.95 0.00 -0.43 0.02 -1.26 -4.44 114.94 109.31 2oal s ASN 252 Ca 0.03 2.28 0.00 0.00 -1.02 0.00 0.00 52.86 54.14 2oal s ASN 252 Cb 0.09 -2.60 0.00 0.00 0.02 0.00 0.00 41.25 38.76 2oal s ASN 252 CO 0.73 -0.51 0.18 -0.90 0.02 0.00 0.00 177.10 176.62 2oal n ASP 253 N 3.16 0.00 -4.10 -1.22 5.68 -0.73 -4.88 116.55 114.46 2oal n ASP 253 Ca 0.08 -1.00 -0.11 0.00 -0.50 0.00 0.00 54.79 53.26 2oal n ASP 253 Cb 0.44 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.34 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 0.00 0.05 -0.12 -1.12 0.01 -0.52 -1.38 113.70 110.62 2oal s SER 254 Ca 0.00 -1.17 -0.29 0.00 1.31 0.00 0.00 55.95 55.80 2oal s SER 254 Cb 0.00 0.46 0.07 0.00 0.21 0.00 0.00 66.02 66.76 2oal s SER 254 CO 0.00 -0.96 0.69 0.00 0.41 0.00 0.00 173.24 173.38 2oal s ALA 255 N -4.09 -1.77 -0.19 1.44 0.00 -0.35 -0.99 121.76 115.81 2oal s ALA 255 Ca 0.31 1.54 0.01 0.00 0.00 0.00 0.00 51.96 53.82 2oal s ALA 255 Cb 0.04 -0.37 0.03 0.00 0.00 0.00 0.00 23.12 22.82 2oal s ALA 255 CO 0.10 -0.36 -0.14 0.14 0.00 0.00 0.00 175.76 175.50 2oal s VAL 256 N -0.69 1.81 0.13 0.00 -7.23 -0.81 0.21 120.40 113.82 2oal s VAL 256 Ca -0.08 -0.97 0.04 0.00 -1.81 0.00 0.00 61.98 59.16 2oal s VAL 256 Cb -0.02 -1.77 -0.04 0.00 0.56 0.00 0.00 36.38 35.11 2oal s VAL 256 CO 0.07 0.32 -0.10 0.00 -0.31 0.00 0.00 175.10 175.08 2oal s ALA 257 N 1.35 1.38 0.36 1.32 0.00 0.50 -0.72 121.76 125.96 2oal s ALA 257 Ca 0.01 -1.42 -0.16 0.00 0.00 0.00 0.00 51.96 50.39 2oal s ALA 257 Cb -0.15 0.04 0.05 0.00 0.00 0.00 0.00 23.12 23.05 2oal s ALA 257 CO -0.10 -0.07 0.76 -0.08 0.00 0.00 0.00 175.76 176.27 2oal s THR 258 N -3.08 0.00 -0.07 0.00 -1.32 -0.58 -0.37 115.64 110.22 2oal s THR 258 Ca 0.14 -1.02 0.04 0.00 -1.21 0.00 0.00 61.69 59.64 2oal s THR 258 Cb 0.01 -2.71 -0.01 0.00 -1.51 0.00 0.00 72.50 68.28 2oal s THR 258 CO 0.00 0.00 -0.20 -1.58 -2.21 0.00 0.00 174.62 170.63 2oal s GLN 259 N -2.64 2.73 -0.11 7.08 0.74 -1.26 -2.01 119.66 124.19 2oal s GLN 259 Ca 0.15 -0.82 0.03 0.00 0.05 0.00 0.00 55.36 54.78 2oal s GLN 259 Cb -0.05 -2.31 0.00 0.00 1.10 0.00 0.00 33.01 31.76 2oal s GLN 259 CO 0.11 0.39 -0.23 0.08 -0.55 0.00 0.00 175.29 175.09 2oal s VAL 260 N -0.16 2.02 0.51 1.34 1.01 -0.65 -4.98 120.40 119.50 2oal s VAL 260 Ca -0.03 -0.98 -0.23 0.00 0.00 0.00 0.00 61.98 60.74 2oal s VAL 260 Cb -0.14 -1.77 -0.06 0.00 0.00 0.00 0.00 36.38 34.41 2oal s VAL 260 CO 0.04 0.55 1.40 -2.84 0.00 0.00 0.00 175.10 174.24 2oal s PRO 261 N 0.52 3.35 -0.01 2.72 0.02 -1.26 -1.34 135.00 139.00 2oal s PRO 261 Ca -0.15 2.33 0.00 0.00 0.02 0.00 0.00 61.00 63.21 2oal s PRO 261 Cb -0.17 -2.42 0.02 0.00 0.02 0.00 0.00 34.50 31.95 2oal s PRO 261 CO 0.05 -1.06 0.02 -1.58 -0.33 0.00 0.00 177.00 174.10 2oal s HIS 262 N -1.25 0.02 -0.85 6.54 2.46 0.68 -4.81 115.29 118.08 2oal s HIS 262 Ca 0.67 0.07 -0.21 0.00 0.47 0.00 0.00 55.06 56.07 2oal s HIS 262 Cb -0.42 -0.12 0.10 0.00 -0.13 0.00 0.00 32.58 32.00 2oal s HIS 262 CO 0.52 -0.05 1.11 0.34 -2.47 0.00 0.00 174.74 174.19 2oal s ASP 263 N 0.56 6.46 0.26 9.88 -1.08 -1.26 -4.21 116.67 127.28 2oal s ASP 263 Ca -0.05 -1.61 -0.00 0.00 -0.52 0.00 0.00 52.55 50.37 2oal s ASP 263 Cb -0.07 -2.43 0.35 0.00 -1.46 0.00 0.00 42.92 39.32 2oal s ASP 263 CO -0.02 -1.25 1.73 0.44 0.52 0.00 0.00 175.17 176.59 2oal h ASP 264 N 9.20 0.63 -0.86 -0.34 3.32 -1.91 -1.98 116.42 124.47 2oal h ASP 264 Ca 0.01 -0.19 0.04 0.00 0.02 0.00 0.00 57.03 56.91 2oal h ASP 264 Cb 1.04 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 40.37 2oal h ASP 264 CO 1.17 0.80 0.57 0.44 -1.72 0.00 0.00 179.24 180.50 2oal h ASP 265 N 0.58 0.92 0.77 6.45 3.32 -1.89 1.18 116.42 127.75 2oal h ASP 265 Ca 0.10 -0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.06 2oal h ASP 265 Cb 0.59 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2oal h ASP 265 CO 0.04 0.63 -1.29 0.00 -1.72 0.00 0.00 179.24 176.90 2oal n ALA 266 N -2.40 2.26 -0.08 3.45 0.00 -1.15 -4.48 120.51 118.10 2oal n ALA 266 Ca 0.11 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2oal n ALA 266 Cb 0.11 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.57 2oal n ALA 266 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2oal n ASN 267 N -2.74 0.51 -0.76 0.00 3.02 -0.76 -5.13 115.26 109.41 2oal n ASN 267 Ca -0.05 -0.77 0.07 0.00 -0.03 0.00 0.00 54.58 53.81 2oal n ASN 267 Cb 0.69 0.35 -0.02 0.00 -0.61 0.00 0.00 39.78 40.20 2oal n ASN 267 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oal n GLY 268 N 0.35 -1.83 3.14 7.41 0.00 0.40 -4.83 105.19 109.84 2oal n GLY 268 Ca 0.00 -1.26 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 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 -1.11 1.82 -0.05 1.61 1.01 -1.26 -4.61 120.40 117.81 2oal s VAL 269 Ca 0.00 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.83 2oal s VAL 269 Cb 0.00 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2oal s VAL 269 CO 0.00 0.50 1.37 -1.61 0.00 0.00 0.00 175.10 175.36 2oal s GLU 270 N 0.70 4.27 -0.13 2.72 2.02 -1.26 -4.50 118.70 122.52 2oal s GLU 270 Ca -0.11 1.87 -0.02 0.00 0.02 0.00 0.00 54.97 56.73 2oal s GLU 270 Cb -0.16 -3.66 0.01 0.00 0.10 0.00 0.00 34.13 30.42 2oal s GLU 270 CO 0.02 -0.61 2.38 -0.35 0.02 0.00 0.00 175.26 176.72 2oal n PRO 271 N 5.81 1.54 -3.47 0.39 -0.04 -1.26 -4.76 135.00 133.21 2oal n PRO 271 Ca 0.13 -0.83 -0.10 0.00 -0.04 0.00 0.00 63.50 62.66 2oal n PRO 271 Cb 0.44 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 32.42 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 -0.47 -0.44 0.08 0.54 -0.12 -1.25 -0.67 117.98 115.65 2oal s PHE 272 Ca 0.26 0.31 -0.14 0.00 -0.05 0.00 0.00 56.93 57.31 2oal s PHE 272 Cb 0.16 0.54 -0.06 0.00 -0.63 0.00 0.00 43.02 43.03 2oal s PHE 272 CO -0.02 -0.66 0.48 0.99 -0.05 0.00 0.00 175.22 175.96 2oal s THR 273 N -3.23 4.93 -0.08 -4.49 2.01 -0.36 -4.55 115.64 109.88 2oal s THR 273 Ca 0.02 0.82 0.00 0.00 0.31 0.00 0.00 61.69 62.85 2oal s THR 273 Cb -0.01 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 2oal s THR 273 CO -0.09 0.40 -0.07 -0.44 -0.69 0.00 0.00 174.62 173.73 2oal s SER 274 N -1.45 4.65 -0.36 3.53 0.01 -0.40 -0.19 113.70 119.49 2oal s SER 274 Ca 0.32 -0.05 0.04 0.00 1.31 0.00 0.00 55.95 57.57 2oal s SER 274 Cb -0.16 -1.29 0.10 0.00 0.21 0.00 0.00 66.02 64.89 2oal s SER 274 CO 0.17 0.33 0.08 0.00 0.41 0.00 0.00 173.24 174.23 2oal s ALA 275 N -0.59 2.96 -0.38 1.44 0.00 -0.31 -1.10 121.76 123.78 2oal s ALA 275 Ca 0.09 -2.63 -0.18 0.00 0.00 0.00 0.00 51.96 49.24 2oal s ALA 275 Cb -0.12 -2.00 0.01 0.00 0.00 0.00 0.00 23.12 21.01 2oal s ALA 275 CO 0.02 -1.73 0.50 0.42 0.00 0.00 0.00 175.76 174.97 2oal s ILE 276 N 0.76 5.02 0.30 0.00 1.01 0.99 -1.24 121.20 128.04 2oal s ILE 276 Ca 0.12 0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.58 2oal s ILE 276 Cb -0.20 -4.01 -0.11 0.00 0.01 0.00 0.00 42.46 38.15 2oal s ILE 276 CO -0.07 -0.31 1.59 0.00 0.00 0.00 0.00 174.94 176.14 2oal s ALA 277 N 2.37 3.73 0.04 9.38 0.00 0.06 0.14 121.76 137.48 2oal s ALA 277 Ca 0.17 1.57 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2oal s ALA 277 Cb -0.16 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2oal s ALA 277 CO 0.14 -0.99 0.00 -1.33 0.00 0.00 0.00 175.76 173.58 2oal n MET 278 N 2.01 1.83 0.08 0.00 0.00 0.32 -4.60 117.12 116.75 2oal n MET 278 Ca 0.07 -0.31 -0.12 0.00 0.00 0.00 0.00 57.70 57.34 2oal n MET 278 Cb 0.38 0.08 -0.05 0.00 0.00 0.00 0.00 33.22 33.62 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 0.31 -0.56 0.03 1.57 -1.88 -3.36 116.57 112.68 2oal h LYS 279 Ca -0.03 -0.37 -0.36 0.00 -1.87 0.00 0.00 60.65 58.01 2oal h LYS 279 Cb 0.11 0.11 -0.41 0.00 0.08 0.00 0.00 32.23 32.12 2oal h LYS 279 CO 0.06 1.07 -1.00 0.43 -0.57 0.00 0.00 179.45 179.44 2oal n SER 280 N -3.68 2.91 0.00 0.86 7.64 -1.26 -4.46 113.62 115.63 2oal n SER 280 Ca -0.06 -2.72 0.00 0.00 1.01 0.00 0.00 58.87 57.10 2oal n SER 280 Cb 0.86 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 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 -0.64 -0.16 3.43 0.23 0.00 -1.26 -2.48 105.19 104.31 2oal n GLY 281 Ca 0.22 -0.79 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.12 -0.05 1.61 1.48 -0.37 -0.52 118.94 116.97 2oal s TRP 282 Ca 0.00 -0.22 0.05 0.00 -1.06 0.00 0.00 56.10 54.87 2oal s TRP 282 Cb 0.00 0.31 -0.00 0.00 -1.16 0.00 0.00 33.47 32.62 2oal s TRP 282 CO 0.00 -0.83 -0.20 0.99 -4.06 0.00 0.00 176.95 172.85 2oal s THR 283 N -3.85 1.66 0.19 0.66 2.01 0.12 0.00 115.64 116.43 2oal s THR 283 Ca 0.08 -0.84 -0.03 0.00 0.31 0.00 0.00 61.69 61.20 2oal s THR 283 Cb 0.00 -1.42 -0.05 0.00 0.01 0.00 0.00 72.50 71.05 2oal s THR 283 CO -0.06 0.47 0.42 -1.66 -0.69 0.00 0.00 174.62 173.10 2oal s TRP 284 N 0.01 3.48 -0.14 4.92 -2.14 -0.09 -0.01 118.94 124.97 2oal s TRP 284 Ca -0.05 0.50 -0.03 0.00 2.66 0.00 0.00 56.10 59.18 2oal s TRP 284 Cb -0.13 -1.97 0.05 0.00 -3.10 0.00 0.00 33.47 28.32 2oal s TRP 284 CO 0.03 0.36 0.03 0.21 -2.66 0.00 0.00 176.95 174.92 2oal s LYS 285 N -3.07 0.53 -0.46 3.25 2.20 -0.26 -2.43 119.74 119.50 2oal s LYS 285 Ca 0.41 -0.14 0.03 0.00 -0.36 0.00 0.00 55.97 55.90 2oal s LYS 285 Cb -0.11 -1.58 0.12 0.00 -1.51 0.00 0.00 37.83 34.75 2oal s LYS 285 CO 0.27 -0.50 0.20 0.42 -0.36 0.00 0.00 175.35 175.38 2oal s ILE 286 N 1.95 2.62 0.26 5.43 1.01 0.17 -1.28 121.20 131.37 2oal s ILE 286 Ca 0.02 -2.90 -0.30 0.00 0.00 0.00 0.00 60.65 57.47 2oal s ILE 286 Cb -0.15 -2.84 -0.11 0.00 0.01 0.00 0.00 42.46 39.37 2oal s ILE 286 CO -0.07 -0.73 1.56 -2.84 0.00 0.00 0.00 174.94 172.86 2oal s PRO 287 N 0.20 4.17 0.00 2.79 0.02 -1.26 -0.50 135.00 140.42 2oal s PRO 287 Ca 0.14 2.49 0.00 0.00 0.02 0.00 0.00 61.00 63.66 2oal s PRO 287 Cb -0.23 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.23 2oal s PRO 287 CO -0.03 -0.59 0.00 -1.33 -0.33 0.00 0.00 177.00 174.72 2oal n MET 288 N 2.50 1.02 -2.66 5.54 2.81 0.12 -4.68 117.12 121.77 2oal n MET 288 Ca 0.09 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.55 2oal n MET 288 Cb 0.38 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.86 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 3.73 0.00 4.03 1.02 -1.26 -3.72 118.68 122.49 2oal s LEU 289 Ca 0.00 0.40 0.00 0.00 0.02 0.00 0.00 54.13 54.55 2oal s LEU 289 Cb 0.00 -3.46 0.00 0.00 0.02 0.00 0.00 46.19 42.75 2oal s LEU 289 CO 0.00 -1.19 0.00 0.61 0.02 0.00 0.00 176.35 175.79 2oal n GLY 290 N 4.84 0.45 3.71 -3.19 0.00 -1.26 -4.95 105.19 104.79 2oal n GLY 290 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.44 0.86 -0.02 1.61 3.03 -1.24 -0.23 118.95 122.52 2oal s ARG 291 Ca 0.00 -0.48 -0.02 0.00 2.03 0.00 0.00 55.73 57.26 2oal s ARG 291 Cb 0.00 0.29 0.01 0.00 -1.03 0.00 0.00 34.95 34.22 2oal s ARG 291 CO 0.00 -0.39 0.05 -0.59 -1.13 0.00 0.00 175.30 173.23 2oal s PHE 292 N -2.86 -0.05 0.28 5.89 -0.12 -0.45 0.11 117.98 120.78 2oal s PHE 292 Ca 0.14 0.13 -0.20 0.00 -0.05 0.00 0.00 56.93 56.96 2oal s PHE 292 Cb 0.01 0.01 -0.09 0.00 -0.63 0.00 0.00 43.02 42.32 2oal s PHE 292 CO -0.00 -0.03 0.78 0.20 -0.05 0.00 0.00 175.22 176.12 2oal s GLY 293 N 0.09 2.55 -0.05 1.99 0.00 0.34 -1.63 107.32 110.62 2oal s GLY 293 Ca -0.01 0.21 -0.16 0.00 0.00 0.00 0.00 44.72 44.75 2oal s GLY 293 CO -0.00 0.53 0.38 -1.08 0.00 0.00 0.00 173.10 172.93 2oal s THR 294 N -1.70 0.04 -0.25 0.90 -1.32 -0.85 0.43 115.64 112.88 2oal s THR 294 Ca 0.48 -0.30 -0.22 0.00 -1.21 0.00 0.00 61.69 60.44 2oal s THR 294 Cb -0.15 -0.65 0.07 0.00 -1.51 0.00 0.00 72.50 70.26 2oal s THR 294 CO 0.20 -0.16 0.67 -0.83 -2.21 0.00 0.00 174.62 172.28 2oal s GLY 295 N -0.92 -0.52 -0.41 6.08 0.00 -1.02 -1.52 107.32 109.01 2oal s GLY 295 Ca -0.10 1.95 -0.19 0.00 0.00 0.00 0.00 44.72 46.39 2oal s GLY 295 CO 0.04 1.73 0.53 -0.47 0.00 0.00 0.00 173.10 174.93 2oal s TYR 296 N 0.54 3.13 -0.22 1.90 5.04 0.11 -0.91 117.35 126.93 2oal s TYR 296 Ca -0.01 -0.16 -0.20 0.00 -2.44 0.00 0.00 57.07 54.26 2oal s TYR 296 Cb -0.05 -3.07 -0.03 0.00 0.35 0.00 0.00 41.96 39.17 2oal s TYR 296 CO -0.02 -0.74 0.59 0.08 -1.34 0.00 0.00 175.55 174.12 2oal s VAL 297 N 2.44 5.04 0.25 3.14 1.01 0.10 -1.92 120.40 130.45 2oal s VAL 297 Ca 0.17 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.23 2oal s VAL 297 Cb -0.16 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2oal s VAL 297 CO 0.16 0.10 0.21 -0.72 0.00 0.00 0.00 175.10 174.85 2oal s TYR 298 N 2.06 1.26 -0.29 5.22 1.13 -0.16 -1.24 117.35 125.33 2oal s TYR 298 Ca 0.26 -1.40 -0.11 0.00 -1.41 0.00 0.00 57.07 54.41 2oal s TYR 298 Cb -0.16 -0.52 -0.04 0.00 -1.10 0.00 0.00 41.96 40.14 2oal s TYR 298 CO 0.09 -0.75 0.18 0.45 -2.51 0.00 0.00 175.55 173.01 2oal s SER 299 N -3.21 5.89 0.54 -0.18 0.15 -1.03 -1.43 113.70 114.43 2oal s SER 299 Ca 0.38 -0.13 0.36 0.00 0.70 0.00 0.00 55.95 57.25 2oal s SER 299 Cb 0.05 -2.09 1.93 0.00 -1.71 0.00 0.00 66.02 64.20 2oal s SER 299 CO 0.16 -0.09 2.09 0.77 1.20 0.00 0.00 173.24 177.37 2oal h SER 300 N 8.37 0.00 0.42 5.45 4.64 -1.80 0.31 113.55 130.94 2oal h SER 300 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2oal h SER 300 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2oal h SER 300 CO 0.57 0.00 -0.09 0.54 -0.87 0.00 0.00 176.83 176.98 2oal n ARG 301 N -2.77 0.60 0.00 4.77 1.74 -1.26 -3.99 116.66 115.76 2oal n ARG 301 Ca -0.02 -0.17 0.00 0.00 -0.77 0.00 0.00 57.85 56.89 2oal n ARG 301 Cb 0.08 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 2oal n ARG 301 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2oal n PHE 302 N -1.06 0.00 -3.71 -1.55 3.01 0.05 -5.05 117.46 109.16 2oal n PHE 302 Ca 0.14 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.47 2oal n PHE 302 Cb 0.27 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.64 2oal n PHE 302 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2oal s ALA 303 N -0.69 -1.17 0.69 4.37 0.00 -0.92 -4.96 121.76 119.07 2oal s ALA 303 Ca 0.00 1.39 -0.11 0.00 0.00 0.00 0.00 51.96 53.24 2oal s ALA 303 Cb 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 23.12 22.31 2oal s ALA 303 CO 0.00 -0.23 1.08 0.95 0.00 0.00 0.00 175.76 177.56 2oal s THR 304 N 0.43 3.74 0.25 0.00 -4.23 -1.26 -4.35 115.64 110.22 2oal s THR 304 Ca -0.01 0.56 -0.04 0.00 -1.18 0.00 0.00 61.69 61.01 2oal s THR 304 Cb -0.04 -3.56 0.23 0.00 1.34 0.00 0.00 72.50 70.48 2oal s THR 304 CO -0.02 -0.74 1.86 -0.08 -0.54 0.00 0.00 174.62 175.11 2oal h GLU 305 N -0.58 1.00 -0.64 3.99 4.81 -1.98 -1.24 114.58 119.94 2oal h GLU 305 Ca -0.45 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 58.65 2oal h GLU 305 Cb 1.24 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 2oal h GLU 305 CO 0.63 0.66 0.12 -0.44 -0.73 0.00 0.00 179.01 179.26 2oal h ASP 306 N 1.04 0.99 -0.68 1.04 3.32 -1.99 0.13 116.42 120.27 2oal h ASP 306 Ca 0.40 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 2oal h ASP 306 Cb 0.18 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 2oal h ASP 306 CO -0.18 0.97 0.12 -0.33 -1.72 0.00 0.00 179.24 178.11 2oal h GLU 307 N 0.98 1.12 -0.35 3.56 5.08 -1.75 -0.26 114.58 122.95 2oal h GLU 307 Ca 0.20 -0.29 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 2oal h GLU 307 Cb 0.39 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2oal h GLU 307 CO 0.01 1.01 0.00 0.00 -1.00 0.00 0.00 179.01 179.03 2oal h ALA 308 N 1.06 0.47 -0.32 3.43 0.00 -0.84 0.97 119.26 124.03 2oal h ALA 308 Ca 0.21 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2oal h ALA 308 Cb 0.43 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2oal h ALA 308 CO 0.01 0.23 0.14 0.28 0.00 0.00 0.00 179.25 179.91 2oal h VAL 309 N 0.42 0.97 0.77 0.00 2.07 -0.52 0.81 116.25 120.77 2oal h VAL 309 Ca 0.10 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2oal h VAL 309 Cb 0.45 0.64 0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2oal h VAL 309 CO 0.02 0.06 -0.37 0.03 0.02 0.00 0.00 177.57 177.32 2oal h ARG 310 N 0.31 -0.99 -0.87 1.57 3.08 -0.86 0.03 114.38 116.64 2oal h ARG 310 Ca 0.13 0.07 0.15 0.00 0.07 0.00 0.00 59.98 60.40 2oal h ARG 310 Cb 0.06 0.23 -0.09 0.00 0.08 0.00 0.00 29.97 30.25 2oal h ARG 310 CO -0.10 -0.65 0.46 0.93 -1.07 0.00 0.00 179.97 179.54 2oal h GLU 311 N -1.08 0.64 0.33 0.04 5.08 -0.71 0.74 114.58 119.63 2oal h GLU 311 Ca -0.11 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 2oal h GLU 311 Cb 0.80 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.91 2oal h GLU 311 CO 0.17 0.43 -0.16 0.35 -1.00 0.00 0.00 179.01 178.80 2oal h PHE 312 N 0.66 -0.42 -0.86 4.33 3.57 -0.70 -2.93 116.94 120.60 2oal h PHE 312 Ca 0.47 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.94 2oal h PHE 312 Cb 0.65 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.48 2oal h PHE 312 CO -0.08 -0.09 0.46 0.00 -2.23 0.00 0.00 178.31 176.36 2oal h GLU 314 N 1.21 0.00 0.00 0.00 5.08 -0.88 0.15 114.58 120.13 2oal h GLU 314 Ca 0.30 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.47 2oal h GLU 314 Cb 0.05 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2oal h GLU 314 CO -0.05 0.05 -1.24 0.00 -1.00 0.00 0.00 179.01 176.77 2oal h MET 315 N 0.00 0.00 -0.44 2.33 -0.00 -1.27 -3.29 114.93 112.26 2oal h MET 315 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2oal h MET 315 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.83 2oal h MET 315 CO 0.01 0.49 0.00 0.91 -0.00 0.00 0.00 176.91 178.32 2oal n TRP 316 N -3.07 0.57 -3.70 -0.10 5.03 -0.98 -4.50 117.44 110.70 2oal n TRP 316 Ca -0.08 -0.33 -0.22 0.00 3.03 0.00 0.00 57.50 59.90 2oal n TRP 316 Cb 0.89 -0.00 0.04 0.00 -1.03 0.00 0.00 31.31 31.20 2oal n TRP 316 CO 0.00 0.00 0.00 0.72 -0.03 0.00 0.00 177.69 178.38 2oal n HIS 317 N 1.33 -2.06 -4.02 -5.99 8.25 0.28 -4.99 115.22 108.02 2oal n HIS 317 Ca 0.19 0.87 -0.22 0.00 -0.26 0.00 0.00 57.72 58.30 2oal n HIS 317 Cb 0.56 -4.43 -0.05 0.00 1.12 0.00 0.00 29.99 27.19 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 -6.78 3.62 -0.34 2.41 1.43 0.13 -5.02 118.68 114.14 2oal s LEU 318 Ca 0.14 -0.43 -0.13 0.00 -1.03 0.00 0.00 54.13 52.68 2oal s LEU 318 Cb -0.07 -2.18 -0.02 0.00 0.03 0.00 0.00 46.19 43.96 2oal s LEU 318 CO 0.80 -0.17 0.26 -0.62 0.23 0.00 0.00 176.35 176.85 2oal s ASP 319 N -3.88 6.08 0.30 2.29 2.15 -1.26 -4.51 116.67 117.83 2oal s ASP 319 Ca 0.36 -0.38 0.05 0.00 0.43 0.00 0.00 52.55 53.01 2oal s ASP 319 Cb -0.06 -2.15 0.71 0.00 -0.30 0.00 0.00 42.92 41.12 2oal s ASP 319 CO 0.25 -0.24 1.78 -0.65 -0.17 0.00 0.00 175.17 176.13 2oal h PRO 320 N 8.48 0.76 0.00 4.34 0.11 -1.92 0.17 132.00 143.93 2oal h PRO 320 Ca -0.31 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.67 2oal h PRO 320 Cb 1.16 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2oal h PRO 320 CO 0.64 0.50 -0.41 0.93 -0.21 0.00 0.00 178.00 179.45 2oal h GLU 321 N 0.78 0.00 0.00 1.05 4.39 -2.01 -3.36 114.58 115.43 2oal h GLU 321 Ca 0.57 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.26 2oal h GLU 321 Cb 0.85 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.50 2oal h GLU 321 CO -0.37 0.41 -1.16 0.25 -1.16 0.00 0.00 179.01 176.98 2oal n THR 322 N -4.04 0.03 -1.97 1.13 -2.24 -0.89 -5.01 114.28 101.28 2oal n THR 322 Ca -0.02 -0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 2oal n THR 322 Cb 0.44 0.25 -0.03 0.00 -2.10 0.00 0.00 70.33 68.89 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 -2.21 4.21 0.08 -0.78 2.00 0.54 -4.93 119.66 118.56 2oal s GLN 323 Ca -0.01 2.27 -0.31 0.00 -2.00 0.00 0.00 55.36 55.31 2oal s GLN 323 Cb 0.02 -3.66 -0.08 0.00 0.80 0.00 0.00 33.01 30.09 2oal s GLN 323 CO 0.14 -0.73 1.58 -1.25 -0.50 0.00 0.00 175.29 174.53 2oal s PRO 324 N 2.85 4.22 -0.01 1.67 0.04 -1.26 -4.92 135.00 137.59 2oal s PRO 324 Ca 0.73 2.26 0.04 0.00 0.04 0.00 0.00 61.00 64.07 2oal s PRO 324 Cb -0.38 -3.51 -0.01 0.00 0.04 0.00 0.00 34.50 30.65 2oal s PRO 324 CO 0.31 -0.67 -0.14 -0.51 0.04 0.00 0.00 177.00 176.03 2oal s LEU 325 N 2.28 2.02 -0.26 -3.56 1.43 -1.26 -4.66 118.68 114.67 2oal s LEU 325 Ca 0.71 -0.25 -0.09 0.00 -1.03 0.00 0.00 54.13 53.47 2oal s LEU 325 Cb -0.39 -0.72 -0.04 0.00 0.03 0.00 0.00 46.19 45.07 2oal s LEU 325 CO 0.31 0.17 0.12 0.20 0.23 0.00 0.00 176.35 177.38 2oal s ASN 326 N -0.31 5.56 -0.31 2.29 0.01 0.50 -4.95 114.94 117.73 2oal s ASN 326 Ca 0.05 -0.10 -0.08 0.00 -0.71 0.00 0.00 52.86 52.02 2oal s ASN 326 Cb -0.06 -2.01 0.01 0.00 0.41 0.00 0.00 41.25 39.60 2oal s ASN 326 CO -0.00 -0.02 0.12 -0.13 -1.51 0.00 0.00 177.10 175.55 2oal s ARG 327 N 1.58 3.14 0.01 -0.60 0.52 -1.26 -0.37 118.95 121.97 2oal s ARG 327 Ca 0.06 -0.84 0.06 0.00 -0.52 0.00 0.00 55.73 54.50 2oal s ARG 327 Cb -0.15 -3.47 -0.03 0.00 0.52 0.00 0.00 34.95 31.82 2oal s ARG 327 CO 0.06 -0.46 -0.17 0.42 0.02 0.00 0.00 175.30 175.17 2oal s ILE 328 N 1.54 2.83 -0.13 1.52 1.01 0.13 -5.00 121.20 123.11 2oal s ILE 328 Ca 0.03 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.63 2oal s ILE 328 Cb -0.17 -2.16 0.02 0.00 0.01 0.00 0.00 42.46 40.16 2oal s ILE 328 CO 0.04 0.42 -0.13 -0.60 0.00 0.00 0.00 174.94 174.67 2oal s ARG 329 N -1.21 2.15 0.18 2.79 6.06 -1.26 -1.21 118.95 126.45 2oal s ARG 329 Ca 0.14 -0.51 0.09 0.00 -2.50 0.00 0.00 55.73 52.94 2oal s ARG 329 Cb -0.10 -1.95 -0.04 0.00 0.06 0.00 0.00 34.95 32.91 2oal s ARG 329 CO 0.04 -0.19 -0.18 -0.59 -2.50 0.00 0.00 175.30 171.88 2oal s PHE 330 N 1.36 1.85 -0.01 5.12 -0.12 -0.48 -5.02 117.98 120.69 2oal s PHE 330 Ca 0.01 -0.47 -0.14 0.00 -0.05 0.00 0.00 56.93 56.28 2oal s PHE 330 Cb -0.13 -0.90 -0.06 0.00 -0.63 0.00 0.00 43.02 41.30 2oal s PHE 330 CO -0.07 0.37 0.39 -0.98 -0.05 0.00 0.00 175.22 174.88 2oal s ARG 331 N -3.00 3.89 -0.19 1.99 1.70 -1.26 -4.72 118.95 117.37 2oal s ARG 331 Ca 0.18 0.38 -0.03 0.00 -0.47 0.00 0.00 55.73 55.79 2oal s ARG 331 Cb -0.05 -3.22 -0.01 0.00 -0.57 0.00 0.00 34.95 31.10 2oal s ARG 331 CO 0.07 0.69 -0.07 0.08 -1.08 0.00 0.00 175.30 175.00 2oal s VAL 332 N -1.06 3.30 -4.27 4.99 1.01 -1.26 -4.58 120.40 118.52 2oal s VAL 332 Ca 0.23 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.67 2oal s VAL 332 Cb -0.16 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.75 2oal s VAL 332 CO 0.13 0.46 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2oal n GLY 333 N 4.31 0.69 3.52 4.51 0.00 -0.74 -0.65 105.19 116.82 2oal n GLY 333 Ca -0.18 -1.54 -0.10 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.00 1.38 0.63 1.61 1.70 -0.96 -1.03 118.95 120.28 2oal s ARG 334 Ca 0.00 -0.77 -0.17 0.00 -0.47 0.00 0.00 55.73 54.32 2oal s ARG 334 Cb 0.00 0.54 -0.01 0.00 -0.57 0.00 0.00 34.95 34.91 2oal s ARG 334 CO 0.00 -0.59 1.15 -0.80 -1.08 0.00 0.00 175.30 173.97 2oal s ASN 335 N -2.84 5.12 0.36 -2.89 0.01 -0.53 0.54 114.94 114.70 2oal s ASN 335 Ca 0.07 2.17 0.06 0.00 -0.71 0.00 0.00 52.86 54.45 2oal s ASN 335 Cb -0.01 -2.57 0.75 0.00 0.41 0.00 0.00 41.25 39.83 2oal s ASN 335 CO -0.05 -1.63 1.93 -0.09 -1.51 0.00 0.00 177.10 175.76 2oal h ARG 336 N 0.40 0.73 -3.07 -0.60 2.43 -1.49 -3.40 114.38 109.39 2oal h ARG 336 Ca -0.48 -0.04 -0.23 0.00 -0.81 0.00 0.00 59.98 58.41 2oal h ARG 336 Cb 1.27 -0.16 -0.32 0.00 -0.42 0.00 0.00 29.97 30.33 2oal h ARG 336 CO 0.54 0.48 -0.56 1.03 -1.51 0.00 0.00 179.97 179.96 2oal s ARG 337 N -5.68 0.13 0.29 0.20 0.52 -1.26 -5.05 118.95 108.09 2oal s ARG 337 Ca -0.10 0.53 0.09 0.00 -0.52 0.00 0.00 55.73 55.73 2oal s ARG 337 Cb 0.20 -0.15 0.42 0.00 0.52 0.00 0.00 34.95 35.94 2oal s ARG 337 CO 0.78 -0.22 1.66 0.00 0.02 0.00 0.00 175.30 177.54 2oal h ALA 338 N 7.66 1.05 -3.14 2.13 0.00 -1.88 -3.42 119.26 121.66 2oal h ALA 338 Ca -0.31 -0.48 -0.60 0.00 0.00 0.00 0.00 54.91 53.52 2oal h ALA 338 Cb 1.13 -0.09 -0.36 0.00 0.00 0.00 0.00 17.79 18.48 2oal h ALA 338 CO 0.30 0.66 -0.83 -0.46 0.00 0.00 0.00 179.25 178.92 2oal s TRP 339 N -3.87 2.11 -0.07 0.00 -0.11 -1.26 -1.21 118.94 114.52 2oal s TRP 339 Ca -0.03 -1.19 0.02 0.00 1.22 0.00 0.00 56.10 56.12 2oal s TRP 339 Cb 0.13 -1.56 0.01 0.00 -1.50 0.00 0.00 33.47 30.55 2oal s TRP 339 CO 0.77 -0.66 -0.14 0.08 -4.62 0.00 0.00 176.95 172.38 2oal s VAL 340 N 1.51 1.28 0.00 5.86 1.01 -0.28 -4.94 120.40 124.84 2oal s VAL 340 Ca 0.05 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2oal s VAL 340 Cb -0.13 -1.16 0.00 0.00 0.00 0.00 0.00 36.38 35.09 2oal s VAL 340 CO -0.10 0.39 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2oal n GLY 341 N 3.84 3.89 1.60 4.51 0.00 -1.26 -0.75 105.19 117.01 2oal n GLY 341 Ca -0.22 0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 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 7.08 3.29 -4.04 1.61 6.94 -1.26 -4.92 115.26 123.96 2oal n ASN 342 Ca 0.00 -3.60 -0.31 0.00 -0.02 0.00 0.00 54.58 50.65 2oal n ASN 342 Cb 0.00 -0.71 -0.16 0.00 -2.36 0.00 0.00 39.78 36.55 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 1.37 3.20 -0.06 0.00 1.01 0.07 -1.12 120.40 124.88 2oal s VAL 344 Ca 0.02 -0.57 -0.17 0.00 0.00 0.00 0.00 61.98 61.25 2oal s VAL 344 Cb -0.15 -2.41 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 2oal s VAL 344 CO -0.10 0.47 0.46 -0.94 0.00 0.00 0.00 175.10 174.99 2oal s SER 345 N 0.98 6.77 -0.05 3.32 1.04 -0.35 -0.31 113.70 125.09 2oal s SER 345 Ca -0.01 0.91 0.01 0.00 0.48 0.00 0.00 55.95 57.34 2oal s SER 345 Cb -0.15 -2.28 0.02 0.00 0.10 0.00 0.00 66.02 63.72 2oal s SER 345 CO -0.00 0.15 -0.04 -0.63 0.98 0.00 0.00 173.24 173.70 2oal s ILE 346 N -0.17 0.52 0.00 -1.02 -1.09 -0.66 -4.69 121.20 114.10 2oal s ILE 346 Ca 0.25 -0.08 0.00 0.00 -2.23 0.00 0.00 60.65 58.59 2oal s ILE 346 Cb -0.16 -0.57 0.00 0.00 -1.58 0.00 0.00 42.46 40.15 2oal s ILE 346 CO 0.12 0.24 0.00 0.61 -1.23 0.00 0.00 174.94 174.68 2oal n GLY 347 N 4.28 -0.53 0.07 6.18 0.00 -1.26 -4.33 105.19 109.61 2oal n GLY 347 Ca -0.21 -1.87 0.09 0.00 0.00 0.00 0.00 46.02 44.03 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 0.97 0.29 2.61 -2.24 -1.26 -1.09 114.28 113.56 2oal n THR 348 Ca 0.00 0.28 0.15 0.00 -2.27 0.00 0.00 64.05 62.21 2oal n THR 348 Cb 0.00 -1.14 0.53 0.00 -2.10 0.00 0.00 70.33 67.62 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 -1.74 -3.34 113.55 116.53 2oal h SER 349 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 2oal h SER 349 Cb 0.28 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.35 2oal h SER 349 CO 0.00 0.00 -1.29 -0.24 -0.87 0.00 0.00 176.83 174.43 2oal n SER 350 N -2.99 1.90 -3.74 4.97 2.88 -0.25 -4.74 113.62 111.65 2oal n SER 350 Ca 0.02 0.42 -0.09 0.00 -1.33 0.00 0.00 58.87 57.89 2oal n SER 350 Cb 0.36 -0.83 -0.02 0.00 -0.75 0.00 0.00 64.21 62.97 2oal n SER 350 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2oal s PHE 352 N -3.87 -0.46 -0.03 0.00 2.19 -0.19 -4.07 117.98 111.55 2oal s PHE 352 Ca 0.09 0.95 -0.11 0.00 0.33 0.00 0.00 56.93 58.19 2oal s PHE 352 Cb -0.04 0.40 0.02 0.00 -1.31 0.00 0.00 43.02 42.09 2oal s PHE 352 CO 0.01 -0.32 0.23 0.54 1.83 0.00 0.00 175.22 177.51 2oal s VAL 353 N -0.47 0.05 0.54 3.12 0.11 -1.26 -1.80 120.40 120.69 2oal s VAL 353 Ca -0.00 -0.44 -0.18 0.00 -2.93 0.00 0.00 61.98 58.43 2oal s VAL 353 Cb -0.03 -0.49 -0.10 0.00 -1.53 0.00 0.00 36.38 34.24 2oal s VAL 353 CO -0.01 -0.24 0.40 -1.84 -3.33 0.00 0.00 175.10 170.08 2oal n GLU 354 N 1.75 0.42 0.00 1.54 0.28 -1.26 -4.77 120.64 118.59 2oal n GLU 354 Ca -0.20 0.16 0.00 0.00 -0.16 0.00 0.00 57.16 56.96 2oal n GLU 354 Cb 0.56 -1.55 0.00 0.00 1.43 0.00 0.00 31.44 31.89 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 0.32 0.64 0.28 3.44 -0.04 -1.26 -4.42 135.00 133.96 2oal n PRO 355 Ca 0.11 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.71 2oal n PRO 355 Cb 0.47 -1.18 0.84 0.00 -0.04 0.00 0.00 33.50 33.58 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 1.33 0.00 -2.90 1.53 5.85 -2.01 -2.88 115.31 116.22 2oal h LEU 356 Ca 0.00 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2oal h LEU 356 Cb 0.63 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.55 2oal h LEU 356 CO 0.00 0.04 -0.57 -0.62 -0.34 0.00 0.00 178.44 176.94 2oal n GLU 357 N -3.86 0.94 -3.84 1.25 -0.58 -1.26 -5.03 120.64 108.26 2oal n GLU 357 Ca -0.03 -2.60 -0.38 0.00 -0.42 0.00 0.00 57.16 53.73 2oal n GLU 357 Cb 0.13 -1.04 0.04 0.00 -0.57 0.00 0.00 31.44 30.00 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 -0.61 -4.88 -0.05 1.62 7.64 -1.09 -4.91 113.62 111.34 2oal n SER 358 Ca 0.13 -1.13 0.05 0.00 1.01 0.00 0.00 58.87 58.93 2oal n SER 358 Cb 0.81 -2.70 -0.04 0.00 -1.01 0.00 0.00 64.21 61.27 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 -4.53 0.00 0.06 0.44 -2.24 -1.26 -4.43 114.28 102.31 2oal n THR 359 Ca -0.10 -0.29 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 2oal n THR 359 Cb 0.58 1.03 -0.09 0.00 -2.10 0.00 0.00 70.33 69.75 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 2.33 -1.17 1.46 3.38 0.00 -1.90 0.15 103.07 107.31 2oal h GLY 360 Ca 0.00 0.65 -0.09 0.00 0.00 0.00 0.00 47.33 47.89 2oal h GLY 360 CO 0.00 -0.28 -0.16 -2.22 0.00 0.00 0.00 176.54 173.88 2oal h ILE 361 N -0.59 1.25 -0.67 2.60 2.04 -1.89 -2.81 117.51 117.44 2oal h ILE 361 Ca 0.01 -1.17 0.06 0.00 1.00 0.00 0.00 64.86 64.75 2oal h ILE 361 Cb 0.63 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.81 2oal h ILE 361 CO -0.30 0.39 0.37 0.22 0.00 0.00 0.00 178.15 178.83 2oal h TYR 362 N 0.58 0.68 -0.31 1.37 3.20 -1.72 -1.06 116.97 119.71 2oal h TYR 362 Ca 0.10 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.05 2oal h TYR 362 Cb 0.60 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 2oal h TYR 362 CO 0.03 0.33 0.22 0.74 -1.64 0.00 0.00 178.16 177.83 2oal h PHE 363 N 0.69 0.17 0.39 -3.82 0.04 -0.45 -0.04 116.94 113.92 2oal h PHE 363 Ca 0.30 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.05 2oal h PHE 363 Cb 0.18 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.28 2oal h PHE 363 CO -0.08 0.09 -0.19 0.28 -0.60 0.00 0.00 178.31 177.82 2oal h VAL 364 N 0.17 0.31 0.00 -0.55 2.07 -1.18 -2.29 116.25 114.78 2oal h VAL 364 Ca 0.14 -0.66 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 2oal h VAL 364 Cb 0.34 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 2oal h VAL 364 CO -0.02 0.07 -0.15 0.10 0.02 0.00 0.00 177.57 177.58 2oal h TYR 365 N -1.04 0.00 -0.36 1.57 -0.00 -1.37 -0.87 116.97 114.90 2oal h TYR 365 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.55 2oal h TYR 365 Cb 0.51 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.23 2oal h TYR 365 CO 0.02 0.15 -0.27 0.00 -0.00 0.00 0.00 178.16 178.07 2oal h ALA 366 N 1.85 0.52 -0.29 0.10 0.00 -1.09 -0.34 119.26 120.02 2oal h ALA 366 Ca -0.00 -0.40 -0.14 0.00 0.00 0.00 0.00 54.91 54.36 2oal h ALA 366 Cb 0.77 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2oal h ALA 366 CO 0.02 0.53 -0.41 0.00 0.00 0.00 0.00 179.25 179.40 2oal h ALA 367 N 0.77 0.74 -0.50 0.00 0.00 -1.10 -1.96 119.26 117.21 2oal h ALA 367 Ca 0.07 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 2oal h ALA 367 Cb 0.84 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2oal h ALA 367 CO 0.07 0.66 -0.08 -0.07 0.00 0.00 0.00 179.25 179.83 2oal h LEU 368 N 0.57 0.89 -0.62 0.00 3.38 -1.05 0.84 115.31 119.33 2oal h LEU 368 Ca 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 2oal h LEU 368 Cb 0.95 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2oal h LEU 368 CO 0.09 1.00 0.34 0.22 0.09 0.00 0.00 178.44 180.18 2oal h TYR 369 N 0.82 0.84 -0.17 1.13 5.03 -0.86 -1.98 116.97 121.78 2oal h TYR 369 Ca 0.14 -0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.32 2oal h TYR 369 Cb 0.60 -0.27 -0.01 0.00 1.55 0.00 0.00 36.73 38.60 2oal h TYR 369 CO 0.04 0.60 -0.39 1.96 -1.32 0.00 0.00 178.16 179.04 2oal h GLN 370 N 0.84 0.38 -0.43 1.82 1.08 -0.99 -1.85 115.11 115.96 2oal h GLN 370 Ca 0.22 -0.18 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 2oal h GLN 370 Cb 0.03 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.44 2oal h GLN 370 CO -0.04 0.72 0.10 1.25 -0.95 0.00 0.00 178.83 179.91 2oal h LEU 371 N 0.32 0.65 -0.73 1.46 5.85 -0.35 -0.24 115.31 122.28 2oal h LEU 371 Ca 0.03 -0.24 -0.10 0.00 0.84 0.00 0.00 57.88 58.42 2oal h LEU 371 Cb 0.83 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2oal h LEU 371 CO 0.07 0.72 -0.07 0.58 -0.34 0.00 0.00 178.44 179.39 2oal h VAL 372 N 0.56 1.26 -0.50 1.05 2.07 -1.30 0.28 116.25 119.66 2oal h VAL 372 Ca 0.13 -1.17 -0.07 0.00 0.82 0.00 0.00 66.70 66.41 2oal h VAL 372 Cb 0.33 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 2oal h VAL 372 CO 0.00 0.41 0.02 0.50 0.02 0.00 0.00 177.57 178.52 2oal h LYS 373 N 0.82 0.83 -0.60 1.57 3.64 -1.07 -2.64 116.57 119.12 2oal h LYS 373 Ca 0.14 -0.22 -0.15 0.00 -1.27 0.00 0.00 60.65 59.14 2oal h LYS 373 Cb 0.59 -0.10 -0.09 0.00 -0.41 0.00 0.00 32.23 32.22 2oal h LYS 373 CO 0.04 0.83 0.16 0.72 -2.27 0.00 0.00 179.45 178.93 2oal n HIS 374 N -4.22 2.02 -1.68 1.91 8.25 -0.12 -5.02 115.22 116.36 2oal n HIS 374 Ca 0.03 -1.14 -0.45 0.00 -0.26 0.00 0.00 57.72 55.90 2oal n HIS 374 Cb 0.30 -0.59 -0.03 0.00 1.12 0.00 0.00 29.99 30.79 2oal n HIS 374 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2oal n PHE 375 N -0.25 2.29 -3.00 4.41 7.35 0.95 -4.76 117.46 124.45 2oal n PHE 375 Ca 0.36 0.33 -0.13 0.00 -0.76 0.00 0.00 57.45 57.25 2oal n PHE 375 Cb 1.25 -2.51 0.05 0.00 0.35 0.00 0.00 39.48 38.61 2oal n PHE 375 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2oal n PRO 376 N 2.70 0.70 -3.00 -7.13 -0.04 -1.26 -5.07 135.00 121.91 2oal n PRO 376 Ca 0.14 -2.13 -0.13 0.00 -0.04 0.00 0.00 63.50 61.34 2oal n PRO 376 Cb 0.31 -0.18 -0.02 0.00 -0.04 0.00 0.00 33.50 33.57 2oal n PRO 376 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2oal n ASP 377 N -2.56 2.46 0.02 3.54 5.75 -1.26 -4.54 116.55 119.96 2oal n ASP 377 Ca 0.11 -1.88 0.04 0.00 -0.01 0.00 0.00 54.79 53.05 2oal n ASP 377 Cb 0.41 0.12 0.19 0.00 -1.03 0.00 0.00 41.12 40.81 2oal n ASP 377 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2oal n LYS 378 N -0.58 0.02 0.04 0.11 5.02 0.54 -1.38 118.16 121.92 2oal n LYS 378 Ca -0.08 0.41 0.13 0.00 -2.02 0.00 0.00 58.31 56.76 2oal n LYS 378 Cb 0.26 -1.55 0.47 0.00 -0.02 0.00 0.00 35.03 34.18 2oal n LYS 378 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2oal n SER 379 N -1.60 0.36 -3.65 4.39 3.41 -1.26 -4.78 113.62 110.49 2oal n SER 379 Ca 0.01 0.39 -0.27 0.00 -0.26 0.00 0.00 58.87 58.75 2oal n SER 379 Cb 0.08 -0.43 0.02 0.00 -0.26 0.00 0.00 64.21 63.63 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 -1.78 -2.97 -4.63 1.04 4.77 -0.48 -4.76 117.00 108.20 2oal n LEU 380 Ca 0.06 -0.89 -0.53 0.00 -0.03 0.00 0.00 56.01 54.63 2oal n LEU 380 Cb 0.37 -2.27 -0.06 0.00 -2.33 0.00 0.00 43.42 39.13 2oal n LEU 380 CO 0.30 0.23 1.51 -3.20 -1.33 0.00 0.00 177.39 174.91 2oal n ASN 381 N -2.46 2.63 -0.25 -1.43 2.85 -1.26 -4.82 115.26 110.51 2oal n ASN 381 Ca -0.13 0.86 0.22 0.00 -0.11 0.00 0.00 54.58 55.41 2oal n ASN 381 Cb 0.60 -1.24 0.56 0.00 1.24 0.00 0.00 39.78 40.94 2oal n ASN 381 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2oal h PRO 382 N 9.29 0.30 -0.65 1.20 0.11 -2.01 -1.77 132.00 138.47 2oal h PRO 382 Ca -0.41 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.62 2oal h PRO 382 Cb 1.31 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 2oal h PRO 382 CO 0.98 0.20 0.19 0.28 -0.21 0.00 0.00 178.00 179.43 2oal h VAL 383 N 0.31 1.25 -0.49 3.15 2.07 -1.99 -0.72 116.25 119.82 2oal h VAL 383 Ca 0.49 -0.86 -0.12 0.00 0.82 0.00 0.00 66.70 67.03 2oal h VAL 383 Cb 1.38 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 2oal h VAL 383 CO -0.16 0.33 -0.16 -0.07 0.02 0.00 0.00 177.57 177.53 2oal h LEU 384 N 0.97 0.97 -0.24 2.57 3.38 -1.66 -1.82 115.31 119.48 2oal h LEU 384 Ca 0.21 -0.34 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 2oal h LEU 384 Cb 0.30 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 2oal h LEU 384 CO -0.01 1.11 0.01 0.74 0.09 0.00 0.00 178.44 180.39 2oal h THR 385 N 0.85 1.25 -0.84 0.22 2.02 -1.46 -1.77 112.91 113.18 2oal h THR 385 Ca 0.12 -0.87 -0.02 0.00 0.77 0.00 0.00 66.41 66.41 2oal h THR 385 Cb 0.72 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 68.43 2oal h THR 385 CO 0.05 0.27 0.45 0.00 0.37 0.00 0.00 175.52 176.66 2oal h ALA 386 N 0.82 1.08 -0.40 6.16 0.00 -1.04 -0.68 119.26 125.20 2oal h ALA 386 Ca 0.07 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2oal h ALA 386 Cb 0.39 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2oal h ALA 386 CO 0.01 0.60 -0.14 0.00 0.00 0.00 0.00 179.25 179.72 2oal h ARG 387 N 1.18 0.79 -0.01 0.00 2.47 -1.26 -1.30 114.38 116.25 2oal h ARG 387 Ca 0.29 -0.33 0.01 0.00 -1.26 0.00 0.00 59.98 58.70 2oal h ARG 387 Cb 0.05 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.33 2oal h ARG 387 CO -0.04 0.95 -0.03 0.35 0.56 0.00 0.00 179.97 181.75 2oal h PHE 388 N 0.60 -0.07 -0.86 3.04 3.57 -1.05 -1.08 116.94 121.09 2oal h PHE 388 Ca 0.09 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.68 2oal h PHE 388 Cb 0.68 0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.40 2oal h PHE 388 CO 0.05 -0.05 0.56 -0.91 -2.23 0.00 0.00 178.31 175.74 2oal h ASN 389 N -0.04 0.80 -0.57 0.41 2.35 -1.00 -1.18 115.58 116.35 2oal h ASN 389 Ca 0.02 0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 2oal h ASN 389 Cb 0.07 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 2oal h ASN 389 CO -0.04 0.49 -0.00 -0.09 -1.65 0.00 0.00 177.43 176.14 2oal h ARG 390 N 0.90 1.00 -0.70 0.81 9.65 -0.61 -1.47 114.38 123.96 2oal h ARG 390 Ca 0.39 -0.32 -0.07 0.00 -1.10 0.00 0.00 59.98 58.87 2oal h ARG 390 Cb 0.32 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.78 2oal h ARG 390 CO -0.15 1.00 0.16 0.93 2.80 0.00 0.00 179.97 184.70 2oal h GLU 391 N 0.89 1.14 -0.08 0.20 4.39 -0.08 -2.43 114.58 118.61 2oal h GLU 391 Ca 0.16 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 2oal h GLU 391 Cb 0.55 -0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.05 2oal h GLU 391 CO 0.03 1.01 0.00 0.82 -1.16 0.00 0.00 179.01 179.71 2oal h ILE 392 N 1.07 1.25 -0.99 3.13 1.08 -1.11 -1.48 117.51 120.46 2oal h ILE 392 Ca 0.22 -0.78 0.01 0.00 -0.39 0.00 0.00 64.86 63.93 2oal h ILE 392 Cb 0.39 1.62 -0.05 0.00 -3.07 0.00 0.00 36.82 35.72 2oal h ILE 392 CO 0.01 0.22 0.66 1.05 -0.69 0.00 0.00 178.15 179.39 2oal h GLU 393 N -0.15 1.29 -0.11 2.37 4.11 -1.19 0.06 114.58 120.97 2oal h GLU 393 Ca 0.02 -0.08 -0.17 0.00 0.07 0.00 0.00 59.36 59.20 2oal h GLU 393 Cb 0.34 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2oal h GLU 393 CO 0.00 0.86 -0.65 1.79 0.07 0.00 0.00 179.01 181.08 2oal h THR 394 N 1.33 1.36 -0.04 -1.06 1.35 -1.43 0.12 112.91 114.54 2oal h THR 394 Ca 0.37 -2.00 -0.00 0.00 -0.55 0.00 0.00 66.41 64.23 2oal h THR 394 Cb -0.14 1.98 -0.00 0.00 -1.73 0.00 0.00 68.15 68.27 2oal h THR 394 CO -0.08 0.61 0.03 -0.03 -0.25 0.00 0.00 175.52 175.79 2oal h MET 395 N 0.31 0.06 0.20 4.72 1.85 -0.65 -1.52 114.93 119.89 2oal h MET 395 Ca -0.02 -0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 59.06 2oal h MET 395 Cb 1.21 -0.01 0.00 0.00 0.43 0.00 0.00 31.60 33.23 2oal h MET 395 CO 0.11 0.08 -0.09 0.35 -0.40 0.00 0.00 176.91 176.96 2oal h PHE 396 N 0.02 -0.25 -0.60 1.39 3.57 -0.92 -3.11 116.94 117.04 2oal h PHE 396 Ca 0.01 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.57 2oal h PHE 396 Cb 0.04 0.08 -0.04 0.00 2.79 0.00 0.00 35.95 38.82 2oal h PHE 396 CO -0.06 0.14 0.40 -0.44 -2.23 0.00 0.00 178.31 176.11 2oal h ASP 397 N -0.70 0.50 -0.38 0.41 5.19 -0.79 0.58 116.42 121.23 2oal h ASP 397 Ca -0.03 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.29 2oal h ASP 397 Cb 0.49 -0.11 -0.02 0.00 0.18 0.00 0.00 39.33 39.88 2oal h ASP 397 CO 0.04 0.32 -0.11 0.44 -3.12 0.00 0.00 179.24 176.81 2oal h ASP 398 N 0.57 0.82 0.04 6.45 5.19 -1.33 -1.82 116.42 126.34 2oal h ASP 398 Ca 0.26 -0.25 -0.23 0.00 -0.62 0.00 0.00 57.03 56.19 2oal h ASP 398 Cb 0.30 -0.22 0.01 0.00 0.18 0.00 0.00 39.33 39.60 2oal h ASP 398 CO -0.08 0.95 -0.89 0.74 -3.12 0.00 0.00 179.24 176.84 2oal h THR 399 N 0.74 1.31 -0.65 0.35 2.02 -1.22 -2.42 112.91 113.05 2oal h THR 399 Ca 0.12 -2.17 0.06 0.00 0.77 0.00 0.00 66.41 65.20 2oal h THR 399 Cb 0.61 2.21 -0.06 0.00 -1.74 0.00 0.00 68.15 69.18 2oal h THR 399 CO 0.04 0.67 0.35 -0.09 0.37 0.00 0.00 175.52 176.86 2oal h ARG 400 N 0.41 0.63 -0.16 6.66 2.43 -0.78 0.31 114.38 123.87 2oal h ARG 400 Ca -0.08 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.02 2oal h ARG 400 Cb 1.53 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.93 2oal h ARG 400 CO 0.17 0.41 -0.01 -0.44 -1.51 0.00 0.00 179.97 178.59 2oal h ASP 401 N 0.65 0.28 -0.50 -3.80 3.32 -1.32 -1.09 116.42 113.97 2oal h ASP 401 Ca 0.29 -0.33 0.05 0.00 0.02 0.00 0.00 57.03 57.06 2oal h ASP 401 Cb 0.20 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 39.63 2oal h ASP 401 CO -0.19 0.55 0.23 0.15 -1.72 0.00 0.00 179.24 178.26 2oal h PHE 402 N 0.01 0.41 -0.66 4.55 3.57 -1.06 -1.67 116.94 122.10 2oal h PHE 402 Ca 0.04 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 2oal h PHE 402 Cb 0.41 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 2oal h PHE 402 CO 0.04 0.18 0.16 0.82 -2.23 0.00 0.00 178.31 177.29 2oal h ILE 403 N 0.45 1.26 -0.30 1.41 2.04 -0.87 -2.44 117.51 119.06 2oal h ILE 403 Ca 0.23 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.15 2oal h ILE 403 Cb 0.17 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2oal h ILE 403 CO -0.18 0.36 0.19 -0.61 0.00 0.00 0.00 178.15 177.91 2oal h GLN 404 N 0.98 0.39 0.00 2.37 4.15 -0.56 -1.23 115.11 121.20 2oal h GLN 404 Ca 0.21 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.59 2oal h GLN 404 Cb 0.36 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.96 2oal h GLN 404 CO 0.00 0.26 -0.09 0.00 -1.93 0.00 0.00 178.83 177.08 2oal h ALA 405 N 1.81 1.83 -0.42 3.38 0.00 -0.82 0.86 119.26 125.90 2oal h ALA 405 Ca 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2oal h ALA 405 Cb -0.04 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2oal h ALA 405 CO -0.02 0.11 0.10 0.45 0.00 0.00 0.00 179.25 179.88 2oal h HIS 406 N 0.00 0.64 0.09 0.00 3.86 -1.20 -2.53 115.15 116.01 2oal h HIS 406 Ca -0.00 -0.05 -0.34 0.00 -1.16 0.00 0.00 60.37 58.82 2oal h HIS 406 Cb 0.15 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 2oal h HIS 406 CO 0.00 0.55 -1.89 1.19 0.86 0.00 0.00 177.93 178.64 2oal n PHE 407 N -4.31 1.12 -0.15 2.45 3.72 -0.70 -3.87 117.46 115.71 2oal n PHE 407 Ca 0.03 0.28 0.04 0.00 -0.05 0.00 0.00 57.45 57.75 2oal n PHE 407 Cb 0.20 -1.14 0.33 0.00 -0.94 0.00 0.00 39.48 37.93 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 -0.18 0.77 -0.66 1.38 3.20 -0.89 -2.90 116.97 117.69 2oal h TYR 408 Ca -0.42 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.46 2oal h TYR 408 Cb 1.87 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 39.88 2oal h TYR 408 CO 0.08 0.45 0.00 1.19 -1.64 0.00 0.00 178.16 178.24 2oal n PHE 409 N -4.46 0.88 -2.31 -3.82 3.72 -0.96 -4.72 117.46 105.79 2oal n PHE 409 Ca 0.08 -0.45 -0.40 0.00 -0.05 0.00 0.00 57.45 56.63 2oal n PHE 409 Cb 0.12 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.63 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 -1.09 6.92 0.22 4.37 0.15 -1.10 -4.74 113.70 118.43 2oal s SER 410 Ca 0.46 2.43 0.25 0.00 0.70 0.00 0.00 55.95 59.80 2oal s SER 410 Cb 0.25 -2.63 0.88 0.00 -1.71 0.00 0.00 66.02 62.81 2oal s SER 410 CO 0.33 -0.40 1.76 -0.81 1.20 0.00 0.00 173.24 175.31 2oal n PRO 411 N 0.79 0.23 -1.77 5.44 -0.04 -1.26 -4.90 135.00 133.48 2oal n PRO 411 Ca 0.01 0.28 -0.41 0.00 -0.04 0.00 0.00 63.50 63.33 2oal n PRO 411 Cb 0.44 -1.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.09 2oal n PRO 411 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2oal n ARG 412 N -2.22 2.63 -0.25 0.54 1.74 -1.26 -4.91 116.66 112.92 2oal n ARG 412 Ca 0.04 0.92 0.00 0.00 -0.77 0.00 0.00 57.85 58.05 2oal n ARG 412 Cb 0.36 -2.65 0.00 0.00 -1.02 0.00 0.00 32.46 29.14 2oal n ARG 412 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2oal n THR 413 N 0.37 0.00 0.47 0.55 -2.24 -1.26 -4.44 114.28 107.73 2oal n THR 413 Ca 0.02 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.92 2oal n THR 413 Cb 0.39 0.67 0.45 0.00 -2.10 0.00 0.00 70.33 69.74 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 -4.53 3.42 2.03 -1.94 -3.44 116.42 111.95 2oal h ASP 414 Ca 0.00 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 56.03 2oal h ASP 414 Cb 1.18 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 39.54 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 -3.25 0.69 0.28 1.15 -4.23 -1.26 -5.01 115.64 104.02 2oal s THR 415 Ca 0.07 -1.97 -0.01 0.00 -1.18 0.00 0.00 61.69 58.60 2oal s THR 415 Cb 0.10 -1.96 0.28 0.00 1.34 0.00 0.00 72.50 72.26 2oal s THR 415 CO 0.51 -0.62 1.89 -0.65 -0.54 0.00 0.00 174.62 175.22 2oal h PRO 416 N 2.79 1.09 0.42 3.99 0.11 -1.89 -2.07 132.00 136.43 2oal h PRO 416 Ca -0.36 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 2oal h PRO 416 Cb 1.19 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 2oal h PRO 416 CO 0.63 0.72 -0.33 0.35 -0.21 0.00 0.00 178.00 179.16 2oal h PHE 417 N 1.12 -0.89 -0.22 0.65 3.57 -1.93 0.21 116.94 119.44 2oal h PHE 417 Ca 0.42 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.89 2oal h PHE 417 Cb 0.18 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 2oal h PHE 417 CO -0.00 -0.49 0.00 -1.49 -2.23 0.00 0.00 178.31 174.10 2oal h TRP 418 N -0.75 0.33 0.01 0.41 4.06 -1.72 -1.91 115.95 116.36 2oal h TRP 418 Ca -0.04 -0.02 -0.19 0.00 2.06 0.00 0.00 58.89 60.70 2oal h TRP 418 Cb 0.65 -0.10 -0.01 0.00 -1.00 0.00 0.00 29.16 28.70 2oal h TRP 418 CO -0.16 0.34 -0.88 0.00 -3.56 0.00 0.00 178.44 174.18 2oal h ARG 419 N 0.32 0.15 -0.37 0.49 3.08 -1.16 -3.23 114.38 113.66 2oal h ARG 419 Ca 0.07 -0.17 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 2oal h ARG 419 Cb 0.21 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2oal h ARG 419 CO 0.00 0.93 -0.14 0.00 -1.07 0.00 0.00 179.97 179.69 2oal h ALA 420 N 1.01 1.07 -0.08 0.04 0.00 0.16 -2.83 119.26 118.63 2oal h ALA 420 Ca -0.04 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.58 2oal h ALA 420 Cb 1.51 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2oal h ALA 420 CO 0.13 0.57 0.07 -0.91 0.00 0.00 0.00 179.25 179.10 2oal h ASN 421 N 0.60 0.00 1.48 0.00 2.35 -1.41 -0.09 115.58 118.51 2oal h ASN 421 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2oal h ASN 421 Cb 0.59 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.96 2oal h ASN 421 CO 0.04 0.00 -0.03 0.11 -1.65 0.00 0.00 177.43 175.90 2oal h LYS 422 N 0.00 0.00 0.00 0.81 1.57 -1.62 -3.14 116.57 114.19 2oal h LYS 422 Ca 0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 2oal h LYS 422 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2oal h LYS 422 CO -0.00 0.00 -0.46 0.93 -0.57 0.00 0.00 179.45 179.35 2oal h GLU 423 N 0.00 0.00 -7.27 3.15 5.08 -1.05 -3.46 114.58 111.03 2oal h GLU 423 Ca 0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 2oal h GLU 423 Cb 0.76 0.00 0.18 0.00 0.50 0.00 0.00 28.75 30.19 2oal h GLU 423 CO 0.00 0.46 0.13 -0.51 -1.00 0.00 0.00 179.01 178.09 2oal s LEU 424 N -6.47 1.37 -0.10 1.33 1.43 -1.18 -5.04 118.68 110.02 2oal s LEU 424 Ca 0.04 1.37 0.00 0.00 -1.03 0.00 0.00 54.13 54.51 2oal s LEU 424 Cb 0.08 -3.47 -0.02 0.00 0.03 0.00 0.00 46.19 42.81 2oal s LEU 424 CO 0.74 -3.53 -0.10 -0.60 0.23 0.00 0.00 176.35 173.08 2oal s ARG 425 N -4.76 3.08 0.28 1.70 3.52 -1.26 -5.09 118.95 116.43 2oal s ARG 425 Ca 0.66 -0.62 -0.22 0.00 -0.13 0.00 0.00 55.73 55.43 2oal s ARG 425 Cb -0.21 -2.61 -0.09 0.00 -1.56 0.00 0.00 34.95 30.47 2oal s ARG 425 CO 0.60 0.42 0.82 -0.51 -0.81 0.00 0.00 175.30 175.83 2oal s LEU 426 N -0.18 4.28 0.69 -0.88 1.43 -1.26 -4.78 118.68 117.98 2oal s LEU 426 Ca 0.01 1.57 -0.16 0.00 -1.03 0.00 0.00 54.13 54.52 2oal s LEU 426 Cb -0.13 -3.86 0.02 0.00 0.03 0.00 0.00 46.19 42.25 2oal s LEU 426 CO 0.03 -0.06 1.21 0.00 0.23 0.00 0.00 176.35 177.77 2oal s ALA 427 N -1.65 2.24 0.26 4.21 0.00 -1.26 -4.70 121.76 120.86 2oal s ALA 427 Ca 0.48 0.93 -0.01 0.00 0.00 0.00 0.00 51.96 53.36 2oal s ALA 427 Cb -0.16 -3.47 0.56 0.00 0.00 0.00 0.00 23.12 20.05 2oal s ALA 427 CO 0.21 -1.69 1.73 -0.44 0.00 0.00 0.00 175.76 175.57 2oal h ASP 428 N 0.03 0.40 -0.92 0.00 3.32 -1.99 -0.36 116.42 116.90 2oal h ASP 428 Ca -0.48 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.68 2oal h ASP 428 Cb 1.30 0.07 -0.04 0.00 0.22 0.00 0.00 39.33 40.87 2oal h ASP 428 CO 0.51 0.13 0.57 1.23 -1.72 0.00 0.00 179.24 179.96 2oal h GLY 429 N 0.51 1.33 1.21 2.75 0.00 -2.00 -0.97 103.07 105.91 2oal h GLY 429 Ca 0.47 -0.55 -0.17 0.00 0.00 0.00 0.00 47.33 47.09 2oal h GLY 429 CO -0.42 0.53 -0.47 1.98 0.00 0.00 0.00 176.54 178.16 2oal h MET 430 N 1.27 0.84 -0.82 4.80 1.85 -1.52 -2.43 114.93 118.92 2oal h MET 430 Ca 0.33 -0.49 0.00 0.00 -0.61 0.00 0.00 59.70 58.94 2oal h MET 430 Cb -0.07 0.04 -0.04 0.00 0.43 0.00 0.00 31.60 31.96 2oal h MET 430 CO -0.06 1.12 0.53 0.37 -0.40 0.00 0.00 176.91 178.47 2oal h GLN 431 N 0.67 1.09 -0.78 0.39 5.75 -0.71 -0.66 115.11 120.86 2oal h GLN 431 Ca 0.04 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 2oal h GLN 431 Cb 1.05 -0.24 -0.04 0.00 1.07 0.00 0.00 27.48 29.33 2oal h GLN 431 CO 0.11 0.74 0.36 1.49 -2.65 0.00 0.00 178.83 178.87 2oal h GLU 432 N 1.12 1.13 -0.66 1.69 4.81 -1.04 -0.29 114.58 121.35 2oal h GLU 432 Ca 0.30 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 2oal h GLU 432 Cb -0.10 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.05 2oal h GLU 432 CO -0.06 0.89 0.08 0.87 -0.73 0.00 0.00 179.01 180.06 2oal h LYS 433 N 1.12 1.11 -0.56 1.92 1.57 -0.86 -1.46 116.57 119.42 2oal h LYS 433 Ca 0.27 -0.31 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 2oal h LYS 433 Cb 0.14 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 2oal h LYS 433 CO -0.03 1.03 0.09 0.82 -0.57 0.00 0.00 179.45 180.79 2oal h ILE 434 N 1.03 1.25 -0.51 1.86 1.08 -0.67 -0.03 117.51 121.52 2oal h ILE 434 Ca 0.20 -0.97 0.01 0.00 -0.39 0.00 0.00 64.86 63.71 2oal h ILE 434 Cb 0.47 0.81 -0.03 0.00 -3.07 0.00 0.00 36.82 35.00 2oal h ILE 434 CO 0.02 0.35 0.33 0.44 -0.69 0.00 0.00 178.15 178.60 2oal h ASP 435 N 0.81 0.56 -0.44 1.72 3.32 -0.82 0.89 116.42 122.46 2oal h ASP 435 Ca 0.17 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.22 2oal h ASP 435 Cb 0.41 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 2oal h ASP 435 CO 0.01 0.40 0.29 0.24 -1.72 0.00 0.00 179.24 178.46 2oal h MET 436 N 0.67 0.57 -0.27 3.56 2.86 -0.97 -1.72 114.93 119.63 2oal h MET 436 Ca 0.19 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.81 2oal h MET 436 Cb -0.05 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 2oal h MET 436 CO -0.06 0.38 0.14 -0.92 1.06 0.00 0.00 176.91 177.52 2oal h TYR 437 N 0.59 0.27 0.00 -0.22 3.20 -0.39 -1.16 116.97 119.26 2oal h TYR 437 Ca 0.17 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 2oal h TYR 437 Cb -0.05 -0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.13 2oal h TYR 437 CO -0.05 0.15 -0.04 0.00 -1.64 0.00 0.00 178.16 176.59 2oal h ARG 438 N 0.30 0.00 -0.38 1.82 3.08 -0.53 -1.56 114.38 117.11 2oal h ARG 438 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2oal h ARG 438 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 2oal h ARG 438 CO -0.07 0.04 0.00 0.00 -1.07 0.00 0.00 179.97 178.87 2oal n ALA 439 N -2.17 2.44 -0.82 0.04 0.00 -0.67 -0.89 120.51 118.44 2oal n ALA 439 Ca -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 53.44 52.74 2oal n ALA 439 Cb 0.17 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 1.13 0.74 3.85 0.00 0.00 -0.59 -4.75 105.19 105.57 2oal n GLY 440 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.18 3.96 0.46 1.61 -1.94 -0.51 -4.60 119.30 118.09 2oal s MET 441 Ca 0.00 0.80 -0.17 0.00 -1.71 0.00 0.00 55.69 54.61 2oal s MET 441 Cb 0.00 -2.26 -0.09 0.00 2.01 0.00 0.00 34.83 34.49 2oal s MET 441 CO 0.00 -0.09 0.92 0.00 -0.01 0.00 0.00 175.02 175.84 2oal s ALA 442 N -2.37 3.11 -0.23 3.03 0.00 -1.26 -4.22 121.76 119.83 2oal s ALA 442 Ca 0.57 0.20 -0.06 0.00 0.00 0.00 0.00 51.96 52.67 2oal s ALA 442 Cb -0.10 -3.05 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 2oal s ALA 442 CO 0.26 -0.03 0.02 0.42 0.00 0.00 0.00 175.76 176.42 2oal s ILE 443 N -2.39 3.94 -1.28 0.00 1.01 -1.26 -4.65 121.20 116.57 2oal s ILE 443 Ca 0.59 -0.30 -0.22 0.00 0.00 0.00 0.00 60.65 60.71 2oal s ILE 443 Cb -0.10 -2.81 0.02 0.00 0.01 0.00 0.00 42.46 39.59 2oal s ILE 443 CO 0.24 0.39 0.55 0.59 0.00 0.00 0.00 174.94 176.71 2oal n ASN 444 N 4.67 -3.01 -4.77 3.58 4.13 -1.26 0.13 115.26 118.74 2oal n ASN 444 Ca -0.17 -1.21 -0.39 0.00 1.68 0.00 0.00 54.58 54.49 2oal n ASN 444 Cb 0.51 -2.13 -0.01 0.00 -1.54 0.00 0.00 39.78 36.61 2oal n ASN 444 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2oal s ALA 445 N -3.72 3.21 0.19 5.41 0.00 -1.26 -2.88 121.76 122.71 2oal s ALA 445 Ca 0.35 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.19 2oal s ALA 445 Cb -0.17 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.39 2oal s ALA 445 CO 0.95 -0.79 1.25 -1.25 0.00 0.00 0.00 175.76 175.92 2oal s PRO 446 N -2.29 4.44 0.56 0.00 0.04 -1.26 -4.86 135.00 131.63 2oal s PRO 446 Ca 0.58 1.96 0.34 0.00 0.04 0.00 0.00 61.00 63.92 2oal s PRO 446 Cb -0.37 -3.22 1.48 0.00 0.04 0.00 0.00 34.50 32.44 2oal s PRO 446 CO 0.47 -0.17 1.78 0.00 0.04 0.00 0.00 177.00 179.12 2oal h ALA 447 N 5.28 2.90 -2.33 8.56 0.00 -1.99 -3.40 119.26 128.27 2oal h ALA 447 Ca -0.45 -0.04 -0.21 0.00 0.00 0.00 0.00 54.91 54.22 2oal h ALA 447 Cb 1.21 0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.93 2oal h ALA 447 CO 0.76 -1.31 -0.66 0.45 0.00 0.00 0.00 179.25 178.48 2oal s SER 448 N -5.04 0.69 -0.28 0.00 0.15 -1.26 -5.07 113.70 102.90 2oal s SER 448 Ca -0.05 -1.14 0.10 0.00 0.70 0.00 0.00 55.95 55.56 2oal s SER 448 Cb 0.20 0.20 0.50 0.00 -1.71 0.00 0.00 66.02 65.22 2oal s SER 448 CO 0.72 -0.63 1.45 -0.90 1.20 0.00 0.00 173.24 175.08 2oal n ASP 449 N -0.09 2.54 -4.31 5.45 5.75 -1.26 -4.91 116.55 119.71 2oal n ASP 449 Ca -0.08 -3.72 -0.46 0.00 -0.01 0.00 0.00 54.79 50.52 2oal n ASP 449 Cb 0.63 -0.62 -0.05 0.00 -1.03 0.00 0.00 41.12 40.05 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 -2.53 6.25 0.31 -1.12 -1.08 -1.26 -4.91 116.67 112.33 2oal s ASP 450 Ca 0.44 -1.90 0.07 0.00 -0.52 0.00 0.00 52.55 50.64 2oal s ASP 450 Cb 0.40 -2.21 0.84 0.00 -1.46 0.00 0.00 42.92 40.49 2oal s ASP 450 CO 0.00 -0.82 1.68 0.00 0.52 0.00 0.00 175.17 176.54 2oal h ALA 451 N 8.75 1.57 -0.17 3.66 0.00 -1.98 -2.35 119.26 128.73 2oal h ALA 451 Ca -0.25 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2oal h ALA 451 Cb 1.09 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2oal h ALA 451 CO 1.00 -0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.82 2oal n GLN 452 N -5.08 0.00 -0.25 0.00 -0.00 -1.26 0.91 117.38 111.70 2oal n GLN 452 Ca 0.25 0.86 -0.02 0.00 -0.00 0.00 0.00 57.00 58.09 2oal n GLN 452 Cb 0.76 -1.47 0.04 0.00 -0.00 0.00 0.00 30.24 29.57 2oal n GLN 452 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 2oal h LEU 453 N 0.00 -1.02 0.00 2.61 3.38 -1.83 0.21 115.31 118.66 2oal h LEU 453 Ca 0.00 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2oal h LEU 453 Cb 0.00 0.56 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2oal h LEU 453 CO 0.00 -0.28 0.00 0.00 0.09 0.00 0.00 178.44 178.25 2oal n TYR 454 N -5.46 0.00 0.27 1.13 9.36 -0.39 -0.45 117.16 121.62 2oal n TYR 454 Ca 0.07 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.32 2oal n TYR 454 Cb 0.37 -0.14 0.15 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 -1.09 0.00 0.02 2.98 4.01 0.26 -2.10 117.16 121.24 2oal n TYR 455 Ca 0.00 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.84 2oal n TYR 455 Cb 0.00 -0.31 -0.15 0.00 -0.31 0.00 0.00 39.34 38.57 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 -0.80 -0.89 3.14 2.72 0.00 0.73 -4.60 105.19 105.50 2oal n GLY 456 Ca 0.03 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 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 -4.20 4.89 0.10 1.61 3.04 0.41 -4.93 114.94 115.86 2oal s ASN 457 Ca -0.07 -1.50 -0.23 0.00 0.04 0.00 0.00 52.86 51.11 2oal s ASN 457 Cb 0.13 -1.70 -0.13 0.00 -1.54 0.00 0.00 41.25 38.00 2oal s ASN 457 CO 0.81 -0.31 1.72 0.15 -3.04 0.00 0.00 177.10 176.43 2oal h PHE 458 N 7.94 -0.08 -0.77 0.43 3.57 -1.87 -2.33 116.94 123.82 2oal h PHE 458 Ca -0.18 0.00 0.18 0.00 3.53 0.00 0.00 57.97 61.50 2oal h PHE 458 Cb 1.05 0.04 -0.12 0.00 2.79 0.00 0.00 35.95 39.71 2oal h PHE 458 CO 0.59 -0.05 0.16 0.93 -2.23 0.00 0.00 178.31 177.71 2oal h GLU 459 N -0.06 0.22 -0.41 1.11 4.39 -1.95 0.25 114.58 118.13 2oal h GLU 459 Ca 0.01 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 2oal h GLU 459 Cb 0.08 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 2oal h GLU 459 CO -0.04 0.15 -0.09 1.49 -1.16 0.00 0.00 179.01 179.36 2oal h GLU 460 N 0.23 0.72 0.07 2.33 4.22 -1.85 -2.80 114.58 117.49 2oal h GLU 460 Ca 0.44 -0.22 -0.25 0.00 0.08 0.00 0.00 59.36 59.41 2oal h GLU 460 Cb 0.80 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.99 2oal h GLU 460 CO -0.57 0.79 -1.10 1.49 -2.18 0.00 0.00 179.01 177.45 2oal h GLU 461 N 0.66 0.38 0.00 1.92 4.81 -0.40 -2.85 114.58 119.10 2oal h GLU 461 Ca 0.12 -0.50 -0.06 0.00 -0.13 0.00 0.00 59.36 58.78 2oal h GLU 461 Cb 0.54 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2oal h GLU 461 CO 0.03 1.18 -0.28 0.35 -0.73 0.00 0.00 179.01 179.56 2oal h PHE 462 N 0.17 0.00 0.00 0.92 3.57 -0.58 0.62 116.94 121.65 2oal h PHE 462 Ca -0.12 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.38 2oal h PHE 462 Cb 1.77 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.51 2oal h PHE 462 CO 0.07 0.28 -0.28 0.00 -2.23 0.00 0.00 178.31 176.15 2oal h ARG 463 N 0.00 0.00 -1.05 1.11 3.08 -1.50 -3.34 114.38 112.67 2oal h ARG 463 Ca -0.00 0.00 -0.42 0.00 0.07 0.00 0.00 59.98 59.63 2oal h ARG 463 Cb 0.51 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.15 2oal h ARG 463 CO 0.04 0.00 -1.04 0.09 -1.07 0.00 0.00 179.97 177.99 2oal n ASN 464 N -2.91 2.54 0.04 7.04 4.13 -0.90 -4.99 115.26 120.20 2oal n ASN 464 Ca 0.03 -2.96 -0.02 0.00 1.68 0.00 0.00 54.58 53.31 2oal n ASN 464 Cb 0.53 -0.49 -0.01 0.00 -1.54 0.00 0.00 39.78 38.26 2oal n ASN 464 CO 0.00 0.00 0.00 0.15 0.28 0.00 0.00 177.26 177.69 2oal h PHE 465 N 2.79 -0.12 -3.29 3.10 3.57 -1.03 -3.37 116.94 118.59 2oal h PHE 465 Ca 0.03 -0.00 -0.65 0.00 3.53 0.00 0.00 57.97 60.87 2oal h PHE 465 Cb 1.14 0.04 -0.16 0.00 2.79 0.00 0.00 35.95 39.77 2oal h PHE 465 CO 0.61 -0.07 0.24 -1.58 -2.23 0.00 0.00 178.31 175.28 2oal s TRP 466 N -3.26 2.97 0.58 0.41 0.23 -1.26 -5.03 118.94 113.58 2oal s TRP 466 Ca -0.02 -0.28 0.09 0.00 -2.03 0.00 0.00 56.10 53.86 2oal s TRP 466 Cb 0.00 -3.69 0.08 0.00 0.03 0.00 0.00 33.47 29.90 2oal s TRP 466 CO 0.05 -1.11 0.71 0.54 0.96 0.00 0.00 176.95 178.10 2oal s ASN 467 N 2.62 4.92 0.39 2.95 4.22 -1.26 -4.74 114.94 124.04 2oal s ASN 467 Ca 0.22 -1.00 0.17 0.00 -2.14 0.00 0.00 52.86 50.10 2oal s ASN 467 Cb -0.16 0.44 1.07 0.00 1.28 0.00 0.00 41.25 43.88 2oal s ASN 467 CO 0.16 -1.34 1.77 -1.13 -2.04 0.00 0.00 177.10 174.51 2oal h ASN 468 N 0.28 0.48 -0.35 3.54 -1.24 0.13 -1.08 115.58 117.33 2oal h ASN 468 Ca -0.31 0.09 -0.03 0.00 0.71 0.00 0.00 56.30 56.77 2oal h ASN 468 Cb 1.29 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 40.34 2oal h ASN 468 CO 0.45 0.09 0.11 0.28 -1.29 0.00 0.00 177.43 177.07 2oal h SER 469 N 0.42 0.51 -0.42 1.15 0.02 -1.90 -1.56 113.55 111.77 2oal h SER 469 Ca 0.60 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 61.33 2oal h SER 469 Cb 1.46 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.85 2oal h SER 469 CO -0.32 0.58 0.21 0.78 -1.14 0.00 0.00 176.83 176.94 2oal h ASN 470 N 0.41 0.54 -0.56 3.07 2.35 -1.58 -1.92 115.58 117.88 2oal h ASN 470 Ca 0.11 -0.12 -0.05 0.00 -0.55 0.00 0.00 56.30 55.70 2oal h ASN 470 Cb 0.25 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 2oal h ASN 470 CO -0.00 0.51 0.16 1.88 -1.65 0.00 0.00 177.43 178.32 2oal h TYR 471 N 0.54 0.93 -0.33 1.19 0.05 -1.35 -2.58 116.97 115.41 2oal h TYR 471 Ca 0.14 -0.10 -0.03 0.00 0.05 0.00 0.00 58.73 58.79 2oal h TYR 471 Cb 0.10 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 37.56 2oal h TYR 471 CO -0.01 0.79 0.09 1.88 -1.05 0.00 0.00 178.16 179.85 2oal h TYR 472 N 0.80 0.54 -0.40 4.88 0.05 -1.14 0.22 116.97 121.92 2oal h TYR 472 Ca 0.18 -0.06 0.08 0.00 0.05 0.00 0.00 58.73 58.98 2oal h TYR 472 Cb 0.31 -0.16 -0.07 0.00 1.01 0.00 0.00 36.73 37.82 2oal h TYR 472 CO 0.02 0.56 -0.05 0.00 -1.05 0.00 0.00 178.16 177.64 2oal h VAL 474 N 0.05 1.26 0.11 0.00 2.07 -1.34 -1.71 116.25 116.70 2oal h VAL 474 Ca 0.20 -1.58 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 2oal h VAL 474 Cb 0.29 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2oal h VAL 474 CO -0.37 0.37 -0.05 -0.07 0.02 0.00 0.00 177.57 177.46 2oal h LEU 475 N -0.84 -0.13 -0.96 2.57 3.38 -0.54 -0.79 115.31 118.01 2oal h LEU 475 Ca -0.01 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 2oal h LEU 475 Cb 0.65 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.42 2oal h LEU 475 CO 0.01 0.16 -0.02 0.00 0.09 0.00 0.00 178.44 178.69 2oal h ALA 476 N 0.42 1.13 -0.62 1.53 0.00 -0.47 0.32 119.26 121.58 2oal h ALA 476 Ca -0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2oal h ALA 476 Cb 0.35 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 2oal h ALA 476 CO 0.03 0.55 0.34 0.78 0.00 0.00 0.00 179.25 180.95 2oal h GLY 477 N 0.96 0.92 2.00 0.00 0.00 -1.17 -2.13 103.07 103.64 2oal h GLY 477 Ca 0.13 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2oal h GLY 477 CO 0.02 0.40 0.00 1.41 0.00 0.00 0.00 176.54 178.37 2oal h LEU 478 N 0.84 0.00 0.00 3.11 3.38 -0.83 -3.47 115.31 118.34 2oal h LEU 478 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2oal h LEU 478 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2oal h LEU 478 CO -0.04 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.10 2oal n GLY 479 N 0.44 1.00 3.64 0.83 0.00 -0.60 -4.51 105.19 105.98 2oal n GLY 479 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 4.09 0.18 0.99 2.96 0.10 -4.94 118.68 122.05 2oal s LEU 480 Ca 0.00 0.91 0.05 0.00 -0.22 0.00 0.00 54.13 54.87 2oal s LEU 480 Cb 0.00 -3.04 -0.05 0.00 0.50 0.00 0.00 46.19 43.60 2oal s LEU 480 CO 0.00 -0.43 -0.10 0.68 -1.32 0.00 0.00 176.35 175.18 2oal s VAL 481 N 2.59 1.30 0.92 1.68 -7.23 -1.26 -2.81 120.40 115.58 2oal s VAL 481 Ca 0.31 -2.09 -0.11 0.00 -1.81 0.00 0.00 61.98 58.27 2oal s VAL 481 Cb -0.15 -1.99 0.09 0.00 0.56 0.00 0.00 36.38 34.89 2oal s VAL 481 CO 0.08 -0.64 0.84 -2.65 -0.31 0.00 0.00 175.10 172.43 2oal n PRO 482 N -0.28 -0.33 0.01 4.82 -0.02 -1.26 -4.86 135.00 133.07 2oal n PRO 482 Ca -0.09 -0.04 -0.02 0.00 -2.02 0.00 0.00 63.50 61.33 2oal n PRO 482 Cb 0.61 -2.16 0.23 0.00 -0.02 0.00 0.00 33.50 32.16 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 -1.65 0.49 -5.02 2.55 3.32 -1.30 -3.46 116.42 111.34 2oal h ASP 483 Ca -0.43 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 56.47 2oal h ASP 483 Cb 1.28 -0.13 -0.10 0.00 0.22 0.00 0.00 39.33 40.60 2oal h ASP 483 CO 0.39 0.68 0.16 0.00 -1.72 0.00 0.00 179.24 178.74 2oal s ALA 484 N -4.65 -1.33 0.81 3.45 0.00 -1.26 -5.14 121.76 113.64 2oal s ALA 484 Ca -0.07 0.12 -0.14 0.00 0.00 0.00 0.00 51.96 51.87 2oal s ALA 484 Cb 0.14 0.86 0.07 0.00 0.00 0.00 0.00 23.12 24.20 2oal s ALA 484 CO 0.78 -0.83 1.13 -2.30 0.00 0.00 0.00 175.76 174.54 2oal n PRO 485 N -0.38 0.18 -1.68 0.00 -0.02 -1.26 -4.47 135.00 127.38 2oal n PRO 485 Ca -0.12 0.14 -0.47 0.00 -2.02 0.00 0.00 63.50 61.02 2oal n PRO 485 Cb 0.63 -2.38 -0.04 0.00 -0.02 0.00 0.00 33.50 31.69 2oal n PRO 485 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2oal n SER 486 N -2.98 3.51 -0.32 2.55 2.88 -1.26 -4.85 113.62 113.15 2oal n SER 486 Ca 0.13 0.99 0.22 0.00 -1.33 0.00 0.00 58.87 58.88 2oal n SER 486 Cb 0.50 -1.41 0.49 0.00 -0.75 0.00 0.00 64.21 63.05 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 8.74 0.41 -0.26 -1.46 0.11 -1.89 -1.51 132.00 136.14 2oal h PRO 487 Ca -0.48 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.61 2oal h PRO 487 Cb 1.26 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2oal h PRO 487 CO 0.94 0.27 0.17 -0.09 -0.21 0.00 0.00 178.00 179.08 2oal h ARG 488 N 0.42 0.31 -0.67 1.05 2.43 -1.98 -2.85 114.38 113.09 2oal h ARG 488 Ca 0.59 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.80 2oal h ARG 488 Cb 1.45 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.89 2oal h ARG 488 CO -0.31 0.21 0.44 -0.07 -1.51 0.00 0.00 179.97 178.73 2oal h LEU 489 N 0.32 0.62 -1.48 3.80 3.38 -1.64 0.36 115.31 120.67 2oal h LEU 489 Ca 0.10 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2oal h LEU 489 Cb -0.01 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2oal h LEU 489 CO -0.02 0.41 0.00 0.00 0.09 0.00 0.00 178.44 178.92 2oal h ALA 490 N 1.63 1.00 -0.57 1.53 0.00 -1.67 -1.08 119.26 120.11 2oal h ALA 490 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2oal h ALA 490 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2oal h ALA 490 CO -0.09 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.88 2oal n HIS 491 N -2.56 0.75 -2.84 0.00 8.25 0.11 -4.59 115.22 114.34 2oal n HIS 491 Ca -0.00 -0.40 -0.22 0.00 -0.26 0.00 0.00 57.72 56.83 2oal n HIS 491 Cb 0.16 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.25 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 1.49 2.45 -0.34 -0.41 2.00 -0.41 -4.92 117.12 116.99 2oal n MET 492 Ca 0.21 -4.20 0.14 0.00 0.00 0.00 0.00 57.70 53.86 2oal n MET 492 Cb 0.60 -1.97 0.36 0.00 0.00 0.00 0.00 33.22 32.21 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 2.89 0.67 -0.42 0.03 0.13 -1.81 0.16 132.00 133.65 2oal h PRO 493 Ca 0.13 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 65.14 2oal h PRO 493 Cb 0.81 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 2oal h PRO 493 CO 0.71 0.44 -0.07 0.37 -0.23 0.00 0.00 178.00 179.22 2oal h GLN 494 N 0.69 0.72 0.03 0.86 4.15 -1.95 -2.63 115.11 116.99 2oal h GLN 494 Ca 0.57 -0.22 -0.00 0.00 0.77 0.00 0.00 58.65 59.77 2oal h GLN 494 Cb 0.98 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.60 2oal h GLN 494 CO -0.35 0.79 -0.01 0.00 -1.93 0.00 0.00 178.83 177.32 2oal h ALA 495 N 1.25 -0.04 0.00 3.38 0.00 -1.18 -2.63 119.26 120.04 2oal h ALA 495 Ca 0.12 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2oal h ALA 495 Cb 0.52 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2oal h ALA 495 CO 0.03 -0.19 0.00 0.25 0.00 0.00 0.00 179.25 179.34 2oal n THR 496 N -4.80 0.53 -0.11 0.00 -2.24 -0.09 -1.26 114.28 106.31 2oal n THR 496 Ca -0.09 0.13 -0.25 0.00 -2.27 0.00 0.00 64.05 61.58 2oal n THR 496 Cb 0.32 -0.95 -0.11 0.00 -2.10 0.00 0.00 70.33 67.49 2oal n THR 496 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2oal n GLU 497 N -1.21 0.61 0.17 -0.78 4.07 -0.99 -4.37 120.64 118.14 2oal n GLU 497 Ca 0.06 0.32 0.13 0.00 -0.06 0.00 0.00 57.16 57.62 2oal n GLU 497 Cb 0.08 -1.58 0.40 0.00 -0.06 0.00 0.00 31.44 30.28 2oal n GLU 497 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 2oal h SER 498 N -0.72 0.00 -0.74 4.31 4.64 -1.15 -3.26 113.55 116.62 2oal h SER 498 Ca -0.57 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 60.97 2oal h SER 498 Cb 1.63 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.69 2oal h SER 498 CO -0.26 0.00 0.53 1.62 -0.87 0.00 0.00 176.83 177.85 2oal h VAL 499 N 0.00 0.63 -0.77 0.95 3.04 -1.38 -0.14 116.25 118.58 2oal h VAL 499 Ca 0.00 -0.01 0.11 0.00 -1.01 0.00 0.00 66.70 65.79 2oal h VAL 499 Cb 0.70 0.62 -0.05 0.00 -2.01 0.00 0.00 31.29 30.55 2oal h VAL 499 CO 0.00 0.00 0.51 0.44 -1.01 0.00 0.00 177.57 177.51 2oal h ASP 500 N 0.02 0.59 -0.85 3.17 5.19 -1.83 0.20 116.42 122.90 2oal h ASP 500 Ca 0.35 0.02 0.07 0.00 -0.62 0.00 0.00 57.03 56.86 2oal h ASP 500 Cb 1.39 -0.10 -0.07 0.00 0.18 0.00 0.00 39.33 40.74 2oal h ASP 500 CO -0.01 0.34 0.51 1.05 -3.12 0.00 0.00 179.24 178.01 2oal h GLU 501 N 0.64 0.88 0.21 3.56 4.11 -1.28 0.13 114.58 122.83 2oal h GLU 501 Ca 0.36 -0.05 -0.01 0.00 0.07 0.00 0.00 59.36 59.73 2oal h GLU 501 Cb 0.53 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2oal h GLU 501 CO -0.14 0.58 -0.10 0.28 0.07 0.00 0.00 179.01 179.71 2oal h VAL 502 N 0.91 0.86 -0.80 -1.06 2.07 -1.09 0.18 116.25 117.32 2oal h VAL 502 Ca 0.38 -0.42 0.05 0.00 0.82 0.00 0.00 66.70 67.53 2oal h VAL 502 Cb 0.24 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 2oal h VAL 502 CO -0.20 0.10 0.53 -0.26 0.02 0.00 0.00 177.57 177.75 2oal h PHE 503 N -0.49 0.93 -0.34 1.57 0.04 -0.97 -0.72 116.94 116.95 2oal h PHE 503 Ca -0.03 0.02 -0.12 0.00 2.80 0.00 0.00 57.97 60.64 2oal h PHE 503 Cb 0.37 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 2oal h PHE 503 CO -0.00 0.52 -0.29 0.78 -0.60 0.00 0.00 178.31 178.72 2oal h GLY 504 N 0.94 0.76 1.09 -1.45 0.00 -0.58 -2.57 103.07 101.25 2oal h GLY 504 Ca 0.33 -0.69 0.01 0.00 0.00 0.00 0.00 47.33 46.98 2oal h GLY 504 CO -0.11 0.62 0.62 0.00 0.00 0.00 0.00 176.54 177.67 2oal h ALA 505 N 1.08 1.33 -0.07 3.60 0.00 0.53 -0.68 119.26 125.05 2oal h ALA 505 Ca 0.07 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 2oal h ALA 505 Cb 0.79 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2oal h ALA 505 CO 0.07 0.62 -0.75 -0.39 0.00 0.00 0.00 179.25 178.80 2oal h VAL 506 N 1.26 1.38 -0.71 0.00 -1.51 -1.28 -0.38 116.25 115.01 2oal h VAL 506 Ca 0.34 -2.16 -0.06 0.00 -1.23 0.00 0.00 66.70 63.59 2oal h VAL 506 Cb -0.14 2.13 -0.03 0.00 -2.13 0.00 0.00 31.29 31.12 2oal h VAL 506 CO -0.07 0.65 0.20 0.11 -1.23 0.00 0.00 177.57 177.23 2oal h LYS 507 N 0.28 1.10 0.16 5.19 1.79 -1.00 0.68 116.57 124.77 2oal h LYS 507 Ca -0.03 -0.24 -0.01 0.00 -2.18 0.00 0.00 60.65 58.19 2oal h LYS 507 Cb 1.33 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 2oal h LYS 507 CO 0.13 0.95 -0.08 -0.44 -1.08 0.00 0.00 179.45 178.93 2oal h ASP 508 N 1.06 -0.18 -0.87 0.86 3.32 -1.06 -1.45 116.42 118.10 2oal h ASP 508 Ca 0.23 -0.32 0.23 0.00 0.02 0.00 0.00 57.03 57.18 2oal h ASP 508 Cb 0.33 0.05 -0.14 0.00 0.22 0.00 0.00 39.33 39.78 2oal h ASP 508 CO -0.00 0.26 0.23 -0.09 -1.72 0.00 0.00 179.24 177.92 2oal h ARG 509 N -0.68 0.21 0.00 3.56 9.65 -0.86 0.15 114.38 126.41 2oal h ARG 509 Ca -0.02 -0.01 -0.15 0.00 -1.10 0.00 0.00 59.98 58.70 2oal h ARG 509 Cb 0.49 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.00 2oal h ARG 509 CO 0.04 0.14 -0.69 -0.56 2.80 0.00 0.00 179.97 181.69 2oal h GLN 510 N 0.21 0.00 -0.34 0.20 3.07 -0.83 -2.65 115.11 114.77 2oal h GLN 510 Ca 0.54 0.00 -0.15 0.00 0.09 0.00 0.00 58.65 59.14 2oal h GLN 510 Cb 1.08 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.63 2oal h GLN 510 CO -0.65 0.69 -0.37 0.00 0.09 0.00 0.00 178.83 178.59 2oal h ARG 511 N 0.00 0.80 -0.24 0.06 3.08 0.34 -2.44 114.38 115.98 2oal h ARG 511 Ca -0.01 -0.41 -0.14 0.00 0.07 0.00 0.00 59.98 59.50 2oal h ARG 511 Cb 1.48 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.54 2oal h ARG 511 CO 0.09 1.04 -0.38 -0.97 -1.07 0.00 0.00 179.97 178.68 2oal h ASN 512 N 0.66 0.76 -0.09 7.04 -0.73 -1.06 -3.21 115.58 118.95 2oal h ASN 512 Ca 0.06 -0.52 -0.10 0.00 1.87 0.00 0.00 56.30 57.60 2oal h ASN 512 Cb 0.93 -0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.29 2oal h ASN 512 CO 0.09 1.13 -0.27 -0.07 -0.37 0.00 0.00 177.43 177.94 2oal h LEU 513 N 0.40 0.55 -1.80 0.34 3.38 -1.49 -0.74 115.31 115.96 2oal h LEU 513 Ca 0.02 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2oal h LEU 513 Cb 0.97 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2oal h LEU 513 CO 0.09 0.80 0.00 0.25 0.09 0.00 0.00 178.44 179.67 2oal h LEU 514 N 0.47 0.00 0.00 1.67 5.85 -1.45 -1.53 115.31 120.32 2oal h LEU 514 Ca 0.07 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.47 2oal h LEU 514 Cb 0.71 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.68 2oal h LEU 514 CO 0.05 0.00 -2.19 -0.62 -0.34 0.00 0.00 178.44 175.35 2oal n GLU 515 N -2.80 0.80 0.06 1.25 1.02 -0.95 -4.68 120.64 115.34 2oal n GLU 515 Ca -0.01 0.08 0.08 0.00 -0.02 0.00 0.00 57.16 57.29 2oal n GLU 515 Cb 0.18 -1.43 -0.06 0.00 -0.02 0.00 0.00 31.44 30.11 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 -2.94 0.64 -2.69 2.62 -2.24 -0.32 -4.95 114.28 104.40 2oal n THR 516 Ca -0.34 -0.58 -0.40 0.00 -2.27 0.00 0.00 64.05 60.46 2oal n THR 516 Cb 0.95 -0.36 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 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 -5.29 4.58 0.40 3.22 1.43 -0.58 -4.98 118.68 117.46 2oal s LEU 517 Ca -0.03 1.96 -0.15 0.00 -1.03 0.00 0.00 54.13 54.88 2oal s LEU 517 Cb 0.10 -3.61 -0.08 0.00 0.03 0.00 0.00 46.19 42.63 2oal s LEU 517 CO 0.82 0.03 0.83 -2.16 0.23 0.00 0.00 176.35 176.10 2oal s PRO 518 N -0.83 3.98 0.86 1.29 0.04 -1.26 -4.86 135.00 134.22 2oal s PRO 518 Ca 0.44 0.75 -0.12 0.00 0.04 0.00 0.00 61.00 62.11 2oal s PRO 518 Cb -0.26 -2.32 0.10 0.00 0.04 0.00 0.00 34.50 32.06 2oal s PRO 518 CO 0.33 -0.01 1.11 -1.13 0.04 0.00 0.00 177.00 177.34 2oal n SER 519 N -0.89 0.47 -0.26 6.66 3.41 -1.26 -1.07 113.62 120.69 2oal n SER 519 Ca 0.04 0.50 -0.06 0.00 -0.26 0.00 0.00 58.87 59.10 2oal n SER 519 Cb 0.54 -1.47 0.05 0.00 -0.26 0.00 0.00 64.21 63.07 2oal n SER 519 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2oal h LEU 520 N -1.35 0.87 -0.23 1.04 5.85 -1.37 -1.70 115.31 118.43 2oal h LEU 520 Ca -0.45 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.23 2oal h LEU 520 Cb 1.29 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.06 2oal h LEU 520 CO 0.43 0.70 -0.02 -0.74 -0.34 0.00 0.00 178.44 178.47 2oal h HIS 521 N 0.97 -0.04 -0.31 1.25 2.76 -1.81 0.40 115.15 118.36 2oal h HIS 521 Ca 0.25 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.51 2oal h HIS 521 Cb 0.01 0.05 -0.07 0.00 1.55 0.00 0.00 27.41 28.95 2oal h HIS 521 CO -0.01 -0.05 -0.16 1.49 -1.30 0.00 0.00 177.93 177.91 2oal h GLU 522 N 0.05 -0.11 -0.59 5.26 4.81 -1.78 -0.26 114.58 121.96 2oal h GLU 522 Ca 0.11 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.28 2oal h GLU 522 Cb 0.15 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2oal h GLU 522 CO -0.20 -0.07 0.11 0.35 -0.73 0.00 0.00 179.01 178.48 2oal h PHE 523 N -0.11 1.03 -0.98 0.92 3.57 -0.76 -3.02 116.94 117.59 2oal h PHE 523 Ca 0.16 -0.14 0.03 0.00 3.53 0.00 0.00 57.97 61.55 2oal h PHE 523 Cb 0.35 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.76 2oal h PHE 523 CO -0.36 0.88 0.64 -0.07 -2.23 0.00 0.00 178.31 177.18 2oal h LEU 524 N 0.87 1.09 0.51 0.59 3.38 0.65 0.19 115.31 122.59 2oal h LEU 524 Ca 0.18 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2oal h LEU 524 Cb 0.40 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2oal h LEU 524 CO 0.01 0.76 -0.47 0.03 0.09 0.00 0.00 178.44 178.86 2oal h ARG 525 N 1.27 -0.94 -0.10 1.13 3.08 -0.95 0.50 114.38 118.37 2oal h ARG 525 Ca 0.38 0.06 0.04 0.00 0.07 0.00 0.00 59.98 60.54 2oal h ARG 525 Cb -0.06 0.21 -0.06 0.00 0.08 0.00 0.00 29.97 30.15 2oal h ARG 525 CO -0.11 -0.63 -0.32 0.37 -1.07 0.00 0.00 179.97 178.22 2oal h GLN 526 N -0.97 -0.39 -0.66 0.04 4.15 -1.46 -2.14 115.11 113.68 2oal h GLN 526 Ca -0.07 0.03 0.14 0.00 0.77 0.00 0.00 58.65 59.52 2oal h GLN 526 Cb 0.83 0.09 -0.10 0.00 0.21 0.00 0.00 27.48 28.51 2oal h GLN 526 CO -0.04 -0.26 0.09 0.37 -1.93 0.00 0.00 178.83 177.07 2oal h GLN 527 N -0.41 0.20 -3.38 1.69 5.75 -0.36 -3.22 115.11 115.38 2oal h GLN 527 Ca 0.09 -0.01 -0.80 0.00 -0.15 0.00 0.00 58.65 57.78 2oal h GLN 527 Cb 0.54 -0.04 -0.27 0.00 1.07 0.00 0.00 27.48 28.78 2oal h GLN 527 CO -0.33 0.13 0.72 0.72 -2.65 0.00 0.00 178.83 177.41 2oal n HIS 528 N -5.20 3.98 -0.16 3.99 8.25 0.17 -5.02 115.22 121.23 2oal n HIS 528 Ca 0.11 -3.31 0.00 0.00 -0.26 0.00 0.00 57.72 54.26 2oal n HIS 528 Cb 0.39 -1.57 0.00 0.00 1.12 0.00 0.00 29.99 29.93 2oal n HIS 528 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39